A0A087YM31_POEFO Loading...

Delta(14)-sterol reductase TM7SF2

Catalyzes the reduction of the C14-unsaturated bond of lanosterol, as part of the metabolic pathway leading to cholesterol biosynthesis.

AlphaFold DB , UniProt , Accession A0A087YM31, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 445 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	34.3	Very low	37.6	Very low	231 Å²	231	149.9 Å²	149.9	100%	1.138	84%	0.835	S	S	*	*				0	118.2	0	-71.9	168.8	131.3	0	0	106.8
2	D	32.2	Very low	38.2	Very low	116 Å²	116	143.8 Å²	143.8	62%	0.62	81%	0.807	S	S	*	*			cis	-160.1	139.3	-4.3	-104.9	-53.2	0	0	0	107.7
3	R	32.8	Very low	38.8	Very low	215 Å²	215	136.9 Å²	136.9	81%	0.811	77%	0.774	S	S	*	*			trans	46.4	109.3	135.7	-60.1	170.4	-164.3	-147.5	-5	120.5
4	T	41.4	Very low	38.9	Very low	146 Å²	146	139.3 Å²	139.3	90%	0.896	77%	0.772	S	S	*	*			trans	-29.5	125.1	131.2	47.4	0	0	0	0	113.8
5	A	35.7	Very low	39.1	Very low	100 Å²	100	137.2 Å²	137.2	83%	0.826	77%	0.765	S	S	*	*			trans	-113.9	120.5	165.1	0	0	0	0	0	109.9
6	S	36.2	Very low	39.2	Very low	113 Å²	113	136.1 Å²	136.1	79%	0.79	75%	0.752	S	S	*	*	P	Polyproline II helix	trans	-75.4	124.3	175.3	112.8	0	0	0	0	109.3
7	E	37.2	Very low	39.4	Very low	198 Å²	198	133.9 Å²	133.9	93%	0.925	74%	0.738	S	S	*	*	P	Polyproline II helix	trans	-80.1	116.8	166.7	-78.2	-175.5	155.8	0	0	110
8	A	38.2	Very low	39.1	Very low	78 Å²	78	135 Å²	135	65%	0.645	73%	0.729	S	S	*	*	P	Polyproline II helix	trans	-78.9	149.4	173.9	0	0	0	0	0	111.2	Q10	A8-Q10 PolarHBondContact O-N 3.12Å
9	P	38.7	Very low	38.9	Very low	125 Å²	125	139.5 Å²	139.5	81%	0.812	74%	0.735	S	S	*	*	P	Polyproline II helix	trans	-73	123.5	177	4.1	9.1	0	0	0	110.6	T11	P9-T11 PolarHBondContact O-N 3.15Å
10	Q	42.2	Very low	39	Very low	194 Å²	194	144.1 Å²	144.1	91%	0.907	74%	0.742	S	S	*	*	P	Polyproline II helix	trans	-66.9	122.4	171.8	-70.3	-176.5	-5.6	0	0	110.5	A8	A8-Q10 PolarHBondContact O-N 3.12Å
11	T	44.6	Very low	38.9	Very low	133 Å²	133	146.2 Å²	146.2	82%	0.816	75%	0.745	S	S	*	*	P	Polyproline II helix	trans	-73.5	132.5	170.9	34.4	0	0	0	0	110.3	P9	P9-T11 PolarHBondContact O-N 3.15Å
12	P	44.8	Very low	39	Very low	76 Å²	76	142 Å²	142	49%	0.494	73%	0.725	S	S	.	*	P	Polyproline II helix	trans	-70.2	142.7	-178.3	26.5	-31.3	0	0	0	111.3	Q16 L17	P12-Q16 HydrophobicContact CB-CB 4.38Å; P12-L17 HydrophobicContact CG-CD1 4.2Å
13	S	45.7	Very low	39.2	Very low	55 Å²	55	139.4 Å²	139.4	39%	0.385	73%	0.725	S	S	.	*	P	Polyproline II helix	trans	-67.4	154.9	-178.4	73.7	0	0	0	0	112.5	T15 Q16 L17	S13-T15 PolarHBondContact O-N 3.32Å; S13-T15 VanDerWaalsContact O-N 3.1Å; S13-T15 PolarHBondContact OG-OG1 3.48Å; S13-Q16 WeakPolarHBondContact O-CA 3.27Å; S13-Q16 WeakPolarHBondContact O-CB 3.2Å; S13-Q16 PolarHBondContact O-N 3.02Å; S13-Q16 PolarHBondContact OG-N 3.24Å; S13-L17 PolarHBondContact O-N 2.96Å; S13-L17 VanDerWaalsContact O-N 3.12Å
14	F	41.3	Very low	39.2	Very low	170 Å²	170	133.6 Å²	133.6	75%	0.746	72%	0.724	S	S	*	*	H	α-helix	trans	-55.4	-31.1	-179.8	-151.3	-95.3	0	0	0	112.6	W18	F14-W18 WeakPolarHBondContact O-CB 3.34Å; F14-W18 PolarHBondContact O-N 2.64Å
15	T	41.4	Very low	38.7	Very low	108 Å²	108	136.5 Å²	136.5	66%	0.663	72%	0.724	S	S	*	*	H	α-helix	trans	-72.8	-30.7	174.8	17.5	0	0	0	0	113.7	S13 R19	S13-T15 PolarHBondContact O-N 3.32Å; S13-T15 VanDerWaalsContact O-N 3.1Å; S13-T15 PolarHBondContact OG-OG1 3.48Å; T15-R19 PolarHBondContact O-N 3.12Å
16	Q	41.4	Very low	38.5	Very low	120 Å²	120	141.3 Å²	141.3	56%	0.561	73%	0.726	S	S	*	*	H	α-helix	trans	-74.2	-36.4	172.3	-76.9	177.7	-22.1	0	0	112.1	P12 S13 R20	P12-Q16 HydrophobicContact CB-CB 4.38Å; S13-Q16 WeakPolarHBondContact O-CA 3.27Å; S13-Q16 WeakPolarHBondContact O-CB 3.2Å; S13-Q16 PolarHBondContact O-N 3.02Å; S13-Q16 PolarHBondContact OG-N 3.24Å; Q16-R20 PolarHBondContact O-N 2.8Å
17	L	42.4	Very low	38.1	Very low	98 Å²	98	139.8 Å²	139.8	51%	0.513	72%	0.72	S	S	.	*	H	α-helix	trans	-66.5	-36.5	172.5	-95.7	138.1	0	0	0	112.4	P12 S13 R20 K21	P12-L17 HydrophobicContact CG-CD1 4.2Å; S13-L17 PolarHBondContact O-N 2.96Å; S13-L17 VanDerWaalsContact O-N 3.12Å; L17-R20 PolarHBondContact O-N 3.41Å; L17-K21 PolarHBondContact O-N 2.92Å
18	W	33.8	Very low	37.7	Very low	154 Å²	154	136 Å²	136	58%	0.583	71%	0.713	S	S	*	*	H	α-helix	trans	-70.3	-40.3	177	-120	88.9	0	0	0	113.2	F14 R20 K21 M22	F14-W18 WeakPolarHBondContact O-CB 3.34Å; F14-W18 PolarHBondContact O-N 2.64Å; W18-R20 VanDerWaalsContact C-N 3.32Å; W18-R20 PolarHBondContact O-N 3.29Å; W18-K21 PolarHBondContact O-N 3.38Å; W18-M22 HydrophobicContact CE3-CG 3.85Å; W18-M22 HydrophobicContact CH2-CE 4.24Å; W18-M22 HydrophobicContact CH2-CG 4.41Å; W18-M22 HydrophobicContact CZ3-CE 3.74Å; W18-M22 HydrophobicContact CZ3-CG 3.64Å; W18-M22 HydrophobicContact CZ3-SD 4.29Å; W18-M22 PolarHBondContact O-N 3.25Å
19	R	34.5	Very low	37.4	Very low	221 Å²	221	141 Å²	141	83%	0.834	72%	0.72	S	S	*	*	H	α-helix	trans	-65.9	-31.1	173.7	-86.4	-173.4	-175.3	-171.5	2.4	113.2	T15	T15-R19 PolarHBondContact O-N 3.12Å
20	R	40.5	Very low	37.1	Very low	230 Å²	230	143.1 Å²	143.1	87%	0.868	72%	0.719	S	S	*	*	H	α-helix	trans	-70.1	-28.6	173.5	-110.4	179.2	169.8	-178.6	-2.7	113.2	Q16 L17 W18	Q16-R20 PolarHBondContact O-N 2.8Å; L17-R20 PolarHBondContact O-N 3.41Å; W18-R20 VanDerWaalsContact C-N 3.32Å; W18-R20 PolarHBondContact O-N 3.29Å
21	K	38.7	Very low	36.8	Very low	189 Å²	189	143 Å²	143	82%	0.822	71%	0.71	S	S	*	*	H	α-helix	trans	-84.3	-21.5	179.3	-100.9	-176.4	174.1	-178.1	0	114.9	L17 W18	L17-K21 PolarHBondContact O-N 2.92Å; W18-K21 PolarHBondContact O-N 3.38Å
22	M	34.4	Very low	36.6	Very low	143 Å²	143	142.9 Å²	142.9	70%	0.704	70%	0.704	S	S	*	*	S	Bend	trans	-115	14.1	-172	-75.9	-84.8	-84.3	0	0	114.5	W18	W18-M22 HydrophobicContact CE3-CG 3.85Å; W18-M22 HydrophobicContact CH2-CE 4.24Å; W18-M22 HydrophobicContact CH2-CG 4.41Å; W18-M22 HydrophobicContact CZ3-CE 3.74Å; W18-M22 HydrophobicContact CZ3-CG 3.64Å; W18-M22 HydrophobicContact CZ3-SD 4.29Å; W18-M22 PolarHBondContact O-N 3.25Å
23	G	36.7	Very low	36.1	Very low	61 Å²	61	144.4 Å²	144.4	63%	0.629	72%	0.716	S	S	*	*			trans	-135.2	29.4	-167.9	0	0	0	0	0	116
24	A	33.7	Very low	36	Very low	94 Å²	94	146.2 Å²	146.2	78%	0.777	72%	0.718	S	S	*	*			trans	-100.8	82.2	161.9	0	0	0	0	0	108	K26	A24-K26 PolarHBondContact O-N 3.29Å
25	K	30.9	Very low	36	Very low	206 Å²	206	145.8 Å²	145.8	90%	0.896	72%	0.724	S	S	*	*			trans	-52.8	113.4	158.3	-82.1	-176.9	176.7	179.7	0	105.3	A27	K25-A27 PolarHBondContact O-N 3.42Å
26	K	30.7	Very low	36.7	Very low	202 Å²	202	144.3 Å²	144.3	88%	0.878	72%	0.715	S	S	*	*			trans	-44.5	118.3	170.4	-84.9	177	175.1	172.7	0	106.2	A24	A24-K26 PolarHBondContact O-N 3.29Å
27	A	28.9	Very low	37.9	Very low	81 Å²	81	145.3 Å²	145.3	67%	0.669	72%	0.719	S	S	*	*			trans	-46.8	136	167.5	0	0	0	0	0	106.7	K25 K29	K25-A27 PolarHBondContact O-N 3.42Å; A27-K29 PolarHBondContact O-N 2.94Å
28	P	27.1	Very low	39.7	Very low	119 Å²	119	146.2 Å²	146.2	77%	0.773	72%	0.716	S	S	*	*			trans	-51.5	123.9	177.5	22.2	-30.4	0	0	0	106.2	H30	P28-H30 VanDerWaalsContact C-N 3.27Å; P28-H30 PolarHBondContact O-N 3.35Å
29	K	33.7	Very low	42.1	Very low	181 Å²	181	141 Å²	141	79%	0.787	70%	0.698	S	S	*	*			trans	-50.8	107.9	165.5	-86.1	-175.4	174.1	-174.1	0	103.7	A27 R31	A27-K29 PolarHBondContact O-N 2.94Å; K29-R31 PolarHBondContact O-N 3.26Å
30	H	31.3	Very low	44.5	Very low	171 Å²	171	133 Å²	133	79%	0.792	67%	0.67	S	S	*	*			trans	-68	82.7	172.7	-151.9	-55.1	0	0	0	104.2	P28 L32	P28-H30 VanDerWaalsContact C-N 3.27Å; P28-H30 PolarHBondContact O-N 3.35Å; H30-L32 VanDerWaalsContact C-N 3.27Å; H30-L32 PolarHBondContact O-N 3.46Å
31	R	36	Very low	46.6	Very low	191 Å²	191	125.3 Å²	125.3	72%	0.721	66%	0.661	S	S	*	*			trans	-59.1	104.6	162.8	-78.9	-174.5	-179.3	-176.3	0.1	103	K29 S33	K29-R31 PolarHBondContact O-N 3.26Å; R31-S33 PolarHBondContact O-N 3.35Å
32	L	40.1	Very low	49	Very low	131 Å²	131	116.6 Å²	116.6	69%	0.686	63%	0.626	S	S	*	*			trans	-49.1	132.1	166.3	-83.9	131.5	0	0	0	106.6	H30 H34	H30-L32 VanDerWaalsContact C-N 3.27Å; H30-L32 PolarHBondContact O-N 3.46Å; L32-H34 PolarHBondContact O-N 2.9Å
33	S	34.9	Very low	51.6	Low	108 Å²	108	111.7 Å²	111.7	76%	0.755	60%	0.604	S	S	*	*			trans	-45.5	123.1	-177	45.4	0	0	0	0	110.6	R31 D35	R31-S33 PolarHBondContact O-N 3.35Å; S33-D35 PolarHBondContact O-N 3.47Å
34	H	44	Very low	54.2	Low	92 Å²	92	114.9 Å²	114.9	43%	0.426	61%	0.606	S	S	.	*	S	Bend	trans	-73.5	29.3	-165.9	-98.4	-76.7	0	0	0	115.7	L32 T36 T193	L32-H34 PolarHBondContact O-N 2.9Å; H34-T36 VanDerWaalsContact C-N 3.29Å; H34-T36 PolarHBondContact O-N 2.9Å; H34-T193 PolarHBondContact CE1-O 3.4Å; H34-T193 PolarHBondContact ND1-O 2.96Å
35	D	41.4	Very low	56.9	Low	162 Å²	162	110.9 Å²	110.9	87%	0.866	57%	0.573	S	S	*	*			trans	-97.5	46.4	171.9	-80.4	-19.5	0	0	0	111	S33 E37	S33-D35 PolarHBondContact O-N 3.47Å; D35-E37 PolarHBondContact O-N 3.3Å
36	T	55.9	Low	59.9	Low	76 Å²	76	101.2 Å²	101.2	47%	0.466	53%	0.532	S	S	.	.			trans	-71.5	108.6	160.6	-43.7	0	0	0	0	106.3	H34 R38	H34-T36 VanDerWaalsContact C-N 3.29Å; H34-T36 PolarHBondContact O-N 2.9Å; T36-R38 PolarHBondContact O-N 3.4Å
37	E	66	Low	62.8	Low	141 Å²	141	94.9 Å²	94.9	66%	0.659	51%	0.51	S	S	*	.			trans	-45.9	110.9	172.5	-165.6	178.3	-156.7	0	0	108.5	D35 E39 R419	D35-E37 PolarHBondContact O-N 3.3Å; E37-E39 PolarHBondContact O-N 3.09Å; E37-R419 IonicContact OE2-NE 3.48Å
38	R	80.9	Confident	65.9	Low	117 Å²	117	93 Å²	93	44%	0.442	49%	0.491	S	S	.	.			trans	-72.9	124.9	-176	-64.9	-176.2	-179.7	159.9	5.2	108.6	T36 T43 Y198	T36-R38 PolarHBondContact O-N 3.4Å; R38-T43 PolarHBondContact NH1-OG1 2.96Å; R38-Y198 HydrophobicContact CB-CE2 3.97Å; R38-Y198 HydrophobicContact CG-CE2 4.44Å
39	E	83.8	Confident	69	Low	45 Å²	45	89.3 Å²	89.3	21%	0.21	47%	0.465	C	S	.	.	S	Bend	trans	-80.7	169.2	-179.3	-60.6	-173.8	148.2	0	0	110.8	E37 G41 G42 Y198 R416	E37-E39 PolarHBondContact O-N 3.09Å; E39-G41 VanDerWaalsContact C-N 3.28Å; E39-G41 PolarHBondContact O-N 3.02Å; E39-G42 PolarHBondContact O-N 3.06Å; E39-Y198 PolarHBondContact N-OH 3.4Å; E39-R416 VanDerWaalsContact CD-NH2 3.34Å; E39-R416 IonicContact OE1-CZ 3.58Å; E39-R416 IonicContact OE1-NE 3.87Å; E39-R416 PolarHBondContact OE1-NE 3.46Å; E39-R416 IonicContact OE1-NH2 3.11Å; E39-R416 PolarHBondContact OE1-NH2 3.3Å; E39-R416 IonicContact OE2-CZ 3.45Å; E39-R416 IonicContact OE2-NE 3.16Å; E39-R416 PolarHBondContact OE2-NE 2.68Å; E39-R416 VanDerWaalsContact OE2-NE 3.16Å; E39-R416 IonicContact OE2-NH2 3.79Å; E39-R416 PolarHBondContact OE2-NH2 3.2Å
40	F	84.6	Confident	71.9	Confident	54 Å²	54	81.2 Å²	81.2	24%	0.237	43%	0.431	C	S	.	.	T	Hydrogen-bonded Turn	trans	55.1	37.5	174.7	-55.2	-85.1	0	0	0	114.4	G42 G45 I49 F201 I202 M285 H412	F40-G42 PolarHBondContact O-N 3.13Å; F40-G45 WeakPolarHBondContact O-CA 3.39Å; F40-I49 HydrophobicContact CB-CD1 4.09Å; F40-F201 HydrophobicContact CB-CE1 3.87Å; F40-F201 HydrophobicContact CB-CZ 4.48Å; F40-F201 HydrophobicContact CD2-CE1 4.25Å; F40-F201 HydrophobicContact CG-CE1 4.06Å; F40-I202 HydrophobicContact CD2-CD1 3.77Å; F40-I202 HydrophobicContact CE2-CD1 4.07Å; F40-M285 HydrophobicContact CD1-SD 4.18Å; F40-M285 HydrophobicContact CD2-SD 3.91Å; F40-M285 HydrophobicContact CE1-SD 3.73Å; F40-M285 HydrophobicContact CE2-CE 4Å; F40-M285 HydrophobicContact CE2-SD 3.44Å; F40-M285 WeakPolarHBondContact CE2-SD 3.41Å; F40-M285 HydrophobicContact CG-SD 4.27Å; F40-M285 HydrophobicContact CZ-CE 3.91Å; F40-M285 HydrophobicContact CZ-SD 3.33Å; F40-M285 WeakPolarHBondContact CZ-SD 3.32Å; F40-H412 AromaticContact CE1-CE1 3.78Å; F40-H412 AromaticContact CZ-CE1 3.93Å
41	G	85	Confident	74.9	Confident	67 Å²	67	77.1 Å²	77.1	69%	0.691	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.9	16.1	-179.4	0	0	0	0	0	114	E39 G45	E39-G41 VanDerWaalsContact C-N 3.28Å; E39-G41 PolarHBondContact O-N 3.02Å; G41-G45 PolarHBondContact O-N 2.96Å
42	G	89.4	Confident	77.6	Confident	7 Å²	7	74 Å²	74	7%	0.072	41%	0.409	C	S	.	.	H	α-helix	trans	62	-137.6	175.6	0	0	0	0	0	113.4	E39 F40 L44 G45 A46	E39-G42 PolarHBondContact O-N 3.06Å; F40-G42 PolarHBondContact O-N 3.13Å; G42-L44 VanDerWaalsContact C-N 3.31Å; G42-L44 PolarHBondContact O-N 3.16Å; G42-G45 PolarHBondContact O-N 3.11Å; G42-A46 WeakPolarHBondContact O-CB 3.29Å; G42-A46 PolarHBondContact O-N 3.25Å
43	T	89.8	Confident	80.2	Confident	40 Å²	40	70.4 Å²	70.4	25%	0.245	39%	0.39	C	S	.	.	H	α-helix	trans	-64.5	-36.1	-174.5	-53.3	0	0	0	0	112.6	R38 A46 V47 N195	R38-T43 PolarHBondContact NH1-OG1 2.96Å; T43-A46 PolarHBondContact O-N 3.32Å; T43-V47 WeakPolarHBondContact O-CG2 3.29Å; T43-V47 PolarHBondContact O-N 2.69Å; T43-V47 VanDerWaalsContact O-N 3.17Å; T43-N195 VanDerWaalsContact CG2-ND2 3.3Å; T43-N195 WeakPolarHBondContact CG2-ND2 3.35Å; T43-N195 PolarHBondContact OG1-ND2 3.19Å
44	L	91.4	Very high	83.1	Confident	128 Å²	128	65.8 Å²	65.8	67%	0.67	36%	0.358	S	S	*	.	H	α-helix	trans	-63.8	-48.1	178.7	-177.8	65.6	0	0	0	110.4	G42 A46 V47 C48	G42-L44 VanDerWaalsContact C-N 3.31Å; G42-L44 PolarHBondContact O-N 3.16Å; L44-A46 PolarHBondContact O-N 3.02Å; L44-V47 PolarHBondContact O-N 3.26Å; L44-V47 VanDerWaalsContact O-N 3.14Å; L44-C48 WeakPolarHBondContact O-CB 3.46Å; L44-C48 PolarHBondContact O-N 3.28Å; L44-C48 PolarHBondContact O-SG 3.22Å; L44-C48 VanDerWaalsContact O-SG 3.36Å
45	G	90.3	Very high	85.5	Confident	9 Å²	9	66.1 Å²	66.1	9%	0.093	36%	0.362	C	S	.	.	H	α-helix	trans	-63.2	-40.9	175.6	0	0	0	0	0	112.6	F40 G41 G42 V47 C48 I49	F40-G45 WeakPolarHBondContact O-CA 3.39Å; G41-G45 PolarHBondContact O-N 2.96Å; G42-G45 PolarHBondContact O-N 3.11Å; G45-V47 PolarHBondContact O-N 3.31Å; G45-V47 VanDerWaalsContact O-N 3.08Å; G45-C48 PolarHBondContact O-N 2.76Å; G45-I49 WeakPolarHBondContact O-CB 3.3Å; G45-I49 WeakPolarHBondContact O-CG1 3.49Å; G45-I49 PolarHBondContact O-N 3.12Å
46	A	92.3	Very high	88	Confident	4 Å²	4	60.5 Å²	60.5	3%	0.033	33%	0.334	C	S	.	.	H	α-helix	trans	-61	-18	175.2	0	0	0	0	0	114.5	G42 T43 L44 P50 Y198 F201	G42-A46 WeakPolarHBondContact O-CB 3.29Å; G42-A46 PolarHBondContact O-N 3.25Å; T43-A46 PolarHBondContact O-N 3.32Å; L44-A46 PolarHBondContact O-N 3.02Å; A46-P50 VanDerWaalsContact O-CD 3.29Å; A46-P50 WeakPolarHBondContact O-CD 3.27Å; A46-P50 VanDerWaalsContact O-CG 3.29Å; A46-P50 WeakPolarHBondContact O-CG 3.12Å; A46-Y198 HydrophobicContact CB-CD2 3.93Å; A46-F201 HydrophobicContact CB-CB 3.69Å; A46-F201 HydrophobicContact CB-CD1 3.96Å; A46-F201 HydrophobicContact CB-CG 3.97Å
47	V	92	Very high	89.9	Confident	68 Å²	68	57 Å²	57	41%	0.412	31%	0.312	S	S	.	.	H	α-helix	trans	-95.2	-46.5	173.1	173.8	0	0	0	0	111.5	T43 L44 G45 L197	T43-V47 WeakPolarHBondContact O-CG2 3.29Å; T43-V47 PolarHBondContact O-N 2.69Å; T43-V47 VanDerWaalsContact O-N 3.17Å; L44-V47 PolarHBondContact O-N 3.26Å; L44-V47 VanDerWaalsContact O-N 3.14Å; G45-V47 PolarHBondContact O-N 3.31Å; G45-V47 VanDerWaalsContact O-N 3.08Å; V47-L197 HydrophobicContact CG2-CB 4.31Å; V47-L197 HydrophobicContact CG2-CD1 3.72Å; V47-L197 HydrophobicContact CG2-CG 4.45Å
48	C	93.8	Very high	91.3	Very high	42 Å²	42	51.5 Å²	51.5	28%	0.284	29%	0.288	S	S	.	.	H	α-helix	trans	-72.1	-43.4	-175.1	-66.3	0	0	0	0	112.2	L44 G45 V51 F52	L44-C48 WeakPolarHBondContact O-CB 3.46Å; L44-C48 PolarHBondContact O-N 3.28Å; L44-C48 PolarHBondContact O-SG 3.22Å; L44-C48 VanDerWaalsContact O-SG 3.36Å; G45-C48 PolarHBondContact O-N 2.76Å; C48-V51 PolarHBondContact O-N 2.71Å; C48-V51 VanDerWaalsContact O-N 3.09Å; C48-F52 HydrophobicContact CB-CD2 3.9Å; C48-F52 HydrophobicContact CB-CE2 4.05Å; C48-F52 WeakPolarHBondContact O-CD2 3.29Å; C48-F52 PolarHBondContact O-N 3.08Å
49	I	93.2	Very high	91.9	Very high	41 Å²	41	48.1 Å²	48.1	21%	0.21	28%	0.276	C	S	.	.	H	α-helix	trans	-61.5	-46.6	-173.7	-65.8	171.2	0	0	0	111.6	F40 G45 V51 F52 L53 F201	F40-I49 HydrophobicContact CB-CD1 4.09Å; G45-I49 WeakPolarHBondContact O-CB 3.3Å; G45-I49 WeakPolarHBondContact O-CG1 3.49Å; G45-I49 PolarHBondContact O-N 3.12Å; I49-V51 PolarHBondContact O-N 2.83Å; I49-V51 VanDerWaalsContact O-N 3.15Å; I49-F52 PolarHBondContact O-N 3.22Å; I49-L53 HydrophobicContact CG2-CD1 3.29Å; I49-L53 HydrophobicContact CG2-CG 3.66Å; I49-L53 WeakPolarHBondContact O-CB 3.49Å; I49-L53 PolarHBondContact O-N 3.25Å; I49-F201 HydrophobicContact CB-CE2 3.97Å; I49-F201 HydrophobicContact CB-CZ 4.15Å; I49-F201 HydrophobicContact CD1-CE1 4.37Å; I49-F201 HydrophobicContact CD1-CZ 3.87Å; I49-F201 HydrophobicContact CG2-CE2 3.57Å; I49-F201 HydrophobicContact CG2-CZ 3.8Å
50	P	94.7	Very high	92.5	Very high	12 Å²	12	46.2 Å²	46.2	8%	0.078	27%	0.267	C	S	.	.	H	α-helix	trans	-60.8	-21.5	175.8	-26.8	36.9	0	0	0	115.2	A46 P54 F169 F201 F284	A46-P50 VanDerWaalsContact O-CD 3.29Å; A46-P50 WeakPolarHBondContact O-CD 3.27Å; A46-P50 VanDerWaalsContact O-CG 3.29Å; A46-P50 WeakPolarHBondContact O-CG 3.12Å; P50-P54 WeakPolarHBondContact O-CD 3.47Å; P50-P54 VanDerWaalsContact O-CG 3.22Å; P50-P54 WeakPolarHBondContact O-CG 3.44Å; P50-F169 HydrophobicContact CB-CE1 4.34Å; P50-F169 HydrophobicContact CB-CZ 4.34Å; P50-F169 WeakPolarHBondContact O-CZ 3.47Å; P50-F201 HydrophobicContact CG-CD2 3.83Å; P50-F201 HydrophobicContact CG-CE2 4.4Å; P50-F284 HydrophobicContact CB-CD1 3.94Å; P50-F284 HydrophobicContact CB-CE1 3.69Å; P50-F284 HydrophobicContact CB-CZ 4.08Å; P50-F284 HydrophobicContact CG-CD1 3.87Å; P50-F284 HydrophobicContact CG-CE1 4.04Å
51	V	93.1	Very high	93	Very high	84 Å²	84	43.7 Å²	43.7	51%	0.509	26%	0.256	S	S	.	.	H	α-helix	trans	-89.6	-49.9	176.8	179.2	0	0	0	0	110.8	C48 I49 L55	C48-V51 PolarHBondContact O-N 2.71Å; C48-V51 VanDerWaalsContact O-N 3.09Å; I49-V51 PolarHBondContact O-N 2.83Å; I49-V51 VanDerWaalsContact O-N 3.15Å; V51-L55 HydrophobicContact CG1-CD1 4.35Å; V51-L55 WeakPolarHBondContact O-CG 3.47Å
52	F	94.1	Very high	93.4	Very high	126 Å²	126	40.9 Å²	40.9	55%	0.553	23%	0.226	S	C	*	.	H	α-helix	trans	-78.4	-32.4	-171.9	-70.5	-67.9	0	0	0	114.1	C48 I49 L55 T56	C48-F52 HydrophobicContact CB-CD2 3.9Å; C48-F52 HydrophobicContact CB-CE2 4.05Å; C48-F52 WeakPolarHBondContact O-CD2 3.29Å; C48-F52 PolarHBondContact O-N 3.08Å; I49-F52 PolarHBondContact O-N 3.22Å; F52-L55 PolarHBondContact O-N 3.01Å; F52-T56 WeakPolarHBondContact O-CB 3.34Å; F52-T56 PolarHBondContact O-N 3.23Å; F52-T56 PolarHBondContact O-OG1 2.9Å
53	L	93.9	Very high	93.7	Very high	55 Å²	55	40.5 Å²	40.5	29%	0.288	22%	0.222	S	C	.	.	H	α-helix	trans	-66.2	-46.4	-179.9	-72.2	-174	0	0	0	113	I49 L55 T56 V57 F288 W293	I49-L53 HydrophobicContact CG2-CD1 3.29Å; I49-L53 HydrophobicContact CG2-CG 3.66Å; I49-L53 WeakPolarHBondContact O-CB 3.49Å; I49-L53 PolarHBondContact O-N 3.25Å; L53-L55 VanDerWaalsContact C-N 3.29Å; L53-L55 PolarHBondContact O-N 2.71Å; L53-T56 WeakPolarHBondContact O-CB 3.49Å; L53-T56 PolarHBondContact O-N 3.09Å; L53-T56 VanDerWaalsContact O-N 3.1Å; L53-V57 WeakPolarHBondContact O-CG2 3.28Å; L53-V57 PolarHBondContact O-N 3.45Å; L53-F288 HydrophobicContact CB-CD1 4.42Å; L53-F288 HydrophobicContact CB-CE1 3.6Å; L53-F288 HydrophobicContact CB-CZ 3.97Å; L53-F288 HydrophobicContact CD1-CD1 4.33Å; L53-F288 HydrophobicContact CD1-CE1 4.08Å; L53-F288 HydrophobicContact CG-CE1 4.49Å; L53-W293 HydrophobicContact CB-CZ3 4.44Å; L53-W293 HydrophobicContact CD2-CE3 4.29Å; L53-W293 HydrophobicContact CD2-CH2 4.02Å; L53-W293 HydrophobicContact CD2-CZ3 3.63Å
54	P	95.8	Very high	93.9	Very high	11 Å²	11	38.6 Å²	38.6	7%	0.071	21%	0.211	C	C	.	.	H	α-helix	trans	-55.5	-44.2	173.1	-29.2	37.1	0	0	0	113	P50 T56 V57 L58 V165 F169 F284 F288	P50-P54 WeakPolarHBondContact O-CD 3.47Å; P50-P54 VanDerWaalsContact O-CG 3.22Å; P50-P54 WeakPolarHBondContact O-CG 3.44Å; P54-T56 VanDerWaalsContact C-N 3.28Å; P54-T56 PolarHBondContact O-N 2.76Å; P54-V57 PolarHBondContact O-N 2.84Å; P54-L58 WeakPolarHBondContact O-CG 3.39Å; P54-L58 PolarHBondContact O-N 3.41Å; P54-L58 VanDerWaalsContact O-N 3.12Å; P54-V165 HydrophobicContact CB-CG1 3.82Å; P54-V165 HydrophobicContact CB-CG2 4.11Å; P54-V165 HydrophobicContact CG-CG1 4.1Å; P54-F169 HydrophobicContact CG-CE2 4.21Å; P54-F284 HydrophobicContact CG-CZ 4.32Å; P54-F288 HydrophobicContact CB-CE2 4.17Å; P54-F288 HydrophobicContact CB-CZ 4.47Å; P54-F288 HydrophobicContact CG-CD2 4.35Å; P54-F288 HydrophobicContact CG-CE2 3.7Å; P54-F288 HydrophobicContact CG-CZ 4.05Å
55	L	94.4	Very high	93.9	Very high	99 Å²	99	35.7 Å²	35.7	52%	0.518	19%	0.194	S	C	.	.	H	α-helix	trans	-62.4	-38.1	177	-64.6	175.3	0	0	0	111.7	V51 F52 L53 L58 F59	V51-L55 HydrophobicContact CG1-CD1 4.35Å; V51-L55 WeakPolarHBondContact O-CG 3.47Å; F52-L55 PolarHBondContact O-N 3.01Å; L53-L55 VanDerWaalsContact C-N 3.29Å; L53-L55 PolarHBondContact O-N 2.71Å; L55-L58 PolarHBondContact O-N 3.29Å; L55-F59 VanDerWaalsContact O-CB 3.22Å; L55-F59 WeakPolarHBondContact O-CB 3.3Å; L55-F59 PolarHBondContact O-N 2.92Å
56	T	94.3	Very high	94	Very high	45 Å²	45	36 Å²	36	28%	0.276	19%	0.194	S	C	.	.	H	α-helix	trans	-64.3	-43.2	176.4	-57.2	0	0	0	0	111.3	F52 L53 P54 F59 L60 W293	F52-T56 WeakPolarHBondContact O-CB 3.34Å; F52-T56 PolarHBondContact O-N 3.23Å; F52-T56 PolarHBondContact O-OG1 2.9Å; L53-T56 WeakPolarHBondContact O-CB 3.49Å; L53-T56 PolarHBondContact O-N 3.09Å; L53-T56 VanDerWaalsContact O-N 3.1Å; P54-T56 VanDerWaalsContact C-N 3.28Å; P54-T56 PolarHBondContact O-N 2.76Å; T56-F59 PolarHBondContact O-N 3.23Å; T56-L60 HydrophobicContact CG2-CD1 3.81Å; T56-L60 HydrophobicContact CG2-CG 4.21Å; T56-L60 WeakPolarHBondContact O-CB 3.46Å; T56-L60 WeakPolarHBondContact O-CG 3.33Å; T56-L60 PolarHBondContact O-N 3.48Å; T56-W293 HydrophobicContact CG2-CH2 4.32Å; T56-W293 HydrophobicContact CG2-CZ3 4.31Å
57	V	95.8	Very high	93.8	Very high	1 Å²	1	39.9 Å²	39.9	1%	0.006	23%	0.226	C	C	.	.	H	α-helix	trans	-58.7	-51.1	176.3	173.3	0	0	0	0	110.5	L53 P54 F59 L60 I61 A161 F288 W293 F296 T297	L53-V57 WeakPolarHBondContact O-CG2 3.28Å; L53-V57 PolarHBondContact O-N 3.45Å; P54-V57 PolarHBondContact O-N 2.84Å; V57-F59 PolarHBondContact O-N 2.9Å; V57-L60 PolarHBondContact O-N 3.5Å; V57-I61 HydrophobicContact CG1-CD1 3.93Å; V57-I61 VanDerWaalsContact O-CG1 3.3Å; V57-I61 WeakPolarHBondContact O-CG1 3.41Å; V57-I61 PolarHBondContact O-N 2.95Å; V57-I61 VanDerWaalsContact O-N 3.09Å; V57-A161 HydrophobicContact CG1-CB 4.3Å; V57-F288 HydrophobicContact CG2-CE1 4.44Å; V57-F288 HydrophobicContact CG2-CZ 3.79Å; V57-W293 HydrophobicContact CG2-CE3 3.56Å; V57-W293 HydrophobicContact CG2-CZ3 3.98Å; V57-F296 HydrophobicContact CG1-CB 3.83Å; V57-T297 HydrophobicContact CG2-CG2 3.85Å
58	L	94.9	Very high	93.6	Very high	27 Å²	27	41.8 Å²	41.8	14%	0.141	23%	0.231	C	C	.	.	H	α-helix	trans	-61.8	-45.3	179.8	-62	178.7	0	0	0	111.6	P54 L55 L60 I61 C62 L84 V158 A161 V162	P54-L58 WeakPolarHBondContact O-CG 3.39Å; P54-L58 PolarHBondContact O-N 3.41Å; P54-L58 VanDerWaalsContact O-N 3.12Å; L55-L58 PolarHBondContact O-N 3.29Å; L58-L60 PolarHBondContact O-N 3.36Å; L58-I61 PolarHBondContact O-N 3.02Å; L58-C62 PolarHBondContact O-N 3.07Å; L58-C62 PolarHBondContact O-SG 3.2Å; L58-L84 HydrophobicContact CD1-CD2 4.49Å; L58-V158 HydrophobicContact CD2-CG1 4.35Å; L58-A161 HydrophobicContact CD2-CB 3.97Å; L58-V162 HydrophobicContact CD1-CG2 4.22Å; L58-V162 HydrophobicContact CD2-CG2 3.68Å
59	F	94.3	Very high	93.4	Very high	46 Å²	46	39.8 Å²	39.8	20%	0.202	22%	0.217	C	C	.	.	H	α-helix	trans	-57	-48.9	176.1	169.2	-106.6	0	0	0	112.1	L55 T56 V57 I61 C62 V63 P76	L55-F59 VanDerWaalsContact O-CB 3.22Å; L55-F59 WeakPolarHBondContact O-CB 3.3Å; L55-F59 PolarHBondContact O-N 2.92Å; T56-F59 PolarHBondContact O-N 3.23Å; V57-F59 PolarHBondContact O-N 2.9Å; F59-I61 VanDerWaalsContact C-N 3.34Å; F59-I61 PolarHBondContact O-N 2.88Å; F59-C62 PolarHBondContact O-N 2.97Å; F59-V63 HydrophobicContact CD1-CG2 4.46Å; F59-V63 HydrophobicContact CD2-CG2 3.86Å; F59-V63 HydrophobicContact CE1-CG2 4.1Å; F59-V63 HydrophobicContact CE2-CG2 3.45Å; F59-V63 VanDerWaalsContact CE2-CG2 3.45Å; F59-V63 HydrophobicContact CG-CG2 4.36Å; F59-V63 HydrophobicContact CZ-CG2 3.59Å; F59-V63 VanDerWaalsContact O-CG2 3.28Å; F59-V63 WeakPolarHBondContact O-CG2 3.43Å; F59-V63 PolarHBondContact O-N 2.98Å; F59-P76 HydrophobicContact CD2-CB 3.96Å; F59-P76 HydrophobicContact CE2-CB 3.72Å
60	L	95.7	Very high	93.3	Very high	5 Å²	5	40.1 Å²	40.1	3%	0.026	22%	0.223	C	C	.	.	H	α-helix	trans	-64.1	-39.1	-178.3	-70.1	170.9	0	0	0	112.2	T56 V57 L58 S64 T297 L300 L398 F401	T56-L60 HydrophobicContact CG2-CD1 3.81Å; T56-L60 HydrophobicContact CG2-CG 4.21Å; T56-L60 WeakPolarHBondContact O-CB 3.46Å; T56-L60 WeakPolarHBondContact O-CG 3.33Å; T56-L60 PolarHBondContact O-N 3.48Å; V57-L60 PolarHBondContact O-N 3.5Å; L58-L60 PolarHBondContact O-N 3.36Å; L60-S64 WeakPolarHBondContact O-CB 3.38Å; L60-S64 PolarHBondContact O-N 3.4Å; L60-T297 HydrophobicContact CD1-CG2 4.29Å; L60-L300 HydrophobicContact CB-CD1 3.94Å; L60-L300 HydrophobicContact CB-CD2 3.93Å; L60-L300 HydrophobicContact CD1-CD1 4.07Å; L60-L300 HydrophobicContact CG-CD1 4.42Å; L60-L300 WeakPolarHBondContact O-CD2 3.36Å; L60-L398 HydrophobicContact CD2-CD1 3.66Å; L60-F401 HydrophobicContact CD1-CD1 3.75Å; L60-F401 HydrophobicContact CD1-CD2 4.47Å; L60-F401 HydrophobicContact CD1-CE1 3.41Å; L60-F401 VanDerWaalsContact CD1-CE1 3.41Å; L60-F401 HydrophobicContact CD1-CE2 4.18Å; L60-F401 HydrophobicContact CD1-CG 4.28Å; L60-F401 HydrophobicContact CD1-CZ 3.65Å; L60-F401 HydrophobicContact CD2-CD1 4.45Å; L60-F401 HydrophobicContact CD2-CD2 4.34Å; L60-F401 HydrophobicContact CD2-CG 4.24Å
61	I	95.3	Very high	93	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-62.4	-49.9	174.9	-64.1	165.4	0	0	0	109.9	V57 L58 F59 V63 S64 Q65 L157 V158 A161 F296	V57-I61 HydrophobicContact CG1-CD1 3.93Å; V57-I61 VanDerWaalsContact O-CG1 3.3Å; V57-I61 WeakPolarHBondContact O-CG1 3.41Å; V57-I61 PolarHBondContact O-N 2.95Å; V57-I61 VanDerWaalsContact O-N 3.09Å; L58-I61 PolarHBondContact O-N 3.02Å; F59-I61 VanDerWaalsContact C-N 3.34Å; F59-I61 PolarHBondContact O-N 2.88Å; I61-V63 PolarHBondContact O-N 3.01Å; I61-S64 WeakPolarHBondContact O-CB 3.43Å; I61-S64 PolarHBondContact O-N 3.42Å; I61-S64 VanDerWaalsContact O-N 3.08Å; I61-S64 PolarHBondContact O-OG 2.93Å; I61-Q65 PolarHBondContact O-N 3.36Å; I61-L157 HydrophobicContact CD1-CG 4.47Å; I61-L157 HydrophobicContact CG2-CB 4.38Å; I61-L157 HydrophobicContact CG2-CD2 3.61Å; I61-L157 HydrophobicContact CG2-CG 3.86Å; I61-V158 HydrophobicContact CB-CG2 4.39Å; I61-V158 HydrophobicContact CG2-CG2 3.55Å; I61-A161 HydrophobicContact CD1-CB 3.49Å; I61-A161 VanDerWaalsContact CD1-CB 3.49Å; I61-F296 HydrophobicContact CD1-CB 3.94Å; I61-F296 HydrophobicContact CD1-CD1 4.18Å; I61-F296 HydrophobicContact CD1-CG 4.38Å
62	C	93.8	Very high	92.7	Very high	8 Å²	8	44.5 Å²	44.5	5%	0.054	24%	0.244	C	C	.	.	H	α-helix	trans	-59.7	-44.6	179.2	-69	0	0	0	0	111.9	L58 F59 S64 Q65 S66 C77 P79	L58-C62 PolarHBondContact O-N 3.07Å; L58-C62 PolarHBondContact O-SG 3.2Å; F59-C62 PolarHBondContact O-N 2.97Å; C62-S64 VanDerWaalsContact C-N 3.3Å; C62-S64 PolarHBondContact O-N 3.23Å; C62-Q65 PolarHBondContact O-N 2.98Å; C62-S66 PolarHBondContact O-N 3.07Å; C62-C77 HydrophobicContact CB-CB 4.34Å; C62-P79 VanDerWaalsContact SG-CD 3.53Å
63	V	94.5	Very high	92.3	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-61.8	-39	175.4	176.9	0	0	0	0	110.9	F59 I61 Q65 S66 A69 V71 C77 L398	F59-V63 HydrophobicContact CD1-CG2 4.46Å; F59-V63 HydrophobicContact CD2-CG2 3.86Å; F59-V63 HydrophobicContact CE1-CG2 4.1Å; F59-V63 HydrophobicContact CE2-CG2 3.45Å; F59-V63 VanDerWaalsContact CE2-CG2 3.45Å; F59-V63 HydrophobicContact CG-CG2 4.36Å; F59-V63 HydrophobicContact CZ-CG2 3.59Å; F59-V63 VanDerWaalsContact O-CG2 3.28Å; F59-V63 WeakPolarHBondContact O-CG2 3.43Å; F59-V63 PolarHBondContact O-N 2.98Å; I61-V63 PolarHBondContact O-N 3.01Å; V63-Q65 PolarHBondContact O-N 3.28Å; V63-S66 PolarHBondContact O-N 3.09Å; V63-S66 PolarHBondContact O-OG 3.01Å; V63-A69 WeakPolarHBondContact O-CA 3.48Å; V63-V71 HydrophobicContact CG1-CG1 4.27Å; V63-C77 HydrophobicContact CG2-CB 4.21Å; V63-L398 HydrophobicContact CB-CD1 4.32Å; V63-L398 HydrophobicContact CG1-CD1 4.02Å; V63-L398 HydrophobicContact CG1-CD2 4.08Å; V63-L398 HydrophobicContact CG1-CG 4.49Å
64	S	94.4	Very high	91.6	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-62.3	-28.9	178.6	78.8	0	0	0	0	114.4	L60 I61 C62 S303	L60-S64 WeakPolarHBondContact O-CB 3.38Å; L60-S64 PolarHBondContact O-N 3.4Å; I61-S64 WeakPolarHBondContact O-CB 3.43Å; I61-S64 PolarHBondContact O-N 3.42Å; I61-S64 VanDerWaalsContact O-N 3.08Å; I61-S64 PolarHBondContact O-OG 2.93Å; C62-S64 VanDerWaalsContact C-N 3.3Å; C62-S64 PolarHBondContact O-N 3.23Å; S64-S303 WeakPolarHBondContact OG-CB 3.21Å; S64-S303 PolarHBondContact OG-OG 2.89Å
65	Q	91.6	Very high	91.1	Very high	67 Å²	67	53.7 Å²	53.7	31%	0.313	29%	0.285	S	S	.	.	H	α-helix	trans	-97.7	-10.7	-179.1	-63.2	-178.8	-19	0	0	112.7	I61 C62 V63 C154	I61-Q65 PolarHBondContact O-N 3.36Å; C62-Q65 PolarHBondContact O-N 2.98Å; V63-Q65 PolarHBondContact O-N 3.28Å; Q65-C154 PolarHBondContact NE2-O 3.25Å
66	S	91.9	Very high	90.5	Very high	15 Å²	15	51 Å²	51	11%	0.105	27%	0.273	C	S	.	.	S	Bend	trans	-70.9	155.2	177	72.2	0	0	0	0	112.5	C62 V63 E68 A69 H308	C62-S66 PolarHBondContact O-N 3.07Å; V63-S66 PolarHBondContact O-N 3.09Å; V63-S66 PolarHBondContact O-OG 3.01Å; S66-E68 VanDerWaalsContact C-N 3.27Å; S66-E68 PolarHBondContact O-N 3.02Å; S66-A69 WeakPolarHBondContact OG-CA 3.35Å; S66-A69 PolarHBondContact OG-N 2.8Å; S66-A69 VanDerWaalsContact OG-N 3.08Å; S66-H308 PolarHBondContact O-NE2 3.35Å
67	A	87.6	Confident	89.8	Confident	85 Å²	85	50.6 Å²	50.6	70%	0.702	27%	0.272	S	S	*	.	S	Bend	trans	-68.9	-24.8	-179.4	0	0	0	0	0	113.3	H308	A67-H308 PolarHBondContact O-CE1 3.45Å; A67-H308 VanDerWaalsContact O-CE1 3.25Å
68	E	88.1	Confident	89.2	Confident	108 Å²	108	56.6 Å²	56.6	51%	0.505	30%	0.303	S	S	.	.	S	Bend	trans	-96.3	-24.3	-177.7	-63.3	77.3	-177.7	0	0	112.8	S66 S70 H396	S66-E68 VanDerWaalsContact C-N 3.27Å; S66-E68 PolarHBondContact O-N 3.02Å; E68-S70 PolarHBondContact O-N 3.15Å; E68-H396 PolarHBondContact O-CD2 2.59Å; E68-H396 VanDerWaalsContact O-CD2 3.29Å; E68-H396 PolarHBondContact O-NE2 3.24Å
69	A	90.9	Very high	88.7	Confident	1 Å²	1	56.4 Å²	56.4	1%	0.008	30%	0.304	C	S	.	.			trans	42.2	34.7	-175.4	0	0	0	0	0	114.7	V63 S66 F304 H308	V63-A69 WeakPolarHBondContact O-CA 3.48Å; S66-A69 WeakPolarHBondContact OG-CA 3.35Å; S66-A69 PolarHBondContact OG-N 2.8Å; S66-A69 VanDerWaalsContact OG-N 3.08Å; A69-F304 HydrophobicContact CB-CD2 3.96Å; A69-F304 HydrophobicContact CB-CE2 3.68Å; A69-H308 VanDerWaalsContact CB-NE2 3.3Å; A69-H308 WeakPolarHBondContact CB-NE2 3.29Å
70	S	90.5	Very high	88.3	Confident	47 Å²	47	56.6 Å²	56.6	33%	0.329	31%	0.31	S	S	.	.			trans	-95.8	114.7	-176.6	179.7	0	0	0	0	110.8	E68 L72 Q73	E68-S70 PolarHBondContact O-N 3.15Å; S70-L72 PolarHBondContact O-N 2.97Å; S70-L72 PolarHBondContact OG-N 2.7Å; S70-Q73 WeakPolarHBondContact O-CB 3.33Å; S70-Q73 PolarHBondContact O-N 3.4Å
71	V	88.1	Confident	87.9	Confident	38 Å²	38	60.3 Å²	60.3	23%	0.23	34%	0.342	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.7	-12.2	174.3	-62.2	0	0	0	0	113.3	V63 L397 L398	V63-V71 HydrophobicContact CG1-CG1 4.27Å; V71-L397 HydrophobicContact CG2-CB 4.18Å; V71-L397 HydrophobicContact CG2-CD2 3.99Å; V71-L397 HydrophobicContact CG2-CG 4.38Å; V71-L398 HydrophobicContact CG1-CB 3.89Å; V71-L398 HydrophobicContact CG1-CD1 3.57Å; V71-L398 HydrophobicContact CG1-CG 4.36Å
72	L	87.4	Confident	87.4	Confident	150 Å²	150	66 Å²	66	79%	0.785	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.7	4.7	179.7	-60.1	178.9	0	0	0	112.7	S70	S70-L72 PolarHBondContact O-N 2.97Å; S70-L72 PolarHBondContact OG-N 2.7Å
73	Q	85.2	Confident	87.1	Confident	66 Å²	66	69.7 Å²	69.7	31%	0.308	39%	0.389	S	S	.	.			trans	-64.8	135.1	-178.8	-174.8	175.2	-1.4	0	0	111.6	S70	S70-Q73 WeakPolarHBondContact O-CB 3.33Å; S70-Q73 PolarHBondContact O-N 3.4Å
74	W	79.8	Confident	87	Confident	224 Å²	224	72.7 Å²	72.7	85%	0.848	41%	0.405	S	S	*	.	S	Bend	trans	-129.2	128.9	172.6	-172.2	-97.5	0	0	0	110.5	P76	W74-P76 HydrophobicContact CZ3-CG 4.36Å
75	P	83.5	Confident	86.9	Confident	96 Å²	96	80.5 Å²	80.5	62%	0.623	43%	0.434	S	S	*	.	S	Bend	cis	-65.1	154.4	-2.8	29.2	-35.3	0	0	0	112.4
76	P	82.1	Confident	87.1	Confident	42 Å²	42	79 Å²	79	27%	0.273	43%	0.428	S	S	.	.			trans	-62.5	145.6	-179.4	26.7	-33.9	0	0	0	110.4	F59 W74 L78	F59-P76 HydrophobicContact CD2-CB 3.96Å; F59-P76 HydrophobicContact CE2-CB 3.72Å; W74-P76 HydrophobicContact CZ3-CG 4.36Å; P76-L78 HydrophobicContact CG-CD2 4.47Å; P76-L78 HydrophobicContact CG-CG 4.36Å; P76-L78 PolarHBondContact O-N 3.08Å; P76-L78 VanDerWaalsContact O-N 3.09Å
77	C	80.7	Confident	87.2	Confident	37 Å²	37	82.1 Å²	82.1	25%	0.25	45%	0.448	C	S	.	.			trans	-66.1	110.4	171.4	-170.1	0	0	0	0	108.6	C62 V63	C62-C77 HydrophobicContact CB-CB 4.34Å; V63-C77 HydrophobicContact CG2-CB 4.21Å
78	L	82.4	Confident	87.6	Confident	126 Å²	126	81 Å²	81	66%	0.66	43%	0.43	S	S	*	.			trans	-109.3	142.1	177.5	-65.7	177	0	0	0	109.2	P76	P76-L78 HydrophobicContact CG-CD2 4.47Å; P76-L78 HydrophobicContact CG-CG 4.36Å; P76-L78 PolarHBondContact O-N 3.08Å; P76-L78 VanDerWaalsContact O-N 3.09Å
79	P	85.3	Confident	88	Confident	24 Å²	24	75.9 Å²	75.9	16%	0.156	41%	0.406	C	S	.	.			trans	-64.7	140.6	175.5	27.6	-32.8	0	0	0	109.9	C62 Q83 L84 V158	C62-P79 VanDerWaalsContact SG-CD 3.53Å; P79-Q83 HydrophobicContact CB-CB 4.11Å; P79-L84 HydrophobicContact CB-CD2 3.99Å; P79-L84 HydrophobicContact CB-CG 4.19Å; P79-L84 HydrophobicContact CG-CD2 3.47Å; P79-L84 VanDerWaalsContact CG-CD2 3.47Å; P79-L84 HydrophobicContact CG-CG 4.04Å; P79-V158 HydrophobicContact CB-CG1 3.97Å; P79-V158 HydrophobicContact CG-CG1 4.42Å
80	S	86.1	Confident	88.3	Confident	49 Å²	49	77.3 Å²	77.3	34%	0.343	42%	0.416	S	S	.	.			trans	-70.4	161.9	170.1	58.7	0	0	0	0	110.8	D82 Q83 L84	S80-D82 WeakPolarHBondContact CB-OD1 3.13Å; S80-D82 PolarHBondContact O-N 3.39Å; S80-D82 VanDerWaalsContact OG-CG 3.25Å; S80-D82 PolarHBondContact OG-OD1 3.48Å; S80-D82 PolarHBondContact OG-OD2 3.12Å; S80-Q83 VanDerWaalsContact N-OE1 3.1Å; S80-Q83 WeakPolarHBondContact O-CB 3.44Å; S80-Q83 PolarHBondContact O-N 3.05Å; S80-Q83 WeakPolarHBondContact OG-CG 3.5Å; S80-Q83 PolarHBondContact OG-OE1 3.49Å; S80-L84 PolarHBondContact O-N 2.63Å
81	A	86.8	Confident	88.6	Confident	84 Å²	84	80.7 Å²	80.7	69%	0.694	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.7	-32.1	-174.5	0	0	0	0	0	113.2	L84	A81-L84 PolarHBondContact O-N 3.22Å
82	D	85.6	Confident	89.1	Confident	120 Å²	120	82.1 Å²	82.1	64%	0.642	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.9	-32.8	173.7	55	-59.9	0	0	0	112.9	S80 L84	S80-D82 WeakPolarHBondContact CB-OD1 3.13Å; S80-D82 PolarHBondContact O-N 3.39Å; S80-D82 VanDerWaalsContact OG-CG 3.25Å; S80-D82 PolarHBondContact OG-OD1 3.48Å; S80-D82 PolarHBondContact OG-OD2 3.12Å; D82-L84 VanDerWaalsContact C-N 3.3Å; D82-L84 PolarHBondContact O-N 3.02Å
83	Q	87.6	Confident	89.6	Confident	85 Å²	85	76 Å²	76	40%	0.397	40%	0.401	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.9	-17.4	176.7	-68.6	177.2	-32.6	0	0	113.1	P79 S80 V158 P159	P79-Q83 HydrophobicContact CB-CB 4.11Å; S80-Q83 VanDerWaalsContact N-OE1 3.1Å; S80-Q83 WeakPolarHBondContact O-CB 3.44Å; S80-Q83 PolarHBondContact O-N 3.05Å; S80-Q83 WeakPolarHBondContact OG-CG 3.5Å; S80-Q83 PolarHBondContact OG-OE1 3.49Å; Q83-V158 VanDerWaalsContact O-CG1 3.23Å; Q83-V158 WeakPolarHBondContact O-CG1 3.36Å; Q83-P159 WeakPolarHBondContact O-CD 3.31Å; Q83-P159 VanDerWaalsContact O-CG 3.3Å; Q83-P159 WeakPolarHBondContact O-CG 3.44Å
84	L	91.8	Very high	90.2	Very high	62 Å²	62	77.6 Å²	77.6	33%	0.325	41%	0.411	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.6	-21.1	-179.9	-73.5	173.9	0	0	0	113.2	L58 P79 S80 A81 D82 V158 V162	L58-L84 HydrophobicContact CD1-CD2 4.49Å; P79-L84 HydrophobicContact CB-CD2 3.99Å; P79-L84 HydrophobicContact CB-CG 4.19Å; P79-L84 HydrophobicContact CG-CD2 3.47Å; P79-L84 VanDerWaalsContact CG-CD2 3.47Å; P79-L84 HydrophobicContact CG-CG 4.04Å; S80-L84 PolarHBondContact O-N 2.63Å; A81-L84 PolarHBondContact O-N 3.22Å; D82-L84 VanDerWaalsContact C-N 3.3Å; D82-L84 PolarHBondContact O-N 3.02Å; L84-V158 HydrophobicContact CD2-CG1 4.34Å; L84-V162 HydrophobicContact CD2-CG2 3.79Å
85	W	92.8	Very high	91	Very high	165 Å²	165	69.9 Å²	69.9	63%	0.625	40%	0.395	S	S	*	.			trans	-140.7	120.2	-170	-176	-99.4	0	0	0	112.9	P90	W85-P90 HydrophobicContact CH2-CG 4.21Å
86	D	94.8	Very high	91.7	Very high	35 Å²	35	67.4 Å²	67.4	19%	0.187	37%	0.374	C	S	.	.			trans	-133.2	126.4	163.7	-175.4	-47.1	0	0	0	107.1	L88 A89 P90 Y152 L156 P159	D86-L88 PolarHBondContact O-N 3.04Å; D86-L88 WeakPolarHBondContact OD1-CA 3.27Å; D86-L88 WeakPolarHBondContact OD1-CB 2.95Å; D86-L88 PolarHBondContact OD1-N 3.36Å; D86-A89 WeakPolarHBondContact O-CB 3.31Å; D86-A89 PolarHBondContact O-N 3.45Å; D86-A89 VanDerWaalsContact O-N 3.11Å; D86-P90 WeakPolarHBondContact O-CD 3.41Å; D86-Y152 PolarHBondContact OD2-OH 3.43Å; D86-L156 HydrophobicContact CB-CD2 3.74Å; D86-L156 VanDerWaalsContact CG-CD2 3.49Å; D86-L156 WeakPolarHBondContact OD2-CD2 3.25Å; D86-P159 HydrophobicContact CB-CB 3.96Å; D86-P159 HydrophobicContact CB-CG 3.97Å
87	P	94.4	Very high	92.5	Very high	80 Å²	80	67 Å²	67	52%	0.519	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-23.2	-178.8	26	-35.3	0	0	0	113.7	P90 M91	P87-P90 WeakPolarHBondContact O-CD 3.35Å; P87-P90 WeakPolarHBondContact O-CG 3.33Å; P87-M91 WeakPolarHBondContact O-CE 3.38Å; P87-M91 WeakPolarHBondContact O-CG 3.27Å
88	L	95.6	Very high	93.3	Very high	63 Å²	63	67.1 Å²	67.1	33%	0.33	38%	0.376	S	S	.	.	H	α-helix	trans	-69.2	-33.7	176.3	-175.5	58.6	0	0	0	112	D86 M91 L92 Y152 L156	D86-L88 PolarHBondContact O-N 3.04Å; D86-L88 WeakPolarHBondContact OD1-CA 3.27Å; D86-L88 WeakPolarHBondContact OD1-CB 2.95Å; D86-L88 PolarHBondContact OD1-N 3.36Å; L88-M91 HydrophobicContact CD1-CE 4.09Å; L88-M91 PolarHBondContact O-N 3.36Å; L88-L92 HydrophobicContact CD1-CD1 4.22Å; L88-L92 HydrophobicContact CD1-CD2 4.24Å; L88-L92 HydrophobicContact CD1-CG 3.89Å; L88-L92 HydrophobicContact CD2-CD1 4.16Å; L88-L92 HydrophobicContact CG-CD1 3.74Å; L88-L92 HydrophobicContact CG-CG 3.89Å; L88-L92 WeakPolarHBondContact O-CG 3.31Å; L88-L92 PolarHBondContact O-N 3.37Å; L88-Y152 HydrophobicContact CD2-CD1 4.47Å; L88-Y152 HydrophobicContact CD2-CE1 4.07Å; L88-L156 HydrophobicContact CD2-CD1 4.06Å; L88-L156 HydrophobicContact CG-CD1 4.34Å
89	A	96.9	Very high	94	Very high	0 Å²	0	63.6 Å²	63.6	0%	0	36%	0.358	C	S	.	.	H	α-helix	trans	-59.7	-52.4	-176.1	0	0	0	0	0	114.3	D86 M91 L92 L93 P159 L160	D86-A89 WeakPolarHBondContact O-CB 3.31Å; D86-A89 PolarHBondContact O-N 3.45Å; D86-A89 VanDerWaalsContact O-N 3.11Å; A89-M91 VanDerWaalsContact C-N 3.28Å; A89-M91 PolarHBondContact O-N 2.91Å; A89-L92 PolarHBondContact O-N 2.78Å; A89-L93 WeakPolarHBondContact O-CB 3.45Å; A89-L93 PolarHBondContact O-N 2.87Å; A89-P159 HydrophobicContact CB-CB 3.49Å; A89-P159 VanDerWaalsContact CB-CB 3.49Å; A89-L160 HydrophobicContact CB-CD2 4.03Å; A89-L160 HydrophobicContact CB-CG 4.09Å; A89-L160 WeakPolarHBondContact O-CD2 3.44Å
90	P	97	Very high	94.6	Very high	31 Å²	31	62.5 Å²	62.5	20%	0.201	35%	0.351	C	S	.	.	H	α-helix	trans	-65.1	-32.9	176.9	25.5	-34	0	0	0	112	W85 D86 P87 L94	W85-P90 HydrophobicContact CH2-CG 4.21Å; D86-P90 WeakPolarHBondContact O-CD 3.41Å; P87-P90 WeakPolarHBondContact O-CD 3.35Å; P87-P90 WeakPolarHBondContact O-CG 3.33Å; P90-L94 WeakPolarHBondContact O-CB 3.18Å; P90-L94 WeakPolarHBondContact O-CG 3.18Å; P90-L94 PolarHBondContact O-N 3.05Å
91	M	97.3	Very high	95.1	Very high	117 Å²	117	61.3 Å²	61.3	58%	0.576	34%	0.344	S	S	*	.	H	α-helix	trans	-64.7	-46.9	175.9	-66.1	-168.6	-67.2	0	0	111.6	P87 L88 A89 A95	P87-M91 WeakPolarHBondContact O-CE 3.38Å; P87-M91 WeakPolarHBondContact O-CG 3.27Å; L88-M91 HydrophobicContact CD1-CE 4.09Å; L88-M91 PolarHBondContact O-N 3.36Å; A89-M91 VanDerWaalsContact C-N 3.28Å; A89-M91 PolarHBondContact O-N 2.91Å; M91-A95 WeakPolarHBondContact O-CB 3.37Å; M91-A95 PolarHBondContact O-N 3.07Å
92	L	97	Very high	95.6	Very high	69 Å²	69	62.4 Å²	62.4	36%	0.361	34%	0.338	S	S	.	.	H	α-helix	trans	-63.5	-44.4	177.2	-72.2	179.4	0	0	0	111.7	L88 A89 A95 W96 L156 L160	L88-L92 HydrophobicContact CD1-CD1 4.22Å; L88-L92 HydrophobicContact CD1-CD2 4.24Å; L88-L92 HydrophobicContact CD1-CG 3.89Å; L88-L92 HydrophobicContact CD2-CD1 4.16Å; L88-L92 HydrophobicContact CG-CD1 3.74Å; L88-L92 HydrophobicContact CG-CG 3.89Å; L88-L92 WeakPolarHBondContact O-CG 3.31Å; L88-L92 PolarHBondContact O-N 3.37Å; A89-L92 PolarHBondContact O-N 2.78Å; L92-A95 PolarHBondContact O-N 3.48Å; L92-W96 VanDerWaalsContact O-CB 3.23Å; L92-W96 WeakPolarHBondContact O-CB 3.11Å; L92-W96 PolarHBondContact O-N 3.41Å; L92-L156 HydrophobicContact CD1-CD1 3.69Å; L92-L160 HydrophobicContact CB-CD2 4.46Å
93	L	98.1	Very high	96.1	Very high	20 Å²	20	57.2 Å²	57.2	11%	0.105	31%	0.31	C	S	.	.	H	α-helix	trans	-62	-47.6	178.6	-179.9	67.4	0	0	0	111.6	A89 W96 I97 L160 A164 V167	A89-L93 WeakPolarHBondContact O-CB 3.45Å; A89-L93 PolarHBondContact O-N 2.87Å; L93-W96 WeakPolarHBondContact O-CB 3.46Å; L93-W96 PolarHBondContact O-N 2.83Å; L93-I97 HydrophobicContact CD1-CD1 4.19Å; L93-I97 HydrophobicContact CG-CD1 4.05Å; L93-I97 WeakPolarHBondContact O-CG1 3.27Å; L93-I97 PolarHBondContact O-N 3.14Å; L93-L160 HydrophobicContact CB-CD2 4.29Å; L93-A164 HydrophobicContact CD2-CB 4.02Å; L93-V167 HydrophobicContact CD2-CB 4.47Å; L93-V167 HydrophobicContact CD2-CG2 3.98Å
94	L	98.1	Very high	96.5	Very high	100 Å²	100	53.3 Å²	53.3	52%	0.524	29%	0.292	S	S	.	.	H	α-helix	trans	-67.9	-38.4	179.2	-68.9	174.5	0	0	0	111.9	P90 W96 I97 G98 V167	P90-L94 WeakPolarHBondContact O-CB 3.18Å; P90-L94 WeakPolarHBondContact O-CG 3.18Å; P90-L94 PolarHBondContact O-N 3.05Å; L94-W96 VanDerWaalsContact C-N 3.32Å; L94-I97 PolarHBondContact O-N 3.46Å; L94-G98 PolarHBondContact O-N 3.02Å; L94-V167 HydrophobicContact CD2-CG2 4.18Å
95	A	97.7	Very high	96.6	Very high	62 Å²	62	55.5 Å²	55.5	51%	0.512	30%	0.303	S	S	.	.	H	α-helix	trans	-62.7	-40.4	173.3	0	0	0	0	0	111.5	M91 L92 G98 L99	M91-A95 WeakPolarHBondContact O-CB 3.37Å; M91-A95 PolarHBondContact O-N 3.07Å; L92-A95 PolarHBondContact O-N 3.48Å; A95-G98 PolarHBondContact O-N 3.24Å; A95-L99 WeakPolarHBondContact O-CB 3.44Å; A95-L99 PolarHBondContact O-N 3.44Å
96	W	97.8	Very high	96.6	Very high	45 Å²	45	50.6 Å²	50.6	17%	0.17	29%	0.289	C	S	.	.	H	α-helix	trans	-64.8	-48.2	176.5	178.1	-111.7	0	0	0	112.6	L92 L93 L94 G98 L99 H100 P223 I226 V230	L92-W96 VanDerWaalsContact O-CB 3.23Å; L92-W96 WeakPolarHBondContact O-CB 3.11Å; L92-W96 PolarHBondContact O-N 3.41Å; L93-W96 WeakPolarHBondContact O-CB 3.46Å; L93-W96 PolarHBondContact O-N 2.83Å; L94-W96 VanDerWaalsContact C-N 3.32Å; W96-G98 VanDerWaalsContact C-N 3.31Å; W96-G98 PolarHBondContact O-N 2.82Å; W96-L99 HydrophobicContact CE3-CD2 4.17Å; W96-L99 HydrophobicContact CZ3-CD2 4.13Å; W96-L99 PolarHBondContact O-N 3.27Å; W96-H100 AromaticContact CD2-CD2 3.76Å; W96-H100 AromaticContact CE2-CD2 3.46Å; W96-H100 VanDerWaalsContact CE2-CD2 3.46Å; W96-H100 AromaticContact CE2-NE2 3.65Å; W96-H100 AromaticContact CH2-CD2 3.74Å; W96-H100 AromaticContact CH2-NE2 3.07Å; W96-H100 WeakPolarHBondContact CH2-NE2 3.46Å; W96-H100 AromaticContact CZ2-CD2 3.47Å; W96-H100 VanDerWaalsContact CZ2-CD2 3.47Å; W96-H100 WeakPolarHBondContact CZ2-CD2 3.21Å; W96-H100 AromaticContact CZ2-NE2 3.1Å; W96-H100 WeakPolarHBondContact CZ2-NE2 3.28Å; W96-H100 AromaticContact CZ3-CD2 3.99Å; W96-H100 AromaticContact CZ3-NE2 3.6Å; W96-H100 AromaticContact NE1-CD2 4Å; W96-H100 PolarHBondContact O-N 3.23Å; W96-P223 PolarHBondContact NE1-O 3.42Å; W96-I226 HydrophobicContact CH2-CG2 3.75Å; W96-I226 HydrophobicContact CZ2-CB 3.96Å; W96-I226 HydrophobicContact CZ2-CG2 3.6Å; W96-V230 HydrophobicContact CH2-CG2 3.52Å; W96-V230 HydrophobicContact CZ2-CG2 3.85Å; W96-V230 HydrophobicContact CZ3-CG2 4.21Å
97	I	98.1	Very high	96.3	Very high	32 Å²	32	55.1 Å²	55.1	16%	0.164	32%	0.32	C	S	.	.	H	α-helix	trans	-60.3	-44.5	174.7	-68.5	169.2	0	0	0	110	L93 L94 H100 A101 V167 F218 P223	L93-I97 HydrophobicContact CD1-CD1 4.19Å; L93-I97 HydrophobicContact CG-CD1 4.05Å; L93-I97 WeakPolarHBondContact O-CG1 3.27Å; L93-I97 PolarHBondContact O-N 3.14Å; L94-I97 PolarHBondContact O-N 3.46Å; I97-H100 PolarHBondContact O-N 3.24Å; I97-A101 WeakPolarHBondContact O-CB 3.42Å; I97-A101 PolarHBondContact O-N 3.24Å; I97-V167 HydrophobicContact CD1-CG1 4.22Å; I97-F218 HydrophobicContact CG2-CE1 4.11Å; I97-F218 HydrophobicContact CG2-CZ 4.3Å; I97-P223 HydrophobicContact CG1-CB 3.92Å
98	G	97.8	Very high	96	Very high	40 Å²	40	54.6 Å²	54.6	41%	0.412	31%	0.312	S	S	.	.	H	α-helix	trans	-62.4	-43.5	177.8	0	0	0	0	0	113.3	L94 A95 W96 A101 L102	L94-G98 PolarHBondContact O-N 3.02Å; A95-G98 PolarHBondContact O-N 3.24Å; W96-G98 VanDerWaalsContact C-N 3.31Å; W96-G98 PolarHBondContact O-N 2.82Å; G98-A101 PolarHBondContact O-N 2.93Å; G98-L102 PolarHBondContact O-N 3.23Å
99	L	97.6	Very high	95.6	Very high	53 Å²	53	53.8 Å²	53.8	28%	0.277	32%	0.32	S	S	.	.	H	α-helix	trans	-57.8	-51.3	173.7	173	67.6	0	0	0	110.4	A95 W96 A101 L102 L103 L139	A95-L99 WeakPolarHBondContact O-CB 3.44Å; A95-L99 PolarHBondContact O-N 3.44Å; W96-L99 HydrophobicContact CE3-CD2 4.17Å; W96-L99 HydrophobicContact CZ3-CD2 4.13Å; W96-L99 PolarHBondContact O-N 3.27Å; L99-A101 VanDerWaalsContact C-N 3.29Å; L99-A101 PolarHBondContact O-N 3.21Å; L99-L102 WeakPolarHBondContact O-CB 3.03Å; L99-L102 PolarHBondContact O-N 3.39Å; L99-L102 VanDerWaalsContact O-N 3.16Å; L99-L103 HydrophobicContact CD1-CD1 4.33Å; L99-L103 HydrophobicContact CD1-CG 4.36Å; L99-L103 HydrophobicContact CG-CD1 4.13Å; L99-L103 WeakPolarHBondContact O-CG 3.33Å; L99-L103 PolarHBondContact O-N 2.65Å; L99-L139 HydrophobicContact CD1-CD1 4.15Å; L99-L139 HydrophobicContact CD2-CD1 4.11Å
100	H	97.6	Very high	95.4	Very high	0 Å²	0	59.3 Å²	59.3	0%	0	34%	0.344	C	S	.	.	H	α-helix	trans	-67	-31.1	-179.8	-87	-72.9	0	0	0	112.9	W96 I97 L103 Y104 S136 F218 R222 I226	W96-H100 AromaticContact CD2-CD2 3.76Å; W96-H100 AromaticContact CE2-CD2 3.46Å; W96-H100 VanDerWaalsContact CE2-CD2 3.46Å; W96-H100 AromaticContact CE2-NE2 3.65Å; W96-H100 AromaticContact CH2-CD2 3.74Å; W96-H100 AromaticContact CH2-NE2 3.07Å; W96-H100 WeakPolarHBondContact CH2-NE2 3.46Å; W96-H100 AromaticContact CZ2-CD2 3.47Å; W96-H100 VanDerWaalsContact CZ2-CD2 3.47Å; W96-H100 WeakPolarHBondContact CZ2-CD2 3.21Å; W96-H100 AromaticContact CZ2-NE2 3.1Å; W96-H100 WeakPolarHBondContact CZ2-NE2 3.28Å; W96-H100 AromaticContact CZ3-CD2 3.99Å; W96-H100 AromaticContact CZ3-NE2 3.6Å; W96-H100 AromaticContact NE1-CD2 4Å; W96-H100 PolarHBondContact O-N 3.23Å; I97-H100 PolarHBondContact O-N 3.24Å; H100-L103 PolarHBondContact O-N 3.08Å; H100-Y104 WeakPolarHBondContact O-CB 3.27Å; H100-Y104 PolarHBondContact O-N 2.87Å; H100-S136 PolarHBondContact CE1-OG 2.9Å; H100-S136 PolarHBondContact NE2-OG 3.39Å; H100-S136 VanDerWaalsContact NE2-OG 3.08Å; H100-F218 HydrophobicContact CB-CE2 3.95Å; H100-F218 HydrophobicContact CB-CZ 4.09Å; H100-R222 HydrophobicContact CB-CB 4.33Å; H100-I226 WeakPolarHBondContact CE1-CD1 3.5Å
101	A	97.3	Very high	95.3	Very high	24 Å²	24	62.5 Å²	62.5	20%	0.198	36%	0.362	C	S	.	.	H	α-helix	trans	-65.6	-40.4	172.7	0	0	0	0	0	111.4	I97 G98 L99 Y104 L105 F213 F218	I97-A101 WeakPolarHBondContact O-CB 3.42Å; I97-A101 PolarHBondContact O-N 3.24Å; G98-A101 PolarHBondContact O-N 2.93Å; L99-A101 VanDerWaalsContact C-N 3.29Å; L99-A101 PolarHBondContact O-N 3.21Å; A101-Y104 WeakPolarHBondContact O-CB 3.44Å; A101-Y104 PolarHBondContact O-N 3.27Å; A101-L105 WeakPolarHBondContact O-CG 3.22Å; A101-L105 PolarHBondContact O-N 3.49Å; A101-F213 HydrophobicContact CB-CE2 3.9Å; A101-F213 HydrophobicContact CB-CZ 4.04Å; A101-F218 HydrophobicContact CB-CE2 4.21Å; A101-F218 HydrophobicContact CB-CZ 4.07Å
102	L	96.5	Very high	95.1	Very high	107 Å²	107	57.7 Å²	57.7	56%	0.56	34%	0.34	S	S	*	.	H	α-helix	trans	-62.3	-48.5	172.3	-179.5	65.3	0	0	0	111	G98 L99 Y104 L105 L106	G98-L102 PolarHBondContact O-N 3.23Å; L99-L102 WeakPolarHBondContact O-CB 3.03Å; L99-L102 PolarHBondContact O-N 3.39Å; L99-L102 VanDerWaalsContact O-N 3.16Å; L102-Y104 VanDerWaalsContact C-N 3.29Å; L102-Y104 PolarHBondContact O-N 3Å; L102-L105 PolarHBondContact O-N 3.31Å; L102-L105 VanDerWaalsContact O-N 3.09Å; L102-L106 PolarHBondContact O-N 3.22Å; L102-L106 VanDerWaalsContact O-N 3.17Å
103	L	96	Very high	94.9	Very high	11 Å²	11	59.8 Å²	59.8	6%	0.058	35%	0.348	C	S	.	.	H	α-helix	trans	-61.4	-35.9	178.7	-65.6	176.2	0	0	0	112.6	L99 H100 L105 L106 N128 I135	L99-L103 HydrophobicContact CD1-CD1 4.33Å; L99-L103 HydrophobicContact CD1-CG 4.36Å; L99-L103 HydrophobicContact CG-CD1 4.13Å; L99-L103 WeakPolarHBondContact O-CG 3.33Å; L99-L103 PolarHBondContact O-N 2.65Å; H100-L103 PolarHBondContact O-N 3.08Å; L103-L105 VanDerWaalsContact C-N 3.31Å; L103-L105 PolarHBondContact O-N 3.39Å; L103-L106 HydrophobicContact CD2-CD1 3.77Å; L103-L106 PolarHBondContact O-N 3.42Å; L103-N128 PolarHBondContact O-ND2 3.44Å; L103-I135 HydrophobicContact CD1-CG2 4.41Å; L103-I135 HydrophobicContact CD2-CB 4.36Å; L103-I135 HydrophobicContact CD2-CD1 3.94Å; L103-I135 HydrophobicContact CD2-CG2 3.89Å
104	Y	95.3	Very high	94.6	Very high	4 Å²	4	59.1 Å²	59.1	2%	0.016	35%	0.346	C	S	.	.	H	α-helix	trans	-59.6	-42.8	173.5	173.7	-81.4	0	0	0	111.7	H100 A101 L102 L106 P126 N128 N212 F213 D214 Y217 F218	H100-Y104 WeakPolarHBondContact O-CB 3.27Å; H100-Y104 PolarHBondContact O-N 2.87Å; A101-Y104 WeakPolarHBondContact O-CB 3.44Å; A101-Y104 PolarHBondContact O-N 3.27Å; L102-Y104 VanDerWaalsContact C-N 3.29Å; L102-Y104 PolarHBondContact O-N 3Å; Y104-L106 VanDerWaalsContact C-N 3.31Å; Y104-L106 PolarHBondContact O-N 3.35Å; Y104-P126 HydrophobicContact CD1-CG 4.28Å; Y104-P126 HydrophobicContact CD2-CG 4.13Å; Y104-P126 HydrophobicContact CE1-CG 3.81Å; Y104-P126 HydrophobicContact CE2-CG 3.64Å; Y104-P126 HydrophobicContact CG-CG 4.43Å; Y104-P126 VanDerWaalsContact CZ-CG 3.47Å; Y104-P126 WeakPolarHBondContact OH-CD 3.3Å; Y104-N128 PolarHBondContact O-ND2 3.41Å; Y104-N128 VanDerWaalsContact O-ND2 3.12Å; Y104-N212 PolarHBondContact OH-O 3.29Å; Y104-F213 AromaticContact CD1-CD2 3.35Å; Y104-F213 HydrophobicContact CD1-CD2 3.35Å; Y104-F213 AromaticContact CD1-CE2 3.62Å; Y104-F213 HydrophobicContact CD1-CE2 3.62Å; Y104-F213 HydrophobicContact CD1-CG 4.32Å; Y104-F213 HydrophobicContact CE1-CB 4.35Å; Y104-F213 AromaticContact CE1-CD2 3.64Å; Y104-F213 HydrophobicContact CE1-CD2 3.64Å; Y104-F213 HydrophobicContact CE1-CE2 4.24Å; Y104-F213 HydrophobicContact CE1-CG 4.18Å; Y104-F213 HydrophobicContact CG-CD2 4.09Å; Y104-F213 AromaticContact CG-CE2 3.87Å; Y104-F213 HydrophobicContact CG-CE2 3.87Å; Y104-D214 PolarHBondContact OH-N 3.49Å; Y104-Y217 AromaticContact CE2-CD1 3.77Å; Y104-Y217 HydrophobicContact CE2-CD1 3.77Å; Y104-Y217 AromaticContact CE2-CE1 3.89Å; Y104-Y217 HydrophobicContact CE2-CE1 3.89Å; Y104-F218 HydrophobicContact CD2-CD2 4.22Å; Y104-F218 HydrophobicContact CG-CD2 4.34Å
105	L	94.1	Very high	94.1	Very high	108 Å²	108	58.2 Å²	58.2	57%	0.565	34%	0.341	S	S	*	.	H	α-helix	trans	-78.3	-13.8	-177	-67.3	173.1	0	0	0	113.5	A101 L102 L103 F213	A101-L105 WeakPolarHBondContact O-CG 3.22Å; A101-L105 PolarHBondContact O-N 3.49Å; L102-L105 PolarHBondContact O-N 3.31Å; L102-L105 VanDerWaalsContact O-N 3.09Å; L103-L105 VanDerWaalsContact C-N 3.31Å; L103-L105 PolarHBondContact O-N 3.39Å; L105-F213 HydrophobicContact CD2-CD2 4.04Å; L105-F213 HydrophobicContact CG-CD2 4.2Å
106	L	93.2	Very high	93.7	Very high	62 Å²	62	58 Å²	58	33%	0.325	34%	0.339	S	S	.	.	S	Bend	trans	-63.4	136.6	175.1	-68.3	-179.9	0	0	0	110.2	L102 L103 Y104 L108 N128	L102-L106 PolarHBondContact O-N 3.22Å; L102-L106 VanDerWaalsContact O-N 3.17Å; L103-L106 HydrophobicContact CD2-CD1 3.77Å; L103-L106 PolarHBondContact O-N 3.42Å; Y104-L106 VanDerWaalsContact C-N 3.31Å; Y104-L106 PolarHBondContact O-N 3.35Å; L106-L108 HydrophobicContact CB-CD1 4.08Å; L106-L108 HydrophobicContact CB-CG 4.02Å; L106-L108 HydrophobicContact CD1-CD1 3.99Å; L106-L108 PolarHBondContact O-N 3.02Å; L106-N128 PolarHBondContact O-ND2 2.96Å
107	P	88.4	Confident	93.2	Very high	130 Å²	130	58.3 Å²	58.3	84%	0.844	34%	0.344	S	S	*	.			trans	-77.2	52	179.1	34.8	-37.3	0	0	0	111.2
108	L	88.2	Confident	92.6	Very high	68 Å²	68	63.2 Å²	63.2	36%	0.356	36%	0.36	S	S	.	.			trans	-97.6	149	174.2	-62.5	175.5	0	0	0	108.8	L106 N128 H131 I135	L106-L108 HydrophobicContact CB-CD1 4.08Å; L106-L108 HydrophobicContact CB-CG 4.02Å; L106-L108 HydrophobicContact CD1-CD1 3.99Å; L106-L108 PolarHBondContact O-N 3.02Å; L108-N128 HydrophobicContact CB-CB 4.14Å; L108-N128 VanDerWaalsContact O-CB 3.25Å; L108-N128 WeakPolarHBondContact O-CB 3.36Å; L108-H131 HydrophobicContact CD1-CB 4.47Å; L108-I135 HydrophobicContact CD1-CD1 3.95Å
109	G	87.4	Confident	92	Very high	47 Å²	47	65 Å²	65	49%	0.485	36%	0.36	S	S	.	.	S	Bend	trans	72	-172.6	178.4	0	0	0	0	0	114.6
110	K	93.3	Very high	91.5	Very high	116 Å²	116	65.1 Å²	65.1	50%	0.504	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	159.8	179	60.4	175.4	167.4	167.5	0	110.8	I127 E269	K110-I127 HydrophobicContact CG-CB 3.99Å; K110-I127 HydrophobicContact CG-CG1 4.21Å; K110-I127 WeakPolarHBondContact O-CB 3.5Å; K110-I127 PolarHBondContact O-N 3.29Å; K110-E269 VanDerWaalsContact CE-CD 3.43Å; K110-E269 WeakPolarHBondContact CE-OE1 3.42Å; K110-E269 IonicContact NZ-OE1 3.42Å; K110-E269 PolarHBondContact NZ-OE1 3.49Å; K110-E269 IonicContact NZ-OE2 2.98Å; K110-E269 PolarHBondContact NZ-OE2 3.25Å
111	V	94.9	Very high	91.2	Very high	98 Å²	98	67.3 Å²	67.3	59%	0.594	39%	0.39	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.9	127.4	170.4	178.4	0	0	0	0	108.5	K124 Y125	V111-K124 HydrophobicContact CG1-CB 3.78Å; V111-K124 HydrophobicContact CG1-CD 4.36Å; V111-K124 HydrophobicContact CG1-CG 4.33Å; V111-Y125 WeakPolarHBondContact CA-O 3.45Å
112	S	93.4	Very high	91	Very high	16 Å²	16	72.3 Å²	72.3	11%	0.112	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	151.4	-178.1	-58.9	0	0	0	0	111.2	Y125 I127 E269	S112-Y125 PolarHBondContact N-O 3.44Å; S112-Y125 PolarHBondContact O-N 2.86Å; S112-I127 WeakPolarHBondContact OG-CG1 3.25Å; S112-E269 WeakPolarHBondContact CB-OE1 3.09Å; S112-E269 PolarHBondContact OG-OE1 2.84Å
113	E	93.4	Very high	90.8	Very high	113 Å²	113	68.8 Å²	68.8	53%	0.528	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	135.1	-179.5	-62.5	-167.5	160.1	0	0	111.1	R122 L123 K124	E113-R122 HydrophobicContact CB-CB 4.47Å; E113-R122 WeakPolarHBondContact OE2-CD 3.33Å; E113-L123 WeakPolarHBondContact CA-O 3.31Å; E113-K124 HydrophobicContact CG-CG 4.45Å
114	G	90.8	Very high	90.8	Very high	5 Å²	5	74.5 Å²	74.5	5%	0.052	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	-176.6	170.5	0	0	0	0	0	112.9	R122 L123	G114-R122 PolarHBondContact O-NH1 3.45Å; G114-L123 PolarHBondContact N-O 2.89Å
115	L	88.3	Confident	90.8	Very high	82 Å²	82	74.5 Å²	74.5	43%	0.429	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.3	155.2	172.4	-64	-173.4	0	0	0	111.6	L117 T273 V278	L115-L117 PolarHBondContact O-N 3.08Å; L115-T273 HydrophobicContact CD2-CG2 4.37Å; L115-V278 HydrophobicContact CD1-CG1 4Å; L115-V278 HydrophobicContact CD1-CG2 3.67Å; L115-V278 HydrophobicContact CG-CG2 4.32Å
116	A	88.5	Confident	90.8	Very high	57 Å²	57	70.5 Å²	70.5	47%	0.471	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.9	126.4	174.3	0	0	0	0	0	109.7	S121 R122	A116-S121 WeakPolarHBondContact CA-O 3.35Å; A116-R122 HydrophobicContact CB-CG 4.44Å
117	L	88	Confident	91	Very high	51 Å²	51	68.5 Å²	68.5	27%	0.267	38%	0.38	S	S	.	.	P	Polyproline II helix	trans	-75.6	172.9	173.5	-62.8	-177.2	0	0	0	110.4	L115 D119 G120 S121 L123 L206	L115-L117 PolarHBondContact O-N 3.08Å; L117-D119 VanDerWaalsContact CB-OD1 3.32Å; L117-D119 WeakPolarHBondContact CB-OD1 3.49Å; L117-D119 PolarHBondContact O-N 3.27Å; L117-G120 WeakPolarHBondContact O-CA 3.26Å; L117-G120 PolarHBondContact O-N 3.07Å; L117-S121 PolarHBondContact N-O 2.92Å; L117-L123 HydrophobicContact CD1-CD1 3.93Å; L117-L123 HydrophobicContact CD1-CD2 4.4Å; L117-L123 HydrophobicContact CD1-CG 3.88Å; L117-L206 HydrophobicContact CD2-CD2 4.09Å
118	R	85.1	Confident	91.3	Very high	135 Å²	135	62.4 Å²	62.4	51%	0.509	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-23.1	-179.3	-66.8	-176.7	-61.2	-178	-1.3	113.8	G120 S184 H185 L187	R118-G120 VanDerWaalsContact C-N 3.27Å; R118-S184 PolarHBondContact NH2-O 3.32Å; R118-H185 PolarHBondContact NH2-O 2.83Å; R118-L187 PolarHBondContact NH2-O 2.89Å
119	D	85.6	Confident	91.7	Very high	77 Å²	77	59.1 Å²	59.1	41%	0.412	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.7	1.4	174.1	65.3	-0.8	0	0	0	113	L117 S121 H185	L117-D119 VanDerWaalsContact CB-OD1 3.32Å; L117-D119 WeakPolarHBondContact CB-OD1 3.49Å; L117-D119 PolarHBondContact O-N 3.27Å; D119-S121 VanDerWaalsContact CG-OG 3.28Å; D119-S121 PolarHBondContact O-N 3.31Å; D119-S121 VanDerWaalsContact OD1-CB 3.27Å; D119-S121 WeakPolarHBondContact OD1-CB 3.4Å; D119-S121 PolarHBondContact OD1-N 3.46Å; D119-S121 PolarHBondContact OD1-OG 2.92Å; D119-S121 PolarHBondContact OD2-OG 3.45Å; D119-H185 IonicContact OD2-CD2 3.42Å; D119-H185 PolarHBondContact OD2-CD2 3.13Å; D119-H185 IonicContact OD2-NE2 3.76Å
120	G	86.4	Confident	92.1	Very high	57 Å²	57	59.7 Å²	59.7	59%	0.588	31%	0.312	S	S	*	.	S	Bend	trans	81.3	-6.3	-177.5	0	0	0	0	0	114.5	L117 R118	L117-G120 WeakPolarHBondContact O-CA 3.26Å; L117-G120 PolarHBondContact O-N 3.07Å; R118-G120 VanDerWaalsContact C-N 3.27Å
121	S	90.4	Very high	92.3	Very high	46 Å²	46	58.2 Å²	58.2	32%	0.322	31%	0.307	S	S	.	.			trans	-73	159	177.6	75	0	0	0	0	111.7	A116 L117 D119	A116-S121 WeakPolarHBondContact CA-O 3.35Å; L117-S121 PolarHBondContact N-O 2.92Å; D119-S121 VanDerWaalsContact CG-OG 3.28Å; D119-S121 PolarHBondContact O-N 3.31Å; D119-S121 VanDerWaalsContact OD1-CB 3.27Å; D119-S121 WeakPolarHBondContact OD1-CB 3.4Å; D119-S121 PolarHBondContact OD1-N 3.46Å; D119-S121 PolarHBondContact OD1-OG 2.92Å; D119-S121 PolarHBondContact OD2-OG 3.45Å
122	R	93.3	Very high	92.4	Very high	128 Å²	128	53.7 Å²	53.7	48%	0.483	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	130.3	173.3	-70.2	-180	-179.7	-93.4	4.9	109.6	E113 G114 A116	E113-R122 HydrophobicContact CB-CB 4.47Å; E113-R122 WeakPolarHBondContact OE2-CD 3.33Å; G114-R122 PolarHBondContact O-NH1 3.45Å; A116-R122 HydrophobicContact CB-CG 4.44Å
123	L	93.8	Very high	92.6	Very high	34 Å²	34	53.7 Å²	53.7	18%	0.178	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	144.3	176.4	-65.5	177.4	0	0	0	110.5	E113 G114 L117 Y125 N207	E113-L123 WeakPolarHBondContact CA-O 3.31Å; G114-L123 PolarHBondContact N-O 2.89Å; L117-L123 HydrophobicContact CD1-CD1 3.93Å; L117-L123 HydrophobicContact CD1-CD2 4.4Å; L117-L123 HydrophobicContact CD1-CG 3.88Å; L123-Y125 HydrophobicContact CB-CD2 4.47Å; L123-Y125 HydrophobicContact CB-CE2 3.58Å; L123-Y125 WeakPolarHBondContact CD1-OH 3.41Å; L123-Y125 WeakPolarHBondContact O-CD2 3.27Å; L123-Y125 WeakPolarHBondContact O-CE2 3.14Å; L123-N207 HydrophobicContact CD1-CB 3.81Å
124	K	94.9	Very high	92.8	Very high	130 Å²	130	51 Å²	51	57%	0.565	27%	0.271	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100	141.4	177	-66.2	-175.9	-178.9	-177.2	0	110.5	V111 E113 R209	V111-K124 HydrophobicContact CG1-CB 3.78Å; V111-K124 HydrophobicContact CG1-CD 4.36Å; V111-K124 HydrophobicContact CG1-CG 4.33Å; E113-K124 HydrophobicContact CG-CG 4.45Å; K124-R209 PolarHBondContact O-NH1 2.99Å; K124-R209 PolarHBondContact O-NH2 3.15Å
125	Y	95.2	Very high	93.1	Very high	5 Å²	5	53.5 Å²	53.5	2%	0.02	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	128.7	-175.6	-62.8	-90.8	0	0	0	110.8	V111 S112 L123 R209 D214 Y217 L272	V111-Y125 WeakPolarHBondContact CA-O 3.45Å; S112-Y125 PolarHBondContact N-O 3.44Å; S112-Y125 PolarHBondContact O-N 2.86Å; L123-Y125 HydrophobicContact CB-CD2 4.47Å; L123-Y125 HydrophobicContact CB-CE2 3.58Å; L123-Y125 WeakPolarHBondContact CD1-OH 3.41Å; L123-Y125 WeakPolarHBondContact O-CD2 3.27Å; L123-Y125 WeakPolarHBondContact O-CE2 3.14Å; Y125-R209 PolarHBondContact OH-NH2 2.81Å; Y125-D214 HydrophobicContact CD1-CB 4.39Å; Y125-D214 HydrophobicContact CE1-CB 3.94Å; Y125-D214 WeakPolarHBondContact CE1-OD2 3.35Å; Y125-D214 PolarHBondContact OH-OD2 2.81Å; Y125-Y217 AromaticContact CD1-CD1 3.59Å; Y125-Y217 HydrophobicContact CD1-CD1 3.59Å; Y125-Y217 HydrophobicContact CD1-CD2 4.04Å; Y125-Y217 AromaticContact CD1-CE1 3.98Å; Y125-Y217 HydrophobicContact CD1-CE1 3.98Å; Y125-Y217 HydrophobicContact CD1-CE2 4.36Å; Y125-Y217 AromaticContact CD1-CG 3.6Å; Y125-Y217 HydrophobicContact CD1-CG 3.6Å; Y125-Y217 HydrophobicContact CE1-CD1 4.26Å; Y125-Y217 HydrophobicContact CE1-CD2 4.32Å; Y125-Y217 AromaticContact CE1-CG 3.88Å; Y125-Y217 HydrophobicContact CE1-CG 3.88Å; Y125-L272 HydrophobicContact CD1-CD2 3.77Å; Y125-L272 HydrophobicContact CD2-CD1 3.93Å; Y125-L272 HydrophobicContact CD2-CD2 3.57Å; Y125-L272 HydrophobicContact CD2-CG 4.39Å; Y125-L272 HydrophobicContact CE1-CD2 4.02Å; Y125-L272 HydrophobicContact CE2-CD2 3.87Å; Y125-L272 HydrophobicContact CG-CD1 4.21Å; Y125-L272 HydrophobicContact CG-CD2 3.51Å
126	P	95.3	Very high	93.5	Very high	24 Å²	24	49.7 Å²	49.7	16%	0.156	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	125.8	172.2	30.9	-31.8	0	0	0	110.5	Y104 N128 Y217 R222	Y104-P126 HydrophobicContact CD1-CG 4.28Å; Y104-P126 HydrophobicContact CD2-CG 4.13Å; Y104-P126 HydrophobicContact CE1-CG 3.81Å; Y104-P126 HydrophobicContact CE2-CG 3.64Å; Y104-P126 HydrophobicContact CG-CG 4.43Å; Y104-P126 VanDerWaalsContact CZ-CG 3.47Å; Y104-P126 WeakPolarHBondContact OH-CD 3.3Å; P126-N128 PolarHBondContact O-N 3.26Å; P126-Y217 PolarHBondContact O-OH 3.11Å; P126-R222 PolarHBondContact O-NH2 3.48Å
127	I	95.7	Very high	93.9	Very high	19 Å²	19	49.2 Å²	49.2	10%	0.097	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	77.9	179.2	-48.7	-55.1	0	0	0	108.4	K110 S112 Y217 E268 E269 L272	K110-I127 HydrophobicContact CG-CB 3.99Å; K110-I127 HydrophobicContact CG-CG1 4.21Å; K110-I127 WeakPolarHBondContact O-CB 3.5Å; K110-I127 PolarHBondContact O-N 3.29Å; S112-I127 WeakPolarHBondContact OG-CG1 3.25Å; I127-Y217 WeakPolarHBondContact CD1-OH 3.23Å; I127-E268 VanDerWaalsContact C-OE2 3.29Å; I127-E268 WeakPolarHBondContact CA-OE2 3.37Å; I127-E268 HydrophobicContact CD1-CG 4.2Å; I127-E268 HydrophobicContact CG2-CB 4.08Å; I127-E268 HydrophobicContact CG2-CG 4.15Å; I127-E268 WeakPolarHBondContact CG2-OE2 3.13Å; I127-E269 HydrophobicContact CD1-CG 3.92Å; I127-E269 HydrophobicContact CG1-CG 3.86Å; I127-E269 HydrophobicContact CG2-CG 4.07Å; I127-L272 HydrophobicContact CD1-CD1 4.37Å
128	N	96.1	Very high	94.4	Very high	2 Å²	2	51.3 Å²	51.3	1%	0.011	27%	0.274	C	S	.	.			trans	-134.9	16.1	-176.8	64.9	4.6	0	0	0	113.5	L103 Y104 L106 L108 P126 F130 H131 G132 R222 E268	L103-N128 PolarHBondContact O-ND2 3.44Å; Y104-N128 PolarHBondContact O-ND2 3.41Å; Y104-N128 VanDerWaalsContact O-ND2 3.12Å; L106-N128 PolarHBondContact O-ND2 2.96Å; L108-N128 HydrophobicContact CB-CB 4.14Å; L108-N128 VanDerWaalsContact O-CB 3.25Å; L108-N128 WeakPolarHBondContact O-CB 3.36Å; P126-N128 PolarHBondContact O-N 3.26Å; N128-F130 PolarHBondContact O-N 3.36Å; N128-H131 WeakPolarHBondContact O-CB 3.47Å; N128-H131 PolarHBondContact O-N 3.09Å; N128-G132 PolarHBondContact O-N 2.99Å; N128-R222 PolarHBondContact OD1-NH1 3.09Å; N128-R222 PolarHBondContact OD1-NH2 3.36Å; N128-E268 PolarHBondContact N-OE2 3.24Å
129	G	96.1	Very high	94.9	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-58.5	-44.1	178	0	0	0	0	0	112.6	H131 G132 L133 E268	G129-H131 PolarHBondContact O-N 3.43Å; G129-G132 WeakPolarHBondContact O-CA 3.46Å; G129-G132 PolarHBondContact O-N 3.49Å; G129-G132 VanDerWaalsContact O-N 3.08Å; G129-L133 PolarHBondContact O-N 3.44Å; G129-E268 WeakPolarHBondContact CA-OE2 3.39Å; G129-E268 PolarHBondContact N-OE2 3.46Å
130	F	96.6	Very high	95.4	Very high	58 Å²	58	46.1 Å²	46.1	25%	0.254	26%	0.256	S	S	.	.	H	α-helix	trans	-64.8	-39.2	177.7	-168.8	-97.2	0	0	0	112.7	N128 G132 L133 C134 A262 L265 W266	N128-F130 PolarHBondContact O-N 3.36Å; F130-G132 VanDerWaalsContact C-N 3.27Å; F130-G132 PolarHBondContact O-N 2.87Å; F130-L133 HydrophobicContact CE2-CD2 4.48Å; F130-L133 WeakPolarHBondContact O-CB 3.35Å; F130-L133 PolarHBondContact O-N 3.36Å; F130-C134 VanDerWaalsContact CE1-SG 3.52Å; F130-C134 PolarHBondContact O-N 3.21Å; F130-C134 PolarHBondContact O-SG 2.77Å; F130-C134 VanDerWaalsContact O-SG 3.42Å; F130-A262 HydrophobicContact CE2-CB 4.19Å; F130-L265 HydrophobicContact CB-CB 4.26Å; F130-L265 HydrophobicContact CD2-CB 4.36Å; F130-W266 AromaticContact CD1-CE3 3.66Å; F130-W266 HydrophobicContact CD1-CE3 3.66Å; F130-W266 AromaticContact CD1-CZ3 3.79Å; F130-W266 HydrophobicContact CD1-CZ3 3.79Å; F130-W266 HydrophobicContact CD2-CB 4.18Å; F130-W266 AromaticContact CD2-CE3 3.83Å; F130-W266 HydrophobicContact CD2-CE3 3.83Å; F130-W266 AromaticContact CE1-CE3 3.61Å; F130-W266 HydrophobicContact CE1-CE3 3.61Å; F130-W266 AromaticContact CE1-CZ3 3.53Å; F130-W266 HydrophobicContact CE1-CZ3 3.53Å; F130-W266 AromaticContact CE2-CE3 3.77Å; F130-W266 HydrophobicContact CE2-CE3 3.77Å; F130-W266 HydrophobicContact CE2-CZ3 4.47Å; F130-W266 AromaticContact CG-CE3 3.77Å; F130-W266 HydrophobicContact CG-CE3 3.77Å; F130-W266 HydrophobicContact CG-CZ3 4.37Å; F130-W266 AromaticContact CZ-CE3 3.66Å; F130-W266 HydrophobicContact CZ-CE3 3.66Å; F130-W266 AromaticContact CZ-CZ3 3.9Å; F130-W266 HydrophobicContact CZ-CZ3 3.9Å
131	H	96.4	Very high	95.8	Very high	86 Å²	86	47 Å²	47	40%	0.398	25%	0.253	S	S	.	.	H	α-helix	trans	-61	-40.6	171.8	-61	91.3	0	0	0	110.8	L108 N128 G129 L133 C134 I135	L108-H131 HydrophobicContact CD1-CB 4.47Å; N128-H131 WeakPolarHBondContact O-CB 3.47Å; N128-H131 PolarHBondContact O-N 3.09Å; G129-H131 PolarHBondContact O-N 3.43Å; H131-L133 PolarHBondContact O-N 3.08Å; H131-C134 PolarHBondContact O-N 2.92Å; H131-I135 WeakPolarHBondContact O-CB 3.4Å; H131-I135 VanDerWaalsContact O-CG1 3.27Å; H131-I135 WeakPolarHBondContact O-CG1 3.28Å; H131-I135 PolarHBondContact O-N 3.34Å
132	G	96.8	Very high	96.1	Very high	2 Å²	2	48.4 Å²	48.4	2%	0.021	26%	0.26	C	S	.	.	H	α-helix	trans	-57.1	-45.2	173.6	0	0	0	0	0	112.7	N128 G129 F130 S136	N128-G132 PolarHBondContact O-N 2.99Å; G129-G132 WeakPolarHBondContact O-CA 3.46Å; G129-G132 PolarHBondContact O-N 3.49Å; G129-G132 VanDerWaalsContact O-N 3.08Å; F130-G132 VanDerWaalsContact C-N 3.27Å; F130-G132 PolarHBondContact O-N 2.87Å; G132-S136 WeakPolarHBondContact O-CB 3.46Å; G132-S136 PolarHBondContact O-N 2.95Å; G132-S136 PolarHBondContact O-OG 3.48Å; G132-S136 VanDerWaalsContact O-OG 3.08Å
133	L	97.6	Very high	96.2	Very high	17 Å²	17	46.3 Å²	46.3	9%	0.089	26%	0.257	C	S	.	.	H	α-helix	trans	-60.5	-48.4	174.5	176.1	66.4	0	0	0	111.8	G129 F130 H131 I135 S136 A137 I226 A262 L265	G129-L133 PolarHBondContact O-N 3.44Å; F130-L133 HydrophobicContact CE2-CD2 4.48Å; F130-L133 WeakPolarHBondContact O-CB 3.35Å; F130-L133 PolarHBondContact O-N 3.36Å; H131-L133 PolarHBondContact O-N 3.08Å; L133-I135 PolarHBondContact O-N 2.94Å; L133-S136 PolarHBondContact O-N 3.32Å; L133-A137 WeakPolarHBondContact O-CB 3.38Å; L133-A137 PolarHBondContact O-N 3.01Å; L133-I226 HydrophobicContact CB-CD1 4.37Å; L133-I226 HydrophobicContact CD1-CG2 3.93Å; L133-A262 HydrophobicContact CD2-CB 3.95Å; L133-L265 HydrophobicContact CB-CD1 3.78Å; L133-L265 HydrophobicContact CD2-CD1 4.04Å; L133-L265 HydrophobicContact CG-CD1 4.38Å
134	C	97.4	Very high	96.2	Very high	56 Å²	56	48.3 Å²	48.3	38%	0.378	27%	0.268	S	S	.	.	H	α-helix	trans	-61.6	-44.3	179.7	-66.6	0	0	0	0	112.4	F130 H131 A137 V138	F130-C134 VanDerWaalsContact CE1-SG 3.52Å; F130-C134 PolarHBondContact O-N 3.21Å; F130-C134 PolarHBondContact O-SG 2.77Å; F130-C134 VanDerWaalsContact O-SG 3.42Å; H131-C134 PolarHBondContact O-N 2.92Å; C134-A137 PolarHBondContact O-N 2.94Å; C134-V138 WeakPolarHBondContact O-CG2 3.42Å; C134-V138 PolarHBondContact O-N 3.32Å
135	I	97.4	Very high	96.2	Very high	57 Å²	57	46.4 Å²	46.4	29%	0.292	28%	0.276	S	S	.	.	H	α-helix	trans	-64.3	-45.7	178.4	-67	165.4	0	0	0	109.9	L103 L108 H131 L133 A137 V138 L139	L103-I135 HydrophobicContact CD1-CG2 4.41Å; L103-I135 HydrophobicContact CD2-CB 4.36Å; L103-I135 HydrophobicContact CD2-CD1 3.94Å; L103-I135 HydrophobicContact CD2-CG2 3.89Å; L108-I135 HydrophobicContact CD1-CD1 3.95Å; H131-I135 WeakPolarHBondContact O-CB 3.4Å; H131-I135 VanDerWaalsContact O-CG1 3.27Å; H131-I135 WeakPolarHBondContact O-CG1 3.28Å; H131-I135 PolarHBondContact O-N 3.34Å; L133-I135 PolarHBondContact O-N 2.94Å; I135-A137 VanDerWaalsContact C-N 3.3Å; I135-A137 PolarHBondContact O-N 3.05Å; I135-V138 PolarHBondContact O-N 3.14Å; I135-L139 HydrophobicContact CG2-CD1 4.07Å; I135-L139 HydrophobicContact CG2-CG 4.39Å; I135-L139 WeakPolarHBondContact O-CG 3.34Å; I135-L139 PolarHBondContact O-N 3.02Å
136	S	96.9	Very high	96.2	Very high	2 Å²	2	52.8 Å²	52.8	1%	0.014	31%	0.31	C	S	.	.	H	α-helix	trans	-59.8	-39.9	175.5	-65.1	0	0	0	0	112	H100 G132 L133 L139 L140	H100-S136 PolarHBondContact CE1-OG 2.9Å; H100-S136 PolarHBondContact NE2-OG 3.39Å; H100-S136 VanDerWaalsContact NE2-OG 3.08Å; G132-S136 WeakPolarHBondContact O-CB 3.46Å; G132-S136 PolarHBondContact O-N 2.95Å; G132-S136 PolarHBondContact O-OG 3.48Å; G132-S136 VanDerWaalsContact O-OG 3.08Å; L133-S136 PolarHBondContact O-N 3.32Å; S136-L139 PolarHBondContact O-N 3.44Å; S136-L140 WeakPolarHBondContact O-CB 3.32Å; S136-L140 VanDerWaalsContact O-CG 3.26Å; S136-L140 WeakPolarHBondContact O-CG 3.4Å; S136-L140 PolarHBondContact O-N 3.3Å
137	A	96.9	Very high	96.1	Very high	48 Å²	48	54.5 Å²	54.5	40%	0.397	33%	0.333	S	S	.	.	H	α-helix	trans	-64	-41.2	176.1	0	0	0	0	0	112.7	L133 C134 I135 L140 S141	L133-A137 WeakPolarHBondContact O-CB 3.38Å; L133-A137 PolarHBondContact O-N 3.01Å; C134-A137 PolarHBondContact O-N 2.94Å; I135-A137 VanDerWaalsContact C-N 3.3Å; I135-A137 PolarHBondContact O-N 3.05Å; A137-L140 PolarHBondContact O-N 3.41Å; A137-S141 WeakPolarHBondContact O-CB 3.41Å; A137-S141 PolarHBondContact O-N 3.13Å; A137-S141 PolarHBondContact O-OG 3.38Å
138	V	97.6	Very high	95.9	Very high	94 Å²	94	55.1 Å²	55.1	57%	0.57	34%	0.34	S	S	*	.	H	α-helix	trans	-63.3	-46.2	174.5	171.2	0	0	0	0	110.6	C134 I135 L140 S141 V142	C134-V138 WeakPolarHBondContact O-CG2 3.42Å; C134-V138 PolarHBondContact O-N 3.32Å; I135-V138 PolarHBondContact O-N 3.14Å; V138-L140 PolarHBondContact O-N 2.87Å; V138-S141 PolarHBondContact O-N 3.45Å; V138-V142 WeakPolarHBondContact O-CG2 3.5Å; V138-V142 PolarHBondContact O-N 3.42Å
139	L	96.8	Very high	95.8	Very high	76 Å²	76	59.5 Å²	59.5	40%	0.398	37%	0.369	S	S	.	.	H	α-helix	trans	-60	-45.1	178	-69.4	173.6	0	0	0	111.7	L99 I135 S136 S141 V142 L143	L99-L139 HydrophobicContact CD1-CD1 4.15Å; L99-L139 HydrophobicContact CD2-CD1 4.11Å; I135-L139 HydrophobicContact CG2-CD1 4.07Å; I135-L139 HydrophobicContact CG2-CG 4.39Å; I135-L139 WeakPolarHBondContact O-CG 3.34Å; I135-L139 PolarHBondContact O-N 3.02Å; S136-L139 PolarHBondContact O-N 3.44Å; L139-S141 VanDerWaalsContact C-N 3.35Å; L139-S141 PolarHBondContact O-N 2.97Å; L139-V142 PolarHBondContact O-N 2.87Å; L139-L143 WeakPolarHBondContact O-CG 3.1Å; L139-L143 PolarHBondContact O-N 2.66Å
140	L	95.6	Very high	95.7	Very high	27 Å²	27	60.5 Å²	60.5	14%	0.141	37%	0.374	C	S	.	.	H	α-helix	trans	-64.5	-38.4	176.7	-70.8	166.6	0	0	0	112.3	S136 A137 V138 V142 L143 L144 L150 V230 L233	S136-L140 WeakPolarHBondContact O-CB 3.32Å; S136-L140 VanDerWaalsContact O-CG 3.26Å; S136-L140 WeakPolarHBondContact O-CG 3.4Å; S136-L140 PolarHBondContact O-N 3.3Å; A137-L140 PolarHBondContact O-N 3.41Å; V138-L140 PolarHBondContact O-N 2.87Å; L140-V142 VanDerWaalsContact C-N 3.35Å; L140-L143 HydrophobicContact CD2-CD1 4.45Å; L140-L143 PolarHBondContact O-N 3.23Å; L140-L144 WeakPolarHBondContact O-CB 3.28Å; L140-L144 PolarHBondContact O-N 3.31Å; L140-L150 HydrophobicContact CD2-CD2 4.32Å; L140-V230 HydrophobicContact CD1-CB 4.47Å; L140-V230 HydrophobicContact CD1-CG1 4.19Å; L140-V230 HydrophobicContact CD1-CG2 3.61Å; L140-V230 HydrophobicContact CD2-CG1 4.28Å; L140-L233 HydrophobicContact CD1-CD2 4.44Å
141	S	95.3	Very high	95.5	Very high	76 Å²	76	57.7 Å²	57.7	53%	0.531	36%	0.362	S	S	.	.	H	α-helix	trans	-64.8	-39.8	176.2	-57.6	0	0	0	0	111.7	A137 V138 L139 L144 A145	A137-S141 WeakPolarHBondContact O-CB 3.41Å; A137-S141 PolarHBondContact O-N 3.13Å; A137-S141 PolarHBondContact O-OG 3.38Å; V138-S141 PolarHBondContact O-N 3.45Å; L139-S141 VanDerWaalsContact C-N 3.35Å; L139-S141 PolarHBondContact O-N 2.97Å; S141-L144 PolarHBondContact O-N 2.91Å; S141-A145 WeakPolarHBondContact O-CB 3.18Å; S141-A145 PolarHBondContact O-N 3.19Å
142	V	96.7	Very high	95.5	Very high	76 Å²	76	57.7 Å²	57.7	46%	0.461	36%	0.359	S	S	.	.	H	α-helix	trans	-64.9	-45.7	173.6	171.6	0	0	0	0	110.6	V138 L139 L140 L144 A145 L146	V138-V142 WeakPolarHBondContact O-CG2 3.5Å; V138-V142 PolarHBondContact O-N 3.42Å; L139-V142 PolarHBondContact O-N 2.87Å; L140-V142 VanDerWaalsContact C-N 3.35Å; V142-L144 VanDerWaalsContact C-N 3.29Å; V142-L144 PolarHBondContact O-N 3.44Å; V142-A145 PolarHBondContact O-N 3.32Å; V142-L146 HydrophobicContact CG1-CD1 3.99Å; V142-L146 HydrophobicContact CG1-CG 4.43Å; V142-L146 VanDerWaalsContact O-CG 3.3Å; V142-L146 WeakPolarHBondContact O-CG 3.1Å; V142-L146 PolarHBondContact O-N 2.84Å
143	L	95.3	Very high	95.4	Very high	83 Å²	83	59 Å²	59	44%	0.435	37%	0.365	S	S	.	.	H	α-helix	trans	-58.2	-42.6	175.9	-72.9	172.6	0	0	0	111.7	L139 L140 L146 G147 A148	L139-L143 WeakPolarHBondContact O-CG 3.1Å; L139-L143 PolarHBondContact O-N 2.66Å; L140-L143 HydrophobicContact CD2-CD1 4.45Å; L140-L143 PolarHBondContact O-N 3.23Å; L143-L146 CarbonylContact O-C 3.45Å; L143-L146 PolarHBondContact O-N 3.48Å; L143-G147 PolarHBondContact O-N 2.96Å; L143-A148 HydrophobicContact CB-CB 3.97Å; L143-A148 WeakPolarHBondContact O-CB 3.46Å; L143-A148 PolarHBondContact O-N 2.75Å
144	L	93.3	Very high	95.3	Very high	77 Å²	77	58.8 Å²	58.8	40%	0.403	37%	0.365	S	S	.	.	H	α-helix	trans	-63.6	-43.6	175.9	-176.6	63.1	0	0	0	111.8	L140 S141 V142 L146 G147 L150 M237	L140-L144 WeakPolarHBondContact O-CB 3.28Å; L140-L144 PolarHBondContact O-N 3.31Å; S141-L144 PolarHBondContact O-N 2.91Å; V142-L144 VanDerWaalsContact C-N 3.29Å; V142-L144 PolarHBondContact O-N 3.44Å; L144-L146 PolarHBondContact O-N 3.44Å; L144-G147 PolarHBondContact O-N 2.87Å; L144-L150 HydrophobicContact CB-CD1 4.31Å; L144-L150 HydrophobicContact CD1-CD1 4.4Å; L144-M237 HydrophobicContact CD1-CE 3.7Å
145	A	94.6	Very high	95.1	Very high	89 Å²	89	61.2 Å²	61.2	74%	0.736	37%	0.371	S	S	*	.	H	α-helix	trans	-63.7	-28.5	176.3	0	0	0	0	0	112.9	S141 V142 G147	S141-A145 WeakPolarHBondContact O-CB 3.18Å; S141-A145 PolarHBondContact O-N 3.19Å; V142-A145 PolarHBondContact O-N 3.32Å; A145-G147 VanDerWaalsContact C-N 3.25Å
146	L	96.4	Very high	95	Very high	139 Å²	139	58.7 Å²	58.7	73%	0.728	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.5	0.6	172.7	-65.3	174.1	0	0	0	113.4	V142 L143 L144	V142-L146 HydrophobicContact CG1-CD1 3.99Å; V142-L146 HydrophobicContact CG1-CG 4.43Å; V142-L146 VanDerWaalsContact O-CG 3.3Å; V142-L146 WeakPolarHBondContact O-CG 3.1Å; V142-L146 PolarHBondContact O-N 2.84Å; L143-L146 CarbonylContact O-C 3.45Å; L143-L146 PolarHBondContact O-N 3.48Å; L144-L146 PolarHBondContact O-N 3.44Å
147	G	92.2	Very high	95	Very high	61 Å²	61	58.6 Å²	58.6	63%	0.629	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.5	21.7	177	0	0	0	0	0	114.9	L143 L144 A145	L143-G147 PolarHBondContact O-N 2.96Å; L144-G147 PolarHBondContact O-N 2.87Å; A145-G147 VanDerWaalsContact C-N 3.25Å
148	A	93.1	Very high	95	Very high	31 Å²	31	56.5 Å²	56.5	26%	0.256	34%	0.339	S	S	.	.			trans	-64.6	132.7	175.8	0	0	0	0	0	111.5	L143 L150	L143-A148 HydrophobicContact CB-CB 3.97Å; L143-A148 WeakPolarHBondContact O-CB 3.46Å; L143-A148 PolarHBondContact O-N 2.75Å; A148-L150 VanDerWaalsContact C-N 3.32Å; A148-L150 PolarHBondContact O-N 2.9Å
149	P	93.1	Very high	95	Very high	94 Å²	94	52.4 Å²	52.4	61%	0.61	32%	0.315	S	S	*	.			trans	-80.7	74	-175.9	33.6	-36.4	0	0	0	111.4	G151 Y152	P149-G151 PolarHBondContact O-N 2.68Å; P149-G151 VanDerWaalsContact O-N 3.15Å; P149-Y152 VanDerWaalsContact O-CB 3.24Å; P149-Y152 WeakPolarHBondContact O-CB 3.25Å; P149-Y152 PolarHBondContact O-N 3.36Å
150	L	93.6	Very high	95	Very high	21 Å²	21	49.4 Å²	49.4	11%	0.11	30%	0.299	C	S	.	.	G	3₁₀ helix	trans	-60.1	-24.9	-178.5	-66.4	-176	0	0	0	113.3	L140 L144 A148 Y152 L153 L233 G234 M237	L140-L150 HydrophobicContact CD2-CD2 4.32Å; L144-L150 HydrophobicContact CB-CD1 4.31Å; L144-L150 HydrophobicContact CD1-CD1 4.4Å; A148-L150 VanDerWaalsContact C-N 3.32Å; A148-L150 PolarHBondContact O-N 2.9Å; L150-Y152 PolarHBondContact O-N 3.09Å; L150-L153 WeakPolarHBondContact O-CB 3.42Å; L150-L153 WeakPolarHBondContact O-CG 3.29Å; L150-L153 PolarHBondContact O-N 3.01Å; L150-L233 HydrophobicContact CD1-CD2 4.18Å; L150-G234 WeakPolarHBondContact O-CA 3.41Å; L150-M237 HydrophobicContact CB-CB 4.34Å; L150-M237 HydrophobicContact CB-CG 4.05Å
151	G	93.6	Very high	95.1	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	29%	0.292	C	S	.	.	G	3₁₀ helix	trans	-61.5	-21.3	173	0	0	0	0	0	114.2	P149 L153 C154 E241	P149-G151 PolarHBondContact O-N 2.68Å; P149-G151 VanDerWaalsContact O-N 3.15Å; G151-L153 PolarHBondContact O-N 3.19Å; G151-C154 VanDerWaalsContact O-CB 3.31Å; G151-C154 WeakPolarHBondContact O-CB 3.45Å; G151-C154 PolarHBondContact O-N 3.07Å; G151-E241 WeakPolarHBondContact CA-OE1 3.31Å; G151-E241 PolarHBondContact N-OE1 2.84Å
152	Y	94.7	Very high	95.2	Very high	85 Å²	85	46.3 Å²	46.3	33%	0.333	28%	0.278	S	S	.	.	G	3₁₀ helix	trans	-63.8	-20	175.8	-167.8	-114.1	0	0	0	112.8	D86 L88 P149 L150 C154 E155 L156	D86-Y152 PolarHBondContact OD2-OH 3.43Å; L88-Y152 HydrophobicContact CD2-CD1 4.47Å; L88-Y152 HydrophobicContact CD2-CE1 4.07Å; P149-Y152 VanDerWaalsContact O-CB 3.24Å; P149-Y152 WeakPolarHBondContact O-CB 3.25Å; P149-Y152 PolarHBondContact O-N 3.36Å; L150-Y152 PolarHBondContact O-N 3.09Å; Y152-C154 PolarHBondContact O-N 3.17Å; Y152-C154 VanDerWaalsContact O-N 3.16Å; Y152-E155 HydrophobicContact CD2-CB 4.14Å; Y152-E155 HydrophobicContact CD2-CG 4.41Å; Y152-E155 WeakPolarHBondContact CD2-OE2 3.46Å; Y152-E155 HydrophobicContact CE2-CB 4.11Å; Y152-E155 WeakPolarHBondContact CE2-OE2 3.32Å; Y152-E155 PolarHBondContact O-N 2.96Å; Y152-L156 HydrophobicContact CD1-CD1 3.64Å; Y152-L156 HydrophobicContact CD1-CD2 4.48Å; Y152-L156 HydrophobicContact CD1-CG 3.8Å; Y152-L156 HydrophobicContact CE1-CD1 3.65Å; Y152-L156 HydrophobicContact CE1-CD2 3.75Å; Y152-L156 HydrophobicContact CE1-CG 3.58Å; Y152-L156 PolarHBondContact O-N 2.75Å; Y152-L156 VanDerWaalsContact O-N 3.13Å
153	L	95.3	Very high	95.3	Very high	31 Å²	31	43.1 Å²	43.1	16%	0.162	26%	0.259	C	S	.	.	G	3₁₀ helix	trans	-58	-27	171.8	-71.5	175.3	0	0	0	112.9	L150 G151 E155 L156 L157 L160 V230	L150-L153 WeakPolarHBondContact O-CB 3.42Å; L150-L153 WeakPolarHBondContact O-CG 3.29Å; L150-L153 PolarHBondContact O-N 3.01Å; G151-L153 PolarHBondContact O-N 3.19Å; L153-E155 VanDerWaalsContact C-N 3.31Å; L153-L156 PolarHBondContact O-N 2.9Å; L153-L157 PolarHBondContact O-N 3.1Å; L153-L160 HydrophobicContact CD2-CD1 4.15Å; L153-V230 HydrophobicContact CD1-CG1 3.98Å
154	C	95.1	Very high	95.5	Very high	12 Å²	12	39.1 Å²	39.1	8%	0.081	24%	0.238	C	C	.	.	G	3₁₀ helix	trans	-64.5	-37.1	174.7	-173.5	0	0	0	0	112.3	Q65 G151 Y152 L157 M235 K238	Q65-C154 PolarHBondContact NE2-O 3.25Å; G151-C154 VanDerWaalsContact O-CB 3.31Å; G151-C154 WeakPolarHBondContact O-CB 3.45Å; G151-C154 PolarHBondContact O-N 3.07Å; Y152-C154 PolarHBondContact O-N 3.17Å; Y152-C154 VanDerWaalsContact O-N 3.16Å; C154-L157 WeakPolarHBondContact O-CB 3.17Å; C154-M235 HydrophobicContact CB-CE 4.26Å; C154-M235 HydrophobicContact CB-SD 3.89Å; C154-M235 VanDerWaalsContact SG-SD 3.7Å; C154-K238 HydrophobicContact CB-CB 3.86Å; C154-K238 HydrophobicContact CB-CD 4.31Å; C154-K238 HydrophobicContact CB-CG 3.7Å
155	E	93.3	Very high	95.7	Very high	107 Å²	107	36.3 Å²	36.3	50%	0.5	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.2	-33.8	179.3	-63.7	174.2	-152.5	0	0	110.7	Y152 L153 L157 K238	Y152-E155 HydrophobicContact CD2-CB 4.14Å; Y152-E155 HydrophobicContact CD2-CG 4.41Å; Y152-E155 WeakPolarHBondContact CD2-OE2 3.46Å; Y152-E155 HydrophobicContact CE2-CB 4.11Å; Y152-E155 WeakPolarHBondContact CE2-OE2 3.32Å; Y152-E155 PolarHBondContact O-N 2.96Å; L153-E155 VanDerWaalsContact C-N 3.31Å; E155-L157 VanDerWaalsContact C-N 3.27Å; E155-L157 PolarHBondContact O-N 2.89Å; E155-K238 IonicContact OE1-NZ 2.68Å; E155-K238 PolarHBondContact OE1-NZ 2.89Å
156	L	96	Very high	95.9	Very high	3 Å²	3	34.3 Å²	34.3	2%	0.016	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.9	0.3	176.2	-65.5	179.9	0	0	0	114.4	D86 L88 L92 Y152 L153 V158 P159 L160	D86-L156 HydrophobicContact CB-CD2 3.74Å; D86-L156 VanDerWaalsContact CG-CD2 3.49Å; D86-L156 WeakPolarHBondContact OD2-CD2 3.25Å; L88-L156 HydrophobicContact CD2-CD1 4.06Å; L88-L156 HydrophobicContact CG-CD1 4.34Å; L92-L156 HydrophobicContact CD1-CD1 3.69Å; Y152-L156 HydrophobicContact CD1-CD1 3.64Å; Y152-L156 HydrophobicContact CD1-CD2 4.48Å; Y152-L156 HydrophobicContact CD1-CG 3.8Å; Y152-L156 HydrophobicContact CE1-CD1 3.65Å; Y152-L156 HydrophobicContact CE1-CD2 3.75Å; Y152-L156 HydrophobicContact CE1-CG 3.58Å; Y152-L156 PolarHBondContact O-N 2.75Å; Y152-L156 VanDerWaalsContact O-N 3.13Å; L153-L156 PolarHBondContact O-N 2.9Å; L156-V158 PolarHBondContact O-N 3.41Å; L156-P159 WeakPolarHBondContact O-CD 3.46Å; L156-L160 HydrophobicContact CB-CD1 3.82Å; L156-L160 HydrophobicContact CB-CG 4.09Å; L156-L160 WeakPolarHBondContact O-CB 3.49Å; L156-L160 WeakPolarHBondContact O-CD1 3.49Å; L156-L160 WeakPolarHBondContact O-CG 3.38Å; L156-L160 PolarHBondContact O-N 3.4Å
157	L	96.3	Very high	96	Very high	1 Å²	1	28.9 Å²	28.9	1%	0.005	18%	0.18	C	C	.	.	H	α-helix	trans	-60.2	-45.1	-171.9	-168.8	64.1	0	0	0	112.8	I61 L153 C154 E155 A161 I231 M235 F296	I61-L157 HydrophobicContact CD1-CG 4.47Å; I61-L157 HydrophobicContact CG2-CB 4.38Å; I61-L157 HydrophobicContact CG2-CD2 3.61Å; I61-L157 HydrophobicContact CG2-CG 3.86Å; L153-L157 PolarHBondContact O-N 3.1Å; C154-L157 WeakPolarHBondContact O-CB 3.17Å; E155-L157 VanDerWaalsContact C-N 3.27Å; E155-L157 PolarHBondContact O-N 2.89Å; L157-A161 WeakPolarHBondContact O-CB 3.45Å; L157-A161 PolarHBondContact O-N 3.46Å; L157-I231 HydrophobicContact CD1-CG2 3.62Å; L157-M235 HydrophobicContact CB-CE 4.27Å; L157-M235 HydrophobicContact CD1-CE 3.76Å; L157-M235 HydrophobicContact CD2-CE 3.69Å; L157-M235 HydrophobicContact CG-CE 4.12Å; L157-F296 HydrophobicContact CD1-CD1 3.71Å; L157-F296 HydrophobicContact CD1-CE1 4Å; L157-F296 HydrophobicContact CG-CD1 4.38Å
158	V	96.8	Very high	96.2	Very high	4 Å²	4	26 Å²	26	2%	0.024	15%	0.15	C	C	.	.	H	α-helix	trans	-68.6	-51.6	176.7	176.8	0	0	0	0	111.5	L58 I61 P79 Q83 L84 L156 L160 A161 V162	L58-V158 HydrophobicContact CD2-CG1 4.35Å; I61-V158 HydrophobicContact CB-CG2 4.39Å; I61-V158 HydrophobicContact CG2-CG2 3.55Å; P79-V158 HydrophobicContact CB-CG1 3.97Å; P79-V158 HydrophobicContact CG-CG1 4.42Å; Q83-V158 VanDerWaalsContact O-CG1 3.23Å; Q83-V158 WeakPolarHBondContact O-CG1 3.36Å; L84-V158 HydrophobicContact CD2-CG1 4.34Å; L156-V158 PolarHBondContact O-N 3.41Å; V158-L160 VanDerWaalsContact C-N 3.27Å; V158-L160 PolarHBondContact O-N 3.33Å; V158-A161 PolarHBondContact O-N 3.47Å; V158-A161 VanDerWaalsContact O-N 3.11Å; V158-V162 HydrophobicContact CG1-CG2 4.45Å; V158-V162 WeakPolarHBondContact O-CG2 3.43Å; V158-V162 PolarHBondContact O-N 3.12Å
159	P	97.3	Very high	96.5	Very high	7 Å²	7	28 Å²	28	5%	0.045	15%	0.153	C	C	.	.	H	α-helix	trans	-56.3	-37.2	175.1	-29.2	36.2	0	0	0	114.4	Q83 D86 A89 L156 S163	Q83-P159 WeakPolarHBondContact O-CD 3.31Å; Q83-P159 VanDerWaalsContact O-CG 3.3Å; Q83-P159 WeakPolarHBondContact O-CG 3.44Å; D86-P159 HydrophobicContact CB-CB 3.96Å; D86-P159 HydrophobicContact CB-CG 3.97Å; A89-P159 HydrophobicContact CB-CB 3.49Å; A89-P159 VanDerWaalsContact CB-CB 3.49Å; L156-P159 WeakPolarHBondContact O-CD 3.46Å; P159-S163 WeakPolarHBondContact O-CB 3.34Å; P159-S163 PolarHBondContact O-N 3.46Å; P159-S163 PolarHBondContact O-OG 2.58Å
160	L	98	Very high	96.7	Very high	14 Å²	14	29.4 Å²	29.4	7%	0.073	16%	0.155	C	C	.	.	H	α-helix	trans	-67.2	-42.1	176	-76.4	168.2	0	0	0	111.3	A89 L92 L93 L153 L156 V158 S163 A164 F296	A89-L160 HydrophobicContact CB-CD2 4.03Å; A89-L160 HydrophobicContact CB-CG 4.09Å; A89-L160 WeakPolarHBondContact O-CD2 3.44Å; L92-L160 HydrophobicContact CB-CD2 4.46Å; L93-L160 HydrophobicContact CB-CD2 4.29Å; L153-L160 HydrophobicContact CD2-CD1 4.15Å; L156-L160 HydrophobicContact CB-CD1 3.82Å; L156-L160 HydrophobicContact CB-CG 4.09Å; L156-L160 WeakPolarHBondContact O-CB 3.49Å; L156-L160 WeakPolarHBondContact O-CD1 3.49Å; L156-L160 WeakPolarHBondContact O-CG 3.38Å; L156-L160 PolarHBondContact O-N 3.4Å; V158-L160 VanDerWaalsContact C-N 3.27Å; V158-L160 PolarHBondContact O-N 3.33Å; L160-S163 PolarHBondContact O-N 3.4Å; L160-A164 WeakPolarHBondContact O-CB 3.3Å; L160-A164 PolarHBondContact O-N 3.38Å; L160-F296 VanDerWaalsContact C-CZ 3.47Å; L160-F296 HydrophobicContact CB-CE1 3.67Å; L160-F296 HydrophobicContact CB-CZ 3.76Å
161	A	97.9	Very high	96.9	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-63.4	-44.3	175.8	0	0	0	0	0	111.6	V57 L58 I61 L157 V158 S163 A164 V165 F296	V57-A161 HydrophobicContact CG1-CB 4.3Å; L58-A161 HydrophobicContact CD2-CB 3.97Å; I61-A161 HydrophobicContact CD1-CB 3.49Å; I61-A161 VanDerWaalsContact CD1-CB 3.49Å; L157-A161 WeakPolarHBondContact O-CB 3.45Å; L157-A161 PolarHBondContact O-N 3.46Å; V158-A161 PolarHBondContact O-N 3.47Å; V158-A161 VanDerWaalsContact O-N 3.11Å; A161-S163 VanDerWaalsContact C-N 3.33Å; A161-S163 PolarHBondContact O-N 2.89Å; A161-A164 PolarHBondContact O-N 3.28Å; A161-V165 WeakPolarHBondContact O-CG2 3.1Å; A161-V165 PolarHBondContact O-N 3.21Å; A161-F296 HydrophobicContact CB-CB 4.47Å; A161-F296 HydrophobicContact CB-CD1 3.7Å; A161-F296 HydrophobicContact CB-CD2 4.25Å; A161-F296 HydrophobicContact CB-CE1 3.92Å; A161-F296 HydrophobicContact CB-CE2 4.45Å; A161-F296 HydrophobicContact CB-CG 3.88Å; A161-F296 HydrophobicContact CB-CZ 4.3Å
162	V	97.7	Very high	97.1	Very high	37 Å²	37	30.5 Å²	30.5	22%	0.224	16%	0.164	C	C	.	.	H	α-helix	trans	-59.4	-44.7	174	174.2	0	0	0	0	110.8	L58 L84 V158 A164 V165 A166	L58-V162 HydrophobicContact CD1-CG2 4.22Å; L58-V162 HydrophobicContact CD2-CG2 3.68Å; L84-V162 HydrophobicContact CD2-CG2 3.79Å; V158-V162 HydrophobicContact CG1-CG2 4.45Å; V158-V162 WeakPolarHBondContact O-CG2 3.43Å; V158-V162 PolarHBondContact O-N 3.12Å; V162-A164 PolarHBondContact O-N 3.27Å; V162-V165 WeakPolarHBondContact O-CB 3.43Å; V162-V165 PolarHBondContact O-N 2.86Å; V162-A166 PolarHBondContact O-N 2.6Å
163	S	98.1	Very high	97.3	Very high	9 Å²	9	30 Å²	30	6%	0.063	17%	0.17	C	C	.	.	H	α-helix	trans	-62.7	-41.7	177.1	-60.5	0	0	0	0	111.7	P159 L160 A161 A166 V167	P159-S163 WeakPolarHBondContact O-CB 3.34Å; P159-S163 PolarHBondContact O-N 3.46Å; P159-S163 PolarHBondContact O-OG 2.58Å; L160-S163 PolarHBondContact O-N 3.4Å; A161-S163 VanDerWaalsContact C-N 3.33Å; A161-S163 PolarHBondContact O-N 2.89Å; S163-A166 PolarHBondContact O-N 2.99Å; S163-V167 WeakPolarHBondContact O-CB 3.39Å; S163-V167 WeakPolarHBondContact O-CG2 3.23Å; S163-V167 PolarHBondContact O-N 3.35Å
164	A	98.3	Very high	97.4	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-67.3	-38.5	177.8	0	0	0	0	0	112.5	L93 L160 A161 V162 S168 A292 F296	L93-A164 HydrophobicContact CD2-CB 4.02Å; L160-A164 WeakPolarHBondContact O-CB 3.3Å; L160-A164 PolarHBondContact O-N 3.38Å; A161-A164 PolarHBondContact O-N 3.28Å; V162-A164 PolarHBondContact O-N 3.27Å; A164-S168 VanDerWaalsContact O-CB 3.31Å; A164-S168 WeakPolarHBondContact O-CB 3.17Å; A164-S168 PolarHBondContact O-N 3.49Å; A164-S168 PolarHBondContact O-OG 3.43Å; A164-A292 HydrophobicContact CB-CB 4.01Å; A164-F296 HydrophobicContact CB-CE2 3.61Å; A164-F296 HydrophobicContact CB-CZ 4.21Å
165	V	98.3	Very high	97.5	Very high	18 Å²	18	33.6 Å²	33.6	11%	0.109	18%	0.181	C	C	.	.	H	α-helix	trans	-59.2	-50.1	171.1	172.3	0	0	0	0	109.9	P54 A161 V162 S168 F169 F288 A292	P54-V165 HydrophobicContact CB-CG1 3.82Å; P54-V165 HydrophobicContact CB-CG2 4.11Å; P54-V165 HydrophobicContact CG-CG1 4.1Å; A161-V165 WeakPolarHBondContact O-CG2 3.1Å; A161-V165 PolarHBondContact O-N 3.21Å; V162-V165 WeakPolarHBondContact O-CB 3.43Å; V162-V165 PolarHBondContact O-N 2.86Å; V165-S168 WeakPolarHBondContact O-CB 3.36Å; V165-S168 PolarHBondContact O-N 3.04Å; V165-S168 VanDerWaalsContact O-N 3.17Å; V165-F169 HydrophobicContact CG1-CD2 3.84Å; V165-F169 HydrophobicContact CG1-CE2 3.76Å; V165-F169 WeakPolarHBondContact O-CD2 3.48Å; V165-F169 PolarHBondContact O-N 2.84Å; V165-F288 HydrophobicContact CG2-CE2 3.94Å; V165-A292 HydrophobicContact CG2-CB 4.38Å
166	A	98.1	Very high	97.7	Very high	47 Å²	47	30.6 Å²	30.6	39%	0.388	17%	0.165	S	C	.	.	H	α-helix	trans	-61.3	-47.7	-179.7	0	0	0	0	0	111.9	V162 S163 S168 F169 L170	V162-A166 PolarHBondContact O-N 2.6Å; S163-A166 PolarHBondContact O-N 2.99Å; A166-S168 VanDerWaalsContact C-N 3.27Å; A166-S168 PolarHBondContact O-N 2.89Å; A166-F169 PolarHBondContact O-N 3.38Å; A166-L170 VanDerWaalsContact O-CG 3.3Å; A166-L170 WeakPolarHBondContact O-CG 3.34Å; A166-L170 PolarHBondContact O-N 3.24Å
167	V	98.3	Very high	97.8	Very high	24 Å²	24	33.7 Å²	33.7	15%	0.145	18%	0.184	C	C	.	.	H	α-helix	trans	-58.1	-42.1	174.3	169.8	0	0	0	0	110.6	L93 L94 I97 S163 F169 L170 S171 L291	L93-V167 HydrophobicContact CD2-CB 4.47Å; L93-V167 HydrophobicContact CD2-CG2 3.98Å; L94-V167 HydrophobicContact CD2-CG2 4.18Å; I97-V167 HydrophobicContact CD1-CG1 4.22Å; S163-V167 WeakPolarHBondContact O-CB 3.39Å; S163-V167 WeakPolarHBondContact O-CG2 3.23Å; S163-V167 PolarHBondContact O-N 3.35Å; V167-F169 PolarHBondContact O-N 3.01Å; V167-L170 PolarHBondContact O-N 3.17Å; V167-S171 VanDerWaalsContact O-CB 3.3Å; V167-S171 WeakPolarHBondContact O-CB 3.43Å; V167-S171 PolarHBondContact O-N 3.37Å; V167-S171 PolarHBondContact O-OG 3.4Å; V167-S171 VanDerWaalsContact O-OG 3.12Å; V167-L291 HydrophobicContact CG1-CD1 4.13Å
168	S	98.3	Very high	97.7	Very high	0 Å²	0	36 Å²	36	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-61.9	-44	178.8	-59.9	0	0	0	0	112.4	A164 V165 A166 S172	A164-S168 VanDerWaalsContact O-CB 3.31Å; A164-S168 WeakPolarHBondContact O-CB 3.17Å; A164-S168 PolarHBondContact O-N 3.49Å; A164-S168 PolarHBondContact O-OG 3.43Å; V165-S168 WeakPolarHBondContact O-CB 3.36Å; V165-S168 PolarHBondContact O-N 3.04Å; V165-S168 VanDerWaalsContact O-N 3.17Å; A166-S168 VanDerWaalsContact C-N 3.27Å; A166-S168 PolarHBondContact O-N 2.89Å; S168-S172 VanDerWaalsContact O-CB 3.28Å; S168-S172 WeakPolarHBondContact O-CB 3.49Å; S168-S172 PolarHBondContact O-N 2.72Å; S168-S172 PolarHBondContact O-OG 3.18Å
169	F	98.2	Very high	97.6	Very high	73 Å²	73	35.9 Å²	35.9	32%	0.32	19%	0.193	S	C	.	.	H	α-helix	trans	-62.1	-48.9	174	-86.3	-72.6	0	0	0	112	P50 P54 V165 A166 V167 S171 S172 V173 F200 F284	P50-F169 HydrophobicContact CB-CE1 4.34Å; P50-F169 HydrophobicContact CB-CZ 4.34Å; P50-F169 WeakPolarHBondContact O-CZ 3.47Å; P54-F169 HydrophobicContact CG-CE2 4.21Å; V165-F169 HydrophobicContact CG1-CD2 3.84Å; V165-F169 HydrophobicContact CG1-CE2 3.76Å; V165-F169 WeakPolarHBondContact O-CD2 3.48Å; V165-F169 PolarHBondContact O-N 2.84Å; A166-F169 PolarHBondContact O-N 3.38Å; V167-F169 PolarHBondContact O-N 3.01Å; F169-S171 PolarHBondContact O-N 3.26Å; F169-S172 PolarHBondContact O-N 2.87Å; F169-V173 WeakPolarHBondContact O-CG2 3.35Å; F169-V173 PolarHBondContact O-N 3.3Å; F169-F200 HydrophobicContact CD1-CZ 4.37Å; F169-F284 AromaticContact CD1-CD2 3.89Å; F169-F284 HydrophobicContact CD1-CD2 3.89Å; F169-F284 AromaticContact CD1-CE2 3.6Å; F169-F284 HydrophobicContact CD1-CE2 3.6Å; F169-F284 AromaticContact CD2-CE2 3.81Å; F169-F284 HydrophobicContact CD2-CE2 3.81Å; F169-F284 AromaticContact CE1-CD2 3.93Å; F169-F284 HydrophobicContact CE1-CD2 3.93Å; F169-F284 AromaticContact CE1-CE2 3.44Å; F169-F284 HydrophobicContact CE1-CE2 3.44Å; F169-F284 VanDerWaalsContact CE1-CE2 3.44Å; F169-F284 HydrophobicContact CE1-CZ 4.03Å; F169-F284 AromaticContact CE2-CE2 3.65Å; F169-F284 HydrophobicContact CE2-CE2 3.65Å; F169-F284 AromaticContact CE2-CZ 3.95Å; F169-F284 HydrophobicContact CE2-CZ 3.95Å; F169-F284 HydrophobicContact CG-CD2 4.32Å; F169-F284 AromaticContact CG-CE2 3.78Å; F169-F284 HydrophobicContact CG-CE2 3.78Å; F169-F284 HydrophobicContact CZ-CD2 4.39Å; F169-F284 AromaticContact CZ-CE2 3.47Å; F169-F284 HydrophobicContact CZ-CE2 3.47Å; F169-F284 VanDerWaalsContact CZ-CE2 3.47Å; F169-F284 AromaticContact CZ-CZ 3.69Å; F169-F284 HydrophobicContact CZ-CZ 3.69Å
170	L	98.2	Very high	97.5	Very high	124 Å²	124	41 Å²	41	65%	0.649	21%	0.214	S	C	*	.	H	α-helix	trans	-61.6	-45.6	-179.2	-68.3	173.6	0	0	0	111.8	A166 V167 S172 V173 Y174	A166-L170 VanDerWaalsContact O-CG 3.3Å; A166-L170 WeakPolarHBondContact O-CG 3.34Å; A166-L170 PolarHBondContact O-N 3.24Å; V167-L170 PolarHBondContact O-N 3.17Å; L170-S172 VanDerWaalsContact C-N 3.32Å; L170-S172 PolarHBondContact O-N 2.72Å; L170-V173 PolarHBondContact O-N 2.89Å; L170-Y174 PolarHBondContact O-N 3.49Å
171	S	97.6	Very high	97.4	Very high	43 Å²	43	50 Å²	50	30%	0.301	25%	0.248	S	C	.	.	H	α-helix	trans	-61.4	-40.9	174.8	-68.3	0	0	0	0	111.5	V167 F169 Y174 L175	V167-S171 VanDerWaalsContact O-CB 3.3Å; V167-S171 WeakPolarHBondContact O-CB 3.43Å; V167-S171 PolarHBondContact O-N 3.37Å; V167-S171 PolarHBondContact O-OG 3.4Å; V167-S171 VanDerWaalsContact O-OG 3.12Å; F169-S171 PolarHBondContact O-N 3.26Å; S171-Y174 WeakPolarHBondContact O-CB 3.33Å; S171-Y174 PolarHBondContact O-N 3.4Å; S171-L175 WeakPolarHBondContact O-CB 3.23Å; S171-L175 WeakPolarHBondContact O-CG 3.18Å; S171-L175 PolarHBondContact O-N 3.16Å
172	S	97.9	Very high	97.1	Very high	1 Å²	1	51 Å²	51	1%	0.007	26%	0.255	C	S	.	.	H	α-helix	trans	-67.1	-39	178.2	-56.9	0	0	0	0	112.6	S168 F169 L170 L175 Y176 F284	S168-S172 VanDerWaalsContact O-CB 3.28Å; S168-S172 WeakPolarHBondContact O-CB 3.49Å; S168-S172 PolarHBondContact O-N 2.72Å; S168-S172 PolarHBondContact O-OG 3.18Å; F169-S172 PolarHBondContact O-N 2.87Å; L170-S172 VanDerWaalsContact C-N 3.32Å; L170-S172 PolarHBondContact O-N 2.72Å; S172-L175 PolarHBondContact O-N 3.25Å; S172-Y176 VanDerWaalsContact O-CB 3.31Å; S172-Y176 WeakPolarHBondContact O-CB 3.22Å; S172-Y176 PolarHBondContact O-N 3.47Å; S172-F284 WeakPolarHBondContact OG-CA 3.41Å
173	V	98.1	Very high	96.7	Very high	76 Å²	76	52.3 Å²	52.3	46%	0.461	27%	0.265	S	S	.	.	H	α-helix	trans	-61.8	-47.2	172.6	170.5	0	0	0	0	110.1	F169 L170 L175 Y176 V177 F200	F169-V173 WeakPolarHBondContact O-CG2 3.35Å; F169-V173 PolarHBondContact O-N 3.3Å; L170-V173 PolarHBondContact O-N 2.89Å; V173-L175 PolarHBondContact O-N 3.4Å; V173-Y176 PolarHBondContact O-N 3.48Å; V173-V177 HydrophobicContact CG1-CG2 4.37Å; V173-V177 WeakPolarHBondContact O-CB 3.47Å; V173-V177 VanDerWaalsContact O-CG2 3.29Å; V173-V177 WeakPolarHBondContact O-CG2 3.28Å; V173-V177 PolarHBondContact O-N 3.3Å; V173-F200 HydrophobicContact CG2-CE2 3.9Å; V173-F200 HydrophobicContact CG2-CZ 4.43Å
174	Y	97.8	Very high	96.3	Very high	109 Å²	109	56 Å²	56	43%	0.427	29%	0.29	S	S	.	.	H	α-helix	trans	-56.5	-49.3	175.4	165.3	-99.5	0	0	0	111.8	L170 S171 V177 R178 L215	L170-Y174 PolarHBondContact O-N 3.49Å; S171-Y174 WeakPolarHBondContact O-CB 3.33Å; S171-Y174 PolarHBondContact O-N 3.4Å; Y174-V177 PolarHBondContact O-N 3.11Å; Y174-R178 WeakPolarHBondContact O-CB 3.43Å; Y174-R178 PolarHBondContact O-N 3.06Å; Y174-L215 HydrophobicContact CE1-CD1 4.18Å
175	L	97.6	Very high	95.8	Very high	8 Å²	8	60.8 Å²	60.8	4%	0.042	31%	0.312	C	S	.	.	H	α-helix	trans	-62.4	-44.4	-179.9	-71.2	167.9	0	0	0	112	S171 S172 V173 S179 P208 L215 F282 V287	S171-L175 WeakPolarHBondContact O-CB 3.23Å; S171-L175 WeakPolarHBondContact O-CG 3.18Å; S171-L175 PolarHBondContact O-N 3.16Å; S172-L175 PolarHBondContact O-N 3.25Å; V173-L175 PolarHBondContact O-N 3.4Å; L175-S179 WeakPolarHBondContact O-CB 3.45Å; L175-S179 PolarHBondContact O-N 3.05Å; L175-P208 HydrophobicContact CD2-CB 3.71Å; L175-P208 HydrophobicContact CD2-CG 3.6Å; L175-L215 HydrophobicContact CD2-CD1 3.88Å; L175-F282 HydrophobicContact CD1-CD1 3.35Å; L175-F282 HydrophobicContact CD1-CE1 3.62Å; L175-F282 HydrophobicContact CD1-CG 4.16Å; L175-F282 HydrophobicContact CD2-CD1 4.02Å; L175-F282 HydrophobicContact CG-CD1 4.32Å; L175-V287 HydrophobicContact CD1-CG2 3.59Å
176	Y	97.3	Very high	95.4	Very high	44 Å²	44	61.1 Å²	61.1	17%	0.173	32%	0.317	C	S	.	.	H	α-helix	trans	-62.9	-48.6	178.2	-178	-101.3	0	0	0	111.5	S172 V173 S179 F180 P196 D199 F200 R204	S172-Y176 VanDerWaalsContact O-CB 3.31Å; S172-Y176 WeakPolarHBondContact O-CB 3.22Å; S172-Y176 PolarHBondContact O-N 3.47Å; V173-Y176 PolarHBondContact O-N 3.48Å; Y176-S179 WeakPolarHBondContact O-CB 3.41Å; Y176-S179 PolarHBondContact O-N 2.91Å; Y176-S179 PolarHBondContact O-OG 3.43Å; Y176-F180 HydrophobicContact CD1-CE2 4.01Å; Y176-F180 AromaticContact CE1-CE2 3.62Å; Y176-F180 HydrophobicContact CE1-CE2 3.62Å; Y176-F180 AromaticContact CE1-CZ 3.82Å; Y176-F180 HydrophobicContact CE1-CZ 3.82Å; Y176-F180 HydrophobicContact CE2-CZ 4.45Å; Y176-F180 AromaticContact CZ-CE2 3.99Å; Y176-F180 AromaticContact CZ-CZ 3.74Å; Y176-F180 WeakPolarHBondContact O-CD2 3.26Å; Y176-P196 WeakPolarHBondContact OH-CA 3.15Å; Y176-P196 WeakPolarHBondContact OH-CB 3.08Å; Y176-D199 HydrophobicContact CE2-CB 3.92Å; Y176-F200 HydrophobicContact CD2-CB 3.94Å; Y176-F200 HydrophobicContact CE2-CB 4.22Å; Y176-F200 HydrophobicContact CG-CB 4.33Å; Y176-F200 HydrophobicContact CG-CD2 4.13Å; Y176-R204 HydrophobicContact CD2-CG 4.17Å; Y176-R204 VanDerWaalsContact CE2-CD 3.45Å; Y176-R204 HydrophobicContact CE2-CG 4.16Å
177	V	96.9	Very high	95.1	Very high	68 Å²	68	59.4 Å²	59.4	41%	0.412	30%	0.301	S	S	.	.	H	α-helix	trans	-60.5	-54.3	177	169.9	0	0	0	0	109.7	V173 Y174 S179 F180 W181	V173-V177 HydrophobicContact CG1-CG2 4.37Å; V173-V177 WeakPolarHBondContact O-CB 3.47Å; V173-V177 VanDerWaalsContact O-CG2 3.29Å; V173-V177 WeakPolarHBondContact O-CG2 3.28Å; V173-V177 PolarHBondContact O-N 3.3Å; Y174-V177 PolarHBondContact O-N 3.11Å; V177-S179 PolarHBondContact O-N 3.39Å; V177-S179 VanDerWaalsContact O-N 3.12Å; V177-F180 VanDerWaalsContact O-CD2 3.26Å; V177-F180 WeakPolarHBondContact O-CD2 3.07Å; V177-F180 PolarHBondContact O-N 3.35Å; V177-F180 VanDerWaalsContact O-N 3.15Å; V177-W181 HydrophobicContact CG1-CH2 4.06Å; V177-W181 HydrophobicContact CG1-CZ3 3.63Å; V177-W181 WeakPolarHBondContact O-CZ3 3.46Å
178	R	95.3	Very high	94.8	Very high	50 Å²	50	58.3 Å²	58.3	19%	0.189	30%	0.295	C	S	.	.	H	α-helix	trans	-53.2	-36.9	179.3	176.9	-171.4	144.1	136.5	13	113.1	Y174 F180 W181 E205 R209	Y174-R178 WeakPolarHBondContact O-CB 3.43Å; Y174-R178 PolarHBondContact O-N 3.06Å; R178-F180 PolarHBondContact O-N 3.18Å; R178-W181 PolarHBondContact O-N 3.4Å; R178-E205 IonicContact CZ-OE1 3.78Å; R178-E205 IonicContact CZ-OE2 2.7Å; R178-E205 IonicContact NE-OE1 3.71Å; R178-E205 IonicContact NE-OE2 3.04Å; R178-E205 PolarHBondContact NE-OE2 3.24Å; R178-E205 IonicContact NH2-OE1 3.77Å; R178-E205 PolarHBondContact NH2-OE1 3.01Å; R178-E205 IonicContact NH2-OE2 3.18Å; R178-R209 PolarHBondContact NH1-O 3.23Å; R178-R209 PolarHBondContact NH2-O 3.33Å
179	S	95.6	Very high	94.2	Very high	2 Å²	2	63.5 Å²	63.5	1%	0.014	32%	0.322	C	S	.	.	G	3₁₀ helix	trans	-59.6	-20.8	-177	78.9	0	0	0	0	114.4	L175 Y176 V177 W181 A182 R204	L175-S179 WeakPolarHBondContact O-CB 3.45Å; L175-S179 PolarHBondContact O-N 3.05Å; Y176-S179 WeakPolarHBondContact O-CB 3.41Å; Y176-S179 PolarHBondContact O-N 2.91Å; Y176-S179 PolarHBondContact O-OG 3.43Å; V177-S179 PolarHBondContact O-N 3.39Å; V177-S179 VanDerWaalsContact O-N 3.12Å; S179-W181 PolarHBondContact O-N 2.85Å; S179-A182 WeakPolarHBondContact O-CB 3.49Å; S179-A182 PolarHBondContact O-N 3.28Å; S179-A182 VanDerWaalsContact O-N 3.13Å; S179-R204 VanDerWaalsContact CB-CB 3.48Å; S179-R204 VanDerWaalsContact OG-CB 3.29Å; S179-R204 WeakPolarHBondContact OG-CB 3.5Å; S179-R204 WeakPolarHBondContact OG-CD 3.48Å; S179-R204 PolarHBondContact OG-NE 2.98Å; S179-R204 VanDerWaalsContact OG-NE 3.12Å
180	F	94.7	Very high	93.6	Very high	115 Å²	115	61.1 Å²	61.1	50%	0.504	32%	0.318	S	S	.	.	G	3₁₀ helix	trans	-69	-18.5	176.7	-69.7	-70	0	0	0	113.5	Y176 V177 R178	Y176-F180 HydrophobicContact CD1-CE2 4.01Å; Y176-F180 AromaticContact CE1-CE2 3.62Å; Y176-F180 HydrophobicContact CE1-CE2 3.62Å; Y176-F180 AromaticContact CE1-CZ 3.82Å; Y176-F180 HydrophobicContact CE1-CZ 3.82Å; Y176-F180 HydrophobicContact CE2-CZ 4.45Å; Y176-F180 AromaticContact CZ-CE2 3.99Å; Y176-F180 AromaticContact CZ-CZ 3.74Å; Y176-F180 WeakPolarHBondContact O-CD2 3.26Å; V177-F180 VanDerWaalsContact O-CD2 3.26Å; V177-F180 WeakPolarHBondContact O-CD2 3.07Å; V177-F180 PolarHBondContact O-N 3.35Å; V177-F180 VanDerWaalsContact O-N 3.15Å; R178-F180 PolarHBondContact O-N 3.18Å
181	W	94.7	Very high	93	Very high	203 Å²	203	55.2 Å²	55.2	77%	0.769	29%	0.287	S	S	*	.	G	3₁₀ helix	trans	-98.3	-3.9	173.4	-64.4	-89.9	0	0	0	113	V177 R178 S179	V177-W181 HydrophobicContact CG1-CH2 4.06Å; V177-W181 HydrophobicContact CG1-CZ3 3.63Å; V177-W181 WeakPolarHBondContact O-CZ3 3.46Å; R178-W181 PolarHBondContact O-N 3.4Å; S179-W181 PolarHBondContact O-N 2.85Å
182	A	91.7	Very high	92.6	Very high	20 Å²	20	56.7 Å²	56.7	17%	0.165	29%	0.292	C	S	.	.	S	Bend	trans	-74	143.6	177	0	0	0	0	0	110.9	S179 L187 E205	S179-A182 WeakPolarHBondContact O-CB 3.49Å; S179-A182 PolarHBondContact O-N 3.28Å; S179-A182 VanDerWaalsContact O-N 3.13Å; A182-L187 HydrophobicContact CB-CD2 4.13Å; A182-E205 HydrophobicContact CB-CG 4.28Å
183	P	90.9	Very high	92.1	Very high	65 Å²	65	57.4 Å²	57.4	42%	0.422	30%	0.296	S	S	.	.			trans	-69.3	149.6	176.5	31	-35.5	0	0	0	110.7	H185 A186	P183-H185 WeakPolarHBondContact CB-CE1 3.32Å; P183-H185 WeakPolarHBondContact CG-CE1 3.45Å; P183-H185 PolarHBondContact O-N 2.69Å; P183-H185 VanDerWaalsContact O-N 3.07Å; P183-A186 HydrophobicContact CG-CB 3.9Å; P183-A186 WeakPolarHBondContact O-CB 3.42Å; P183-A186 PolarHBondContact O-N 3.08Å
184	S	87.8	Confident	91.6	Very high	85 Å²	85	56.8 Å²	56.8	59%	0.594	31%	0.305	S	S	*	.	G	3₁₀ helix	trans	-59.2	-27.6	-173.6	-56.5	0	0	0	0	114.6	R118 A186 L187	R118-S184 PolarHBondContact NH2-O 3.32Å; S184-A186 VanDerWaalsContact C-N 3.28Å; S184-A186 PolarHBondContact O-N 2.89Å; S184-L187 PolarHBondContact O-N 3.04Å
185	H	88	Confident	91.4	Very high	101 Å²	101	53.1 Å²	53.1	47%	0.468	29%	0.293	S	S	.	.	G	3₁₀ helix	trans	-70.6	-23.9	176.5	62.1	-97.8	0	0	0	113.1	R118 D119 P183	R118-H185 PolarHBondContact NH2-O 2.83Å; D119-H185 IonicContact OD2-CD2 3.42Å; D119-H185 PolarHBondContact OD2-CD2 3.13Å; D119-H185 IonicContact OD2-NE2 3.76Å; P183-H185 WeakPolarHBondContact CB-CE1 3.32Å; P183-H185 WeakPolarHBondContact CG-CE1 3.45Å; P183-H185 PolarHBondContact O-N 2.69Å; P183-H185 VanDerWaalsContact O-N 3.07Å
186	A	89.6	Confident	91.2	Very high	26 Å²	26	56.5 Å²	56.5	22%	0.215	32%	0.315	C	S	.	.	G	3₁₀ helix	trans	-86.3	-6.4	179.2	0	0	0	0	0	113.6	P183 S184 L206	P183-A186 HydrophobicContact CG-CB 3.9Å; P183-A186 WeakPolarHBondContact O-CB 3.42Å; P183-A186 PolarHBondContact O-N 3.08Å; S184-A186 VanDerWaalsContact C-N 3.28Å; S184-A186 PolarHBondContact O-N 2.89Å; A186-L206 WeakPolarHBondContact O-CB 3.44Å; A186-L206 PolarHBondContact O-N 3.16Å
187	L	92.7	Very high	91	Very high	10 Å²	10	58.9 Å²	58.9	5%	0.052	33%	0.331	C	S	.	.	B	Isolated β-bridge	trans	-78.4	138.9	178.8	-59.2	-179.3	0	0	0	111.8	R118 A182 S184 D192 R204	R118-L187 PolarHBondContact NH2-O 2.89Å; A182-L187 HydrophobicContact CB-CD2 4.13Å; S184-L187 PolarHBondContact O-N 3.04Å; L187-D192 HydrophobicContact CD1-CB 4.37Å; L187-R204 CarbonylContact C-O 3.49Å; L187-R204 WeakPolarHBondContact CA-O 3.38Å; L187-R204 HydrophobicContact CD2-CB 4.43Å
188	A	91.1	Very high	90.9	Very high	2 Å²	2	56 Å²	56	2%	0.017	31%	0.312	C	S	.	.			trans	-68.2	138.3	173.7	0	0	0	0	0	110.6	G190 G191 D192 R204 L206	A188-G190 VanDerWaalsContact C-N 3.31Å; A188-G190 PolarHBondContact O-N 3.26Å; A188-G191 PolarHBondContact O-N 2.82Å; A188-G191 VanDerWaalsContact O-N 3.07Å; A188-D192 PolarHBondContact O-N 3.5Å; A188-R204 PolarHBondContact N-O 2.86Å; A188-L206 HydrophobicContact CB-CB 4.35Å; A188-L206 HydrophobicContact CB-CD1 4.13Å
189	L	86.8	Confident	90.9	Very high	108 Å²	108	53.7 Å²	53.7	57%	0.565	30%	0.304	S	S	*	.	G	3₁₀ helix	trans	-62.4	-38.3	-179.3	-76.3	170.1	0	0	0	112.4	G191	L189-G191 VanDerWaalsContact C-N 3.26Å; L189-G191 PolarHBondContact O-N 3.1Å
190	G	85.3	Confident	90.9	Very high	23 Å²	23	55.7 Å²	55.7	24%	0.237	31%	0.312	C	S	.	.	G	3₁₀ helix	trans	-76.4	-11.8	176.2	0	0	0	0	0	114	A188 T193 Y198	A188-G190 VanDerWaalsContact C-N 3.31Å; A188-G190 PolarHBondContact O-N 3.26Å; G190-T193 WeakPolarHBondContact O-CG2 3.47Å; G190-Y198 WeakPolarHBondContact O-CE1 3.26Å
191	G	85.8	Confident	91	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	29%	0.289	C	S	.	.	G	3₁₀ helix	trans	-110.1	0.4	-170.5	0	0	0	0	0	115.8	A188 L189 D199 G203 R204	A188-G191 PolarHBondContact O-N 2.82Å; A188-G191 VanDerWaalsContact O-N 3.07Å; L189-G191 VanDerWaalsContact C-N 3.26Å; L189-G191 PolarHBondContact O-N 3.1Å; G191-D199 WeakPolarHBondContact O-CB 3.26Å; G191-D199 VanDerWaalsContact O-OD1 3.14Å; G191-G203 VanDerWaalsContact CA-O 3.3Å; G191-G203 WeakPolarHBondContact CA-O 3.28Å; G191-R204 VanDerWaalsContact O-CG 3.27Å; G191-R204 WeakPolarHBondContact O-CG 3.44Å
192	D	88.9	Confident	91	Very high	75 Å²	75	41 Å²	41	40%	0.401	25%	0.254	S	S	.	.			trans	-112.3	52.8	178.3	-165.8	35	0	0	0	110.9	L187 A188 R204	L187-D192 HydrophobicContact CD1-CB 4.37Å; A188-D192 PolarHBondContact O-N 3.5Å; D192-R204 IonicContact OD1-CZ 3.94Å; D192-R204 VanDerWaalsContact OD1-CZ 3.28Å; D192-R204 IonicContact OD1-NH1 2.79Å; D192-R204 PolarHBondContact OD1-NH1 2.67Å; D192-R204 IonicContact OD1-NH2 3.16Å; D192-R204 PolarHBondContact OD1-NH2 3.42Å
193	T	88.3	Confident	91.2	Very high	16 Å²	16	40.1 Å²	40.1	10%	0.098	25%	0.247	C	C	.	.	S	Bend	trans	-86.1	-15.5	-172.7	73.5	0	0	0	0	113.4	H34 G190 N195 Y198 D199	H34-T193 PolarHBondContact CE1-O 3.4Å; H34-T193 PolarHBondContact ND1-O 2.96Å; G190-T193 WeakPolarHBondContact O-CG2 3.47Å; T193-N195 PolarHBondContact O-N 3Å; T193-N195 PolarHBondContact OG1-N 3.31Å; T193-Y198 HydrophobicContact CG2-CD1 3.63Å; T193-Y198 HydrophobicContact CG2-CE1 3.73Å; T193-D199 WeakPolarHBondContact CB-OD1 3.16Å; T193-D199 PolarHBondContact N-OD1 3.36Å; T193-D199 PolarHBondContact N-OD2 3.23Å; T193-D199 PolarHBondContact OG1-OD1 2.91Å
194	G	88.1	Confident	91.4	Very high	63 Å²	63	38.1 Å²	38.1	65%	0.649	23%	0.231	S	C	*	.	S	Bend	trans	80.4	0.2	-174.6	0	0	0	0	0	113.8	P196 D199	G194-P196 WeakPolarHBondContact O-CD 3.43Å; G194-D199 PolarHBondContact N-OD2 2.88Å; G194-D199 VanDerWaalsContact N-OD2 3.14Å
195	N	92.3	Very high	91.8	Very high	31 Å²	31	34.9 Å²	34.9	17%	0.166	21%	0.207	C	C	.	.			trans	-94.3	111.3	167.9	-178.4	-40.5	0	0	0	109.1	T43 T193 L197 Y198 D199	T43-N195 VanDerWaalsContact CG2-ND2 3.3Å; T43-N195 WeakPolarHBondContact CG2-ND2 3.35Å; T43-N195 PolarHBondContact OG1-ND2 3.19Å; T193-N195 PolarHBondContact O-N 3Å; T193-N195 PolarHBondContact OG1-N 3.31Å; N195-L197 VanDerWaalsContact C-N 3.31Å; N195-L197 PolarHBondContact O-N 2.95Å; N195-L197 PolarHBondContact OD1-N 3.41Å; N195-Y198 PolarHBondContact O-N 2.94Å; N195-Y198 PolarHBondContact OD1-N 3.07Å; N195-D199 VanDerWaalsContact O-CB 3.3Å; N195-D199 WeakPolarHBondContact O-CB 3.28Å; N195-D199 VanDerWaalsContact O-CG 3.27Å; N195-D199 PolarHBondContact O-N 3.43Å
196	P	93.3	Very high	92.1	Very high	79 Å²	79	31.1 Å²	31.1	51%	0.513	19%	0.19	S	C	.	.	H	α-helix	trans	-57.3	-38.4	-175.6	-28.5	36.9	0	0	0	114.8	Y176 G194 F200	Y176-P196 WeakPolarHBondContact OH-CA 3.15Å; Y176-P196 WeakPolarHBondContact OH-CB 3.08Å; G194-P196 WeakPolarHBondContact O-CD 3.43Å; P196-F200 WeakPolarHBondContact O-CB 3.4Å; P196-F200 PolarHBondContact O-N 3.29Å
197	L	93.9	Very high	92.4	Very high	95 Å²	95	30.8 Å²	30.8	50%	0.497	19%	0.185	S	C	.	.	H	α-helix	trans	-70.6	-42.9	-177.1	-62.8	168.6	0	0	0	110.7	V47 N195 F201	V47-L197 HydrophobicContact CG2-CB 4.31Å; V47-L197 HydrophobicContact CG2-CD1 3.72Å; V47-L197 HydrophobicContact CG2-CG 4.45Å; N195-L197 VanDerWaalsContact C-N 3.31Å; N195-L197 PolarHBondContact O-N 2.95Å; N195-L197 PolarHBondContact OD1-N 3.41Å; L197-F201 WeakPolarHBondContact O-CB 3.49Å; L197-F201 PolarHBondContact O-N 3.01Å; L197-F201 VanDerWaalsContact O-N 3.1Å
198	Y	94.8	Very high	92.5	Very high	6 Å²	6	30.3 Å²	30.3	2%	0.024	18%	0.182	C	C	.	.	H	α-helix	trans	-69.7	-43.7	177.5	-171.7	-93.3	0	0	0	112	R38 E39 A46 G190 T193 N195 F200 F201 I202	R38-Y198 HydrophobicContact CB-CE2 3.97Å; R38-Y198 HydrophobicContact CG-CE2 4.44Å; E39-Y198 PolarHBondContact N-OH 3.4Å; A46-Y198 HydrophobicContact CB-CD2 3.93Å; G190-Y198 WeakPolarHBondContact O-CE1 3.26Å; T193-Y198 HydrophobicContact CG2-CD1 3.63Å; T193-Y198 HydrophobicContact CG2-CE1 3.73Å; N195-Y198 PolarHBondContact O-N 2.94Å; N195-Y198 PolarHBondContact OD1-N 3.07Å; Y198-F200 VanDerWaalsContact C-N 3.31Å; Y198-F200 PolarHBondContact O-N 3.31Å; Y198-F201 PolarHBondContact O-N 2.83Å; Y198-F201 VanDerWaalsContact O-N 3.16Å; Y198-I202 HydrophobicContact CD1-CG1 4.24Å; Y198-I202 HydrophobicContact CE1-CB 4.41Å; Y198-I202 HydrophobicContact CE1-CG1 3.69Å; Y198-I202 HydrophobicContact CE2-CG1 4.06Å; Y198-I202 PolarHBondContact O-N 3.02Å
199	D	95	Very high	92.7	Very high	2 Å²	2	32.2 Å²	32.2	1%	0.011	19%	0.189	C	C	.	.	H	α-helix	trans	-67.3	-30.5	178.7	-72.1	3.2	0	0	0	112	Y176 G191 T193 G194 N195 G203 R204	Y176-D199 HydrophobicContact CE2-CB 3.92Å; G191-D199 WeakPolarHBondContact O-CB 3.26Å; G191-D199 VanDerWaalsContact O-OD1 3.14Å; T193-D199 WeakPolarHBondContact CB-OD1 3.16Å; T193-D199 PolarHBondContact N-OD1 3.36Å; T193-D199 PolarHBondContact N-OD2 3.23Å; T193-D199 PolarHBondContact OG1-OD1 2.91Å; G194-D199 PolarHBondContact N-OD2 2.88Å; G194-D199 VanDerWaalsContact N-OD2 3.14Å; N195-D199 VanDerWaalsContact O-CB 3.3Å; N195-D199 WeakPolarHBondContact O-CB 3.28Å; N195-D199 VanDerWaalsContact O-CG 3.27Å; N195-D199 PolarHBondContact O-N 3.43Å; D199-G203 CarbonylContact O-C 3.46Å; D199-G203 WeakPolarHBondContact O-CA 3.25Å; D199-G203 PolarHBondContact O-N 3.46Å; D199-R204 HydrophobicContact CB-CG 3.73Å; D199-R204 IonicContact OD2-NH1 3.82Å; D199-R204 PolarHBondContact OD2-NH1 3.05Å
200	F	96.3	Very high	93.1	Very high	44 Å²	44	31.7 Å²	31.7	19%	0.193	19%	0.186	C	C	.	.	H	α-helix	trans	-67.1	-44	169.4	172.2	-93.9	0	0	0	111.9	F169 V173 Y176 P196 Y198 F284	F169-F200 HydrophobicContact CD1-CZ 4.37Å; V173-F200 HydrophobicContact CG2-CE2 3.9Å; V173-F200 HydrophobicContact CG2-CZ 4.43Å; Y176-F200 HydrophobicContact CD2-CB 3.94Å; Y176-F200 HydrophobicContact CE2-CB 4.22Å; Y176-F200 HydrophobicContact CG-CB 4.33Å; Y176-F200 HydrophobicContact CG-CD2 4.13Å; P196-F200 WeakPolarHBondContact O-CB 3.4Å; P196-F200 PolarHBondContact O-N 3.29Å; Y198-F200 VanDerWaalsContact C-N 3.31Å; Y198-F200 PolarHBondContact O-N 3.31Å; F200-F284 HydrophobicContact CD1-CB 4.22Å; F200-F284 HydrophobicContact CE1-CB 3.73Å; F200-F284 HydrophobicContact CE1-CD2 4.26Å; F200-F284 HydrophobicContact CE1-CG 4.13Å; F200-F284 HydrophobicContact CZ-CB 4.21Å; F200-F284 HydrophobicContact CZ-CD2 4.39Å; F200-F284 PolarHBondContact O-N 3.36Å; F200-F284 VanDerWaalsContact O-N 3.11Å
201	F	96	Very high	93.4	Very high	1 Å²	1	33.8 Å²	33.8	0%	0.004	21%	0.207	C	C	.	.	H	α-helix	trans	-67.1	-54.2	-178.5	175.4	-111.7	0	0	0	112.6	F40 A46 I49 P50 L197 Y198 G283 F284 M285	F40-F201 HydrophobicContact CB-CE1 3.87Å; F40-F201 HydrophobicContact CB-CZ 4.48Å; F40-F201 HydrophobicContact CD2-CE1 4.25Å; F40-F201 HydrophobicContact CG-CE1 4.06Å; A46-F201 HydrophobicContact CB-CB 3.69Å; A46-F201 HydrophobicContact CB-CD1 3.96Å; A46-F201 HydrophobicContact CB-CG 3.97Å; I49-F201 HydrophobicContact CB-CE2 3.97Å; I49-F201 HydrophobicContact CB-CZ 4.15Å; I49-F201 HydrophobicContact CD1-CE1 4.37Å; I49-F201 HydrophobicContact CD1-CZ 3.87Å; I49-F201 HydrophobicContact CG2-CE2 3.57Å; I49-F201 HydrophobicContact CG2-CZ 3.8Å; P50-F201 HydrophobicContact CG-CD2 3.83Å; P50-F201 HydrophobicContact CG-CE2 4.4Å; L197-F201 WeakPolarHBondContact O-CB 3.49Å; L197-F201 PolarHBondContact O-N 3.01Å; L197-F201 VanDerWaalsContact O-N 3.1Å; Y198-F201 PolarHBondContact O-N 2.83Å; Y198-F201 VanDerWaalsContact O-N 3.16Å; F201-G283 CarbonylContact O-C 3.59Å; F201-F284 HydrophobicContact CD2-CD1 4.15Å; F201-F284 HydrophobicContact CE2-CD1 4.4Å; F201-F284 PolarHBondContact O-N 3.08Å; F201-F284 VanDerWaalsContact O-N 3.14Å; F201-M285 HydrophobicContact CD2-CB 4.14Å; F201-M285 HydrophobicContact CE1-CB 4.26Å; F201-M285 HydrophobicContact CE1-CG 4.37Å; F201-M285 HydrophobicContact CE1-SD 4.1Å; F201-M285 HydrophobicContact CE2-CB 3.67Å; F201-M285 HydrophobicContact CE2-CG 4.05Å; F201-M285 HydrophobicContact CZ-CB 3.74Å; F201-M285 HydrophobicContact CZ-CG 3.72Å; F201-M285 HydrophobicContact CZ-SD 3.94Å; F201-M285 WeakPolarHBondContact O-CB 3.48Å; F201-M285 PolarHBondContact O-N 3.37Å
202	I	94.8	Very high	93.5	Very high	8 Å²	8	40.3 Å²	40.3	4%	0.041	24%	0.242	C	C	.	.	H	α-helix	trans	-75.2	-36.6	-179.9	-66.2	-60.7	0	0	0	111.7	F40 Y198 G281 G283 M285	F40-I202 HydrophobicContact CD2-CD1 3.77Å; F40-I202 HydrophobicContact CE2-CD1 4.07Å; Y198-I202 HydrophobicContact CD1-CG1 4.24Å; Y198-I202 HydrophobicContact CE1-CB 4.41Å; Y198-I202 HydrophobicContact CE1-CG1 3.69Å; Y198-I202 HydrophobicContact CE2-CG1 4.06Å; Y198-I202 PolarHBondContact O-N 3.02Å; I202-G281 CarbonylContact O-C 3.45Å; I202-G283 PolarHBondContact O-N 2.63Å; I202-M285 HydrophobicContact CD1-SD 4.27Å
203	G	96.2	Very high	93.8	Very high	2 Å²	2	37.9 Å²	37.9	2%	0.021	23%	0.228	C	C	.	.			trans	97.7	133.1	-176.5	0	0	0	0	0	113	G191 D199 G281	G191-G203 VanDerWaalsContact CA-O 3.3Å; G191-G203 WeakPolarHBondContact CA-O 3.28Å; D199-G203 CarbonylContact O-C 3.46Å; D199-G203 WeakPolarHBondContact O-CA 3.25Å; D199-G203 PolarHBondContact O-N 3.46Å; G203-G281 WeakPolarHBondContact O-CA 3.3Å
204	R	95.3	Very high	94.2	Very high	23 Å²	23	37.1 Å²	37.1	9%	0.087	22%	0.223	C	C	.	.	S	Bend	trans	-83	-44.9	-176.5	-68.4	-178.2	54.1	72.1	11.6	113.3	Y176 S179 L187 A188 G191 D192 D199	Y176-R204 HydrophobicContact CD2-CG 4.17Å; Y176-R204 VanDerWaalsContact CE2-CD 3.45Å; Y176-R204 HydrophobicContact CE2-CG 4.16Å; S179-R204 VanDerWaalsContact CB-CB 3.48Å; S179-R204 VanDerWaalsContact OG-CB 3.29Å; S179-R204 WeakPolarHBondContact OG-CB 3.5Å; S179-R204 WeakPolarHBondContact OG-CD 3.48Å; S179-R204 PolarHBondContact OG-NE 2.98Å; S179-R204 VanDerWaalsContact OG-NE 3.12Å; L187-R204 CarbonylContact C-O 3.49Å; L187-R204 WeakPolarHBondContact CA-O 3.38Å; L187-R204 HydrophobicContact CD2-CB 4.43Å; A188-R204 PolarHBondContact N-O 2.86Å; G191-R204 VanDerWaalsContact O-CG 3.27Å; G191-R204 WeakPolarHBondContact O-CG 3.44Å; D192-R204 IonicContact OD1-CZ 3.94Å; D192-R204 VanDerWaalsContact OD1-CZ 3.28Å; D192-R204 IonicContact OD1-NH1 2.79Å; D192-R204 PolarHBondContact OD1-NH1 2.67Å; D192-R204 IonicContact OD1-NH2 3.16Å; D192-R204 PolarHBondContact OD1-NH2 3.42Å; D199-R204 HydrophobicContact CB-CG 3.73Å; D199-R204 IonicContact OD2-NH1 3.82Å; D199-R204 PolarHBondContact OD2-NH1 3.05Å
205	E	95.3	Very high	94.6	Very high	18 Å²	18	35.5 Å²	35.5	8%	0.084	20%	0.199	C	C	.	.	B	Isolated β-bridge	trans	-84.3	133.8	-178.5	-165.6	170.9	172	0	0	109.7	R178 A182 P208 F282	R178-E205 IonicContact CZ-OE1 3.78Å; R178-E205 IonicContact CZ-OE2 2.7Å; R178-E205 IonicContact NE-OE1 3.71Å; R178-E205 IonicContact NE-OE2 3.04Å; R178-E205 PolarHBondContact NE-OE2 3.24Å; R178-E205 IonicContact NH2-OE1 3.77Å; R178-E205 PolarHBondContact NH2-OE1 3.01Å; R178-E205 IonicContact NH2-OE2 3.18Å; A182-E205 HydrophobicContact CB-CG 4.28Å; E205-P208 HydrophobicContact CB-CB 4.29Å; E205-P208 HydrophobicContact CG-CB 3.98Å; E205-P208 VanDerWaalsContact OE1-CA 3.31Å; E205-P208 WeakPolarHBondContact OE1-CA 3.12Å; E205-F282 PolarHBondContact O-N 2.79Å
206	L	94.6	Very high	94.8	Very high	21 Å²	21	34.1 Å²	34.1	11%	0.11	19%	0.192	C	C	.	.	S	Bend	trans	-69.6	-59.6	-179.5	-176.4	68.3	0	0	0	110.3	L117 A186 A188 K216 D280	L117-L206 HydrophobicContact CD2-CD2 4.09Å; A186-L206 WeakPolarHBondContact O-CB 3.44Å; A186-L206 PolarHBondContact O-N 3.16Å; A188-L206 HydrophobicContact CB-CB 4.35Å; A188-L206 HydrophobicContact CB-CD1 4.13Å; L206-K216 WeakPolarHBondContact O-CE 3.24Å; L206-K216 PolarHBondContact O-NZ 3.34Å; L206-D280 WeakPolarHBondContact CD1-O 3.44Å
207	N	95	Very high	94.9	Very high	20 Å²	20	30.3 Å²	30.3	11%	0.107	17%	0.167	C	C	.	.	S	Bend	trans	-128.8	79.7	-177.3	-65.2	-47.2	0	0	0	110.2	L123 R209 K216 I277	L123-N207 HydrophobicContact CD1-CB 3.81Å; N207-R209 PolarHBondContact O-N 3.18Å; N207-K216 PolarHBondContact OD1-NZ 2.99Å; N207-I277 PolarHBondContact OD1-O 3.44Å
208	P	96.2	Very high	95.1	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	15%	0.145	C	C	.	.			trans	-67.6	126	-176.2	26	-32.7	0	0	0	112.2	L175 E205 L215 F282	L175-P208 HydrophobicContact CD2-CB 3.71Å; L175-P208 HydrophobicContact CD2-CG 3.6Å; E205-P208 HydrophobicContact CB-CB 4.29Å; E205-P208 HydrophobicContact CG-CB 3.98Å; E205-P208 VanDerWaalsContact OE1-CA 3.31Å; E205-P208 WeakPolarHBondContact OE1-CA 3.12Å; P208-L215 HydrophobicContact CB-CD1 4.21Å; P208-L215 HydrophobicContact CG-CB 4.31Å; P208-L215 WeakPolarHBondContact O-CB 3.39Å; P208-L215 PolarHBondContact O-N 3.37Å; P208-F282 HydrophobicContact CG-CB 3.74Å; P208-F282 HydrophobicContact CG-CD1 3.61Å; P208-F282 HydrophobicContact CG-CG 4.12Å
209	R	95.1	Very high	95.2	Very high	42 Å²	42	26.3 Å²	26.3	16%	0.158	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	140.7	-174.3	-74.4	-179.6	174.2	-127.3	-9.9	115.6	K124 Y125 R178 N207 F213 D214	K124-R209 PolarHBondContact O-NH1 2.99Å; K124-R209 PolarHBondContact O-NH2 3.15Å; Y125-R209 PolarHBondContact OH-NH2 2.81Å; R178-R209 PolarHBondContact NH1-O 3.23Å; R178-R209 PolarHBondContact NH2-O 3.33Å; N207-R209 PolarHBondContact O-N 3.18Å; R209-F213 CarbonylContact C-O 3.57Å; R209-F213 WeakPolarHBondContact CA-O 3.38Å; R209-D214 HydrophobicContact CG-CB 4.09Å; R209-D214 IonicContact CZ-OD2 3.22Å; R209-D214 VanDerWaalsContact CZ-OD2 3.27Å; R209-D214 IonicContact NE-OD2 3.03Å; R209-D214 PolarHBondContact NE-OD2 2.83Å; R209-D214 IonicContact NH2-OD2 2.75Å; R209-D214 PolarHBondContact NH2-OD2 2.93Å
210	I	94.4	Very high	95.1	Very high	97 Å²	97	27.5 Å²	27.5	50%	0.497	15%	0.153	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	98	165.3	-56.4	174.5	0	0	0	107	N212 F213 L215	I210-N212 PolarHBondContact O-N 3.03Å; I210-F213 PolarHBondContact N-O 3.38Å; I210-F213 VanDerWaalsContact O-CB 3.25Å; I210-F213 WeakPolarHBondContact O-CB 3.45Å; I210-F213 PolarHBondContact O-N 3.17Å; I210-L215 HydrophobicContact CD1-CD1 4.33Å; I210-L215 HydrophobicContact CD1-CD2 4.34Å; I210-L215 HydrophobicContact CG1-CD1 4.29Å
211	G	91.3	Very high	94.8	Very high	66 Å²	66	25.7 Å²	25.7	68%	0.68	15%	0.145	S	C	*	.	T	Hydrogen-bonded Turn	trans	59.5	-119.9	-167.9	0	0	0	0	0	111.3
212	N	89.4	Confident	94.7	Very high	137 Å²	137	25.7 Å²	25.7	73%	0.733	15%	0.145	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89.3	0.8	177.2	-65.1	-28.4	0	0	0	113.8	Y104 I210	Y104-N212 PolarHBondContact OH-O 3.29Å; I210-N212 PolarHBondContact O-N 3.03Å
213	F	94.9	Very high	94.8	Very high	25 Å²	25	25.7 Å²	25.7	11%	0.11	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	112.1	-179.2	-167.1	-84.2	0	0	0	110.7	A101 Y104 L105 R209 I210 L215 F218	A101-F213 HydrophobicContact CB-CE2 3.9Å; A101-F213 HydrophobicContact CB-CZ 4.04Å; Y104-F213 AromaticContact CD1-CD2 3.35Å; Y104-F213 HydrophobicContact CD1-CD2 3.35Å; Y104-F213 AromaticContact CD1-CE2 3.62Å; Y104-F213 HydrophobicContact CD1-CE2 3.62Å; Y104-F213 HydrophobicContact CD1-CG 4.32Å; Y104-F213 HydrophobicContact CE1-CB 4.35Å; Y104-F213 AromaticContact CE1-CD2 3.64Å; Y104-F213 HydrophobicContact CE1-CD2 3.64Å; Y104-F213 HydrophobicContact CE1-CE2 4.24Å; Y104-F213 HydrophobicContact CE1-CG 4.18Å; Y104-F213 HydrophobicContact CG-CD2 4.09Å; Y104-F213 AromaticContact CG-CE2 3.87Å; Y104-F213 HydrophobicContact CG-CE2 3.87Å; L105-F213 HydrophobicContact CD2-CD2 4.04Å; L105-F213 HydrophobicContact CG-CD2 4.2Å; R209-F213 CarbonylContact C-O 3.57Å; R209-F213 WeakPolarHBondContact CA-O 3.38Å; I210-F213 PolarHBondContact N-O 3.38Å; I210-F213 VanDerWaalsContact O-CB 3.25Å; I210-F213 WeakPolarHBondContact O-CB 3.45Å; I210-F213 PolarHBondContact O-N 3.17Å; F213-L215 HydrophobicContact CD1-CD2 3.95Å; F213-L215 HydrophobicContact CD1-CG 4.24Å; F213-L215 HydrophobicContact CE1-CD2 3.78Å; F213-L215 HydrophobicContact CE1-CG 4.42Å; F213-F218 HydrophobicContact CE1-CB 3.71Å; F213-F218 AromaticContact CE1-CD1 3.8Å; F213-F218 HydrophobicContact CE1-CD1 3.8Å; F213-F218 HydrophobicContact CE1-CD2 4.25Å; F213-F218 HydrophobicContact CE1-CE1 4.5Å; F213-F218 AromaticContact CE1-CG 3.64Å; F213-F218 HydrophobicContact CE1-CG 3.64Å; F213-F218 AromaticContact CE2-CD2 3.87Å; F213-F218 HydrophobicContact CE2-CD2 3.87Å; F213-F218 HydrophobicContact CE2-CE2 4.28Å; F213-F218 HydrophobicContact CE2-CG 4.11Å; F213-F218 HydrophobicContact CZ-CB 3.69Å; F213-F218 AromaticContact CZ-CD1 3.51Å; F213-F218 HydrophobicContact CZ-CD1 3.51Å; F213-F218 AromaticContact CZ-CD2 3.37Å; F213-F218 HydrophobicContact CZ-CD2 3.37Å; F213-F218 AromaticContact CZ-CE1 3.93Å; F213-F218 HydrophobicContact CZ-CE1 3.93Å; F213-F218 AromaticContact CZ-CE2 3.83Å; F213-F218 HydrophobicContact CZ-CE2 3.83Å; F213-F218 AromaticContact CZ-CG 3.2Å; F213-F218 HydrophobicContact CZ-CG 3.2Å; F213-F218 HydrophobicContact CZ-CZ 4.08Å
214	D	96.5	Very high	94.8	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	110.3	177.5	-167	-62.6	0	0	0	109.8	Y104 Y125 R209 K216 Y217 F218	Y104-D214 PolarHBondContact OH-N 3.49Å; Y125-D214 HydrophobicContact CD1-CB 4.39Å; Y125-D214 HydrophobicContact CE1-CB 3.94Å; Y125-D214 WeakPolarHBondContact CE1-OD2 3.35Å; Y125-D214 PolarHBondContact OH-OD2 2.81Å; R209-D214 HydrophobicContact CG-CB 4.09Å; R209-D214 IonicContact CZ-OD2 3.22Å; R209-D214 VanDerWaalsContact CZ-OD2 3.27Å; R209-D214 IonicContact NE-OD2 3.03Å; R209-D214 PolarHBondContact NE-OD2 2.83Å; R209-D214 IonicContact NH2-OD2 2.75Å; R209-D214 PolarHBondContact NH2-OD2 2.93Å; D214-K216 VanDerWaalsContact C-N 3.34Å; D214-K216 PolarHBondContact O-N 3.13Å; D214-K216 PolarHBondContact OD1-N 3.19Å; D214-Y217 WeakPolarHBondContact OD1-CB 3.43Å; D214-Y217 PolarHBondContact OD1-N 2.95Å; D214-F218 WeakPolarHBondContact O-CB 3.5Å; D214-F218 PolarHBondContact O-N 3.27Å
215	L	96.9	Very high	94.8	Very high	29 Å²	29	25.5 Å²	25.5	15%	0.152	15%	0.146	C	C	.	.	H	α-helix	trans	-66.2	-37.7	-171.3	-70.5	161.5	0	0	0	111.8	Y174 L175 P208 I210 F213 C219 F282	Y174-L215 HydrophobicContact CE1-CD1 4.18Å; L175-L215 HydrophobicContact CD2-CD1 3.88Å; P208-L215 HydrophobicContact CB-CD1 4.21Å; P208-L215 HydrophobicContact CG-CB 4.31Å; P208-L215 WeakPolarHBondContact O-CB 3.39Å; P208-L215 PolarHBondContact O-N 3.37Å; I210-L215 HydrophobicContact CD1-CD1 4.33Å; I210-L215 HydrophobicContact CD1-CD2 4.34Å; I210-L215 HydrophobicContact CG1-CD1 4.29Å; F213-L215 HydrophobicContact CD1-CD2 3.95Å; F213-L215 HydrophobicContact CD1-CG 4.24Å; F213-L215 HydrophobicContact CE1-CD2 3.78Å; F213-L215 HydrophobicContact CE1-CG 4.42Å; L215-C219 WeakPolarHBondContact O-CB 3.44Å; L215-C219 PolarHBondContact O-N 3.5Å; L215-C219 VanDerWaalsContact O-N 3.08Å; L215-C219 PolarHBondContact O-SG 3.44Å; L215-C219 VanDerWaalsContact O-SG 3.36Å; L215-F282 HydrophobicContact CB-CD1 4.2Å; L215-F282 HydrophobicContact CB-CE1 3.85Å
216	K	96.1	Very high	95	Very high	1 Å²	1	24.7 Å²	24.7	0%	0.004	14%	0.142	C	C	.	.	H	α-helix	trans	-66.2	-57.3	178.8	-179.1	-166.3	-69.9	177.9	0	110.3	L206 N207 D214 F218 C219 E220 D276 I277 D280 F282 L286	L206-K216 WeakPolarHBondContact O-CE 3.24Å; L206-K216 PolarHBondContact O-NZ 3.34Å; N207-K216 PolarHBondContact OD1-NZ 2.99Å; D214-K216 VanDerWaalsContact C-N 3.34Å; D214-K216 PolarHBondContact O-N 3.13Å; D214-K216 PolarHBondContact OD1-N 3.19Å; K216-F218 PolarHBondContact O-N 3.24Å; K216-C219 PolarHBondContact O-N 3.36Å; K216-C219 VanDerWaalsContact O-N 3.16Å; K216-E220 WeakPolarHBondContact O-CB 3.46Å; K216-E220 PolarHBondContact O-N 2.83Å; K216-D276 WeakPolarHBondContact CD-O 3.41Å; K216-D276 WeakPolarHBondContact CE-O 3.43Å; K216-D276 PolarHBondContact NZ-O 3.31Å; K216-I277 HydrophobicContact CD-CD1 3.74Å; K216-I277 HydrophobicContact CG-CD1 4.1Å; K216-I277 PolarHBondContact NZ-O 2.88Å; K216-D280 PolarHBondContact NZ-O 3.37Å; K216-F282 HydrophobicContact CB-CB 4.07Å; K216-F282 HydrophobicContact CB-CD1 4.05Å; K216-F282 HydrophobicContact CB-CD2 3.67Å; K216-F282 HydrophobicContact CB-CE1 4.42Å; K216-F282 HydrophobicContact CB-CE2 4.08Å; K216-F282 HydrophobicContact CB-CG 3.67Å; K216-F282 HydrophobicContact CB-CZ 4.43Å; K216-F282 HydrophobicContact CD-CD2 4.48Å; K216-F282 HydrophobicContact CG-CB 4.36Å; K216-F282 HydrophobicContact CG-CD2 3.56Å; K216-F282 HydrophobicContact CG-CE2 4.01Å; K216-F282 HydrophobicContact CG-CG 4.02Å; K216-L286 HydrophobicContact CD-CD1 4.4Å
217	Y	95.9	Very high	95.1	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-60.7	-33.9	-178.8	174.3	-102.6	0	0	0	112.5	Y104 Y125 P126 I127 D214 L221 E268 L272 I277	Y104-Y217 AromaticContact CE2-CD1 3.77Å; Y104-Y217 HydrophobicContact CE2-CD1 3.77Å; Y104-Y217 AromaticContact CE2-CE1 3.89Å; Y104-Y217 HydrophobicContact CE2-CE1 3.89Å; Y125-Y217 AromaticContact CD1-CD1 3.59Å; Y125-Y217 HydrophobicContact CD1-CD1 3.59Å; Y125-Y217 HydrophobicContact CD1-CD2 4.04Å; Y125-Y217 AromaticContact CD1-CE1 3.98Å; Y125-Y217 HydrophobicContact CD1-CE1 3.98Å; Y125-Y217 HydrophobicContact CD1-CE2 4.36Å; Y125-Y217 AromaticContact CD1-CG 3.6Å; Y125-Y217 HydrophobicContact CD1-CG 3.6Å; Y125-Y217 HydrophobicContact CE1-CD1 4.26Å; Y125-Y217 HydrophobicContact CE1-CD2 4.32Å; Y125-Y217 AromaticContact CE1-CG 3.88Å; Y125-Y217 HydrophobicContact CE1-CG 3.88Å; P126-Y217 PolarHBondContact O-OH 3.11Å; I127-Y217 WeakPolarHBondContact CD1-OH 3.23Å; D214-Y217 WeakPolarHBondContact OD1-CB 3.43Å; D214-Y217 PolarHBondContact OD1-N 2.95Å; Y217-L221 HydrophobicContact CE2-CD1 4.06Å; Y217-E268 HydrophobicContact CE2-CG 4.36Å; Y217-E268 WeakPolarHBondContact OH-CG 3.47Å; Y217-E268 PolarHBondContact OH-OE1 2.89Å; Y217-L272 HydrophobicContact CD2-CD2 3.68Å; Y217-L272 HydrophobicContact CE2-CD2 3.46Å; Y217-L272 VanDerWaalsContact CE2-CD2 3.46Å; Y217-L272 HydrophobicContact CE2-CG 4.32Å; Y217-I277 HydrophobicContact CD2-CD1 4.23Å
218	F	96.9	Very high	95.3	Very high	6 Å²	6	23.1 Å²	23.1	3%	0.026	14%	0.136	C	C	.	.	H	α-helix	trans	-62.3	-53.6	173	170.5	-103.5	0	0	0	112.2	I97 H100 A101 Y104 F213 D214 K216 R222 P223	I97-F218 HydrophobicContact CG2-CE1 4.11Å; I97-F218 HydrophobicContact CG2-CZ 4.3Å; H100-F218 HydrophobicContact CB-CE2 3.95Å; H100-F218 HydrophobicContact CB-CZ 4.09Å; A101-F218 HydrophobicContact CB-CE2 4.21Å; A101-F218 HydrophobicContact CB-CZ 4.07Å; Y104-F218 HydrophobicContact CD2-CD2 4.22Å; Y104-F218 HydrophobicContact CG-CD2 4.34Å; F213-F218 HydrophobicContact CE1-CB 3.71Å; F213-F218 AromaticContact CE1-CD1 3.8Å; F213-F218 HydrophobicContact CE1-CD1 3.8Å; F213-F218 HydrophobicContact CE1-CD2 4.25Å; F213-F218 HydrophobicContact CE1-CE1 4.5Å; F213-F218 AromaticContact CE1-CG 3.64Å; F213-F218 HydrophobicContact CE1-CG 3.64Å; F213-F218 AromaticContact CE2-CD2 3.87Å; F213-F218 HydrophobicContact CE2-CD2 3.87Å; F213-F218 HydrophobicContact CE2-CE2 4.28Å; F213-F218 HydrophobicContact CE2-CG 4.11Å; F213-F218 HydrophobicContact CZ-CB 3.69Å; F213-F218 AromaticContact CZ-CD1 3.51Å; F213-F218 HydrophobicContact CZ-CD1 3.51Å; F213-F218 AromaticContact CZ-CD2 3.37Å; F213-F218 HydrophobicContact CZ-CD2 3.37Å; F213-F218 AromaticContact CZ-CE1 3.93Å; F213-F218 HydrophobicContact CZ-CE1 3.93Å; F213-F218 AromaticContact CZ-CE2 3.83Å; F213-F218 HydrophobicContact CZ-CE2 3.83Å; F213-F218 AromaticContact CZ-CG 3.2Å; F213-F218 HydrophobicContact CZ-CG 3.2Å; F213-F218 HydrophobicContact CZ-CZ 4.08Å; D214-F218 WeakPolarHBondContact O-CB 3.5Å; D214-F218 PolarHBondContact O-N 3.27Å; K216-F218 PolarHBondContact O-N 3.24Å; F218-R222 HydrophobicContact CD2-CB 4.25Å; F218-R222 HydrophobicContact CE2-CB 4.11Å; F218-R222 WeakPolarHBondContact O-CB 3.18Å; F218-R222 PolarHBondContact O-N 3.27Å; F218-R222 VanDerWaalsContact O-N 3.12Å; F218-P223 HydrophobicContact CD1-CG 4.37Å; F218-P223 HydrophobicContact CE1-CG 3.77Å; F218-P223 HydrophobicContact CZ-CG 4Å; F218-P223 VanDerWaalsContact O-CD 3.27Å; F218-P223 WeakPolarHBondContact O-CD 3.18Å
219	C	96.8	Very high	95.4	Very high	11 Å²	11	24.3 Å²	24.3	7%	0.074	14%	0.143	C	C	.	.	H	α-helix	trans	-64.6	-41.6	-176.8	-72.9	0	0	0	0	112.4	L215 K216 L221 F282 D290 L291	L215-C219 WeakPolarHBondContact O-CB 3.44Å; L215-C219 PolarHBondContact O-N 3.5Å; L215-C219 VanDerWaalsContact O-N 3.08Å; L215-C219 PolarHBondContact O-SG 3.44Å; L215-C219 VanDerWaalsContact O-SG 3.36Å; K216-C219 PolarHBondContact O-N 3.36Å; K216-C219 VanDerWaalsContact O-N 3.16Å; C219-L221 PolarHBondContact O-N 2.91Å; C219-F282 HydrophobicContact CB-CE2 4.34Å; C219-F282 HydrophobicContact CB-CZ 3.76Å; C219-D290 HydrophobicContact CB-CB 3.95Å; C219-D290 WeakPolarHBondContact CB-OD2 3.29Å; C219-L291 HydrophobicContact CB-CD2 4.48Å
220	E	94.2	Very high	95.5	Very high	27 Å²	27	23.3 Å²	23.3	13%	0.126	14%	0.141	C	C	.	.	H	α-helix	trans	-56.1	-36.3	-175.3	-172	175.3	-174.4	0	0	112.8	K216 V271 T274 I277 D290	K216-E220 WeakPolarHBondContact O-CB 3.46Å; K216-E220 PolarHBondContact O-N 2.83Å; E220-V271 HydrophobicContact CG-CG1 4.33Å; E220-V271 WeakPolarHBondContact OE1-CG1 3.35Å; E220-V271 WeakPolarHBondContact OE2-CG1 3.43Å; E220-T274 PolarHBondContact OE1-OG1 2.95Å; E220-I277 WeakPolarHBondContact OE2-CD1 3.34Å; E220-I277 VanDerWaalsContact OE2-CG1 3.22Å; E220-I277 WeakPolarHBondContact OE2-CG1 3.17Å; E220-D290 PolarHBondContact N-OD2 2.84Å
221	L	89.7	Confident	95.7	Very high	6 Å²	6	19.3 Å²	19.3	3%	0.031	12%	0.121	C	C	.	.	H	α-helix	trans	-114.6	-26.1	-172.5	-66.3	177.1	0	0	0	116	Y217 C219 L225 L265 E268 V271	Y217-L221 HydrophobicContact CE2-CD1 4.06Å; C219-L221 PolarHBondContact O-N 2.91Å; L221-L225 HydrophobicContact CD2-CD1 3.76Å; L221-L225 WeakPolarHBondContact O-CB 3.16Å; L221-L265 HydrophobicContact CB-CD2 4.11Å; L221-E268 HydrophobicContact CD1-CB 4.4Å; L221-E268 HydrophobicContact CD1-CG 3.76Å; L221-V271 HydrophobicContact CD1-CB 4.07Å; L221-V271 HydrophobicContact CD1-CG1 4.06Å; L221-V271 HydrophobicContact CD1-CG2 3.89Å; L221-V271 HydrophobicContact CD2-CG1 4.39Å; L221-V271 HydrophobicContact CD2-CG2 3.85Å; L221-V271 HydrophobicContact CG-CG1 4.27Å; L221-V271 HydrophobicContact CG-CG2 4.34Å
222	R	94	Very high	96	Very high	0 Å²	0	16.3 Å²	16.3	0%	0	9%	0.089	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.8	-83.5	-162.3	-60.3	174.2	-171.5	-114.8	4	112.7	H100 P126 N128 F218 G224 I226 E268	H100-R222 HydrophobicContact CB-CB 4.33Å; P126-R222 PolarHBondContact O-NH2 3.48Å; N128-R222 PolarHBondContact OD1-NH1 3.09Å; N128-R222 PolarHBondContact OD1-NH2 3.36Å; F218-R222 HydrophobicContact CD2-CB 4.25Å; F218-R222 HydrophobicContact CE2-CB 4.11Å; F218-R222 WeakPolarHBondContact O-CB 3.18Å; F218-R222 PolarHBondContact O-N 3.27Å; F218-R222 VanDerWaalsContact O-N 3.12Å; R222-G224 PolarHBondContact O-N 3.14Å; R222-G224 VanDerWaalsContact O-N 3.16Å; R222-I226 VanDerWaalsContact O-CB 3.27Å; R222-I226 WeakPolarHBondContact O-CB 3.33Å; R222-I226 WeakPolarHBondContact O-CG1 3.4Å; R222-I226 PolarHBondContact O-N 3.15Å; R222-E268 IonicContact CZ-OE1 2.8Å; R222-E268 IonicContact NE-OE1 3.27Å; R222-E268 IonicContact NH2-OE1 2.84Å; R222-E268 PolarHBondContact NH2-OE1 3.36Å
223	P	96.1	Very high	96.4	Very high	8 Å²	8	12.3 Å²	12.3	5%	0.052	7%	0.068	C	C	.	.	H	α-helix	trans	-59	-35.2	-173.1	27.2	-35.7	0	0	0	112.1	W96 I97 F218 G227 L291	W96-P223 PolarHBondContact NE1-O 3.42Å; I97-P223 HydrophobicContact CG1-CB 3.92Å; F218-P223 HydrophobicContact CD1-CG 4.37Å; F218-P223 HydrophobicContact CE1-CG 3.77Å; F218-P223 HydrophobicContact CZ-CG 4Å; F218-P223 VanDerWaalsContact O-CD 3.27Å; F218-P223 WeakPolarHBondContact O-CD 3.18Å; P223-G227 VanDerWaalsContact O-CA 3.29Å; P223-G227 WeakPolarHBondContact O-CA 3.45Å; P223-G227 PolarHBondContact O-N 3.49Å; P223-G227 VanDerWaalsContact O-N 3.12Å; P223-L291 HydrophobicContact CB-CD2 4.06Å; P223-L291 HydrophobicContact CG-CD2 3.56Å
224	G	95.8	Very high	96.5	Very high	1 Å²	1	11.2 Å²	11.2	1%	0.01	6%	0.063	C	C	.	.	H	α-helix	trans	-70.1	-69.5	177.7	0	0	0	0	0	113.8	R222 I226 G227 W228 D290	R222-G224 PolarHBondContact O-N 3.14Å; R222-G224 VanDerWaalsContact O-N 3.16Å; G224-I226 PolarHBondContact O-N 3.09Å; G224-G227 PolarHBondContact O-N 3.46Å; G224-W228 PolarHBondContact O-N 2.83Å; G224-D290 WeakPolarHBondContact CA-O 3.33Å
225	L	96.6	Very high	96.6	Very high	20 Å²	20	11.2 Å²	11.2	11%	0.105	6%	0.063	C	C	.	.	H	α-helix	trans	-65.5	-39.8	-174.9	-66.8	177.9	0	0	0	113.4	L221 G227 W228 V229 V261 V294	L221-L225 HydrophobicContact CD2-CD1 3.76Å; L221-L225 WeakPolarHBondContact O-CB 3.16Å; L225-G227 VanDerWaalsContact C-N 3.34Å; L225-W228 HydrophobicContact CD2-CE3 4.14Å; L225-W228 HydrophobicContact CD2-CZ3 4.44Å; L225-W228 WeakPolarHBondContact O-CB 3.42Å; L225-W228 PolarHBondContact O-N 3.41Å; L225-V229 PolarHBondContact O-N 2.9Å; L225-V261 HydrophobicContact CB-CG1 4.02Å; L225-V261 HydrophobicContact CB-CG2 4.24Å; L225-V261 HydrophobicContact CD2-CG2 4.46Å; L225-V294 HydrophobicContact CD2-CG1 3.76Å
226	I	98	Very high	96.7	Very high	2 Å²	2	11.3 Å²	11.3	1%	0.01	6%	0.063	C	C	.	.	H	α-helix	trans	-71.1	-38.3	176.3	-54.8	174.9	0	0	0	109	W96 H100 L133 R222 G224 W228 V229 V230 L265	W96-I226 HydrophobicContact CH2-CG2 3.75Å; W96-I226 HydrophobicContact CZ2-CB 3.96Å; W96-I226 HydrophobicContact CZ2-CG2 3.6Å; H100-I226 WeakPolarHBondContact CE1-CD1 3.5Å; L133-I226 HydrophobicContact CB-CD1 4.37Å; L133-I226 HydrophobicContact CD1-CG2 3.93Å; R222-I226 VanDerWaalsContact O-CB 3.27Å; R222-I226 WeakPolarHBondContact O-CB 3.33Å; R222-I226 WeakPolarHBondContact O-CG1 3.4Å; R222-I226 PolarHBondContact O-N 3.15Å; G224-I226 PolarHBondContact O-N 3.09Å; I226-W228 VanDerWaalsContact C-N 3.29Å; I226-W228 PolarHBondContact O-N 3.03Å; I226-V229 WeakPolarHBondContact O-CB 3.17Å; I226-V229 PolarHBondContact O-N 3.08Å; I226-V229 VanDerWaalsContact O-N 3.15Å; I226-V230 WeakPolarHBondContact O-CG2 3.3Å; I226-V230 PolarHBondContact O-N 2.94Å; I226-L265 HydrophobicContact CD1-CD1 3.92Å; I226-L265 HydrophobicContact CG1-CD1 3.73Å
227	G	97.6	Very high	96.7	Very high	8 Å²	8	13.1 Å²	13.1	8%	0.082	7%	0.072	C	C	.	.	H	α-helix	trans	-59.6	-38.3	175.1	0	0	0	0	0	113	P223 G224 L225 V229 V230 I231	P223-G227 VanDerWaalsContact O-CA 3.29Å; P223-G227 WeakPolarHBondContact O-CA 3.45Å; P223-G227 PolarHBondContact O-N 3.49Å; P223-G227 VanDerWaalsContact O-N 3.12Å; G224-G227 PolarHBondContact O-N 3.46Å; L225-G227 VanDerWaalsContact C-N 3.34Å; G227-V229 VanDerWaalsContact C-N 3.34Å; G227-V229 PolarHBondContact O-N 3.27Å; G227-V230 PolarHBondContact O-N 3.39Å; G227-V230 VanDerWaalsContact O-N 3.11Å; G227-I231 WeakPolarHBondContact O-CG1 3.33Å; G227-I231 PolarHBondContact O-N 3.11Å
228	W	98.3	Very high	96.8	Very high	0 Å²	0	14.6 Å²	14.6	0%	0	8%	0.079	C	C	.	.	H	α-helix	trans	-55.4	-46.3	173	174.2	27.5	0	0	0	112.3	G224 L225 I226 V230 I231 N232 Q257 Y260 V261 P295 Y298 W388	G224-W228 PolarHBondContact O-N 2.83Å; L225-W228 HydrophobicContact CD2-CE3 4.14Å; L225-W228 HydrophobicContact CD2-CZ3 4.44Å; L225-W228 WeakPolarHBondContact O-CB 3.42Å; L225-W228 PolarHBondContact O-N 3.41Å; I226-W228 VanDerWaalsContact C-N 3.29Å; I226-W228 PolarHBondContact O-N 3.03Å; W228-V230 VanDerWaalsContact C-N 3.3Å; W228-V230 PolarHBondContact O-N 3.03Å; W228-I231 PolarHBondContact O-N 3.47Å; W228-N232 PolarHBondContact NE1-ND2 3.03Å; W228-N232 PolarHBondContact O-N 2.86Å; W228-Q257 HydrophobicContact CH2-CB 3.86Å; W228-Q257 HydrophobicContact CH2-CG 3.94Å; W228-Q257 HydrophobicContact CZ2-CB 3.49Å; W228-Q257 VanDerWaalsContact CZ2-CB 3.49Å; W228-Q257 HydrophobicContact CZ2-CG 3.39Å; W228-Y260 HydrophobicContact CH2-CD1 4.37Å; W228-Y260 HydrophobicContact CZ3-CD1 4.04Å; W228-V261 HydrophobicContact CD2-CG2 4.37Å; W228-V261 HydrophobicContact CE3-CG2 3.35Å; W228-V261 HydrophobicContact CZ3-CG2 3.47Å; W228-V261 VanDerWaalsContact CZ3-CG2 3.47Å; W228-P295 HydrophobicContact CB-CB 4.32Å; W228-Y298 HydrophobicContact CD2-CD2 4.49Å; W228-Y298 VanDerWaalsContact CE2-CB 3.41Å; W228-Y298 HydrophobicContact CE3-CD2 4.29Å; W228-Y298 AromaticContact CH2-CD2 3.84Å; W228-Y298 HydrophobicContact CH2-CD2 3.84Å; W228-Y298 AromaticContact CZ2-CD2 4Å; W228-Y298 HydrophobicContact CZ2-CD2 4Å; W228-Y298 HydrophobicContact CZ2-CG 4.32Å; W228-Y298 AromaticContact CZ3-CD2 3.99Å; W228-Y298 HydrophobicContact CZ3-CD2 3.99Å; W228-Y298 PolarHBondContact NE1-O 3.42Å; W228-W388 HydrophobicContact CH2-CE3 4.41Å; W228-W388 HydrophobicContact CH2-CH2 4.05Å; W228-W388 AromaticContact CH2-CZ3 3.71Å; W228-W388 HydrophobicContact CH2-CZ3 3.71Å; W228-W388 HydrophobicContact CZ2-CZ3 4.21Å
229	V	98.3	Very high	96.8	Very high	25 Å²	25	14.3 Å²	14.3	15%	0.152	8%	0.078	C	C	.	.	H	α-helix	trans	-60.7	-41.3	176.1	175.4	0	0	0	0	111.1	L225 I226 G227 N232 L233 L258 V261	L225-V229 PolarHBondContact O-N 2.9Å; I226-V229 WeakPolarHBondContact O-CB 3.17Å; I226-V229 PolarHBondContact O-N 3.08Å; I226-V229 VanDerWaalsContact O-N 3.15Å; G227-V229 VanDerWaalsContact C-N 3.34Å; G227-V229 PolarHBondContact O-N 3.27Å; V229-N232 PolarHBondContact O-N 3.44Å; V229-L233 PolarHBondContact O-N 3.43Å; V229-L258 HydrophobicContact CG1-CD1 3.73Å; V229-L258 HydrophobicContact CG2-CD1 4.2Å; V229-V261 HydrophobicContact CG2-CB 3.83Å; V229-V261 HydrophobicContact CG2-CG1 3.88Å; V229-V261 HydrophobicContact CG2-CG2 3.86Å
230	V	97.7	Very high	96.8	Very high	20 Å²	20	14.8 Å²	14.8	12%	0.121	8%	0.082	C	C	.	.	H	α-helix	trans	-67.1	-41.1	179	-178.6	0	0	0	0	111.7	W96 L140 L153 I226 G227 W228 N232 L233 G234	W96-V230 HydrophobicContact CH2-CG2 3.52Å; W96-V230 HydrophobicContact CZ2-CG2 3.85Å; W96-V230 HydrophobicContact CZ3-CG2 4.21Å; L140-V230 HydrophobicContact CD1-CB 4.47Å; L140-V230 HydrophobicContact CD1-CG1 4.19Å; L140-V230 HydrophobicContact CD1-CG2 3.61Å; L140-V230 HydrophobicContact CD2-CG1 4.28Å; L153-V230 HydrophobicContact CD1-CG1 3.98Å; I226-V230 WeakPolarHBondContact O-CG2 3.3Å; I226-V230 PolarHBondContact O-N 2.94Å; G227-V230 PolarHBondContact O-N 3.39Å; G227-V230 VanDerWaalsContact O-N 3.11Å; W228-V230 VanDerWaalsContact C-N 3.3Å; W228-V230 PolarHBondContact O-N 3.03Å; V230-N232 VanDerWaalsContact C-N 3.35Å; V230-L233 PolarHBondContact O-N 3.02Å; V230-G234 PolarHBondContact O-N 2.98Å
231	I	98.2	Very high	96.9	Very high	14 Å²	14	18.1 Å²	18.1	7%	0.072	10%	0.098	C	C	.	.	H	α-helix	trans	-60.1	-47.4	174.9	-70.1	168.2	0	0	0	110	L157 G227 W228 L233 G234 M235 P295 F296	L157-I231 HydrophobicContact CD1-CG2 3.62Å; G227-I231 WeakPolarHBondContact O-CG1 3.33Å; G227-I231 PolarHBondContact O-N 3.11Å; W228-I231 PolarHBondContact O-N 3.47Å; I231-L233 VanDerWaalsContact C-N 3.34Å; I231-L233 PolarHBondContact O-N 2.99Å; I231-G234 WeakPolarHBondContact O-CA 3.36Å; I231-G234 PolarHBondContact O-N 3.12Å; I231-M235 HydrophobicContact CG2-CE 3.76Å; I231-M235 WeakPolarHBondContact O-CG 3.37Å; I231-M235 PolarHBondContact O-N 3.08Å; I231-P295 HydrophobicContact CD1-CB 3.78Å; I231-F296 HydrophobicContact CD1-CD1 4.1Å; I231-F296 HydrophobicContact CD1-CE1 3.86Å; I231-F296 HydrophobicContact CD1-CZ 4.19Å
232	N	98.3	Very high	97.2	Very high	2 Å²	2	23 Å²	23	1%	0.011	12%	0.124	C	C	.	.	H	α-helix	trans	-60.4	-42	177.3	-75.8	-16.2	0	0	0	112.7	W228 V229 V230 G234 M235 L236 N254 Q257 S299 A302	W228-N232 PolarHBondContact NE1-ND2 3.03Å; W228-N232 PolarHBondContact O-N 2.86Å; V229-N232 PolarHBondContact O-N 3.44Å; V230-N232 VanDerWaalsContact C-N 3.35Å; N232-G234 VanDerWaalsContact C-N 3.28Å; N232-G234 PolarHBondContact O-N 2.72Å; N232-M235 WeakPolarHBondContact O-CB 3.27Å; N232-M235 PolarHBondContact O-N 3.19Å; N232-M235 VanDerWaalsContact O-N 3.13Å; N232-L236 PolarHBondContact O-N 2.98Å; N232-N254 WeakPolarHBondContact CB-OD1 3.22Å; N232-N254 PolarHBondContact O-OD1 2.83Å; N232-N254 VanDerWaalsContact O-OD1 3.08Å; N232-Q257 PolarHBondContact ND2-OE1 3.02Å; N232-S299 WeakPolarHBondContact OD1-CA 3.46Å; N232-S299 VanDerWaalsContact OD1-CB 3.25Å; N232-S299 WeakPolarHBondContact OD1-CB 3.21Å; N232-A302 WeakPolarHBondContact OD1-CB 3.33Å
233	L	97.7	Very high	97.3	Very high	54 Å²	54	27.4 Å²	27.4	28%	0.283	14%	0.14	S	C	.	.	H	α-helix	trans	-59.3	-42.4	173.6	178.6	62.8	0	0	0	110.6	L140 L150 V229 V230 I231 M235 L236 M237 N254	L140-L233 HydrophobicContact CD1-CD2 4.44Å; L150-L233 HydrophobicContact CD1-CD2 4.18Å; V229-L233 PolarHBondContact O-N 3.43Å; V230-L233 PolarHBondContact O-N 3.02Å; I231-L233 VanDerWaalsContact C-N 3.34Å; I231-L233 PolarHBondContact O-N 2.99Å; L233-M235 VanDerWaalsContact C-N 3.34Å; L233-M235 PolarHBondContact O-N 3.29Å; L233-L236 PolarHBondContact O-N 3.28Å; L233-M237 HydrophobicContact CD1-CG 4.29Å; L233-M237 HydrophobicContact CG-CG 4.44Å; L233-M237 VanDerWaalsContact O-CG 3.25Å; L233-M237 WeakPolarHBondContact O-CG 3.22Å; L233-M237 PolarHBondContact O-N 3.49Å; L233-N254 PolarHBondContact N-OD1 3.16Å
234	G	97.6	Very high	97.2	Very high	1 Å²	1	30.4 Å²	30.4	1%	0.01	17%	0.173	C	C	.	.	H	α-helix	trans	-56.5	-44.9	172.7	0	0	0	0	0	113	L150 V230 I231 N232 M237 K238	L150-G234 WeakPolarHBondContact O-CA 3.41Å; V230-G234 PolarHBondContact O-N 2.98Å; I231-G234 WeakPolarHBondContact O-CA 3.36Å; I231-G234 PolarHBondContact O-N 3.12Å; N232-G234 VanDerWaalsContact C-N 3.28Å; N232-G234 PolarHBondContact O-N 2.72Å; G234-M237 PolarHBondContact O-N 3.47Å; G234-K238 WeakPolarHBondContact O-CB 3.42Å; G234-K238 PolarHBondContact O-N 2.61Å
235	M	98.1	Very high	97.1	Very high	0 Å²	0	34 Å²	34	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-63.8	-42.2	175.3	-58.2	-52.8	144.2	0	0	112.2	C154 L157 I231 N232 L233 K238 E239 M250 A302 V306	C154-M235 HydrophobicContact CB-CE 4.26Å; C154-M235 HydrophobicContact CB-SD 3.89Å; C154-M235 VanDerWaalsContact SG-SD 3.7Å; L157-M235 HydrophobicContact CB-CE 4.27Å; L157-M235 HydrophobicContact CD1-CE 3.76Å; L157-M235 HydrophobicContact CD2-CE 3.69Å; L157-M235 HydrophobicContact CG-CE 4.12Å; I231-M235 HydrophobicContact CG2-CE 3.76Å; I231-M235 WeakPolarHBondContact O-CG 3.37Å; I231-M235 PolarHBondContact O-N 3.08Å; N232-M235 WeakPolarHBondContact O-CB 3.27Å; N232-M235 PolarHBondContact O-N 3.19Å; N232-M235 VanDerWaalsContact O-N 3.13Å; L233-M235 VanDerWaalsContact C-N 3.34Å; L233-M235 PolarHBondContact O-N 3.29Å; M235-K238 PolarHBondContact O-N 2.87Å; M235-E239 PolarHBondContact O-N 3.49Å; M235-M250 HydrophobicContact CB-CE 4.37Å; M235-A302 HydrophobicContact CB-CB 3.8Å; M235-A302 HydrophobicContact CG-CB 3.96Å; M235-V306 HydrophobicContact CB-CG2 3.79Å; M235-V306 HydrophobicContact CG-CG2 4.49Å; M235-V306 VanDerWaalsContact O-CG2 3.29Å; M235-V306 WeakPolarHBondContact O-CG2 3.37Å; M235-V306 HydrophobicContact SD-CG2 4.26Å
236	L	97.9	Very high	97.1	Very high	31 Å²	31	35 Å²	35	16%	0.162	21%	0.205	C	C	.	.	H	α-helix	trans	-61.2	-44.9	176.3	-177.8	154	0	0	0	111.2	N232 L233 E239 A240 P246 M250 N254	N232-L236 PolarHBondContact O-N 2.98Å; L233-L236 PolarHBondContact O-N 3.28Å; L236-E239 PolarHBondContact O-N 2.95Å; L236-A240 WeakPolarHBondContact O-CB 3.12Å; L236-A240 PolarHBondContact O-N 2.9Å; L236-P246 HydrophobicContact CD2-CB 4.15Å; L236-P246 HydrophobicContact CD2-CG 4.29Å; L236-P246 HydrophobicContact CG-CB 3.96Å; L236-M250 HydrophobicContact CB-CG 3.92Å; L236-M250 HydrophobicContact CB-SD 4.35Å; L236-M250 HydrophobicContact CD1-CG 4.3Å; L236-M250 HydrophobicContact CG-CG 3.99Å; L236-N254 HydrophobicContact CD1-CB 4.04Å
237	M	97.4	Very high	97	Very high	39 Å²	39	36.2 Å²	36.2	19%	0.192	21%	0.214	C	C	.	.	H	α-helix	trans	-64.1	-42.9	176.9	-67.7	-54.9	-57.3	0	0	111.2	L144 L150 L233 G234 E239 A240 E241	L144-M237 HydrophobicContact CD1-CE 3.7Å; L150-M237 HydrophobicContact CB-CB 4.34Å; L150-M237 HydrophobicContact CB-CG 4.05Å; L233-M237 HydrophobicContact CD1-CG 4.29Å; L233-M237 HydrophobicContact CG-CG 4.44Å; L233-M237 VanDerWaalsContact O-CG 3.25Å; L233-M237 WeakPolarHBondContact O-CG 3.22Å; L233-M237 PolarHBondContact O-N 3.49Å; G234-M237 PolarHBondContact O-N 3.47Å; M237-E239 VanDerWaalsContact C-N 3.35Å; M237-E239 PolarHBondContact O-N 3.39Å; M237-A240 PolarHBondContact O-N 3.13Å; M237-E241 WeakPolarHBondContact O-CG 3.45Å; M237-E241 PolarHBondContact O-N 3.27Å
238	K	97.8	Very high	97	Very high	31 Å²	31	39.4 Å²	39.4	14%	0.135	23%	0.229	C	C	.	.	H	α-helix	trans	-61.7	-41.7	175.9	-171.3	60.2	160.2	-170.1	0	112.3	C154 E155 G234 M235 A240 E241 L242 V306	C154-K238 HydrophobicContact CB-CB 3.86Å; C154-K238 HydrophobicContact CB-CD 4.31Å; C154-K238 HydrophobicContact CB-CG 3.7Å; E155-K238 IonicContact OE1-NZ 2.68Å; E155-K238 PolarHBondContact OE1-NZ 2.89Å; G234-K238 WeakPolarHBondContact O-CB 3.42Å; G234-K238 PolarHBondContact O-N 2.61Å; M235-K238 PolarHBondContact O-N 2.87Å; K238-A240 VanDerWaalsContact C-N 3.33Å; K238-A240 PolarHBondContact O-N 2.78Å; K238-E241 PolarHBondContact O-N 3.39Å; K238-L242 HydrophobicContact CG-CD1 4.25Å; K238-L242 VanDerWaalsContact O-CG 3.31Å; K238-L242 WeakPolarHBondContact O-CG 3.42Å; K238-L242 PolarHBondContact O-N 3.41Å; K238-L242 VanDerWaalsContact O-N 3.07Å; K238-V306 HydrophobicContact CB-CG1 4.35Å; K238-V306 HydrophobicContact CG-CG1 3.82Å
239	E	97.3	Very high	97	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-62.1	-43.1	176	-164.4	-163.2	-145.3	0	0	111.2	M235 L236 M237 L242 R243 P246 S247 M250 V306	M235-E239 PolarHBondContact O-N 3.49Å; L236-E239 PolarHBondContact O-N 2.95Å; M237-E239 VanDerWaalsContact C-N 3.35Å; M237-E239 PolarHBondContact O-N 3.39Å; E239-L242 PolarHBondContact O-N 3.28Å; E239-R243 VanDerWaalsContact CG-NH1 3.26Å; E239-R243 WeakPolarHBondContact O-CB 3.12Å; E239-R243 PolarHBondContact O-N 3.17Å; E239-P246 VanDerWaalsContact OE2-CA 3.31Å; E239-P246 WeakPolarHBondContact OE2-CA 3.47Å; E239-S247 VanDerWaalsContact OE1-CB 3.3Å; E239-S247 WeakPolarHBondContact OE1-CB 3.35Å; E239-S247 PolarHBondContact OE1-OG 2.94Å; E239-S247 PolarHBondContact OE2-N 3.23Å; E239-S247 PolarHBondContact OE2-OG 3.32Å; E239-M250 HydrophobicContact CB-CE 3.86Å; E239-M250 HydrophobicContact CG-CE 4.2Å; E239-M250 WeakPolarHBondContact OE2-CB 3.22Å; E239-M250 VanDerWaalsContact OE2-CG 3.27Å; E239-M250 WeakPolarHBondContact OE2-CG 3.26Å; E239-V306 HydrophobicContact CB-CG2 4.43Å
240	A	96.5	Very high	97	Very high	21 Å²	21	38.2 Å²	38.2	17%	0.174	22%	0.222	C	C	.	.	H	α-helix	trans	-65	-39.1	176.9	0	0	0	0	0	112.7	L236 M237 K238 R243 G244	L236-A240 WeakPolarHBondContact O-CB 3.12Å; L236-A240 PolarHBondContact O-N 2.9Å; M237-A240 PolarHBondContact O-N 3.13Å; K238-A240 VanDerWaalsContact C-N 3.33Å; K238-A240 PolarHBondContact O-N 2.78Å; A240-R243 PolarHBondContact O-N 2.98Å; A240-G244 CarbonylContact O-C 3.59Å; A240-G244 WeakPolarHBondContact O-CA 3.35Å; A240-G244 PolarHBondContact O-N 3.49Å
241	E	96.1	Very high	97	Very high	98 Å²	98	40.2 Å²	40.2	46%	0.458	23%	0.231	S	C	.	.	H	α-helix	trans	-61.7	-43.3	174.1	-73.8	165.9	-170.2	0	0	111.8	G151 M237 K238	G151-E241 WeakPolarHBondContact CA-OE1 3.31Å; G151-E241 PolarHBondContact N-OE1 2.84Å; M237-E241 WeakPolarHBondContact O-CG 3.45Å; M237-E241 PolarHBondContact O-N 3.27Å; K238-E241 PolarHBondContact O-N 3.39Å
242	L	96.3	Very high	97	Very high	108 Å²	108	40.4 Å²	40.4	57%	0.565	23%	0.232	S	C	*	.	H	α-helix	trans	-73.7	-28.2	-178.4	-68.9	173	0	0	0	113.4	K238 E239 V306	K238-L242 HydrophobicContact CG-CD1 4.25Å; K238-L242 VanDerWaalsContact O-CG 3.31Å; K238-L242 WeakPolarHBondContact O-CG 3.42Å; K238-L242 PolarHBondContact O-N 3.41Å; K238-L242 VanDerWaalsContact O-N 3.07Å; E239-L242 PolarHBondContact O-N 3.28Å; L242-V306 HydrophobicContact CD1-CG1 4.05Å
243	R	94.9	Very high	97	Very high	92 Å²	92	40.3 Å²	40.3	35%	0.347	23%	0.231	S	C	.	.	H	α-helix	trans	-126.8	2.3	-166.8	-58.9	178.7	-179	80.1	-3.8	114.4	E239 A240 S245 V306	E239-R243 VanDerWaalsContact CG-NH1 3.26Å; E239-R243 WeakPolarHBondContact O-CB 3.12Å; E239-R243 PolarHBondContact O-N 3.17Å; A240-R243 PolarHBondContact O-N 2.98Å; R243-S245 PolarHBondContact O-N 3.31Å; R243-S245 VanDerWaalsContact O-N 3.16Å; R243-V306 PolarHBondContact NH1-O 2.75Å; R243-V306 PolarHBondContact NH2-O 2.92Å
244	G	94.8	Very high	97.1	Very high	72 Å²	72	38.6 Å²	38.6	74%	0.742	22%	0.223	S	C	*	.	S	Bend	trans	77	-18.4	-177.2	0	0	0	0	0	115.2	A240	A240-G244 CarbonylContact O-C 3.59Å; A240-G244 WeakPolarHBondContact O-CA 3.35Å; A240-G244 PolarHBondContact O-N 3.49Å
245	S	94.3	Very high	97.1	Very high	75 Å²	75	46.4 Å²	46.4	52%	0.524	25%	0.252	S	S	.	.	S	Bend	trans	-158.7	152.4	174.9	60.8	0	0	0	0	111.5	R243	R243-S245 PolarHBondContact O-N 3.31Å; R243-S245 VanDerWaalsContact O-N 3.16Å
246	P	95.8	Very high	97.1	Very high	42 Å²	42	47.2 Å²	47.2	27%	0.273	26%	0.255	S	S	.	.			trans	-72.8	141.7	175.4	29.7	-33.1	0	0	0	111.2	L236 E239 I251	L236-P246 HydrophobicContact CD2-CB 4.15Å; L236-P246 HydrophobicContact CD2-CG 4.29Å; L236-P246 HydrophobicContact CG-CB 3.96Å; E239-P246 VanDerWaalsContact OE2-CA 3.31Å; E239-P246 WeakPolarHBondContact OE2-CA 3.47Å; P246-I251 HydrophobicContact CB-CG1 4.18Å; P246-I251 HydrophobicContact CG-CD1 4.2Å; P246-I251 HydrophobicContact CG-CG1 4.21Å
247	S	97	Very high	97.1	Very high	27 Å²	27	45.7 Å²	45.7	19%	0.189	25%	0.248	C	C	.	.			trans	-71.7	156.7	178.4	68.9	0	0	0	0	111.7	E239 S249 M250 I251	E239-S247 VanDerWaalsContact OE1-CB 3.3Å; E239-S247 WeakPolarHBondContact OE1-CB 3.35Å; E239-S247 PolarHBondContact OE1-OG 2.94Å; E239-S247 PolarHBondContact OE2-N 3.23Å; E239-S247 PolarHBondContact OE2-OG 3.32Å; S247-S249 PolarHBondContact O-N 3.18Å; S247-M250 PolarHBondContact O-N 2.95Å; S247-M250 VanDerWaalsContact O-N 3.15Å; S247-M250 WeakPolarHBondContact OG-CB 3.12Å; S247-M250 PolarHBondContact OG-N 2.89Å; S247-I251 WeakPolarHBondContact O-CG1 3.34Å; S247-I251 PolarHBondContact O-N 3.33Å
248	L	97.3	Very high	97.2	Very high	75 Å²	75	46.4 Å²	46.4	39%	0.393	25%	0.252	S	S	.	.	H	α-helix	trans	-56.7	-38.2	173.9	-179.4	59.2	0	0	0	111.3	I251 L252 L312 A317	L248-I251 PolarHBondContact O-N 2.94Å; L248-L252 HydrophobicContact CD1-CG 4.26Å; L248-L252 HydrophobicContact CG-CD1 4.3Å; L248-L252 HydrophobicContact CG-CG 4.47Å; L248-L252 VanDerWaalsContact O-CG 3.29Å; L248-L252 WeakPolarHBondContact O-CG 3.4Å; L248-L252 PolarHBondContact O-N 3.25Å; L248-L312 HydrophobicContact CD2-CB 4.46Å; L248-A317 HydrophobicContact CD2-CB 3.66Å; L248-A317 HydrophobicContact CG-CB 4.39Å
249	S	97.7	Very high	97.2	Very high	1 Å²	1	48.4 Å²	48.4	1%	0.007	26%	0.264	C	S	.	.	H	α-helix	trans	-58.5	-48.7	176.5	-47.3	0	0	0	0	111.8	S247 L252 V253 Q310 L312	S247-S249 PolarHBondContact O-N 3.18Å; S249-L252 PolarHBondContact O-N 3.48Å; S249-V253 WeakPolarHBondContact O-CG2 3.46Å; S249-V253 PolarHBondContact O-N 3.47Å; S249-V253 VanDerWaalsContact O-N 3.09Å; S249-Q310 PolarHBondContact OG-O 3.31Å; S249-L312 WeakPolarHBondContact OG-CD1 3.27Å; S249-L312 VanDerWaalsContact OG-CG 3.27Å; S249-L312 WeakPolarHBondContact OG-CG 3.45Å
250	M	98.1	Very high	97.2	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-64	-43.3	179.3	-177.4	63.6	79.3	0	0	112.1	M235 L236 E239 S247 L252 V253 N254 A302 L305 V306	M235-M250 HydrophobicContact CB-CE 4.37Å; L236-M250 HydrophobicContact CB-CG 3.92Å; L236-M250 HydrophobicContact CB-SD 4.35Å; L236-M250 HydrophobicContact CD1-CG 4.3Å; L236-M250 HydrophobicContact CG-CG 3.99Å; E239-M250 HydrophobicContact CB-CE 3.86Å; E239-M250 HydrophobicContact CG-CE 4.2Å; E239-M250 WeakPolarHBondContact OE2-CB 3.22Å; E239-M250 VanDerWaalsContact OE2-CG 3.27Å; E239-M250 WeakPolarHBondContact OE2-CG 3.26Å; S247-M250 PolarHBondContact O-N 2.95Å; S247-M250 VanDerWaalsContact O-N 3.15Å; S247-M250 WeakPolarHBondContact OG-CB 3.12Å; S247-M250 PolarHBondContact OG-N 2.89Å; M250-L252 PolarHBondContact O-N 3.03Å; M250-V253 PolarHBondContact O-N 3.42Å; M250-N254 WeakPolarHBondContact O-CB 3.45Å; M250-N254 PolarHBondContact O-N 2.97Å; M250-N254 PolarHBondContact O-ND2 3.3Å; M250-N254 PolarHBondContact SD-ND2 2.81Å; M250-A302 WeakPolarHBondContact CE-O 3.44Å; M250-A302 HydrophobicContact SD-CB 4.01Å; M250-L305 HydrophobicContact CB-CD1 4.44Å; M250-L305 HydrophobicContact CE-CB 3.64Å; M250-V306 HydrophobicContact CE-CG2 3.77Å
251	I	98.1	Very high	97.3	Very high	61 Å²	61	49.3 Å²	49.3	31%	0.313	26%	0.263	S	S	.	.	H	α-helix	trans	-59.8	-47.2	177.2	-67.4	169.2	0	0	0	110.2	P246 S247 L248 N254 W255	P246-I251 HydrophobicContact CB-CG1 4.18Å; P246-I251 HydrophobicContact CG-CD1 4.2Å; P246-I251 HydrophobicContact CG-CG1 4.21Å; S247-I251 WeakPolarHBondContact O-CG1 3.34Å; S247-I251 PolarHBondContact O-N 3.33Å; L248-I251 PolarHBondContact O-N 2.94Å; I251-N254 PolarHBondContact O-N 3.43Å; I251-W255 WeakPolarHBondContact O-CB 3.24Å; I251-W255 PolarHBondContact O-N 2.95Å
252	L	98.4	Very high	97.4	Very high	18 Å²	18	45.5 Å²	45.5	9%	0.094	25%	0.248	C	C	.	.	H	α-helix	trans	-61.9	-47.6	179.8	-71.7	178.2	0	0	0	112.1	L248 S249 M250 N254 W255 F256 L312 A317 V321 P391	L248-L252 HydrophobicContact CD1-CG 4.26Å; L248-L252 HydrophobicContact CG-CD1 4.3Å; L248-L252 HydrophobicContact CG-CG 4.47Å; L248-L252 VanDerWaalsContact O-CG 3.29Å; L248-L252 WeakPolarHBondContact O-CG 3.4Å; L248-L252 PolarHBondContact O-N 3.25Å; S249-L252 PolarHBondContact O-N 3.48Å; M250-L252 PolarHBondContact O-N 3.03Å; L252-N254 PolarHBondContact O-N 2.85Å; L252-W255 PolarHBondContact O-N 3.45Å; L252-F256 HydrophobicContact CB-CE2 4Å; L252-F256 HydrophobicContact CB-CZ 4.21Å; L252-F256 HydrophobicContact CD2-CE1 4.28Å; L252-F256 HydrophobicContact CD2-CZ 3.89Å; L252-F256 HydrophobicContact CG-CZ 4.5Å; L252-F256 WeakPolarHBondContact O-CB 3.4Å; L252-F256 VanDerWaalsContact O-CD2 3.27Å; L252-F256 WeakPolarHBondContact O-CD2 3.47Å; L252-F256 WeakPolarHBondContact O-CG 3.47Å; L252-F256 PolarHBondContact O-N 3.48Å; L252-L312 HydrophobicContact CD1-CD1 4.1Å; L252-A317 HydrophobicContact CD1-CB 4.02Å; L252-V321 HydrophobicContact CD2-CG2 3.71Å; L252-P391 HydrophobicContact CB-CG 4.33Å
253	V	98.4	Very high	97.4	Very high	0 Å²	0	41 Å²	41	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-58.1	-50.4	177.8	171.9	0	0	0	0	110.8	S249 M250 W255 F256 Q257 Q301 A302 L305 P391	S249-V253 WeakPolarHBondContact O-CG2 3.46Å; S249-V253 PolarHBondContact O-N 3.47Å; S249-V253 VanDerWaalsContact O-N 3.09Å; M250-V253 PolarHBondContact O-N 3.42Å; V253-W255 PolarHBondContact O-N 2.77Å; V253-F256 PolarHBondContact O-N 2.87Å; V253-Q257 WeakPolarHBondContact O-CB 3.42Å; V253-Q257 VanDerWaalsContact O-CG 3.28Å; V253-Q257 WeakPolarHBondContact O-CG 3.17Å; V253-Q257 PolarHBondContact O-N 3.31Å; V253-Q257 VanDerWaalsContact O-N 3.09Å; V253-Q301 HydrophobicContact CG1-CB 3.83Å; V253-Q301 HydrophobicContact CG2-CB 4.23Å; V253-A302 HydrophobicContact CG1-CB 4.34Å; V253-L305 HydrophobicContact CG2-CD1 3.88Å; V253-P391 HydrophobicContact CG2-CB 3.79Å; V253-P391 HydrophobicContact CG2-CG 3.93Å
254	N	98.5	Very high	97.4	Very high	19 Å²	19	37.7 Å²	37.7	10%	0.102	22%	0.218	C	C	.	.	H	α-helix	trans	-59.5	-45.8	179.5	-87.3	-102.4	0	0	0	111.7	N232 L233 L236 M250 I251 L252 L258	N232-N254 WeakPolarHBondContact CB-OD1 3.22Å; N232-N254 PolarHBondContact O-OD1 2.83Å; N232-N254 VanDerWaalsContact O-OD1 3.08Å; L233-N254 PolarHBondContact N-OD1 3.16Å; L236-N254 HydrophobicContact CD1-CB 4.04Å; M250-N254 WeakPolarHBondContact O-CB 3.45Å; M250-N254 PolarHBondContact O-N 2.97Å; M250-N254 PolarHBondContact O-ND2 3.3Å; M250-N254 PolarHBondContact SD-ND2 2.81Å; I251-N254 PolarHBondContact O-N 3.43Å; L252-N254 PolarHBondContact O-N 2.85Å; N254-L258 WeakPolarHBondContact O-CB 3.35Å; N254-L258 PolarHBondContact O-N 3.48Å
255	W	98.4	Very high	97.5	Very high	165 Å²	165	34.4 Å²	34.4	63%	0.625	18%	0.183	S	C	*	.	H	α-helix	trans	-67.2	-43.5	-179.1	-94.8	102.4	0	0	0	113.4	I251 L252 V253 L258 L259	I251-W255 WeakPolarHBondContact O-CB 3.24Å; I251-W255 PolarHBondContact O-N 2.95Å; L252-W255 PolarHBondContact O-N 3.45Å; V253-W255 PolarHBondContact O-N 2.77Å; W255-L258 HydrophobicContact CE3-CD2 4.49Å; W255-L258 HydrophobicContact CZ3-CD2 4.49Å; W255-L259 VanDerWaalsContact O-CB 3.32Å; W255-L259 WeakPolarHBondContact O-CB 3.4Å; W255-L259 PolarHBondContact O-N 3.48Å
256	F	98.6	Very high	97.6	Very high	16 Å²	16	39.2 Å²	39.2	7%	0.07	19%	0.189	C	C	.	.	H	α-helix	trans	-64.1	-44.1	179.3	-62.7	-25.3	0	0	0	111.6	L252 V253 L259 Y260 I320 V321 N324 W388	L252-F256 HydrophobicContact CB-CE2 4Å; L252-F256 HydrophobicContact CB-CZ 4.21Å; L252-F256 HydrophobicContact CD2-CE1 4.28Å; L252-F256 HydrophobicContact CD2-CZ 3.89Å; L252-F256 HydrophobicContact CG-CZ 4.5Å; L252-F256 WeakPolarHBondContact O-CB 3.4Å; L252-F256 VanDerWaalsContact O-CD2 3.27Å; L252-F256 WeakPolarHBondContact O-CD2 3.47Å; L252-F256 WeakPolarHBondContact O-CG 3.47Å; L252-F256 PolarHBondContact O-N 3.48Å; V253-F256 PolarHBondContact O-N 2.87Å; F256-L259 PolarHBondContact O-N 3.19Å; F256-Y260 PolarHBondContact O-N 3.15Å; F256-I320 HydrophobicContact CE2-CG2 3.62Å; F256-I320 HydrophobicContact CZ-CG2 4.05Å; F256-V321 HydrophobicContact CE1-CG2 4.09Å; F256-V321 HydrophobicContact CZ-CB 4.44Å; F256-V321 HydrophobicContact CZ-CG2 3.8Å; F256-N324 HydrophobicContact CD1-CB 4.14Å; F256-N324 VanDerWaalsContact CD1-ND2 3.33Å; F256-N324 WeakPolarHBondContact CD1-ND2 3.47Å; F256-N324 HydrophobicContact CD2-CB 4.37Å; F256-N324 HydrophobicContact CE1-CB 3.97Å; F256-N324 HydrophobicContact CE2-CB 4.22Å; F256-N324 HydrophobicContact CG-CB 4.34Å; F256-N324 HydrophobicContact CZ-CB 4Å; F256-W388 VanDerWaalsContact CB-CD1 3.47Å; F256-W388 HydrophobicContact CB-CG 4.45Å; F256-W388 AromaticContact CD2-CD1 3.9Å
257	Q	98.6	Very high	97.4	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-71.4	-38.4	-179.2	-65.6	-177.7	-9.8	0	0	111.5	W228 N232 V253 Y260 V261 Y298 W388	W228-Q257 HydrophobicContact CH2-CB 3.86Å; W228-Q257 HydrophobicContact CH2-CG 3.94Å; W228-Q257 HydrophobicContact CZ2-CB 3.49Å; W228-Q257 VanDerWaalsContact CZ2-CB 3.49Å; W228-Q257 HydrophobicContact CZ2-CG 3.39Å; N232-Q257 PolarHBondContact ND2-OE1 3.02Å; V253-Q257 WeakPolarHBondContact O-CB 3.42Å; V253-Q257 VanDerWaalsContact O-CG 3.28Å; V253-Q257 WeakPolarHBondContact O-CG 3.17Å; V253-Q257 PolarHBondContact O-N 3.31Å; V253-Q257 VanDerWaalsContact O-N 3.09Å; Q257-Y260 PolarHBondContact O-N 3.41Å; Q257-V261 WeakPolarHBondContact O-CG2 3.43Å; Q257-V261 PolarHBondContact O-N 3.38Å; Q257-Y298 PolarHBondContact NE2-O 2.99Å; Q257-Y298 VanDerWaalsContact NE2-O 3.14Å; Q257-Y298 PolarHBondContact OE1-O 3.3Å; Q257-W388 HydrophobicContact CG-CD2 3.99Å; Q257-W388 HydrophobicContact CG-CE3 4.06Å; Q257-W388 HydrophobicContact CG-CG 4.23Å
258	L	98.4	Very high	97.3	Very high	53 Å²	53	38.1 Å²	38.1	28%	0.277	18%	0.179	S	C	.	.	H	α-helix	trans	-60.1	-46.3	170.8	172.3	61.6	0	0	0	111.6	V229 N254 W255 Y260 V261 A262	V229-L258 HydrophobicContact CG1-CD1 3.73Å; V229-L258 HydrophobicContact CG2-CD1 4.2Å; N254-L258 WeakPolarHBondContact O-CB 3.35Å; N254-L258 PolarHBondContact O-N 3.48Å; W255-L258 HydrophobicContact CE3-CD2 4.49Å; W255-L258 HydrophobicContact CZ3-CD2 4.49Å; L258-Y260 VanDerWaalsContact C-N 3.29Å; L258-Y260 PolarHBondContact O-N 3.12Å; L258-V261 PolarHBondContact O-N 3.22Å; L258-A262 WeakPolarHBondContact O-CB 3.21Å; L258-A262 PolarHBondContact O-N 3.28Å
259	L	98.1	Very high	97	Very high	73 Å²	73	38.1 Å²	38.1	38%	0.382	18%	0.177	S	C	.	.	H	α-helix	trans	-59.4	-42.6	178.5	179.6	64.9	0	0	0	111	W255 F256 A262 D263	W255-L259 VanDerWaalsContact O-CB 3.32Å; W255-L259 WeakPolarHBondContact O-CB 3.4Å; W255-L259 PolarHBondContact O-N 3.48Å; F256-L259 PolarHBondContact O-N 3.19Å; L259-A262 PolarHBondContact O-N 3.11Å; L259-D263 WeakPolarHBondContact O-CB 3.47Å; L259-D263 PolarHBondContact O-N 3.21Å
260	Y	97.9	Very high	96.6	Very high	40 Å²	40	39.7 Å²	39.7	16%	0.157	19%	0.19	C	C	.	.	H	α-helix	trans	-61.7	-47.5	177.4	-176.5	-89.4	0	0	0	112.1	W228 F256 Q257 L258 D263 A264 M384 W388	W228-Y260 HydrophobicContact CH2-CD1 4.37Å; W228-Y260 HydrophobicContact CZ3-CD1 4.04Å; F256-Y260 PolarHBondContact O-N 3.15Å; Q257-Y260 PolarHBondContact O-N 3.41Å; L258-Y260 VanDerWaalsContact C-N 3.29Å; L258-Y260 PolarHBondContact O-N 3.12Å; Y260-D263 PolarHBondContact O-N 2.98Å; Y260-A264 PolarHBondContact O-N 2.79Å; Y260-M384 HydrophobicContact CD2-CE 3.93Å; Y260-M384 HydrophobicContact CD2-SD 4.27Å; Y260-M384 HydrophobicContact CE2-CE 3.92Å; Y260-W388 AromaticContact CD1-CH2 3.95Å; Y260-W388 HydrophobicContact CD1-CH2 3.95Å; Y260-W388 AromaticContact CD2-CH2 3.69Å; Y260-W388 HydrophobicContact CD2-CH2 3.69Å; Y260-W388 AromaticContact CD2-CZ2 3.65Å; Y260-W388 HydrophobicContact CD2-CZ2 3.65Å; Y260-W388 HydrophobicContact CE1-CH2 4.33Å; Y260-W388 HydrophobicContact CE2-CH2 4.09Å; Y260-W388 HydrophobicContact CE2-CZ2 4.37Å; Y260-W388 AromaticContact CG-CH2 3.61Å; Y260-W388 HydrophobicContact CG-CH2 3.61Å; Y260-W388 AromaticContact CG-CZ2 3.73Å; Y260-W388 HydrophobicContact CG-CZ2 3.73Å
261	V	98.1	Very high	96.3	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-65	-45	177.5	172.1	0	0	0	0	111.5	L225 W228 V229 Q257 L258 D263 A264 L265	L225-V261 HydrophobicContact CB-CG1 4.02Å; L225-V261 HydrophobicContact CB-CG2 4.24Å; L225-V261 HydrophobicContact CD2-CG2 4.46Å; W228-V261 HydrophobicContact CD2-CG2 4.37Å; W228-V261 HydrophobicContact CE3-CG2 3.35Å; W228-V261 HydrophobicContact CZ3-CG2 3.47Å; W228-V261 VanDerWaalsContact CZ3-CG2 3.47Å; V229-V261 HydrophobicContact CG2-CB 3.83Å; V229-V261 HydrophobicContact CG2-CG1 3.88Å; V229-V261 HydrophobicContact CG2-CG2 3.86Å; Q257-V261 WeakPolarHBondContact O-CG2 3.43Å; Q257-V261 PolarHBondContact O-N 3.38Å; L258-V261 PolarHBondContact O-N 3.22Å; V261-D263 VanDerWaalsContact C-N 3.3Å; V261-D263 PolarHBondContact O-N 3.31Å; V261-A264 PolarHBondContact O-N 2.98Å; V261-L265 HydrophobicContact CG1-CD1 3.84Å; V261-L265 HydrophobicContact CG1-CG 4.44Å; V261-L265 WeakPolarHBondContact O-CG 3.26Å; V261-L265 PolarHBondContact O-N 2.94Å
262	A	97.9	Very high	96	Very high	19 Å²	19	37.9 Å²	37.9	16%	0.157	18%	0.182	C	C	.	.	H	α-helix	trans	-59.6	-42.3	177.1	0	0	0	0	0	111.5	F130 L133 L258 L259 L265 W266	F130-A262 HydrophobicContact CE2-CB 4.19Å; L133-A262 HydrophobicContact CD2-CB 3.95Å; L258-A262 WeakPolarHBondContact O-CB 3.21Å; L258-A262 PolarHBondContact O-N 3.28Å; L259-A262 PolarHBondContact O-N 3.11Å; A262-L265 PolarHBondContact O-N 3.03Å; A262-W266 VanDerWaalsContact O-CB 3.27Å; A262-W266 WeakPolarHBondContact O-CB 3.33Å; A262-W266 PolarHBondContact O-N 3.47Å
263	D	96.7	Very high	95.5	Very high	12 Å²	12	40 Å²	40	6%	0.064	20%	0.195	C	C	.	.	H	α-helix	trans	-67	-38.9	177.9	179.5	69.3	0	0	0	112.6	L259 Y260 V261 N267 Y328 R332	L259-D263 WeakPolarHBondContact O-CB 3.47Å; L259-D263 PolarHBondContact O-N 3.21Å; Y260-D263 PolarHBondContact O-N 2.98Å; V261-D263 VanDerWaalsContact C-N 3.3Å; V261-D263 PolarHBondContact O-N 3.31Å; D263-N267 WeakPolarHBondContact O-CB 3.44Å; D263-N267 PolarHBondContact O-N 2.86Å; D263-N267 VanDerWaalsContact O-N 3.12Å; D263-N267 PolarHBondContact O-ND2 3.36Å; D263-N267 PolarHBondContact OD1-ND2 3.16Å; D263-Y328 HydrophobicContact CB-CE2 4Å; D263-Y328 VanDerWaalsContact CG-CE2 3.47Å; D263-Y328 PolarHBondContact OD1-OH 2.88Å; D263-R332 PolarHBondContact O-NH2 2.98Å; D263-R332 IonicContact OD1-CZ 3.37Å; D263-R332 IonicContact OD1-NE 3.32Å; D263-R332 PolarHBondContact OD1-NE 2.63Å; D263-R332 IonicContact OD1-NH2 2.69Å; D263-R332 PolarHBondContact OD1-NH2 2.7Å; D263-R332 VanDerWaalsContact OD1-NH2 3.08Å; D263-R332 IonicContact OD2-CZ 3.57Å; D263-R332 IonicContact OD2-NE 3.91Å; D263-R332 PolarHBondContact OD2-NE 3.26Å; D263-R332 IonicContact OD2-NH2 3.28Å; D263-R332 PolarHBondContact OD2-NH2 2.95Å
264	A	95.3	Very high	95	Very high	24 Å²	24	41.7 Å²	41.7	20%	0.198	21%	0.206	C	C	.	.	H	α-helix	trans	-62.1	-46	172.5	0	0	0	0	0	111.6	Y260 V261 N267 E268	Y260-A264 PolarHBondContact O-N 2.79Å; V261-A264 PolarHBondContact O-N 2.98Å; A264-N267 CarbonylContact O-C 3.43Å; A264-N267 VanDerWaalsContact O-C 3.24Å; A264-N267 PolarHBondContact O-N 3.44Å; A264-E268 WeakPolarHBondContact O-CA 3.2Å; A264-E268 PolarHBondContact O-N 2.96Å
265	L	96.4	Very high	94.4	Very high	2 Å²	2	41.4 Å²	41.4	1%	0.01	20%	0.204	C	C	.	.	H	α-helix	trans	-72.2	-32.7	179.6	-66.7	171.2	0	0	0	113.2	F130 L133 L221 I226 V261 A262 N267 E268	F130-L265 HydrophobicContact CB-CB 4.26Å; F130-L265 HydrophobicContact CD2-CB 4.36Å; L133-L265 HydrophobicContact CB-CD1 3.78Å; L133-L265 HydrophobicContact CD2-CD1 4.04Å; L133-L265 HydrophobicContact CG-CD1 4.38Å; L221-L265 HydrophobicContact CB-CD2 4.11Å; I226-L265 HydrophobicContact CD1-CD1 3.92Å; I226-L265 HydrophobicContact CG1-CD1 3.73Å; V261-L265 HydrophobicContact CG1-CD1 3.84Å; V261-L265 HydrophobicContact CG1-CG 4.44Å; V261-L265 WeakPolarHBondContact O-CG 3.26Å; V261-L265 PolarHBondContact O-N 2.94Å; A262-L265 PolarHBondContact O-N 3.03Å; L265-N267 VanDerWaalsContact C-N 3.25Å; L265-N267 PolarHBondContact O-N 2.82Å; L265-E268 VanDerWaalsContact O-CB 3.25Å; L265-E268 WeakPolarHBondContact O-CB 3.29Å; L265-E268 PolarHBondContact O-N 2.96Å
266	W	95.3	Very high	93.9	Very high	176 Å²	176	34.8 Å²	34.8	67%	0.667	18%	0.181	S	C	*	.	H	α-helix	trans	-66.1	-33	173	-171.9	-88.4	0	0	0	111.6	F130 A262	F130-W266 AromaticContact CD1-CE3 3.66Å; F130-W266 HydrophobicContact CD1-CE3 3.66Å; F130-W266 AromaticContact CD1-CZ3 3.79Å; F130-W266 HydrophobicContact CD1-CZ3 3.79Å; F130-W266 HydrophobicContact CD2-CB 4.18Å; F130-W266 AromaticContact CD2-CE3 3.83Å; F130-W266 HydrophobicContact CD2-CE3 3.83Å; F130-W266 AromaticContact CE1-CE3 3.61Å; F130-W266 HydrophobicContact CE1-CE3 3.61Å; F130-W266 AromaticContact CE1-CZ3 3.53Å; F130-W266 HydrophobicContact CE1-CZ3 3.53Å; F130-W266 AromaticContact CE2-CE3 3.77Å; F130-W266 HydrophobicContact CE2-CE3 3.77Å; F130-W266 HydrophobicContact CE2-CZ3 4.47Å; F130-W266 AromaticContact CG-CE3 3.77Å; F130-W266 HydrophobicContact CG-CE3 3.77Å; F130-W266 HydrophobicContact CG-CZ3 4.37Å; F130-W266 AromaticContact CZ-CE3 3.66Å; F130-W266 HydrophobicContact CZ-CE3 3.66Å; F130-W266 AromaticContact CZ-CZ3 3.9Å; F130-W266 HydrophobicContact CZ-CZ3 3.9Å; A262-W266 VanDerWaalsContact O-CB 3.27Å; A262-W266 WeakPolarHBondContact O-CB 3.33Å; A262-W266 PolarHBondContact O-N 3.47Å
267	N	93.2	Very high	93.6	Very high	45 Å²	45	34.2 Å²	34.2	24%	0.241	18%	0.179	C	C	.	.	T	Hydrogen-bonded Turn	trans	-106.9	31.1	179.6	-62.1	-93	0	0	0	112.1	D263 A264 L265 E269 A270 R332	D263-N267 WeakPolarHBondContact O-CB 3.44Å; D263-N267 PolarHBondContact O-N 2.86Å; D263-N267 VanDerWaalsContact O-N 3.12Å; D263-N267 PolarHBondContact O-ND2 3.36Å; D263-N267 PolarHBondContact OD1-ND2 3.16Å; A264-N267 CarbonylContact O-C 3.43Å; A264-N267 VanDerWaalsContact O-C 3.24Å; A264-N267 PolarHBondContact O-N 3.44Å; L265-N267 VanDerWaalsContact C-N 3.25Å; L265-N267 PolarHBondContact O-N 2.82Å; N267-E269 PolarHBondContact O-N 3.16Å; N267-E269 VanDerWaalsContact O-N 3.08Å; N267-A270 VanDerWaalsContact O-CB 3.28Å; N267-A270 WeakPolarHBondContact O-CB 3.11Å; N267-A270 PolarHBondContact O-N 2.94Å; N267-R332 VanDerWaalsContact CG-CZ 3.43Å; N267-R332 PolarHBondContact ND2-NH1 3.45Å; N267-R332 VanDerWaalsContact ND2-NH1 3.19Å; N267-R332 PolarHBondContact ND2-NH2 3.17Å; N267-R332 VanDerWaalsContact ND2-NH2 3.12Å; N267-R332 PolarHBondContact OD1-NH1 2.93Å
268	E	93.9	Very high	93.1	Very high	2 Å²	2	36 Å²	36	1%	0.009	19%	0.189	C	C	.	.	G	3₁₀ helix	trans	-51.8	-33.9	-174.1	168.1	176.9	-156	0	0	113.1	I127 N128 G129 Y217 L221 R222 A264 L265 A270 V271	I127-E268 VanDerWaalsContact C-OE2 3.29Å; I127-E268 WeakPolarHBondContact CA-OE2 3.37Å; I127-E268 HydrophobicContact CD1-CG 4.2Å; I127-E268 HydrophobicContact CG2-CB 4.08Å; I127-E268 HydrophobicContact CG2-CG 4.15Å; I127-E268 WeakPolarHBondContact CG2-OE2 3.13Å; N128-E268 PolarHBondContact N-OE2 3.24Å; G129-E268 WeakPolarHBondContact CA-OE2 3.39Å; G129-E268 PolarHBondContact N-OE2 3.46Å; Y217-E268 HydrophobicContact CE2-CG 4.36Å; Y217-E268 WeakPolarHBondContact OH-CG 3.47Å; Y217-E268 PolarHBondContact OH-OE1 2.89Å; L221-E268 HydrophobicContact CD1-CB 4.4Å; L221-E268 HydrophobicContact CD1-CG 3.76Å; R222-E268 IonicContact CZ-OE1 2.8Å; R222-E268 IonicContact NE-OE1 3.27Å; R222-E268 IonicContact NH2-OE1 2.84Å; R222-E268 PolarHBondContact NH2-OE1 3.36Å; A264-E268 WeakPolarHBondContact O-CA 3.2Å; A264-E268 PolarHBondContact O-N 2.96Å; L265-E268 VanDerWaalsContact O-CB 3.25Å; L265-E268 WeakPolarHBondContact O-CB 3.29Å; L265-E268 PolarHBondContact O-N 2.96Å; E268-A270 PolarHBondContact O-N 3.48Å; E268-A270 VanDerWaalsContact O-N 3.16Å; E268-V271 VanDerWaalsContact O-CB 3.28Å; E268-V271 WeakPolarHBondContact O-CB 3.49Å; E268-V271 PolarHBondContact O-N 3.11Å
269	E	91.4	Very high	92.6	Very high	75 Å²	75	37.9 Å²	37.9	35%	0.35	20%	0.197	S	C	.	.	G	3₁₀ helix	trans	-58.8	-29.2	175.9	-66.8	-173.5	142.7	0	0	114.4	K110 S112 I127 N267 V271 L272	K110-E269 VanDerWaalsContact CE-CD 3.43Å; K110-E269 WeakPolarHBondContact CE-OE1 3.42Å; K110-E269 IonicContact NZ-OE1 3.42Å; K110-E269 PolarHBondContact NZ-OE1 3.49Å; K110-E269 IonicContact NZ-OE2 2.98Å; K110-E269 PolarHBondContact NZ-OE2 3.25Å; S112-E269 WeakPolarHBondContact CB-OE1 3.09Å; S112-E269 PolarHBondContact OG-OE1 2.84Å; I127-E269 HydrophobicContact CD1-CG 3.92Å; I127-E269 HydrophobicContact CG1-CG 3.86Å; I127-E269 HydrophobicContact CG2-CG 4.07Å; N267-E269 PolarHBondContact O-N 3.16Å; N267-E269 VanDerWaalsContact O-N 3.08Å; E269-V271 PolarHBondContact O-N 3.18Å; E269-L272 WeakPolarHBondContact O-CB 3.14Å; E269-L272 PolarHBondContact O-N 2.78Å
270	A	89.3	Confident	92.2	Very high	33 Å²	33	35 Å²	35	27%	0.273	18%	0.181	S	C	.	.	G	3₁₀ helix	trans	-64.5	-27.3	179.7	0	0	0	0	0	111.7	N267 E268 L272 T273	N267-A270 VanDerWaalsContact O-CB 3.28Å; N267-A270 WeakPolarHBondContact O-CB 3.11Å; N267-A270 PolarHBondContact O-N 2.94Å; E268-A270 PolarHBondContact O-N 3.48Å; E268-A270 VanDerWaalsContact O-N 3.16Å; A270-L272 VanDerWaalsContact C-N 3.28Å; A270-L272 PolarHBondContact O-N 2.78Å; A270-T273 PolarHBondContact O-N 3.3Å; A270-T273 PolarHBondContact O-OG1 2.93Å
271	V	90.8	Very high	92.1	Very high	18 Å²	18	33.1 Å²	33.1	11%	0.109	17%	0.174	C	C	.	.	G	3₁₀ helix	trans	-66.8	-30.9	-179.1	179.7	0	0	0	0	111.1	E220 L221 E268 E269 T273 T274 I277	E220-V271 HydrophobicContact CG-CG1 4.33Å; E220-V271 WeakPolarHBondContact OE1-CG1 3.35Å; E220-V271 WeakPolarHBondContact OE2-CG1 3.43Å; L221-V271 HydrophobicContact CD1-CB 4.07Å; L221-V271 HydrophobicContact CD1-CG1 4.06Å; L221-V271 HydrophobicContact CD1-CG2 3.89Å; L221-V271 HydrophobicContact CD2-CG1 4.39Å; L221-V271 HydrophobicContact CD2-CG2 3.85Å; L221-V271 HydrophobicContact CG-CG1 4.27Å; L221-V271 HydrophobicContact CG-CG2 4.34Å; E268-V271 VanDerWaalsContact O-CB 3.28Å; E268-V271 WeakPolarHBondContact O-CB 3.49Å; E268-V271 PolarHBondContact O-N 3.11Å; E269-V271 PolarHBondContact O-N 3.18Å; V271-T273 PolarHBondContact O-N 3.39Å; V271-T274 HydrophobicContact CG1-CG2 4.39Å; V271-T274 WeakPolarHBondContact O-CB 3.14Å; V271-T274 WeakPolarHBondContact O-CG2 3.49Å; V271-T274 PolarHBondContact O-N 3.17Å; V271-T274 PolarHBondContact O-OG1 3.08Å; V271-I277 HydrophobicContact CG1-CG1 4.21Å; V271-I277 WeakPolarHBondContact O-CG1 3.29Å
272	L	91.7	Very high	92	Very high	6 Å²	6	33.4 Å²	33.4	3%	0.031	18%	0.176	C	C	.	.	G	3₁₀ helix	trans	-62.5	-7.7	176.4	-58.2	-179.3	0	0	0	114.2	Y125 I127 Y217 E269 A270	Y125-L272 HydrophobicContact CD1-CD2 3.77Å; Y125-L272 HydrophobicContact CD2-CD1 3.93Å; Y125-L272 HydrophobicContact CD2-CD2 3.57Å; Y125-L272 HydrophobicContact CD2-CG 4.39Å; Y125-L272 HydrophobicContact CE1-CD2 4.02Å; Y125-L272 HydrophobicContact CE2-CD2 3.87Å; Y125-L272 HydrophobicContact CG-CD1 4.21Å; Y125-L272 HydrophobicContact CG-CD2 3.51Å; I127-L272 HydrophobicContact CD1-CD1 4.37Å; Y217-L272 HydrophobicContact CD2-CD2 3.68Å; Y217-L272 HydrophobicContact CE2-CD2 3.46Å; Y217-L272 VanDerWaalsContact CE2-CD2 3.46Å; Y217-L272 HydrophobicContact CE2-CG 4.32Å; E269-L272 WeakPolarHBondContact O-CB 3.14Å; E269-L272 PolarHBondContact O-N 2.78Å; A270-L272 VanDerWaalsContact C-N 3.28Å; A270-L272 PolarHBondContact O-N 2.78Å
273	T	87.9	Confident	91.9	Very high	61 Å²	61	32.6 Å²	32.6	37%	0.374	17%	0.169	S	C	.	.	G	3₁₀ helix	trans	-113	4.6	177.6	71.5	0	0	0	0	113.7	L115 A270 V271	L115-T273 HydrophobicContact CD2-CG2 4.37Å; A270-T273 PolarHBondContact O-N 3.3Å; A270-T273 PolarHBondContact O-OG1 2.93Å; V271-T273 PolarHBondContact O-N 3.39Å
274	T	88.3	Confident	92	Very high	36 Å²	36	32.1 Å²	32.1	22%	0.221	17%	0.166	C	C	.	.	S	Bend	trans	-72.3	160.4	178.8	64.3	0	0	0	0	111.2	E220 V271 D276 I277 V278	E220-T274 PolarHBondContact OE1-OG1 2.95Å; V271-T274 HydrophobicContact CG1-CG2 4.39Å; V271-T274 WeakPolarHBondContact O-CB 3.14Å; V271-T274 WeakPolarHBondContact O-CG2 3.49Å; V271-T274 PolarHBondContact O-N 3.17Å; V271-T274 PolarHBondContact O-OG1 3.08Å; T274-D276 PolarHBondContact O-N 3.37Å; T274-I277 PolarHBondContact OG1-N 2.96Å; T274-V278 WeakPolarHBondContact O-CB 3.29Å; T274-V278 WeakPolarHBondContact O-CG2 3.39Å; T274-V278 PolarHBondContact O-N 3.27Å; T274-V278 VanDerWaalsContact O-N 3.14Å
275	M	86.3	Confident	92	Very high	14 Å²	14	32.6 Å²	32.6	7%	0.069	17%	0.165	C	C	.	.	H	α-helix	trans	-59.6	-35.5	176	-170.1	174.3	-65.6	0	0	111.5	V278 H279 D280 R416 D417	M275-V278 PolarHBondContact O-N 2.99Å; M275-H279 HydrophobicContact CG-CB 4.3Å; M275-H279 PolarHBondContact O-N 2.94Å; M275-D280 PolarHBondContact O-N 3.49Å; M275-R416 HydrophobicContact CE-CB 4.13Å; M275-R416 HydrophobicContact SD-CB 4.18Å; M275-R416 PolarHBondContact SD-NH1 2.81Å; M275-D417 HydrophobicContact CE-CB 4.11Å
276	D	88.4	Confident	92	Very high	25 Å²	25	33.3 Å²	33.3	13%	0.134	17%	0.169	C	C	.	.	H	α-helix	trans	-69.8	-41.5	-171.4	-47.4	-15.7	0	0	0	109.8	K216 T274 L286 R413	K216-D276 WeakPolarHBondContact CD-O 3.41Å; K216-D276 WeakPolarHBondContact CE-O 3.43Å; K216-D276 PolarHBondContact NZ-O 3.31Å; T274-D276 PolarHBondContact O-N 3.37Å; D276-L286 HydrophobicContact CB-CD1 4.46Å; D276-L286 HydrophobicContact CB-CD2 4.44Å; D276-R413 IonicContact OD1-CZ 3.08Å; D276-R413 IonicContact OD1-NH1 3.88Å; D276-R413 IonicContact OD1-NH2 2.87Å; D276-R413 PolarHBondContact OD1-NH2 2.91Å; D276-R413 IonicContact OD2-CZ 2.61Å; D276-R413 IonicContact OD2-NH1 3.27Å; D276-R413 PolarHBondContact OD2-NH1 3.41Å; D276-R413 VanDerWaalsContact OD2-NH1 3.16Å; D276-R413 IonicContact OD2-NH2 3.29Å; D276-R413 PolarHBondContact OD2-NH2 3.17Å
277	I	91.4	Very high	92.1	Very high	5 Å²	5	25 Å²	25	3%	0.026	14%	0.137	C	C	.	.	H	α-helix	trans	-71.1	-43.5	172.6	-66.3	-60.5	0	0	0	112.7	N207 K216 Y217 E220 V271 T274	N207-I277 PolarHBondContact OD1-O 3.44Å; K216-I277 HydrophobicContact CD-CD1 3.74Å; K216-I277 HydrophobicContact CG-CD1 4.1Å; K216-I277 PolarHBondContact NZ-O 2.88Å; Y217-I277 HydrophobicContact CD2-CD1 4.23Å; E220-I277 WeakPolarHBondContact OE2-CD1 3.34Å; E220-I277 VanDerWaalsContact OE2-CG1 3.22Å; E220-I277 WeakPolarHBondContact OE2-CG1 3.17Å; V271-I277 HydrophobicContact CG1-CG1 4.21Å; V271-I277 WeakPolarHBondContact O-CG1 3.29Å; T274-I277 PolarHBondContact OG1-N 2.96Å
278	V	89.7	Confident	92.4	Very high	37 Å²	37	23 Å²	23	22%	0.224	13%	0.126	C	C	.	.	H	α-helix	trans	-90.2	-33.1	-163	179.9	0	0	0	0	113.4	L115 T274 M275	L115-V278 HydrophobicContact CD1-CG1 4Å; L115-V278 HydrophobicContact CD1-CG2 3.67Å; L115-V278 HydrophobicContact CG-CG2 4.32Å; T274-V278 WeakPolarHBondContact O-CB 3.29Å; T274-V278 WeakPolarHBondContact O-CG2 3.39Å; T274-V278 PolarHBondContact O-N 3.27Å; T274-V278 VanDerWaalsContact O-N 3.14Å; M275-V278 PolarHBondContact O-N 2.99Å
279	H	86.3	Confident	92.5	Very high	93 Å²	93	23.7 Å²	23.7	43%	0.431	14%	0.135	S	C	.	.	T	Hydrogen-bonded Turn	trans	-120.2	-40.4	-170.3	-57.9	100	0	0	0	113.3	M275	M275-H279 HydrophobicContact CG-CB 4.3Å; M275-H279 PolarHBondContact O-N 2.94Å
280	D	90.6	Very high	92.8	Very high	12 Å²	12	21.1 Å²	21.1	6%	0.064	12%	0.123	C	C	.	.	S	Bend	trans	-82.1	141.4	-171.3	-66.1	-12.1	0	0	0	111	L206 K216 M275 L286 R416	L206-D280 WeakPolarHBondContact CD1-O 3.44Å; K216-D280 PolarHBondContact NZ-O 3.37Å; M275-D280 PolarHBondContact O-N 3.49Å; D280-L286 HydrophobicContact CB-CD1 4.3Å; D280-R416 IonicContact OD1-CZ 3.03Å; D280-R416 IonicContact OD1-NH1 2.83Å; D280-R416 IonicContact OD1-NH2 3.58Å; D280-R416 PolarHBondContact OD1-NH2 2.94Å; D280-R416 IonicContact OD2-CZ 3.59Å; D280-R416 IonicContact OD2-NH1 2.81Å; D280-R416 PolarHBondContact OD2-NH1 2.88Å; D280-R416 IonicContact OD2-NH2 3.56Å; D280-R416 PolarHBondContact OD2-NH2 2.97Å
281	G	94.5	Very high	93.2	Very high	1 Å²	1	20.1 Å²	20.1	1%	0.01	11%	0.113	C	C	.	.			trans	-70.5	162.6	173.8	0	0	0	0	0	111.7	I202 G203 G283 L286	I202-G281 CarbonylContact O-C 3.45Å; G203-G281 WeakPolarHBondContact O-CA 3.3Å; G281-G283 PolarHBondContact O-N 3.37Å; G281-L286 VanDerWaalsContact O-CD1 3.26Å; G281-L286 WeakPolarHBondContact O-CD1 3.27Å
282	F	96.9	Very high	93.5	Very high	6 Å²	6	19.3 Å²	19.3	3%	0.026	11%	0.108	C	C	.	.			trans	-97.4	87.6	173.4	-162.2	-130.3	0	0	0	110.9	L175 E205 P208 L215 K216 C219 L286 V287	L175-F282 HydrophobicContact CD1-CD1 3.35Å; L175-F282 HydrophobicContact CD1-CE1 3.62Å; L175-F282 HydrophobicContact CD1-CG 4.16Å; L175-F282 HydrophobicContact CD2-CD1 4.02Å; L175-F282 HydrophobicContact CG-CD1 4.32Å; E205-F282 PolarHBondContact O-N 2.79Å; P208-F282 HydrophobicContact CG-CB 3.74Å; P208-F282 HydrophobicContact CG-CD1 3.61Å; P208-F282 HydrophobicContact CG-CG 4.12Å; L215-F282 HydrophobicContact CB-CD1 4.2Å; L215-F282 HydrophobicContact CB-CE1 3.85Å; K216-F282 HydrophobicContact CB-CB 4.07Å; K216-F282 HydrophobicContact CB-CD1 4.05Å; K216-F282 HydrophobicContact CB-CD2 3.67Å; K216-F282 HydrophobicContact CB-CE1 4.42Å; K216-F282 HydrophobicContact CB-CE2 4.08Å; K216-F282 HydrophobicContact CB-CG 3.67Å; K216-F282 HydrophobicContact CB-CZ 4.43Å; K216-F282 HydrophobicContact CD-CD2 4.48Å; K216-F282 HydrophobicContact CG-CB 4.36Å; K216-F282 HydrophobicContact CG-CD2 3.56Å; K216-F282 HydrophobicContact CG-CE2 4.01Å; K216-F282 HydrophobicContact CG-CG 4.02Å; C219-F282 HydrophobicContact CB-CE2 4.34Å; C219-F282 HydrophobicContact CB-CZ 3.76Å; F282-L286 HydrophobicContact CD2-CB 3.71Å; F282-L286 HydrophobicContact CD2-CD1 4.15Å; F282-L286 HydrophobicContact CE2-CB 3.87Å; F282-V287 HydrophobicContact CD1-CG2 4.21Å; F282-V287 HydrophobicContact CD2-CG2 4.23Å; F282-V287 HydrophobicContact CE1-CG2 3.74Å; F282-V287 HydrophobicContact CE2-CG2 3.76Å; F282-V287 HydrophobicContact CG-CG2 4.44Å; F282-V287 HydrophobicContact CZ-CB 4.42Å; F282-V287 HydrophobicContact CZ-CG2 3.5Å; F282-V287 VanDerWaalsContact CZ-CG2 3.5Å
283	G	96.7	Very high	93.8	Very high	2 Å²	2	19.6 Å²	19.6	2%	0.021	11%	0.109	C	C	.	.	S	Bend	trans	-121.3	-165.8	177.7	0	0	0	0	0	112.4	F201 I202 G281 M285 L286 V287	F201-G283 CarbonylContact O-C 3.59Å; I202-G283 PolarHBondContact O-N 2.63Å; G281-G283 PolarHBondContact O-N 3.37Å; G283-M285 PolarHBondContact O-N 2.94Å; G283-L286 PolarHBondContact O-N 2.87Å; G283-V287 VanDerWaalsContact O-CG2 3.31Å; G283-V287 WeakPolarHBondContact O-CG2 3.48Å; G283-V287 PolarHBondContact O-N 3.49Å
284	F	97.6	Very high	94.3	Very high	1 Å²	1	17.7 Å²	17.7	0%	0.004	10%	0.097	C	C	.	.	H	α-helix	trans	-52.7	-41.1	-176.8	178.9	-89	0	0	0	113.4	P50 P54 F169 S172 F200 F201 L286 V287 F288	P50-F284 HydrophobicContact CB-CD1 3.94Å; P50-F284 HydrophobicContact CB-CE1 3.69Å; P50-F284 HydrophobicContact CB-CZ 4.08Å; P50-F284 HydrophobicContact CG-CD1 3.87Å; P50-F284 HydrophobicContact CG-CE1 4.04Å; P54-F284 HydrophobicContact CG-CZ 4.32Å; F169-F284 AromaticContact CD1-CD2 3.89Å; F169-F284 HydrophobicContact CD1-CD2 3.89Å; F169-F284 AromaticContact CD1-CE2 3.6Å; F169-F284 HydrophobicContact CD1-CE2 3.6Å; F169-F284 AromaticContact CD2-CE2 3.81Å; F169-F284 HydrophobicContact CD2-CE2 3.81Å; F169-F284 AromaticContact CE1-CD2 3.93Å; F169-F284 HydrophobicContact CE1-CD2 3.93Å; F169-F284 AromaticContact CE1-CE2 3.44Å; F169-F284 HydrophobicContact CE1-CE2 3.44Å; F169-F284 VanDerWaalsContact CE1-CE2 3.44Å; F169-F284 HydrophobicContact CE1-CZ 4.03Å; F169-F284 AromaticContact CE2-CE2 3.65Å; F169-F284 HydrophobicContact CE2-CE2 3.65Å; F169-F284 AromaticContact CE2-CZ 3.95Å; F169-F284 HydrophobicContact CE2-CZ 3.95Å; F169-F284 HydrophobicContact CG-CD2 4.32Å; F169-F284 AromaticContact CG-CE2 3.78Å; F169-F284 HydrophobicContact CG-CE2 3.78Å; F169-F284 HydrophobicContact CZ-CD2 4.39Å; F169-F284 AromaticContact CZ-CE2 3.47Å; F169-F284 HydrophobicContact CZ-CE2 3.47Å; F169-F284 VanDerWaalsContact CZ-CE2 3.47Å; F169-F284 AromaticContact CZ-CZ 3.69Å; F169-F284 HydrophobicContact CZ-CZ 3.69Å; S172-F284 WeakPolarHBondContact OG-CA 3.41Å; F200-F284 HydrophobicContact CD1-CB 4.22Å; F200-F284 HydrophobicContact CE1-CB 3.73Å; F200-F284 HydrophobicContact CE1-CD2 4.26Å; F200-F284 HydrophobicContact CE1-CG 4.13Å; F200-F284 HydrophobicContact CZ-CB 4.21Å; F200-F284 HydrophobicContact CZ-CD2 4.39Å; F200-F284 PolarHBondContact O-N 3.36Å; F200-F284 VanDerWaalsContact O-N 3.11Å; F201-F284 HydrophobicContact CD2-CD1 4.15Å; F201-F284 HydrophobicContact CE2-CD1 4.4Å; F201-F284 PolarHBondContact O-N 3.08Å; F201-F284 VanDerWaalsContact O-N 3.14Å; F284-L286 PolarHBondContact O-N 3.43Å; F284-V287 PolarHBondContact O-N 2.89Å; F284-F288 HydrophobicContact CD1-CB 4.21Å; F284-F288 HydrophobicContact CD2-CB 4.46Å; F284-F288 HydrophobicContact CE1-CB 3.8Å; F284-F288 HydrophobicContact CE1-CD1 4.41Å; F284-F288 HydrophobicContact CE1-CD2 4.37Å; F284-F288 AromaticContact CE1-CG 3.93Å; F284-F288 HydrophobicContact CE1-CG 3.93Å; F284-F288 HydrophobicContact CE2-CB 4.1Å; F284-F288 HydrophobicContact CE2-CD2 4.35Å; F284-F288 HydrophobicContact CE2-CG 4.46Å; F284-F288 HydrophobicContact CZ-CB 3.77Å; F284-F288 AromaticContact CZ-CD2 3.76Å; F284-F288 HydrophobicContact CZ-CD2 3.76Å; F284-F288 AromaticContact CZ-CG 3.77Å; F284-F288 HydrophobicContact CZ-CG 3.77Å; F284-F288 WeakPolarHBondContact O-CB 3.29Å; F284-F288 PolarHBondContact O-N 3.45Å
285	M	96	Very high	94.7	Very high	34 Å²	34	16.2 Å²	16.2	17%	0.167	9%	0.088	C	C	.	.	H	α-helix	trans	-54.9	-50.4	-178.9	-173.1	-173	79	0	0	112.6	F40 F201 I202 G283 G289	F40-M285 HydrophobicContact CD1-SD 4.18Å; F40-M285 HydrophobicContact CD2-SD 3.91Å; F40-M285 HydrophobicContact CE1-SD 3.73Å; F40-M285 HydrophobicContact CE2-CE 4Å; F40-M285 HydrophobicContact CE2-SD 3.44Å; F40-M285 WeakPolarHBondContact CE2-SD 3.41Å; F40-M285 HydrophobicContact CG-SD 4.27Å; F40-M285 HydrophobicContact CZ-CE 3.91Å; F40-M285 HydrophobicContact CZ-SD 3.33Å; F40-M285 WeakPolarHBondContact CZ-SD 3.32Å; F201-M285 HydrophobicContact CD2-CB 4.14Å; F201-M285 HydrophobicContact CE1-CB 4.26Å; F201-M285 HydrophobicContact CE1-CG 4.37Å; F201-M285 HydrophobicContact CE1-SD 4.1Å; F201-M285 HydrophobicContact CE2-CB 3.67Å; F201-M285 HydrophobicContact CE2-CG 4.05Å; F201-M285 HydrophobicContact CZ-CB 3.74Å; F201-M285 HydrophobicContact CZ-CG 3.72Å; F201-M285 HydrophobicContact CZ-SD 3.94Å; F201-M285 WeakPolarHBondContact O-CB 3.48Å; F201-M285 PolarHBondContact O-N 3.37Å; I202-M285 HydrophobicContact CD1-SD 4.27Å; G283-M285 PolarHBondContact O-N 2.94Å; M285-G289 PolarHBondContact O-N 3.4Å
286	L	96.3	Very high	95.2	Very high	18 Å²	18	15.8 Å²	15.8	9%	0.094	9%	0.086	C	C	.	.	H	α-helix	trans	-76	-45	-179	-69.4	-172.4	0	0	0	111.3	K216 D276 D280 G281 F282 G283 F284 F288 G289 D290	K216-L286 HydrophobicContact CD-CD1 4.4Å; D276-L286 HydrophobicContact CB-CD1 4.46Å; D276-L286 HydrophobicContact CB-CD2 4.44Å; D280-L286 HydrophobicContact CB-CD1 4.3Å; G281-L286 VanDerWaalsContact O-CD1 3.26Å; G281-L286 WeakPolarHBondContact O-CD1 3.27Å; F282-L286 HydrophobicContact CD2-CB 3.71Å; F282-L286 HydrophobicContact CD2-CD1 4.15Å; F282-L286 HydrophobicContact CE2-CB 3.87Å; G283-L286 PolarHBondContact O-N 2.87Å; F284-L286 PolarHBondContact O-N 3.43Å; L286-F288 VanDerWaalsContact C-N 3.34Å; L286-F288 PolarHBondContact O-N 3.01Å; L286-G289 PolarHBondContact O-N 2.95Å; L286-G289 VanDerWaalsContact O-N 3.16Å; L286-D290 WeakPolarHBondContact O-CB 3.48Å; L286-D290 PolarHBondContact O-N 3.46Å
287	V	98	Very high	95.7	Very high	1 Å²	1	14.7 Å²	14.7	1%	0.006	8%	0.08	C	C	.	.	H	α-helix	trans	-57.9	-48.2	179.6	179	0	0	0	0	111.1	L175 F282 G283 F284 L291	L175-V287 HydrophobicContact CD1-CG2 3.59Å; F282-V287 HydrophobicContact CD1-CG2 4.21Å; F282-V287 HydrophobicContact CD2-CG2 4.23Å; F282-V287 HydrophobicContact CE1-CG2 3.74Å; F282-V287 HydrophobicContact CE2-CG2 3.76Å; F282-V287 HydrophobicContact CG-CG2 4.44Å; F282-V287 HydrophobicContact CZ-CB 4.42Å; F282-V287 HydrophobicContact CZ-CG2 3.5Å; F282-V287 VanDerWaalsContact CZ-CG2 3.5Å; G283-V287 VanDerWaalsContact O-CG2 3.31Å; G283-V287 WeakPolarHBondContact O-CG2 3.48Å; G283-V287 PolarHBondContact O-N 3.49Å; F284-V287 PolarHBondContact O-N 2.89Å; V287-L291 HydrophobicContact CG1-CD1 3.96Å; V287-L291 WeakPolarHBondContact O-CB 3.27Å; V287-L291 WeakPolarHBondContact O-CG 3.05Å; V287-L291 PolarHBondContact O-N 2.91Å
288	F	98.2	Very high	96	Very high	2 Å²	2	15.2 Å²	15.2	1%	0.009	8%	0.082	C	C	.	.	H	α-helix	trans	-67	-41.7	177.1	176.1	-93.3	0	0	0	111.6	L53 P54 V57 V165 F284 L286 D290 A292 W293	L53-F288 HydrophobicContact CB-CD1 4.42Å; L53-F288 HydrophobicContact CB-CE1 3.6Å; L53-F288 HydrophobicContact CB-CZ 3.97Å; L53-F288 HydrophobicContact CD1-CD1 4.33Å; L53-F288 HydrophobicContact CD1-CE1 4.08Å; L53-F288 HydrophobicContact CG-CE1 4.49Å; P54-F288 HydrophobicContact CB-CE2 4.17Å; P54-F288 HydrophobicContact CB-CZ 4.47Å; P54-F288 HydrophobicContact CG-CD2 4.35Å; P54-F288 HydrophobicContact CG-CE2 3.7Å; P54-F288 HydrophobicContact CG-CZ 4.05Å; V57-F288 HydrophobicContact CG2-CE1 4.44Å; V57-F288 HydrophobicContact CG2-CZ 3.79Å; V165-F288 HydrophobicContact CG2-CE2 3.94Å; F284-F288 HydrophobicContact CD1-CB 4.21Å; F284-F288 HydrophobicContact CD2-CB 4.46Å; F284-F288 HydrophobicContact CE1-CB 3.8Å; F284-F288 HydrophobicContact CE1-CD1 4.41Å; F284-F288 HydrophobicContact CE1-CD2 4.37Å; F284-F288 AromaticContact CE1-CG 3.93Å; F284-F288 HydrophobicContact CE1-CG 3.93Å; F284-F288 HydrophobicContact CE2-CB 4.1Å; F284-F288 HydrophobicContact CE2-CD2 4.35Å; F284-F288 HydrophobicContact CE2-CG 4.46Å; F284-F288 HydrophobicContact CZ-CB 3.77Å; F284-F288 AromaticContact CZ-CD2 3.76Å; F284-F288 HydrophobicContact CZ-CD2 3.76Å; F284-F288 AromaticContact CZ-CG 3.77Å; F284-F288 HydrophobicContact CZ-CG 3.77Å; F284-F288 WeakPolarHBondContact O-CB 3.29Å; F284-F288 PolarHBondContact O-N 3.45Å; L286-F288 VanDerWaalsContact C-N 3.34Å; L286-F288 PolarHBondContact O-N 3.01Å; F288-D290 VanDerWaalsContact C-N 3.32Å; F288-D290 PolarHBondContact O-N 2.99Å; F288-A292 HydrophobicContact CD2-CB 3.72Å; F288-A292 HydrophobicContact CE2-CB 3.64Å; F288-A292 HydrophobicContact CG-CB 4.4Å; F288-A292 HydrophobicContact CZ-CB 4.27Å; F288-A292 CarbonylContact O-C 3.51Å; F288-A292 WeakPolarHBondContact O-CA 3.33Å; F288-A292 PolarHBondContact O-N 2.84Å; F288-W293 HydrophobicContact CD1-CB 4.32Å; F288-W293 HydrophobicContact CE1-CB 4.03Å; F288-W293 AromaticContact CE1-CE3 3.94Å; F288-W293 HydrophobicContact CE1-CE3 3.94Å; F288-W293 HydrophobicContact CZ-CE3 4.48Å; F288-W293 PolarHBondContact O-N 3.08Å
289	G	96.9	Very high	96.3	Very high	18 Å²	18	13.5 Å²	13.5	19%	0.186	7%	0.072	C	C	.	.	I	π-helix	trans	-52	-52	174.1	0	0	0	0	0	111.8	M285 L286 W293 V294	M285-G289 PolarHBondContact O-N 3.4Å; L286-G289 PolarHBondContact O-N 2.95Å; L286-G289 VanDerWaalsContact O-N 3.16Å; G289-W293 WeakPolarHBondContact O-CB 3.28Å; G289-W293 PolarHBondContact O-N 3.45Å; G289-V294 VanDerWaalsContact O-CG2 3.26Å; G289-V294 WeakPolarHBondContact O-CG2 3.45Å; G289-V294 PolarHBondContact O-N 2.83Å
290	D	97.4	Very high	96.9	Very high	20 Å²	20	9.2 Å²	9.2	11%	0.107	5%	0.052	C	C	.	.	I	π-helix	trans	-70.8	-47.2	-175.2	-65	-21.3	0	0	0	112.6	C219 E220 G224 L286 F288 P295	C219-D290 HydrophobicContact CB-CB 3.95Å; C219-D290 WeakPolarHBondContact CB-OD2 3.29Å; E220-D290 PolarHBondContact N-OD2 2.84Å; G224-D290 WeakPolarHBondContact CA-O 3.33Å; L286-D290 WeakPolarHBondContact O-CB 3.48Å; L286-D290 PolarHBondContact O-N 3.46Å; F288-D290 VanDerWaalsContact C-N 3.32Å; F288-D290 PolarHBondContact O-N 2.99Å; D290-P295 WeakPolarHBondContact O-CD 3.47Å
291	L	97.8	Very high	97.3	Very high	13 Å²	13	8.7 Å²	8.7	7%	0.068	5%	0.049	C	C	.	.	I	π-helix	trans	-91.5	-28.6	-169.5	-61.8	-177.6	0	0	0	114.2	V167 C219 P223 V287 P295	V167-L291 HydrophobicContact CG1-CD1 4.13Å; C219-L291 HydrophobicContact CB-CD2 4.48Å; P223-L291 HydrophobicContact CB-CD2 4.06Å; P223-L291 HydrophobicContact CG-CD2 3.56Å; V287-L291 HydrophobicContact CG1-CD1 3.96Å; V287-L291 WeakPolarHBondContact O-CB 3.27Å; V287-L291 WeakPolarHBondContact O-CG 3.05Å; V287-L291 PolarHBondContact O-N 2.91Å; L291-P295 WeakPolarHBondContact O-CG 3.27Å
292	A	97.9	Very high	97.4	Very high	0 Å²	0	8.6 Å²	8.6	0%	0	5%	0.048	C	C	.	.	I	π-helix	trans	-124.3	-37.5	-171.1	0	0	0	0	0	113.3	A164 V165 F288 F296	A164-A292 HydrophobicContact CB-CB 4.01Å; V165-A292 HydrophobicContact CG2-CB 4.38Å; F288-A292 HydrophobicContact CD2-CB 3.72Å; F288-A292 HydrophobicContact CE2-CB 3.64Å; F288-A292 HydrophobicContact CG-CB 4.4Å; F288-A292 HydrophobicContact CZ-CB 4.27Å; F288-A292 CarbonylContact O-C 3.51Å; F288-A292 WeakPolarHBondContact O-CA 3.33Å; F288-A292 PolarHBondContact O-N 2.84Å; A292-F296 WeakPolarHBondContact O-CB 3.25Å; A292-F296 VanDerWaalsContact O-CD2 3.23Å; A292-F296 WeakPolarHBondContact O-CD2 3.4Å
293	W	98	Very high	97.5	Very high	13 Å²	13	8.4 Å²	8.4	5%	0.049	5%	0.047	C	C	.	.	I	π-helix	trans	-73.9	-58.1	-179.3	-175.8	-93.1	0	0	0	111.3	L53 T56 V57 F288 G289 T297 F401 Y405	L53-W293 HydrophobicContact CB-CZ3 4.44Å; L53-W293 HydrophobicContact CD2-CE3 4.29Å; L53-W293 HydrophobicContact CD2-CH2 4.02Å; L53-W293 HydrophobicContact CD2-CZ3 3.63Å; T56-W293 HydrophobicContact CG2-CH2 4.32Å; T56-W293 HydrophobicContact CG2-CZ3 4.31Å; V57-W293 HydrophobicContact CG2-CE3 3.56Å; V57-W293 HydrophobicContact CG2-CZ3 3.98Å; F288-W293 HydrophobicContact CD1-CB 4.32Å; F288-W293 HydrophobicContact CE1-CB 4.03Å; F288-W293 AromaticContact CE1-CE3 3.94Å; F288-W293 HydrophobicContact CE1-CE3 3.94Å; F288-W293 HydrophobicContact CZ-CE3 4.48Å; F288-W293 PolarHBondContact O-N 3.08Å; G289-W293 WeakPolarHBondContact O-CB 3.28Å; G289-W293 PolarHBondContact O-N 3.45Å; W293-T297 HydrophobicContact CD2-CG2 3.97Å; W293-T297 HydrophobicContact CE3-CG2 4Å; W293-T297 HydrophobicContact CG-CG2 4.48Å; W293-T297 HydrophobicContact CH2-CG2 4.47Å; W293-T297 HydrophobicContact CZ2-CG2 4.41Å; W293-T297 HydrophobicContact CZ3-CG2 4.25Å; W293-T297 PolarHBondContact NE1-OG1 2.81Å; W293-T297 WeakPolarHBondContact O-CB 3.37Å; W293-T297 WeakPolarHBondContact O-CG2 3.41Å; W293-T297 PolarHBondContact O-N 3.06Å; W293-T297 PolarHBondContact O-OG1 3.3Å; W293-F401 HydrophobicContact CH2-CE1 4.28Å; W293-F401 AromaticContact CH2-CZ 3.92Å; W293-F401 HydrophobicContact CH2-CZ 3.92Å; W293-F401 HydrophobicContact CZ2-CE1 4.08Å; W293-F401 HydrophobicContact CZ2-CZ 4.03Å; W293-Y405 AromaticContact CE2-CE2 3.76Å; W293-Y405 AromaticContact CE2-CZ 3.66Å; W293-Y405 HydrophobicContact CZ2-CD1 4.35Å; W293-Y405 AromaticContact CZ2-CD2 3.61Å; W293-Y405 HydrophobicContact CZ2-CD2 3.61Å; W293-Y405 HydrophobicContact CZ2-CE1 4.28Å; W293-Y405 AromaticContact CZ2-CE2 3.5Å; W293-Y405 HydrophobicContact CZ2-CE2 3.5Å; W293-Y405 HydrophobicContact CZ2-CG 4.04Å; W293-Y405 AromaticContact CZ2-CZ 3.87Å; W293-Y405 AromaticContact NE1-CE1 3.28Å; W293-Y405 VanDerWaalsContact NE1-CE1 3.28Å; W293-Y405 AromaticContact NE1-CE2 3.65Å; W293-Y405 AromaticContact NE1-CZ 3.03Å; W293-Y405 PolarHBondContact NE1-OH 3.37Å
294	V	96.9	Very high	97.5	Very high	20 Å²	20	8.3 Å²	8.3	12%	0.121	5%	0.046	C	C	.	.	H	α-helix	trans	-55.7	-60.5	-175.9	168.2	0	0	0	0	112.3	L225 G289 F296 Y298	L225-V294 HydrophobicContact CD2-CG1 3.76Å; G289-V294 VanDerWaalsContact O-CG2 3.26Å; G289-V294 WeakPolarHBondContact O-CG2 3.45Å; G289-V294 PolarHBondContact O-N 2.83Å; V294-F296 VanDerWaalsContact C-N 3.31Å; V294-F296 PolarHBondContact O-N 3.47Å; V294-Y298 HydrophobicContact CG1-CD2 4.15Å; V294-Y298 HydrophobicContact CG1-CE2 4.32Å; V294-Y298 HydrophobicContact CG1-CG 4.43Å; V294-Y298 HydrophobicContact CG2-CE1 4.37Å; V294-Y298 HydrophobicContact CG2-CE2 4.45Å; V294-Y298 WeakPolarHBondContact O-CB 3.26Å; V294-Y298 WeakPolarHBondContact O-CD1 3.35Å; V294-Y298 VanDerWaalsContact O-CG 3.3Å; V294-Y298 PolarHBondContact O-N 3.39Å
295	P	97.1	Very high	97.5	Very high	5 Å²	5	8.2 Å²	8.2	3%	0.032	5%	0.046	C	C	.	.	H	α-helix	trans	-63.5	-33.1	-173	19.6	-30.4	0	0	0	114.5	W228 I231 D290 L291 S299	W228-P295 HydrophobicContact CB-CB 4.32Å; I231-P295 HydrophobicContact CD1-CB 3.78Å; D290-P295 WeakPolarHBondContact O-CD 3.47Å; L291-P295 WeakPolarHBondContact O-CG 3.27Å; P295-S299 WeakPolarHBondContact O-CB 3.38Å; P295-S299 PolarHBondContact O-OG 3.33Å
296	F	97.8	Very high	97.6	Very high	6 Å²	6	7.2 Å²	7.2	3%	0.026	4%	0.042	C	C	.	.	H	α-helix	trans	-98.2	-24	-172	-61.4	-82	0	0	0	114.1	V57 I61 L157 L160 A161 A164 I231 A292 V294 S299	V57-F296 HydrophobicContact CG1-CB 3.83Å; I61-F296 HydrophobicContact CD1-CB 3.94Å; I61-F296 HydrophobicContact CD1-CD1 4.18Å; I61-F296 HydrophobicContact CD1-CG 4.38Å; L157-F296 HydrophobicContact CD1-CD1 3.71Å; L157-F296 HydrophobicContact CD1-CE1 4Å; L157-F296 HydrophobicContact CG-CD1 4.38Å; L160-F296 VanDerWaalsContact C-CZ 3.47Å; L160-F296 HydrophobicContact CB-CE1 3.67Å; L160-F296 HydrophobicContact CB-CZ 3.76Å; A161-F296 HydrophobicContact CB-CB 4.47Å; A161-F296 HydrophobicContact CB-CD1 3.7Å; A161-F296 HydrophobicContact CB-CD2 4.25Å; A161-F296 HydrophobicContact CB-CE1 3.92Å; A161-F296 HydrophobicContact CB-CE2 4.45Å; A161-F296 HydrophobicContact CB-CG 3.88Å; A161-F296 HydrophobicContact CB-CZ 4.3Å; A164-F296 HydrophobicContact CB-CE2 3.61Å; A164-F296 HydrophobicContact CB-CZ 4.21Å; I231-F296 HydrophobicContact CD1-CD1 4.1Å; I231-F296 HydrophobicContact CD1-CE1 3.86Å; I231-F296 HydrophobicContact CD1-CZ 4.19Å; A292-F296 WeakPolarHBondContact O-CB 3.25Å; A292-F296 VanDerWaalsContact O-CD2 3.23Å; A292-F296 WeakPolarHBondContact O-CD2 3.4Å; V294-F296 VanDerWaalsContact C-N 3.31Å; V294-F296 PolarHBondContact O-N 3.47Å; F296-S299 PolarHBondContact O-OG 3.17Å
297	T	97.3	Very high	97.5	Very high	1 Å²	1	8.4 Å²	8.4	1%	0.006	5%	0.054	C	C	.	.	H	α-helix	trans	-92.3	-27.5	173.2	67.4	0	0	0	0	112.5	V57 L60 W293 S299 L300	V57-T297 HydrophobicContact CG2-CG2 3.85Å; L60-T297 HydrophobicContact CD1-CG2 4.29Å; W293-T297 HydrophobicContact CD2-CG2 3.97Å; W293-T297 HydrophobicContact CE3-CG2 4Å; W293-T297 HydrophobicContact CG-CG2 4.48Å; W293-T297 HydrophobicContact CH2-CG2 4.47Å; W293-T297 HydrophobicContact CZ2-CG2 4.41Å; W293-T297 HydrophobicContact CZ3-CG2 4.25Å; W293-T297 PolarHBondContact NE1-OG1 2.81Å; W293-T297 WeakPolarHBondContact O-CB 3.37Å; W293-T297 WeakPolarHBondContact O-CG2 3.41Å; W293-T297 PolarHBondContact O-N 3.06Å; W293-T297 PolarHBondContact O-OG1 3.3Å; T297-S299 VanDerWaalsContact C-N 3.3Å; T297-L300 WeakPolarHBondContact O-CB 3.28Å; T297-L300 VanDerWaalsContact O-CD1 3.25Å; T297-L300 WeakPolarHBondContact O-CD1 3.45Å; T297-L300 WeakPolarHBondContact O-CG 3.28Å; T297-L300 PolarHBondContact O-N 3.12Å
298	Y	97.6	Very high	97.4	Very high	17 Å²	17	9.4 Å²	9.4	7%	0.067	6%	0.059	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.3	-12.6	-179.8	-66.4	25	0	0	0	111.9	W228 Q257 V294 Q301 Y402 Y405	W228-Y298 HydrophobicContact CD2-CD2 4.49Å; W228-Y298 VanDerWaalsContact CE2-CB 3.41Å; W228-Y298 HydrophobicContact CE3-CD2 4.29Å; W228-Y298 AromaticContact CH2-CD2 3.84Å; W228-Y298 HydrophobicContact CH2-CD2 3.84Å; W228-Y298 AromaticContact CZ2-CD2 4Å; W228-Y298 HydrophobicContact CZ2-CD2 4Å; W228-Y298 HydrophobicContact CZ2-CG 4.32Å; W228-Y298 AromaticContact CZ3-CD2 3.99Å; W228-Y298 HydrophobicContact CZ3-CD2 3.99Å; W228-Y298 PolarHBondContact NE1-O 3.42Å; Q257-Y298 PolarHBondContact NE2-O 2.99Å; Q257-Y298 VanDerWaalsContact NE2-O 3.14Å; Q257-Y298 PolarHBondContact OE1-O 3.3Å; V294-Y298 HydrophobicContact CG1-CD2 4.15Å; V294-Y298 HydrophobicContact CG1-CE2 4.32Å; V294-Y298 HydrophobicContact CG1-CG 4.43Å; V294-Y298 HydrophobicContact CG2-CE1 4.37Å; V294-Y298 HydrophobicContact CG2-CE2 4.45Å; V294-Y298 WeakPolarHBondContact O-CB 3.26Å; V294-Y298 WeakPolarHBondContact O-CD1 3.35Å; V294-Y298 VanDerWaalsContact O-CG 3.3Å; V294-Y298 PolarHBondContact O-N 3.39Å; Y298-Q301 PolarHBondContact O-OE1 3.41Å; Y298-Q301 VanDerWaalsContact O-OE1 3.05Å; Y298-Y402 AromaticContact CD1-CD2 3.92Å; Y298-Y402 HydrophobicContact CD1-CD2 3.92Å; Y298-Y402 AromaticContact CD1-CE2 3.6Å; Y298-Y402 HydrophobicContact CD1-CE2 3.6Å; Y298-Y402 AromaticContact CD2-CE2 3.71Å; Y298-Y402 HydrophobicContact CD2-CE2 3.71Å; Y298-Y402 HydrophobicContact CE1-CD2 4.12Å; Y298-Y402 AromaticContact CE1-CE2 3.57Å; Y298-Y402 HydrophobicContact CE1-CE2 3.57Å; Y298-Y402 AromaticContact CE2-CE2 3.66Å; Y298-Y402 HydrophobicContact CE2-CE2 3.66Å; Y298-Y402 HydrophobicContact CG-CD2 4.2Å; Y298-Y402 AromaticContact CG-CE2 3.68Å; Y298-Y402 HydrophobicContact CG-CE2 3.68Å; Y298-Y402 AromaticContact CZ-CE2 3.59Å; Y298-Y405 HydrophobicContact CE1-CE1 4.02Å
299	S	97.6	Very high	97.1	Very high	1 Å²	1	12.8 Å²	12.8	1%	0.007	8%	0.081	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.2	2.8	172.8	52.4	0	0	0	0	113.4	N232 P295 F296 T297 Q301 A302 S303	N232-S299 WeakPolarHBondContact OD1-CA 3.46Å; N232-S299 VanDerWaalsContact OD1-CB 3.25Å; N232-S299 WeakPolarHBondContact OD1-CB 3.21Å; P295-S299 WeakPolarHBondContact O-CB 3.38Å; P295-S299 PolarHBondContact O-OG 3.33Å; F296-S299 PolarHBondContact O-OG 3.17Å; T297-S299 VanDerWaalsContact C-N 3.3Å; S299-Q301 VanDerWaalsContact C-N 3.27Å; S299-Q301 PolarHBondContact O-N 2.83Å; S299-A302 PolarHBondContact O-N 3.28Å; S299-A302 VanDerWaalsContact O-N 3.12Å; S299-S303 PolarHBondContact O-N 3.28Å
300	L	97.7	Very high	97	Very high	2 Å²	2	14.2 Å²	14.2	1%	0.01	8%	0.083	C	C	.	.	H	α-helix	trans	-59.2	-35.2	-177	-74.5	172.2	0	0	0	113.1	L60 T297 F304 F401	L60-L300 HydrophobicContact CB-CD1 3.94Å; L60-L300 HydrophobicContact CB-CD2 3.93Å; L60-L300 HydrophobicContact CD1-CD1 4.07Å; L60-L300 HydrophobicContact CG-CD1 4.42Å; L60-L300 WeakPolarHBondContact O-CD2 3.36Å; T297-L300 WeakPolarHBondContact O-CB 3.28Å; T297-L300 VanDerWaalsContact O-CD1 3.25Å; T297-L300 WeakPolarHBondContact O-CD1 3.45Å; T297-L300 WeakPolarHBondContact O-CG 3.28Å; T297-L300 PolarHBondContact O-N 3.12Å; L300-F304 WeakPolarHBondContact O-CB 3.3Å; L300-F304 PolarHBondContact O-N 3.37Å; L300-F401 HydrophobicContact CD1-CD1 4.15Å
301	Q	98.2	Very high	96.6	Very high	1 Å²	1	19.1 Å²	19.1	1%	0.005	12%	0.119	C	C	.	.	H	α-helix	trans	-64.3	-44.9	177.4	-63.3	86.8	-14.5	0	0	111	V253 Y298 S299 L305 S389 P399	V253-Q301 HydrophobicContact CG1-CB 3.83Å; V253-Q301 HydrophobicContact CG2-CB 4.23Å; Y298-Q301 PolarHBondContact O-OE1 3.41Å; Y298-Q301 VanDerWaalsContact O-OE1 3.05Å; S299-Q301 VanDerWaalsContact C-N 3.27Å; S299-Q301 PolarHBondContact O-N 2.83Å; Q301-L305 VanDerWaalsContact O-CG 3.27Å; Q301-L305 WeakPolarHBondContact O-CG 3.45Å; Q301-L305 PolarHBondContact O-N 3.21Å; Q301-S389 PolarHBondContact NE2-OG 3.48Å; Q301-P399 HydrophobicContact CG-CB 4.35Å
302	A	98.1	Very high	96.4	Very high	0 Å²	0	20 Å²	20	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-67	-46.9	176.8	0	0	0	0	0	110.9	N232 M235 M250 V253 S299 F304 L305 V306	N232-A302 WeakPolarHBondContact OD1-CB 3.33Å; M235-A302 HydrophobicContact CB-CB 3.8Å; M235-A302 HydrophobicContact CG-CB 3.96Å; M250-A302 WeakPolarHBondContact CE-O 3.44Å; M250-A302 HydrophobicContact SD-CB 4.01Å; V253-A302 HydrophobicContact CG1-CB 4.34Å; S299-A302 PolarHBondContact O-N 3.28Å; S299-A302 VanDerWaalsContact O-N 3.12Å; A302-F304 VanDerWaalsContact C-N 3.33Å; A302-F304 PolarHBondContact O-N 3.36Å; A302-L305 PolarHBondContact O-N 3.48Å; A302-V306 PolarHBondContact O-N 3.06Å
303	S	97.5	Very high	96.3	Very high	1 Å²	1	23 Å²	23	1%	0.007	15%	0.145	C	C	.	.	H	α-helix	trans	-57.4	-45.5	175.9	-173	0	0	0	0	111.9	S64 S299 L305 V306	S64-S303 WeakPolarHBondContact OG-CB 3.21Å; S64-S303 PolarHBondContact OG-OG 2.89Å; S299-S303 PolarHBondContact O-N 3.28Å; S303-L305 PolarHBondContact O-N 3.38Å; S303-V306 WeakPolarHBondContact O-CB 3.39Å; S303-V306 PolarHBondContact O-N 3.49Å
304	F	97.8	Very high	96.2	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-59.4	-45.2	176.8	173.2	-94.7	0	0	0	111.9	A69 L300 A302 V306 A307 H308 Q310 C392 H396 L398 P399	A69-F304 HydrophobicContact CB-CD2 3.96Å; A69-F304 HydrophobicContact CB-CE2 3.68Å; L300-F304 WeakPolarHBondContact O-CB 3.3Å; L300-F304 PolarHBondContact O-N 3.37Å; A302-F304 VanDerWaalsContact C-N 3.33Å; A302-F304 PolarHBondContact O-N 3.36Å; F304-V306 PolarHBondContact O-N 3.47Å; F304-A307 PolarHBondContact O-N 2.97Å; F304-A307 VanDerWaalsContact O-N 3.12Å; F304-H308 HydrophobicContact CD1-CB 4.1Å; F304-H308 HydrophobicContact CD2-CB 4.08Å; F304-H308 AromaticContact CD2-CD2 3.54Å; F304-H308 AromaticContact CD2-CG 3.94Å; F304-H308 HydrophobicContact CE1-CB 3.66Å; F304-H308 HydrophobicContact CE2-CB 3.64Å; F304-H308 AromaticContact CE2-CD2 3.47Å; F304-H308 VanDerWaalsContact CE2-CD2 3.47Å; F304-H308 WeakPolarHBondContact CE2-CD2 3.45Å; F304-H308 AromaticContact CE2-CG 3.46Å; F304-H308 VanDerWaalsContact CE2-CG 3.46Å; F304-H308 HydrophobicContact CG-CB 4.3Å; F304-H308 HydrophobicContact CZ-CB 3.41Å; F304-H308 VanDerWaalsContact CZ-CB 3.41Å; F304-H308 AromaticContact CZ-CG 3.74Å; F304-H308 WeakPolarHBondContact O-CA 3.47Å; F304-H308 WeakPolarHBondContact O-CB 3Å; F304-H308 PolarHBondContact O-N 3.22Å; F304-Q310 HydrophobicContact CE1-CG 4.4Å; F304-C392 HydrophobicContact CD1-CB 3.76Å; F304-C392 HydrophobicContact CE1-CB 3.79Å; F304-H396 HydrophobicContact CE2-CB 3.82Å; F304-H396 AromaticContact CE2-CG 3.71Å; F304-H396 AromaticContact CE2-ND1 3.91Å; F304-H396 HydrophobicContact CZ-CB 3.94Å; F304-H396 AromaticContact CZ-CG 3.8Å; F304-H396 AromaticContact CZ-ND1 3.58Å; F304-L398 HydrophobicContact CD2-CD2 4.25Å; F304-P399 HydrophobicContact CB-CG 4.47Å; F304-P399 HydrophobicContact CD1-CG 3.75Å; F304-P399 HydrophobicContact CD2-CG 4.16Å; F304-P399 HydrophobicContact CE1-CG 3.95Å; F304-P399 HydrophobicContact CE2-CG 4.34Å; F304-P399 HydrophobicContact CG-CG 3.86Å; F304-P399 HydrophobicContact CZ-CG 4.24Å
305	L	97.6	Very high	96.1	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-64.1	-27.6	-179.5	-73.6	171.4	0	0	0	113.3	M250 V253 Q301 A302 S303 Q310	M250-L305 HydrophobicContact CB-CD1 4.44Å; M250-L305 HydrophobicContact CE-CB 3.64Å; V253-L305 HydrophobicContact CG2-CD1 3.88Å; Q301-L305 VanDerWaalsContact O-CG 3.27Å; Q301-L305 WeakPolarHBondContact O-CG 3.45Å; Q301-L305 PolarHBondContact O-N 3.21Å; A302-L305 PolarHBondContact O-N 3.48Å; S303-L305 PolarHBondContact O-N 3.38Å; L305-Q310 HydrophobicContact CD2-CB 3.95Å; L305-Q310 HydrophobicContact CD2-CG 3.75Å
306	V	97.1	Very high	96.1	Very high	12 Å²	12	35.4 Å²	35.4	7%	0.073	22%	0.22	C	C	.	.	H	α-helix	trans	-63.3	-41.6	173.4	178.2	0	0	0	0	111.2	M235 K238 E239 L242 R243 M250 A302 S303 F304	M235-V306 HydrophobicContact CB-CG2 3.79Å; M235-V306 HydrophobicContact CG-CG2 4.49Å; M235-V306 VanDerWaalsContact O-CG2 3.29Å; M235-V306 WeakPolarHBondContact O-CG2 3.37Å; M235-V306 HydrophobicContact SD-CG2 4.26Å; K238-V306 HydrophobicContact CB-CG1 4.35Å; K238-V306 HydrophobicContact CG-CG1 3.82Å; E239-V306 HydrophobicContact CB-CG2 4.43Å; L242-V306 HydrophobicContact CD1-CG1 4.05Å; R243-V306 PolarHBondContact NH1-O 2.75Å; R243-V306 PolarHBondContact NH2-O 2.92Å; M250-V306 HydrophobicContact CE-CG2 3.77Å; A302-V306 PolarHBondContact O-N 3.06Å; S303-V306 WeakPolarHBondContact O-CB 3.39Å; S303-V306 PolarHBondContact O-N 3.49Å; F304-V306 PolarHBondContact O-N 3.47Å
307	A	95.4	Very high	96.1	Very high	44 Å²	44	35.5 Å²	35.5	36%	0.364	22%	0.222	S	C	.	.	H	α-helix	trans	-86.7	-33.1	179.8	0	0	0	0	0	112.8	F304 P309	F304-A307 PolarHBondContact O-N 2.97Å; F304-A307 VanDerWaalsContact O-N 3.12Å; A307-P309 VanDerWaalsContact O-CD 3.28Å; A307-P309 WeakPolarHBondContact O-CD 3.22Å
308	H	95.6	Very high	96.1	Very high	21 Å²	21	40 Å²	40	10%	0.097	25%	0.249	C	C	.	.	S	Bend	trans	-122.6	75.8	-170.7	-64.9	-84	0	0	0	111.5	S66 A67 A69 F304 Q310	S66-H308 PolarHBondContact O-NE2 3.35Å; A67-H308 PolarHBondContact O-CE1 3.45Å; A67-H308 VanDerWaalsContact O-CE1 3.25Å; A69-H308 VanDerWaalsContact CB-NE2 3.3Å; A69-H308 WeakPolarHBondContact CB-NE2 3.29Å; F304-H308 HydrophobicContact CD1-CB 4.1Å; F304-H308 HydrophobicContact CD2-CB 4.08Å; F304-H308 AromaticContact CD2-CD2 3.54Å; F304-H308 AromaticContact CD2-CG 3.94Å; F304-H308 HydrophobicContact CE1-CB 3.66Å; F304-H308 HydrophobicContact CE2-CB 3.64Å; F304-H308 AromaticContact CE2-CD2 3.47Å; F304-H308 VanDerWaalsContact CE2-CD2 3.47Å; F304-H308 WeakPolarHBondContact CE2-CD2 3.45Å; F304-H308 AromaticContact CE2-CG 3.46Å; F304-H308 VanDerWaalsContact CE2-CG 3.46Å; F304-H308 HydrophobicContact CG-CB 4.3Å; F304-H308 HydrophobicContact CZ-CB 3.41Å; F304-H308 VanDerWaalsContact CZ-CB 3.41Å; F304-H308 AromaticContact CZ-CG 3.74Å; F304-H308 WeakPolarHBondContact O-CA 3.47Å; F304-H308 WeakPolarHBondContact O-CB 3Å; F304-H308 PolarHBondContact O-N 3.22Å; H308-Q310 WeakPolarHBondContact O-CG 3.32Å; H308-Q310 PolarHBondContact O-N 2.97Å; H308-Q310 PolarHBondContact O-NE2 2.94Å; H308-Q310 VanDerWaalsContact O-NE2 3.12Å
309	P	92.8	Very high	96.2	Very high	74 Å²	74	42.1 Å²	42.1	48%	0.481	27%	0.27	S	S	.	.			trans	-61.6	127.3	-175.7	20.4	-27.4	0	0	0	111.3	A307	A307-P309 VanDerWaalsContact O-CD 3.28Å; A307-P309 WeakPolarHBondContact O-CD 3.22Å
310	Q	93.3	Very high	96.2	Very high	47 Å²	47	42.3 Å²	42.3	22%	0.22	27%	0.271	C	S	.	.			trans	-110.8	132.8	179.1	-60.7	-55.8	-50.3	0	0	110.4	S249 F304 L305 H308 C392	S249-Q310 PolarHBondContact OG-O 3.31Å; F304-Q310 HydrophobicContact CE1-CG 4.4Å; L305-Q310 HydrophobicContact CD2-CB 3.95Å; L305-Q310 HydrophobicContact CD2-CG 3.75Å; H308-Q310 WeakPolarHBondContact O-CG 3.32Å; H308-Q310 PolarHBondContact O-N 2.97Å; H308-Q310 PolarHBondContact O-NE2 2.94Å; H308-Q310 VanDerWaalsContact O-NE2 3.12Å; Q310-C392 WeakPolarHBondContact CG-O 3.16Å
311	S	90.1	Very high	96.2	Very high	123 Å²	123	45.5 Å²	45.5	86%	0.86	29%	0.29	S	S	*	.			trans	-90.8	128.8	170.1	63	0	0	0	0	109.9
312	L	93.6	Very high	96.3	Very high	32 Å²	32	48.1 Å²	48.1	17%	0.168	31%	0.312	C	S	.	.			trans	-112.2	128.9	175.6	-75.7	172.3	0	0	0	109.8	L248 S249 L252 T316 I320 P391	L248-L312 HydrophobicContact CD2-CB 4.46Å; S249-L312 WeakPolarHBondContact OG-CD1 3.27Å; S249-L312 VanDerWaalsContact OG-CG 3.27Å; S249-L312 WeakPolarHBondContact OG-CG 3.45Å; L252-L312 HydrophobicContact CD1-CD1 4.1Å; L312-T316 HydrophobicContact CD2-CG2 3.92Å; L312-I320 HydrophobicContact CD2-CD1 4.23Å; L312-P391 HydrophobicContact CD1-CB 4.01Å
313	S	95.2	Very high	96.3	Very high	64 Å²	64	50.2 Å²	50.2	45%	0.448	32%	0.323	S	S	.	.			trans	-67.5	149.4	166.6	85.8	0	0	0	0	110	L315 T316 A317	S313-L315 PolarHBondContact O-N 2.94Å; S313-T316 PolarHBondContact O-N 3.33Å; S313-T316 VanDerWaalsContact O-N 3.15Å; S313-T316 PolarHBondContact OG-N 3.31Å; S313-T316 VanDerWaalsContact OG-N 3.12Å; S313-T316 PolarHBondContact OG-OG1 2.97Å; S313-A317 PolarHBondContact O-N 3.45Å
314	S	95.1	Very high	96.3	Very high	94 Å²	94	50.5 Å²	50.5	66%	0.657	33%	0.325	S	S	*	.	H	α-helix	trans	-58.9	-34.5	177.6	-51.2	0	0	0	0	112.4	A317 V318	S314-A317 PolarHBondContact O-N 2.92Å; S314-V318 WeakPolarHBondContact O-CG2 3.47Å; S314-V318 PolarHBondContact O-N 2.89Å
315	L	96.6	Very high	96.4	Very high	141 Å²	141	52.2 Å²	52.2	74%	0.738	34%	0.342	S	S	*	.	H	α-helix	trans	-65.4	-45.6	176.9	-179.1	61.7	0	0	0	111.6	S313 A317 V318 A319	S313-L315 PolarHBondContact O-N 2.94Å; L315-A317 VanDerWaalsContact C-N 3.32Å; L315-A317 PolarHBondContact O-N 3.38Å; L315-V318 PolarHBondContact O-N 2.9Å; L315-A319 PolarHBondContact O-N 2.82Å
316	T	96.4	Very high	96.4	Very high	62 Å²	62	55.7 Å²	55.7	38%	0.38	36%	0.364	S	S	.	.	H	α-helix	trans	-61.4	-43.4	175.7	-50.5	0	0	0	0	110.7	L312 S313 V318 A319 I320	L312-T316 HydrophobicContact CD2-CG2 3.92Å; S313-T316 PolarHBondContact O-N 3.33Å; S313-T316 VanDerWaalsContact O-N 3.15Å; S313-T316 PolarHBondContact OG-N 3.31Å; S313-T316 VanDerWaalsContact OG-N 3.12Å; S313-T316 PolarHBondContact OG-OG1 2.97Å; T316-V318 PolarHBondContact O-N 3.48Å; T316-A319 PolarHBondContact O-N 3.17Å; T316-I320 HydrophobicContact CG2-CD1 3.95Å; T316-I320 HydrophobicContact CG2-CG1 4.48Å; T316-I320 VanDerWaalsContact O-CG1 3.29Å; T316-I320 WeakPolarHBondContact O-CG1 3.48Å; T316-I320 PolarHBondContact O-N 3.22Å
317	A	97.4	Very high	96.5	Very high	9 Å²	9	55.1 Å²	55.1	7%	0.074	36%	0.36	C	S	.	.	H	α-helix	trans	-59.8	-45.1	176.5	0	0	0	0	0	112.2	L248 L252 S313 S314 L315 A319 I320 V321	L248-A317 HydrophobicContact CD2-CB 3.66Å; L248-A317 HydrophobicContact CG-CB 4.39Å; L252-A317 HydrophobicContact CD1-CB 4.02Å; S313-A317 PolarHBondContact O-N 3.45Å; S314-A317 PolarHBondContact O-N 2.92Å; L315-A317 VanDerWaalsContact C-N 3.32Å; L315-A317 PolarHBondContact O-N 3.38Å; A317-A319 VanDerWaalsContact C-N 3.35Å; A317-A319 PolarHBondContact O-N 3.16Å; A317-I320 PolarHBondContact O-N 3.4Å; A317-V321 VanDerWaalsContact O-CG2 3.29Å; A317-V321 WeakPolarHBondContact O-CG2 3.1Å; A317-V321 PolarHBondContact O-N 2.96Å
318	V	98.2	Very high	96.6	Very high	96 Å²	96	56 Å²	56	58%	0.582	35%	0.354	S	S	*	.	H	α-helix	trans	-61	-43.1	176.1	169.3	0	0	0	0	111.4	S314 L315 T316 V321 A322	S314-V318 WeakPolarHBondContact O-CG2 3.47Å; S314-V318 PolarHBondContact O-N 2.89Å; L315-V318 PolarHBondContact O-N 2.9Å; T316-V318 PolarHBondContact O-N 3.48Å; V318-V321 PolarHBondContact O-N 3.45Å; V318-A322 WeakPolarHBondContact O-CB 3.07Å; V318-A322 PolarHBondContact O-N 2.94Å
319	A	98.3	Very high	96.7	Very high	60 Å²	60	61 Å²	61	50%	0.496	37%	0.373	S	S	.	.	H	α-helix	trans	-62.9	-42.4	177.3	0	0	0	0	0	112.2	L315 T316 A317 A322 L323	L315-A319 PolarHBondContact O-N 2.82Å; T316-A319 PolarHBondContact O-N 3.17Å; A317-A319 VanDerWaalsContact C-N 3.35Å; A317-A319 PolarHBondContact O-N 3.16Å; A319-A322 PolarHBondContact O-N 3.12Å; A319-L323 PolarHBondContact O-N 3.08Å
320	I	98.4	Very high	97	Very high	6 Å²	6	58.5 Å²	58.5	3%	0.031	36%	0.356	C	S	.	.	H	α-helix	trans	-64.3	-44.1	176.2	-66.6	168.4	0	0	0	110.8	F256 L312 T316 A317 A322 L323 N324 A387 L390 P391	F256-I320 HydrophobicContact CE2-CG2 3.62Å; F256-I320 HydrophobicContact CZ-CG2 4.05Å; L312-I320 HydrophobicContact CD2-CD1 4.23Å; T316-I320 HydrophobicContact CG2-CD1 3.95Å; T316-I320 HydrophobicContact CG2-CG1 4.48Å; T316-I320 VanDerWaalsContact O-CG1 3.29Å; T316-I320 WeakPolarHBondContact O-CG1 3.48Å; T316-I320 PolarHBondContact O-N 3.22Å; A317-I320 PolarHBondContact O-N 3.4Å; I320-A322 VanDerWaalsContact C-N 3.32Å; I320-A322 PolarHBondContact O-N 2.7Å; I320-L323 WeakPolarHBondContact O-CB 3.35Å; I320-L323 PolarHBondContact O-N 2.88Å; I320-N324 PolarHBondContact O-N 3Å; I320-A387 HydrophobicContact CG2-CB 4.33Å; I320-A387 WeakPolarHBondContact CG2-O 3.49Å; I320-L390 HydrophobicContact CD1-CB 3.73Å; I320-L390 HydrophobicContact CG1-CB 3.84Å; I320-L390 HydrophobicContact CG1-CD1 4.15Å; I320-P391 HydrophobicContact CD1-CG 4.34Å; I320-P391 HydrophobicContact CG2-CG 4.23Å
321	V	98.6	Very high	97.1	Very high	68 Å²	68	57.4 Å²	57.4	41%	0.412	35%	0.35	S	S	.	.	H	α-helix	trans	-61.1	-42.3	176.1	170.4	0	0	0	0	111	L252 F256 A317 V318 N324 G325	L252-V321 HydrophobicContact CD2-CG2 3.71Å; F256-V321 HydrophobicContact CE1-CG2 4.09Å; F256-V321 HydrophobicContact CZ-CB 4.44Å; F256-V321 HydrophobicContact CZ-CG2 3.8Å; A317-V321 VanDerWaalsContact O-CG2 3.29Å; A317-V321 WeakPolarHBondContact O-CG2 3.1Å; A317-V321 PolarHBondContact O-N 2.96Å; V318-V321 PolarHBondContact O-N 3.45Å; V321-N324 PolarHBondContact O-N 3.22Å; V321-G325 PolarHBondContact O-N 2.75Å
322	A	98.6	Very high	97.4	Very high	56 Å²	56	53 Å²	53	46%	0.463	32%	0.315	S	S	.	.	H	α-helix	trans	-63.6	-40.2	176.1	0	0	0	0	0	112.1	V318 A319 I320 G325 T326	V318-A322 WeakPolarHBondContact O-CB 3.07Å; V318-A322 PolarHBondContact O-N 2.94Å; A319-A322 PolarHBondContact O-N 3.12Å; I320-A322 VanDerWaalsContact C-N 3.32Å; I320-A322 PolarHBondContact O-N 2.7Å; A322-G325 PolarHBondContact O-N 3.18Å; A322-T326 WeakPolarHBondContact O-CB 3.23Å; A322-T326 PolarHBondContact O-N 3.22Å; A322-T326 PolarHBondContact O-OG1 2.85Å
323	L	98.6	Very high	97.5	Very high	44 Å²	44	56.6 Å²	56.6	23%	0.23	33%	0.329	C	S	.	.	H	α-helix	trans	-62.4	-50.2	174.6	-178.5	66.7	0	0	0	111.4	A319 I320 G325 T326 G327 L383 L386 A387 L390	A319-L323 PolarHBondContact O-N 3.08Å; I320-L323 WeakPolarHBondContact O-CB 3.35Å; I320-L323 PolarHBondContact O-N 2.88Å; L323-G325 VanDerWaalsContact C-N 3.34Å; L323-G325 PolarHBondContact O-N 3.46Å; L323-T326 PolarHBondContact O-N 3.36Å; L323-G327 PolarHBondContact O-N 3.37Å; L323-L383 HydrophobicContact CD1-CB 4.48Å; L323-L383 HydrophobicContact CD1-CD2 3.96Å; L323-L386 HydrophobicContact CD2-CD2 4.17Å; L323-L386 HydrophobicContact CD2-CG 4.2Å; L323-A387 HydrophobicContact CB-CB 4.37Å; L323-A387 HydrophobicContact CD2-CB 4Å; L323-A387 HydrophobicContact CG-CB 4.11Å; L323-L390 HydrophobicContact CD2-CD1 3.57Å
324	N	98.4	Very high	97.5	Very high	8 Å²	8	53.5 Å²	53.5	4%	0.043	31%	0.307	C	S	.	.	H	α-helix	trans	-60.1	-44.8	177.3	-172.9	73.3	0	0	0	111.3	F256 I320 V321 T326 G327 Y328 A387 W388	F256-N324 HydrophobicContact CD1-CB 4.14Å; F256-N324 VanDerWaalsContact CD1-ND2 3.33Å; F256-N324 WeakPolarHBondContact CD1-ND2 3.47Å; F256-N324 HydrophobicContact CD2-CB 4.37Å; F256-N324 HydrophobicContact CE1-CB 3.97Å; F256-N324 HydrophobicContact CE2-CB 4.22Å; F256-N324 HydrophobicContact CG-CB 4.34Å; F256-N324 HydrophobicContact CZ-CB 4Å; I320-N324 PolarHBondContact O-N 3Å; V321-N324 PolarHBondContact O-N 3.22Å; N324-T326 VanDerWaalsContact C-N 3.33Å; N324-T326 PolarHBondContact O-N 3.38Å; N324-G327 PolarHBondContact O-N 2.96Å; N324-Y328 VanDerWaalsContact O-CB 3.31Å; N324-Y328 WeakPolarHBondContact O-CB 3.27Å; N324-Y328 PolarHBondContact O-N 3.42Å; N324-A387 HydrophobicContact CB-CB 3.68Å; N324-W388 PolarHBondContact OD1-NE1 3.07Å; N324-W388 VanDerWaalsContact OD1-NE1 3.13Å
325	G	98.4	Very high	97.5	Very high	36 Å²	36	50 Å²	50	37%	0.371	28%	0.281	S	S	.	.	H	α-helix	trans	-62.3	-38.6	177.6	0	0	0	0	0	112.9	V321 A322 L323 Y329	V321-G325 PolarHBondContact O-N 2.75Å; A322-G325 PolarHBondContact O-N 3.18Å; L323-G325 VanDerWaalsContact C-N 3.34Å; L323-G325 PolarHBondContact O-N 3.46Å; G325-Y329 VanDerWaalsContact O-CB 3.27Å; G325-Y329 WeakPolarHBondContact O-CB 3.37Å; G325-Y329 PolarHBondContact O-N 3.05Å
326	T	98.5	Very high	97.3	Very high	73 Å²	73	45.7 Å²	45.7	45%	0.448	26%	0.263	S	S	.	.	H	α-helix	trans	-65.9	-47.7	174.7	-58.3	0	0	0	0	111	A322 L323 N324 Y328 Y329 I330	A322-T326 WeakPolarHBondContact O-CB 3.23Å; A322-T326 PolarHBondContact O-N 3.22Å; A322-T326 PolarHBondContact O-OG1 2.85Å; L323-T326 PolarHBondContact O-N 3.36Å; N324-T326 VanDerWaalsContact C-N 3.33Å; N324-T326 PolarHBondContact O-N 3.38Å; T326-Y328 PolarHBondContact O-N 3.22Å; T326-Y329 PolarHBondContact O-N 2.99Å; T326-I330 HydrophobicContact CG2-CD1 4.03Å; T326-I330 WeakPolarHBondContact O-CG1 3.34Å; T326-I330 PolarHBondContact O-N 3.41Å
327	G	98.3	Very high	97.2	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-57.6	-49.3	175.5	0	0	0	0	0	112.1	L323 N324 Y329 I330 F331 G380	L323-G327 PolarHBondContact O-N 3.37Å; N324-G327 PolarHBondContact O-N 2.96Å; G327-Y329 PolarHBondContact O-N 3.17Å; G327-I330 PolarHBondContact O-N 3.27Å; G327-F331 WeakPolarHBondContact O-CB 3.26Å; G327-F331 PolarHBondContact O-N 2.95Å; G327-G380 CarbonylContact C-O 3.55Å; G327-G380 WeakPolarHBondContact CA-O 3.46Å; G327-G380 VanDerWaalsContact O-CA 3.25Å; G327-G380 WeakPolarHBondContact O-CA 3.41Å
328	Y	98.3	Very high	96.9	Very high	62 Å²	62	45.6 Å²	45.6	24%	0.243	26%	0.256	C	S	.	.	H	α-helix	trans	-59.3	-44.4	176.6	-179.3	-102.8	0	0	0	112.2	D263 N324 T326 I330 F331 R332 M384	D263-Y328 HydrophobicContact CB-CE2 4Å; D263-Y328 VanDerWaalsContact CG-CE2 3.47Å; D263-Y328 PolarHBondContact OD1-OH 2.88Å; N324-Y328 VanDerWaalsContact O-CB 3.31Å; N324-Y328 WeakPolarHBondContact O-CB 3.27Å; N324-Y328 PolarHBondContact O-N 3.42Å; T326-Y328 PolarHBondContact O-N 3.22Å; Y328-I330 PolarHBondContact O-N 2.9Å; Y328-F331 PolarHBondContact O-N 3.34Å; Y328-R332 HydrophobicContact CE1-CB 4.33Å; Y328-R332 HydrophobicContact CE1-CG 4.47Å; Y328-R332 HydrophobicContact CE2-CB 4.43Å; Y328-R332 WeakPolarHBondContact O-CB 3.43Å; Y328-R332 PolarHBondContact O-N 2.88Å; Y328-M384 VanDerWaalsContact CA-SD 3.57Å; Y328-M384 HydrophobicContact CD2-SD 4.06Å; Y328-M384 HydrophobicContact CG-SD 4.47Å
329	Y	98.1	Very high	96.4	Very high	127 Å²	127	43.3 Å²	43.3	50%	0.498	24%	0.241	S	C	.	.	H	α-helix	trans	-59.7	-48.5	178	179	-97.3	0	0	0	111.6	G325 T326 G327 K333 W369	G325-Y329 VanDerWaalsContact O-CB 3.27Å; G325-Y329 WeakPolarHBondContact O-CB 3.37Å; G325-Y329 PolarHBondContact O-N 3.05Å; T326-Y329 PolarHBondContact O-N 2.99Å; G327-Y329 PolarHBondContact O-N 3.17Å; Y329-K333 HydrophobicContact CD1-CG 4.43Å; Y329-K333 HydrophobicContact CD2-CG 3.86Å; Y329-K333 HydrophobicContact CE1-CG 4.22Å; Y329-K333 HydrophobicContact CE2-CD 4.24Å; Y329-K333 HydrophobicContact CE2-CG 3.63Å; Y329-K333 HydrophobicContact CG-CG 4.26Å; Y329-K333 WeakPolarHBondContact O-CB 3.28Å; Y329-K333 VanDerWaalsContact O-CG 3.28Å; Y329-K333 WeakPolarHBondContact O-CG 3.42Å; Y329-K333 PolarHBondContact O-N 2.87Å; Y329-W369 HydrophobicContact CD1-CH2 4.18Å; Y329-W369 HydrophobicContact CD1-CZ2 4.17Å; Y329-W369 AromaticContact CE1-CH2 3.9Å; Y329-W369 HydrophobicContact CE1-CH2 3.9Å; Y329-W369 AromaticContact CE1-CZ2 3.62Å; Y329-W369 HydrophobicContact CE1-CZ2 3.62Å
330	I	98	Very high	96.1	Very high	21 Å²	21	41.6 Å²	41.6	11%	0.108	22%	0.223	C	C	.	.	H	α-helix	trans	-61.8	-48.5	178	-65.1	168.7	0	0	0	110.3	T326 G327 Y328 S334 W369 P376 L383	T326-I330 HydrophobicContact CG2-CD1 4.03Å; T326-I330 WeakPolarHBondContact O-CG1 3.34Å; T326-I330 PolarHBondContact O-N 3.41Å; G327-I330 PolarHBondContact O-N 3.27Å; Y328-I330 PolarHBondContact O-N 2.9Å; I330-S334 VanDerWaalsContact O-CB 3.23Å; I330-S334 WeakPolarHBondContact O-CB 3.31Å; I330-S334 PolarHBondContact O-N 3.38Å; I330-S334 PolarHBondContact O-OG 2.94Å; I330-W369 HydrophobicContact CB-CZ3 4.37Å; I330-W369 HydrophobicContact CG1-CH2 3.94Å; I330-W369 HydrophobicContact CG1-CZ3 3.83Å; I330-W369 HydrophobicContact CG2-CE3 4.23Å; I330-W369 HydrophobicContact CG2-CZ3 4.1Å; I330-P376 VanDerWaalsContact CG2-O 3.26Å; I330-P376 WeakPolarHBondContact CG2-O 3.41Å; I330-L383 HydrophobicContact CD1-CD1 3.9Å
331	F	97	Very high	95.7	Very high	23 Å²	23	42.3 Å²	42.3	10%	0.101	23%	0.225	C	C	.	.	H	α-helix	trans	-58.1	-53	179.7	171.8	-99.2	0	0	0	111.8	G327 Y328 S334 N335 N377 D381 M384	G327-F331 WeakPolarHBondContact O-CB 3.26Å; G327-F331 PolarHBondContact O-N 2.95Å; Y328-F331 PolarHBondContact O-N 3.34Å; F331-S334 PolarHBondContact O-OG 2.83Å; F331-S334 VanDerWaalsContact O-OG 3.11Å; F331-N335 VanDerWaalsContact CE2-ND2 3.35Å; F331-N335 WeakPolarHBondContact CE2-ND2 3.3Å; F331-N335 WeakPolarHBondContact O-CB 3.18Å; F331-N335 PolarHBondContact O-N 3.14Å; F331-N335 PolarHBondContact O-ND2 3.11Å; F331-N377 HydrophobicContact CD2-CB 4.08Å; F331-N377 WeakPolarHBondContact CD2-O 3.38Å; F331-N377 HydrophobicContact CE2-CB 4.5Å; F331-D381 VanDerWaalsContact CD2-CG 3.41Å; F331-D381 WeakPolarHBondContact CD2-OD1 3.36Å; F331-D381 WeakPolarHBondContact CD2-OD2 3.17Å; F331-D381 WeakPolarHBondContact CE2-OD1 3.4Å; F331-D381 VanDerWaalsContact CE2-OD2 3.26Å; F331-D381 WeakPolarHBondContact CE2-OD2 3.42Å; F331-M384 HydrophobicContact CB-CE 3.82Å; F331-M384 HydrophobicContact CD1-CE 4.16Å; F331-M384 HydrophobicContact CD2-CE 4.33Å; F331-M384 HydrophobicContact CG-CE 3.85Å
332	R	95.4	Very high	95.1	Very high	32 Å²	32	46.4 Å²	46.4	12%	0.121	23%	0.233	C	C	.	.	H	α-helix	trans	-71.8	-45.3	-174.2	-178.9	47.9	58.3	-167.3	-3	111.3	D263 N267 Y328 N335 S336	D263-R332 PolarHBondContact O-NH2 2.98Å; D263-R332 IonicContact OD1-CZ 3.37Å; D263-R332 IonicContact OD1-NE 3.32Å; D263-R332 PolarHBondContact OD1-NE 2.63Å; D263-R332 IonicContact OD1-NH2 2.69Å; D263-R332 PolarHBondContact OD1-NH2 2.7Å; D263-R332 VanDerWaalsContact OD1-NH2 3.08Å; D263-R332 IonicContact OD2-CZ 3.57Å; D263-R332 IonicContact OD2-NE 3.91Å; D263-R332 PolarHBondContact OD2-NE 3.26Å; D263-R332 IonicContact OD2-NH2 3.28Å; D263-R332 PolarHBondContact OD2-NH2 2.95Å; N267-R332 VanDerWaalsContact CG-CZ 3.43Å; N267-R332 PolarHBondContact ND2-NH1 3.45Å; N267-R332 VanDerWaalsContact ND2-NH1 3.19Å; N267-R332 PolarHBondContact ND2-NH2 3.17Å; N267-R332 VanDerWaalsContact ND2-NH2 3.12Å; N267-R332 PolarHBondContact OD1-NH1 2.93Å; Y328-R332 HydrophobicContact CE1-CB 4.33Å; Y328-R332 HydrophobicContact CE1-CG 4.47Å; Y328-R332 HydrophobicContact CE2-CB 4.43Å; Y328-R332 WeakPolarHBondContact O-CB 3.43Å; Y328-R332 PolarHBondContact O-N 2.88Å; R332-N335 PolarHBondContact O-N 3.17Å; R332-S336 WeakPolarHBondContact O-CB 3.33Å; R332-S336 PolarHBondContact O-N 2.88Å; R332-S336 PolarHBondContact O-OG 3.38Å; R332-S336 VanDerWaalsContact O-OG 3.11Å
333	K	95.8	Very high	94.5	Very high	106 Å²	106	52.9 Å²	52.9	46%	0.461	25%	0.246	S	C	.	.	H	α-helix	trans	-66.9	-40.3	-179.4	-70.5	-65.2	-171.9	-178.8	0	112.5	Y329 S336 Q337 W369	Y329-K333 HydrophobicContact CD1-CG 4.43Å; Y329-K333 HydrophobicContact CD2-CG 3.86Å; Y329-K333 HydrophobicContact CE1-CG 4.22Å; Y329-K333 HydrophobicContact CE2-CD 4.24Å; Y329-K333 HydrophobicContact CE2-CG 3.63Å; Y329-K333 HydrophobicContact CG-CG 4.26Å; Y329-K333 WeakPolarHBondContact O-CB 3.28Å; Y329-K333 VanDerWaalsContact O-CG 3.28Å; Y329-K333 WeakPolarHBondContact O-CG 3.42Å; Y329-K333 PolarHBondContact O-N 2.87Å; K333-S336 PolarHBondContact O-N 3.31Å; K333-Q337 WeakPolarHBondContact O-CB 3.33Å; K333-Q337 PolarHBondContact O-N 3.24Å; K333-W369 HydrophobicContact CB-CZ2 4.25Å
334	S	95.8	Very high	94	Very high	0 Å²	0	53.4 Å²	53.4	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-66	-41	177.2	62.7	0	0	0	0	112.4	I330 F331 Q337 K338 W370 N377	I330-S334 VanDerWaalsContact O-CB 3.23Å; I330-S334 WeakPolarHBondContact O-CB 3.31Å; I330-S334 PolarHBondContact O-N 3.38Å; I330-S334 PolarHBondContact O-OG 2.94Å; F331-S334 PolarHBondContact O-OG 2.83Å; F331-S334 VanDerWaalsContact O-OG 3.11Å; S334-Q337 PolarHBondContact O-N 3.12Å; S334-K338 PolarHBondContact O-N 2.89Å; S334-K338 VanDerWaalsContact O-N 3.08Å; S334-W370 PolarHBondContact O-NE1 3.33Å; S334-N377 PolarHBondContact OG-N 3.25Å
335	N	94.1	Very high	93.5	Very high	19 Å²	19	56 Å²	56	10%	0.102	27%	0.266	C	S	.	.	H	α-helix	trans	-66.2	-45	174.3	-83.5	-49.9	0	0	0	112.4	F331 R332 Q337 K338 N339	F331-N335 VanDerWaalsContact CE2-ND2 3.35Å; F331-N335 WeakPolarHBondContact CE2-ND2 3.3Å; F331-N335 WeakPolarHBondContact O-CB 3.18Å; F331-N335 PolarHBondContact O-N 3.14Å; F331-N335 PolarHBondContact O-ND2 3.11Å; R332-N335 PolarHBondContact O-N 3.17Å; N335-Q337 VanDerWaalsContact C-N 3.3Å; N335-Q337 PolarHBondContact O-N 3.06Å; N335-K338 PolarHBondContact O-N 3.26Å; N335-K338 WeakPolarHBondContact OD1-CE 3.5Å; N335-K338 PolarHBondContact OD1-NZ 3.16Å; N335-N339 WeakPolarHBondContact O-CB 3.21Å; N335-N339 PolarHBondContact O-N 3.1Å; N335-N339 PolarHBondContact O-OD1 3.29Å
336	S	92.4	Very high	93.1	Very high	52 Å²	52	59.5 Å²	59.5	36%	0.364	28%	0.28	S	S	.	.	H	α-helix	trans	-60	-39.3	175.2	-69	0	0	0	0	112.2	R332 K333 N339 Q340	R332-S336 WeakPolarHBondContact O-CB 3.33Å; R332-S336 PolarHBondContact O-N 2.88Å; R332-S336 PolarHBondContact O-OG 3.38Å; R332-S336 VanDerWaalsContact O-OG 3.11Å; K333-S336 PolarHBondContact O-N 3.31Å; S336-N339 PolarHBondContact O-N 3.43Å; S336-Q340 VanDerWaalsContact O-CB 3.27Å; S336-Q340 WeakPolarHBondContact O-CB 3.4Å; S336-Q340 PolarHBondContact O-N 2.96Å
337	Q	94.3	Very high	92.9	Very high	31 Å²	31	59.3 Å²	59.3	15%	0.145	27%	0.274	C	S	.	.	H	α-helix	trans	-61.5	-49.1	175.2	-176.8	175	66.4	0	0	111.5	K333 S334 N335 F341 V350 L353 L365 W370	K333-Q337 WeakPolarHBondContact O-CB 3.33Å; K333-Q337 PolarHBondContact O-N 3.24Å; S334-Q337 PolarHBondContact O-N 3.12Å; N335-Q337 VanDerWaalsContact C-N 3.3Å; N335-Q337 PolarHBondContact O-N 3.06Å; Q337-F341 VanDerWaalsContact O-CB 3.29Å; Q337-F341 WeakPolarHBondContact O-CB 3.49Å; Q337-F341 PolarHBondContact O-N 3.04Å; Q337-V350 HydrophobicContact CG-CG1 4.3Å; Q337-L353 HydrophobicContact CG-CD1 3.68Å; Q337-L365 HydrophobicContact CG-CD1 4.47Å; Q337-W370 VanDerWaalsContact OE1-CD1 3.3Å
338	K	91.2	Very high	92.6	Very high	37 Å²	37	64.6 Å²	64.6	16%	0.161	31%	0.308	C	S	.	.	H	α-helix	trans	-61.1	-45.1	176.3	175.8	-178	62.7	-169.2	0	112.1	S334 N335 F341 R342 W370	S334-K338 PolarHBondContact O-N 2.89Å; S334-K338 VanDerWaalsContact O-N 3.08Å; N335-K338 PolarHBondContact O-N 3.26Å; N335-K338 WeakPolarHBondContact OD1-CE 3.5Å; N335-K338 PolarHBondContact OD1-NZ 3.16Å; K338-F341 PolarHBondContact O-N 3.43Å; K338-R342 WeakPolarHBondContact O-CB 3.4Å; K338-R342 WeakPolarHBondContact O-CG 3.47Å; K338-R342 PolarHBondContact O-N 3.23Å; K338-W370 HydrophobicContact CB-CZ2 3.65Å; K338-W370 HydrophobicContact CD-CH2 3.71Å; K338-W370 HydrophobicContact CD-CZ2 3.6Å; K338-W370 HydrophobicContact CG-CZ2 4.14Å
339	N	88.9	Confident	92.3	Very high	49 Å²	49	65.1 Å²	65.1	26%	0.262	32%	0.321	S	S	.	.	H	α-helix	trans	-67.9	-44.6	-176.9	-70.2	-7	0	0	0	111.3	N335 S336 F341 R342 R343	N335-N339 WeakPolarHBondContact O-CB 3.21Å; N335-N339 PolarHBondContact O-N 3.1Å; N335-N339 PolarHBondContact O-OD1 3.29Å; S336-N339 PolarHBondContact O-N 3.43Å; N339-F341 VanDerWaalsContact C-N 3.35Å; N339-F341 PolarHBondContact O-N 3.39Å; N339-R342 PolarHBondContact O-N 3.26Å; N339-R343 WeakPolarHBondContact O-CB 3.19Å; N339-R343 PolarHBondContact O-N 2.81Å
340	Q	90.6	Very high	92.1	Very high	24 Å²	24	59.2 Å²	59.2	11%	0.112	30%	0.298	C	S	.	.	H	α-helix	trans	-60.2	-46.5	174.6	-178.9	60.1	43.5	0	0	110.9	S336 R342 R343 D344 H347 V350	S336-Q340 VanDerWaalsContact O-CB 3.27Å; S336-Q340 WeakPolarHBondContact O-CB 3.4Å; S336-Q340 PolarHBondContact O-N 2.96Å; Q340-R342 VanDerWaalsContact C-N 3.35Å; Q340-R342 PolarHBondContact O-N 3.5Å; Q340-R343 PolarHBondContact O-N 3.18Å; Q340-D344 CarbonylContact O-C 3.19Å; Q340-D344 PolarHBondContact O-N 3.01Å; Q340-H347 HydrophobicContact CG-CB 4.17Å; Q340-V350 HydrophobicContact CB-CG1 4.1Å; Q340-V350 HydrophobicContact CG-CG1 3.96Å; Q340-V350 HydrophobicContact CG-CG2 4.05Å
341	F	91.5	Very high	91.7	Very high	20 Å²	20	61.5 Å²	61.5	9%	0.088	32%	0.317	C	S	.	.	H	α-helix	trans	-60.8	-41.2	178.3	176.8	-102.9	0	0	0	113	Q337 K338 N339 R343 P345 V350 T355 R363 L365	Q337-F341 VanDerWaalsContact O-CB 3.29Å; Q337-F341 WeakPolarHBondContact O-CB 3.49Å; Q337-F341 PolarHBondContact O-N 3.04Å; K338-F341 PolarHBondContact O-N 3.43Å; N339-F341 VanDerWaalsContact C-N 3.35Å; N339-F341 PolarHBondContact O-N 3.39Å; F341-R343 VanDerWaalsContact C-N 3.32Å; F341-R343 PolarHBondContact O-N 2.89Å; F341-P345 HydrophobicContact CD2-CB 4.16Å; F341-P345 HydrophobicContact CE2-CB 4.04Å; F341-P345 WeakPolarHBondContact O-CD 3.45Å; F341-P345 VanDerWaalsContact O-CG 3.29Å; F341-P345 WeakPolarHBondContact O-CG 3.3Å; F341-V350 HydrophobicContact CB-CB 4.39Å; F341-V350 HydrophobicContact CB-CG1 4.37Å; F341-V350 HydrophobicContact CB-CG2 4.44Å; F341-T355 HydrophobicContact CE2-CG2 3.56Å; F341-T355 HydrophobicContact CZ-CG2 3.5Å; F341-R363 HydrophobicContact CE1-CB 4.27Å; F341-R363 WeakPolarHBondContact CE1-O 3.46Å; F341-R363 HydrophobicContact CZ-CB 3.69Å; F341-L365 HydrophobicContact CB-CD1 3.81Å; F341-L365 HydrophobicContact CB-CD2 4.34Å; F341-L365 HydrophobicContact CB-CG 4.33Å; F341-L365 HydrophobicContact CD1-CD1 3.81Å; F341-L365 HydrophobicContact CD1-CD2 4.05Å; F341-L365 HydrophobicContact CD1-CG 3.62Å; F341-L365 HydrophobicContact CD2-CD2 3.61Å; F341-L365 HydrophobicContact CD2-CG 4.14Å; F341-L365 HydrophobicContact CE1-CD2 4.22Å; F341-L365 HydrophobicContact CE1-CG 3.85Å; F341-L365 HydrophobicContact CE2-CD2 3.79Å; F341-L365 HydrophobicContact CE2-CG 4.34Å; F341-L365 HydrophobicContact CG-CD1 3.79Å; F341-L365 HydrophobicContact CG-CD2 3.73Å; F341-L365 HydrophobicContact CG-CG 3.76Å; F341-L365 HydrophobicContact CZ-CD2 4.07Å; F341-L365 HydrophobicContact CZ-CG 4.18Å
342	R	85.7	Confident	91.5	Very high	154 Å²	154	64 Å²	64	58%	0.581	35%	0.348	S	S	*	.	H	α-helix	trans	-68.5	-31.1	176.8	-74.4	176.4	176.8	-176	-1.6	112.9	K338 N339 Q340	K338-R342 WeakPolarHBondContact O-CB 3.4Å; K338-R342 WeakPolarHBondContact O-CG 3.47Å; K338-R342 PolarHBondContact O-N 3.23Å; N339-R342 PolarHBondContact O-N 3.26Å; Q340-R342 VanDerWaalsContact C-N 3.35Å; Q340-R342 PolarHBondContact O-N 3.5Å
343	R	84.9	Confident	91.4	Very high	193 Å²	193	64 Å²	64	73%	0.728	35%	0.351	S	S	*	.	H	α-helix	trans	-80	-50.1	-180	-178.8	174.9	68	175.1	4	112.1	N339 Q340 F341	N339-R343 WeakPolarHBondContact O-CB 3.19Å; N339-R343 PolarHBondContact O-N 2.81Å; Q340-R343 PolarHBondContact O-N 3.18Å; F341-R343 VanDerWaalsContact C-N 3.32Å; F341-R343 PolarHBondContact O-N 2.89Å
344	D	87.9	Confident	91.3	Very high	54 Å²	54	63.8 Å²	63.8	29%	0.289	35%	0.351	S	S	.	.			trans	-149.4	97.1	-178.7	174.8	13.1	0	0	0	109.7	Q340 T346 H347	Q340-D344 CarbonylContact O-C 3.19Å; Q340-D344 PolarHBondContact O-N 3.01Å; D344-T346 PolarHBondContact O-N 3.42Å; D344-T346 WeakPolarHBondContact OD1-CA 3.48Å; D344-T346 WeakPolarHBondContact OD1-CB 3.41Å; D344-T346 PolarHBondContact OD1-N 3.35Å; D344-T346 PolarHBondContact OD1-OG1 2.74Å; D344-H347 HydrophobicContact CB-CB 4.41Å; D344-H347 WeakPolarHBondContact O-CB 3.45Å; D344-H347 PolarHBondContact O-N 2.91Å; D344-H347 PolarHBondContact OD1-N 3.19Å
345	P	88.4	Confident	91.3	Very high	62 Å²	62	65.9 Å²	65.9	40%	0.403	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65	-16.5	176.4	-17.5	27.8	0	0	0	114.3	F341	F341-P345 HydrophobicContact CD2-CB 4.16Å; F341-P345 HydrophobicContact CE2-CB 4.04Å; F341-P345 WeakPolarHBondContact O-CD 3.45Å; F341-P345 VanDerWaalsContact O-CG 3.29Å; F341-P345 WeakPolarHBondContact O-CG 3.3Å
346	T	91	Very high	91.3	Very high	110 Å²	110	66.6 Å²	66.6	68%	0.675	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.8	-10.1	-177.2	69.7	0	0	0	0	113	D344	D344-T346 PolarHBondContact O-N 3.42Å; D344-T346 WeakPolarHBondContact OD1-CA 3.48Å; D344-T346 WeakPolarHBondContact OD1-CB 3.41Å; D344-T346 PolarHBondContact OD1-N 3.35Å; D344-T346 PolarHBondContact OD1-OG1 2.74Å
347	H	92.9	Very high	91.3	Very high	70 Å²	70	67.6 Å²	67.6	32%	0.324	38%	0.379	S	S	.	.	S	Bend	trans	-59.5	136.5	-179.3	-171.8	-88.6	0	0	0	111.8	Q340 D344 S349 V350 S351	Q340-H347 HydrophobicContact CG-CB 4.17Å; D344-H347 HydrophobicContact CB-CB 4.41Å; D344-H347 WeakPolarHBondContact O-CB 3.45Å; D344-H347 PolarHBondContact O-N 2.91Å; D344-H347 PolarHBondContact OD1-N 3.19Å; H347-S349 PolarHBondContact CE1-OG 2.91Å; H347-S349 PolarHBondContact ND1-N 3.47Å; H347-S349 PolarHBondContact ND1-OG 3.11Å; H347-S349 PolarHBondContact O-N 3.16Å; H347-V350 HydrophobicContact CB-CG2 4.15Å; H347-V350 WeakPolarHBondContact O-CG2 3.29Å; H347-V350 PolarHBondContact O-N 3.05Å; H347-S351 WeakPolarHBondContact O-CB 3.36Å; H347-S351 PolarHBondContact O-N 3.26Å; H347-S351 PolarHBondContact O-OG 3.01Å
348	P	93.4	Very high	91.2	Very high	110 Å²	110	66.7 Å²	66.7	71%	0.714	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54	-29.6	-174.2	-29.5	35.2	0	0	0	115.5	V350	P348-V350 VanDerWaalsContact C-N 3.27Å; P348-V350 PolarHBondContact O-N 3.27Å
349	S	92.1	Very high	91.1	Very high	73 Å²	73	70.3 Å²	70.3	51%	0.51	41%	0.413	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.6	-14.4	179.3	67.9	0	0	0	0	114.9	H347	H347-S349 PolarHBondContact CE1-OG 2.91Å; H347-S349 PolarHBondContact ND1-N 3.47Å; H347-S349 PolarHBondContact ND1-OG 3.11Å; H347-S349 PolarHBondContact O-N 3.16Å
350	V	93.2	Very high	90.8	Very high	3 Å²	3	71.4 Å²	71.4	2%	0.018	42%	0.421	C	S	.	.	T	Hydrogen-bonded Turn	trans	-132.9	-12.6	-177.6	-62.4	0	0	0	0	113.6	Q337 Q340 F341 H347 P348 G352 L353	Q337-V350 HydrophobicContact CG-CG1 4.3Å; Q340-V350 HydrophobicContact CB-CG1 4.1Å; Q340-V350 HydrophobicContact CG-CG1 3.96Å; Q340-V350 HydrophobicContact CG-CG2 4.05Å; F341-V350 HydrophobicContact CB-CB 4.39Å; F341-V350 HydrophobicContact CB-CG1 4.37Å; F341-V350 HydrophobicContact CB-CG2 4.44Å; H347-V350 HydrophobicContact CB-CG2 4.15Å; H347-V350 WeakPolarHBondContact O-CG2 3.29Å; H347-V350 PolarHBondContact O-N 3.05Å; P348-V350 VanDerWaalsContact C-N 3.27Å; P348-V350 PolarHBondContact O-N 3.27Å; V350-G352 VanDerWaalsContact C-N 3.26Å; V350-G352 PolarHBondContact O-N 3.21Å; V350-L353 HydrophobicContact CB-CD1 3.87Å; V350-L353 HydrophobicContact CG1-CD1 3.96Å; V350-L353 VanDerWaalsContact O-CB 3.27Å; V350-L353 WeakPolarHBondContact O-CB 3.47Å; V350-L353 WeakPolarHBondContact O-CG 3.48Å; V350-L353 PolarHBondContact O-N 2.88Å
351	S	89.9	Confident	90.5	Very high	70 Å²	70	73.7 Å²	73.7	49%	0.49	45%	0.451	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-28.9	-176.6	59.7	0	0	0	0	113.6	H347 L353	H347-S351 WeakPolarHBondContact O-CB 3.36Å; H347-S351 PolarHBondContact O-N 3.26Å; H347-S351 PolarHBondContact O-OG 3.01Å; S351-L353 VanDerWaalsContact C-N 3.28Å; S351-L353 PolarHBondContact O-N 3.42Å
352	G	91.5	Very high	90.2	Very high	74 Å²	74	78.4 Å²	78.4	76%	0.763	47%	0.472	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.3	-1.2	174.1	0	0	0	0	0	114.7	V350	V350-G352 VanDerWaalsContact C-N 3.26Å; V350-G352 PolarHBondContact O-N 3.21Å
353	L	93.6	Very high	90.4	Very high	34 Å²	34	78.5 Å²	78.5	18%	0.178	47%	0.472	C	S	.	.	S	Bend	trans	-79.8	132.6	179.7	-61.9	174.2	0	0	0	110.7	Q337 V350 S351 L365 S367	Q337-L353 HydrophobicContact CG-CD1 3.68Å; V350-L353 HydrophobicContact CB-CD1 3.87Å; V350-L353 HydrophobicContact CG1-CD1 3.96Å; V350-L353 VanDerWaalsContact O-CB 3.27Å; V350-L353 WeakPolarHBondContact O-CB 3.47Å; V350-L353 WeakPolarHBondContact O-CG 3.48Å; V350-L353 PolarHBondContact O-N 2.88Å; S351-L353 VanDerWaalsContact C-N 3.28Å; S351-L353 PolarHBondContact O-N 3.42Å; L353-L365 HydrophobicContact CB-CD2 3.83Å; L353-L365 HydrophobicContact CD1-CD2 3.74Å; L353-L365 HydrophobicContact CG-CD2 4.44Å; L353-S367 WeakPolarHBondContact CA-OG 3.45Å; L353-S367 WeakPolarHBondContact CB-OG 2.97Å
354	E	95.1	Very high	90.8	Very high	101 Å²	101	70.2 Å²	70.2	47%	0.472	44%	0.442	S	S	.	.			trans	-65.7	142	171.7	-58.9	177	119.4	0	0	111	V366 S367 R435	E354-V366 HydrophobicContact CB-CG2 3.84Å; E354-V366 PolarHBondContact O-N 3.08Å; E354-S367 PolarHBondContact N-OG 3.28Å; E354-S367 PolarHBondContact O-OG 2.9Å; E354-R435 IonicContact OE1-CZ 3.64Å; E354-R435 IonicContact OE1-NH2 2.86Å; E354-R435 PolarHBondContact OE1-NH2 2.99Å; E354-R435 IonicContact OE2-CZ 3.99Å; E354-R435 IonicContact OE2-NH2 2.6Å; E354-R435 PolarHBondContact OE2-NH2 2.98Å
355	T	95.1	Very high	91.1	Very high	44 Å²	44	68.3 Å²	68.3	27%	0.27	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	158.3	-178.4	58.7	0	0	0	0	112.4	F341 R363 L364 L365	F341-T355 HydrophobicContact CE2-CG2 3.56Å; F341-T355 HydrophobicContact CZ-CG2 3.5Å; T355-R363 HydrophobicContact CG2-CB 4.42Å; T355-L364 CarbonylContact C-O 3.58Å; T355-L364 WeakPolarHBondContact CA-O 3.45Å; T355-L364 VanDerWaalsContact CB-O 3.27Å; T355-L364 WeakPolarHBondContact CB-O 3.48Å; T355-L365 HydrophobicContact CG2-CD2 4.02Å
356	I	94.3	Very high	91.4	Very high	33 Å²	33	65.5 Å²	65.5	17%	0.169	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	126.3	167.9	-65.4	174.5	0	0	0	108.5	R363 L364 V366 A428 A431	I356-R363 CarbonylContact O-C 3.58Å; I356-R363 VanDerWaalsContact O-CA 3.29Å; I356-R363 WeakPolarHBondContact O-CA 3.48Å; I356-L364 HydrophobicContact CB-CB 4.42Å; I356-L364 PolarHBondContact N-O 2.96Å; I356-L364 PolarHBondContact O-N 3.06Å; I356-V366 HydrophobicContact CB-CG1 4.29Å; I356-V366 HydrophobicContact CD1-CG1 3.63Å; I356-V366 HydrophobicContact CG1-CG1 3.63Å; I356-V366 HydrophobicContact CG1-CG2 4.4Å; I356-A428 HydrophobicContact CG2-CB 4.06Å; I356-A431 HydrophobicContact CD1-CB 4.14Å
357	A	92.7	Very high	91.5	Very high	73 Å²	73	61.1 Å²	61.1	60%	0.603	39%	0.387	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.5	142	173.7	0	0	0	0	0	111.1
358	T	92	Very high	91.5	Very high	13 Å²	13	60 Å²	60	8%	0.08	39%	0.394	C	S	.	.			trans	-112.7	155.1	178.9	72.3	0	0	0	0	110.9	T360 G361 K362 L364 Y425 A428	T358-T360 PolarHBondContact O-N 2.65Å; T358-T360 VanDerWaalsContact O-N 3.11Å; T358-T360 PolarHBondContact OG1-OG1 3.46Å; T358-G361 PolarHBondContact O-N 2.78Å; T358-K362 PolarHBondContact N-O 2.76Å; T358-K362 PolarHBondContact OG1-N 2.73Å; T358-K362 PolarHBondContact OG1-O 3.29Å; T358-L364 HydrophobicContact CG2-CD1 4.03Å; T358-L364 HydrophobicContact CG2-CD2 4.32Å; T358-L364 HydrophobicContact CG2-CG 3.73Å; T358-Y425 HydrophobicContact CG2-CD1 3.58Å; T358-Y425 HydrophobicContact CG2-CE1 4.07Å; T358-Y425 HydrophobicContact CG2-CG 4.21Å; T358-A428 HydrophobicContact CG2-CB 4.01Å
359	A	87.9	Confident	91.6	Very high	113 Å²	113	58 Å²	58	93%	0.934	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	-19.1	174.6	0	0	0	0	0	113.3	G361	A359-G361 PolarHBondContact O-N 3.44Å
360	T	83.9	Confident	91.8	Very high	72 Å²	72	55.6 Å²	55.6	44%	0.442	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.2	4.7	176	53.5	0	0	0	0	113.7	T358 K362 Y425	T358-T360 PolarHBondContact O-N 2.65Å; T358-T360 VanDerWaalsContact O-N 3.11Å; T358-T360 PolarHBondContact OG1-OG1 3.46Å; T360-K362 PolarHBondContact O-N 3.08Å; T360-Y425 WeakPolarHBondContact OG1-CE1 3.29Å
361	G	83.9	Confident	91.8	Very high	72 Å²	72	56.6 Å²	56.6	74%	0.742	36%	0.363	S	S	*	.	S	Bend	trans	74.4	2.7	-176.1	0	0	0	0	0	114.1	T358 A359	T358-G361 PolarHBondContact O-N 2.78Å; A359-G361 PolarHBondContact O-N 3.44Å
362	K	85.8	Confident	92	Very high	119 Å²	119	56.8 Å²	56.8	52%	0.517	36%	0.358	S	S	.	.			trans	-91.3	172.3	174.2	-61.4	-165.7	179.2	-168.8	0	110.1	T358 T360 Y425	T358-K362 PolarHBondContact N-O 2.76Å; T358-K362 PolarHBondContact OG1-N 2.73Å; T358-K362 PolarHBondContact OG1-O 3.29Å; T360-K362 PolarHBondContact O-N 3.08Å; K362-Y425 HydrophobicContact CB-CE1 4.43Å
363	R	90	Very high	92.3	Very high	155 Å²	155	53.3 Å²	53.3	59%	0.585	32%	0.322	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-129	145.1	177.3	-69.1	-177	177.8	-169	-0.6	109.8	F341 T355 I356	F341-R363 HydrophobicContact CE1-CB 4.27Å; F341-R363 WeakPolarHBondContact CE1-O 3.46Å; F341-R363 HydrophobicContact CZ-CB 3.69Å; T355-R363 HydrophobicContact CG2-CB 4.42Å; I356-R363 CarbonylContact O-C 3.58Å; I356-R363 VanDerWaalsContact O-CA 3.29Å; I356-R363 WeakPolarHBondContact O-CA 3.48Å
364	L	92.6	Very high	92.4	Very high	19 Å²	19	52.3 Å²	52.3	10%	0.099	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	130.5	175.9	-58	176.2	0	0	0	108.9	T355 I356 T358 Y425 W429	T355-L364 CarbonylContact C-O 3.58Å; T355-L364 WeakPolarHBondContact CA-O 3.45Å; T355-L364 VanDerWaalsContact CB-O 3.27Å; T355-L364 WeakPolarHBondContact CB-O 3.48Å; I356-L364 HydrophobicContact CB-CB 4.42Å; I356-L364 PolarHBondContact N-O 2.96Å; I356-L364 PolarHBondContact O-N 3.06Å; T358-L364 HydrophobicContact CG2-CD1 4.03Å; T358-L364 HydrophobicContact CG2-CD2 4.32Å; T358-L364 HydrophobicContact CG2-CG 3.73Å; L364-Y425 HydrophobicContact CD2-CD2 4.1Å; L364-Y425 HydrophobicContact CD2-CE1 4.47Å; L364-Y425 HydrophobicContact CD2-CE2 3.95Å; L364-Y425 HydrophobicContact CD2-CG 4.45Å; L364-W429 HydrophobicContact CD1-CE3 3.87Å; L364-W429 HydrophobicContact CD1-CZ3 4.35Å; L364-W429 HydrophobicContact CD2-CZ3 4.43Å
365	L	93.4	Very high	92.5	Very high	14 Å²	14	47.8 Å²	47.8	7%	0.073	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	130.5	174.1	-76	170.5	0	0	0	109.7	Q337 F341 L353 T355 W370 Y432	Q337-L365 HydrophobicContact CG-CD1 4.47Å; F341-L365 HydrophobicContact CB-CD1 3.81Å; F341-L365 HydrophobicContact CB-CD2 4.34Å; F341-L365 HydrophobicContact CB-CG 4.33Å; F341-L365 HydrophobicContact CD1-CD1 3.81Å; F341-L365 HydrophobicContact CD1-CD2 4.05Å; F341-L365 HydrophobicContact CD1-CG 3.62Å; F341-L365 HydrophobicContact CD2-CD2 3.61Å; F341-L365 HydrophobicContact CD2-CG 4.14Å; F341-L365 HydrophobicContact CE1-CD2 4.22Å; F341-L365 HydrophobicContact CE1-CG 3.85Å; F341-L365 HydrophobicContact CE2-CD2 3.79Å; F341-L365 HydrophobicContact CE2-CG 4.34Å; F341-L365 HydrophobicContact CG-CD1 3.79Å; F341-L365 HydrophobicContact CG-CD2 3.73Å; F341-L365 HydrophobicContact CG-CG 3.76Å; F341-L365 HydrophobicContact CZ-CD2 4.07Å; F341-L365 HydrophobicContact CZ-CG 4.18Å; L353-L365 HydrophobicContact CB-CD2 3.83Å; L353-L365 HydrophobicContact CD1-CD2 3.74Å; L353-L365 HydrophobicContact CG-CD2 4.44Å; T355-L365 HydrophobicContact CG2-CD2 4.02Å; L365-W370 HydrophobicContact CB-CB 3.96Å; L365-W370 HydrophobicContact CB-CG 4.27Å; L365-W370 HydrophobicContact CD1-CG 4.42Å; L365-Y432 WeakPolarHBondContact O-CE2 3.32Å
366	V	94.9	Very high	92.5	Very high	4 Å²	4	45.8 Å²	45.8	2%	0.024	28%	0.283	C	S	.	.			trans	-129.4	16.3	-177.7	-50.2	0	0	0	0	113.7	E354 I356 G371 Y432	E354-V366 HydrophobicContact CB-CG2 3.84Å; E354-V366 PolarHBondContact O-N 3.08Å; I356-V366 HydrophobicContact CB-CG1 4.29Å; I356-V366 HydrophobicContact CD1-CG1 3.63Å; I356-V366 HydrophobicContact CG1-CG1 3.63Å; I356-V366 HydrophobicContact CG1-CG2 4.4Å; V366-G371 WeakPolarHBondContact O-CA 3.34Å; V366-Y432 HydrophobicContact CB-CD2 4.2Å; V366-Y432 HydrophobicContact CB-CE2 4.3Å; V366-Y432 HydrophobicContact CG1-CD2 3.39Å; V366-Y432 HydrophobicContact CG1-CE2 3.79Å; V366-Y432 HydrophobicContact CG1-CG 4.5Å
367	S	93.8	Very high	92.6	Very high	18 Å²	18	44.8 Å²	44.8	13%	0.126	28%	0.278	C	S	.	.	S	Bend	trans	-142	173.4	-179.8	60.9	0	0	0	0	110.1	L353 E354 G371	L353-S367 WeakPolarHBondContact CA-OG 3.45Å; L353-S367 WeakPolarHBondContact CB-OG 2.97Å; E354-S367 PolarHBondContact N-OG 3.28Å; E354-S367 PolarHBondContact O-OG 2.9Å; S367-G371 PolarHBondContact O-N 3.35Å
368	G	92.7	Very high	92.8	Very high	45 Å²	45	42.5 Å²	42.5	46%	0.464	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	66.1	-139.2	-170.9	0	0	0	0	0	111.1	W370 G371 L372	G368-W370 VanDerWaalsContact C-N 3.3Å; G368-W370 PolarHBondContact O-N 3.35Å; G368-G371 PolarHBondContact O-N 3.23Å; G368-L372 PolarHBondContact O-N 3.35Å
369	W	95	Very high	93.1	Very high	70 Å²	70	43.1 Å²	43.1	27%	0.265	26%	0.256	S	S	.	.	H	α-helix	trans	-62	-40	179.2	-63.5	105.5	0	0	0	112.4	Y329 I330 K333 G371 L372 V373 P376	Y329-W369 HydrophobicContact CD1-CH2 4.18Å; Y329-W369 HydrophobicContact CD1-CZ2 4.17Å; Y329-W369 AromaticContact CE1-CH2 3.9Å; Y329-W369 HydrophobicContact CE1-CH2 3.9Å; Y329-W369 AromaticContact CE1-CZ2 3.62Å; Y329-W369 HydrophobicContact CE1-CZ2 3.62Å; I330-W369 HydrophobicContact CB-CZ3 4.37Å; I330-W369 HydrophobicContact CG1-CH2 3.94Å; I330-W369 HydrophobicContact CG1-CZ3 3.83Å; I330-W369 HydrophobicContact CG2-CE3 4.23Å; I330-W369 HydrophobicContact CG2-CZ3 4.1Å; K333-W369 HydrophobicContact CB-CZ2 4.25Å; W369-G371 PolarHBondContact O-N 2.81Å; W369-L372 PolarHBondContact O-N 2.68Å; W369-V373 PolarHBondContact O-N 3.14Å; W369-P376 HydrophobicContact CB-CB 3.91Å; W369-P376 HydrophobicContact CB-CG 3.76Å
370	W	95.9	Very high	93.5	Very high	22 Å²	22	37.7 Å²	37.7	8%	0.083	21%	0.212	C	C	.	.	H	α-helix	trans	-78.1	-3.6	-179.4	-56	89.7	0	0	0	113.1	S334 Q337 K338 L365 G368 R374 P376 N377 Y432	S334-W370 PolarHBondContact O-NE1 3.33Å; Q337-W370 VanDerWaalsContact OE1-CD1 3.3Å; K338-W370 HydrophobicContact CB-CZ2 3.65Å; K338-W370 HydrophobicContact CD-CH2 3.71Å; K338-W370 HydrophobicContact CD-CZ2 3.6Å; K338-W370 HydrophobicContact CG-CZ2 4.14Å; L365-W370 HydrophobicContact CB-CB 3.96Å; L365-W370 HydrophobicContact CB-CG 4.27Å; L365-W370 HydrophobicContact CD1-CG 4.42Å; G368-W370 VanDerWaalsContact C-N 3.3Å; G368-W370 PolarHBondContact O-N 3.35Å; W370-R374 WeakPolarHBondContact CZ3-O 3.38Å; W370-P376 HydrophobicContact CD2-CG 4.07Å; W370-P376 HydrophobicContact CE3-CG 4.28Å; W370-P376 HydrophobicContact CG-CG 4.49Å; W370-P376 HydrophobicContact CH2-CG 4.45Å; W370-P376 HydrophobicContact CZ2-CG 4.27Å; W370-P376 HydrophobicContact CZ3-CG 4.48Å; W370-N377 WeakPolarHBondContact CH2-OD1 3.37Å; W370-Y432 PolarHBondContact O-OH 3.05Å
371	G	94.5	Very high	94.2	Very high	24 Å²	24	34.8 Å²	34.8	25%	0.247	19%	0.193	C	C	.	.	H	α-helix	trans	-93.8	-19.8	169.8	0	0	0	0	0	113.7	V366 S367 G368 W369	V366-G371 WeakPolarHBondContact O-CA 3.34Å; S367-G371 PolarHBondContact O-N 3.35Å; G368-G371 PolarHBondContact O-N 3.23Å; W369-G371 PolarHBondContact O-N 2.81Å
372	L	94.1	Very high	94.8	Very high	74 Å²	74	31.9 Å²	31.9	39%	0.387	16%	0.161	S	C	.	.	H	α-helix	trans	-83.6	-50.3	179.7	179.8	64.3	0	0	0	111.3	G368 W369 P442	G368-L372 PolarHBondContact O-N 3.35Å; W369-L372 PolarHBondContact O-N 2.68Å; L372-P442 HydrophobicContact CD1-CB 4.29Å; L372-P442 HydrophobicContact CG-CB 4.34Å
373	V	96.5	Very high	95.4	Very high	1 Å²	1	28.3 Å²	28.3	1%	0.006	15%	0.147	C	C	.	.			trans	-141	156.3	175.8	-65.8	0	0	0	0	108.7	W369 H375 P376 Y438 P442	W369-V373 PolarHBondContact O-N 3.14Å; V373-H375 VanDerWaalsContact C-N 3.32Å; V373-H375 PolarHBondContact O-N 2.62Å; V373-P376 HydrophobicContact CG2-CB 3.78Å; V373-P376 WeakPolarHBondContact O-CD 3.27Å; V373-Y438 CarbonylContact C-O 3.24Å; V373-Y438 WeakPolarHBondContact CA-O 3.4Å; V373-P442 HydrophobicContact CG1-CB 3.86Å; V373-P442 HydrophobicContact CG1-CG 4.4Å
374	R	96.4	Very high	95.8	Very high	13 Å²	13	21 Å²	21	5%	0.049	12%	0.12	C	C	.	.	S	Bend	trans	-73.1	-24.7	-179	-62.8	-165.4	-67	-99.1	8.3	113.2	W370 E418 Y432 V436 P437 Y438 R439	W370-R374 WeakPolarHBondContact CZ3-O 3.38Å; R374-E418 IonicContact CZ-OE1 2.78Å; R374-E418 IonicContact NE-OE1 2.64Å; R374-E418 PolarHBondContact NE-OE1 2.65Å; R374-E418 IonicContact NH2-OE1 2.99Å; R374-E418 PolarHBondContact NH2-OE1 2.84Å; R374-Y432 HydrophobicContact CB-CE1 4.13Å; R374-Y432 VanDerWaalsContact CD-CE1 3.47Å; R374-Y432 HydrophobicContact CG-CD1 4.39Å; R374-Y432 HydrophobicContact CG-CE1 3.62Å; R374-V436 WeakPolarHBondContact CD-O 3.44Å; R374-V436 HydrophobicContact CG-CB 4.02Å; R374-V436 HydrophobicContact CG-CG1 3.73Å; R374-V436 WeakPolarHBondContact CG-O 3.25Å; R374-V436 PolarHBondContact NH1-O 2.96Å; R374-P437 VanDerWaalsContact NH1-C 3.31Å; R374-P437 PolarHBondContact NH1-O 3.22Å; R374-Y438 PolarHBondContact N-O 3.06Å; R374-R439 PolarHBondContact N-O 3.37Å
375	H	96.3	Very high	96.1	Very high	6 Å²	6	20.1 Å²	20.1	3%	0.028	12%	0.115	C	C	.	.			trans	-130.7	66.4	179.1	-64.8	-86.3	0	0	0	112.9	V373 N377 Y378 L379 E414 D417 R439 I440	V373-H375 VanDerWaalsContact C-N 3.32Å; V373-H375 PolarHBondContact O-N 2.62Å; H375-N377 PolarHBondContact O-N 2.91Å; H375-Y378 HydrophobicContact CB-CD2 3.39Å; H375-Y378 HydrophobicContact CB-CE2 3.95Å; H375-Y378 HydrophobicContact CB-CG 3.78Å; H375-Y378 AromaticContact CE1-CE2 3.93Å; H375-Y378 AromaticContact CG-CD2 3.6Å; H375-Y378 AromaticContact CG-CE2 3.64Å; H375-Y378 AromaticContact ND1-CD2 3.71Å; H375-Y378 AromaticContact ND1-CE2 3.28Å; H375-Y378 VanDerWaalsContact ND1-CE2 3.28Å; H375-Y378 WeakPolarHBondContact ND1-CE2 3.34Å; H375-Y378 AromaticContact ND1-CZ 3.74Å; H375-Y378 PolarHBondContact O-N 3.46Å; H375-Y378 VanDerWaalsContact O-N 3.08Å; H375-L379 PolarHBondContact O-N 3.36Å; H375-E414 WeakPolarHBondContact CD2-CG 3.49Å; H375-D417 IonicContact CE1-OD2 2.81Å; H375-D417 PolarHBondContact CE1-OD2 3.39Å; H375-D417 VanDerWaalsContact CE1-OD2 3.27Å; H375-D417 IonicContact NE2-OD2 3.93Å; H375-R439 WeakPolarHBondContact CB-O 3.27Å; H375-R439 PolarHBondContact N-O 3.26Å; H375-I440 HydrophobicContact CB-CG1 4.33Å
376	P	97	Very high	96.3	Very high	2 Å²	2	22.4 Å²	22.4	1%	0.013	13%	0.127	C	C	.	.	H	α-helix	trans	-63.2	-29.7	180	27.6	-36.6	0	0	0	112.3	I330 W369 W370 V373 Y378 L379 G380	I330-P376 VanDerWaalsContact CG2-O 3.26Å; I330-P376 WeakPolarHBondContact CG2-O 3.41Å; W369-P376 HydrophobicContact CB-CB 3.91Å; W369-P376 HydrophobicContact CB-CG 3.76Å; W370-P376 HydrophobicContact CD2-CG 4.07Å; W370-P376 HydrophobicContact CE3-CG 4.28Å; W370-P376 HydrophobicContact CG-CG 4.49Å; W370-P376 HydrophobicContact CH2-CG 4.45Å; W370-P376 HydrophobicContact CZ2-CG 4.27Å; W370-P376 HydrophobicContact CZ3-CG 4.48Å; V373-P376 HydrophobicContact CG2-CB 3.78Å; V373-P376 WeakPolarHBondContact O-CD 3.27Å; P376-Y378 VanDerWaalsContact C-N 3.33Å; P376-Y378 PolarHBondContact O-N 3.16Å; P376-L379 WeakPolarHBondContact O-CB 3.39Å; P376-L379 PolarHBondContact O-N 3.08Å; P376-G380 PolarHBondContact O-N 3.46Å; P376-G380 VanDerWaalsContact O-N 3.08Å
377	N	95.8	Very high	96.5	Very high	11 Å²	11	22.2 Å²	22.2	6%	0.059	13%	0.126	C	C	.	.	H	α-helix	trans	-63.5	-38.4	174.9	58.5	-61.2	0	0	0	111.8	F331 S334 W370 H375 L379 G380 D381	F331-N377 HydrophobicContact CD2-CB 4.08Å; F331-N377 WeakPolarHBondContact CD2-O 3.38Å; F331-N377 HydrophobicContact CE2-CB 4.5Å; S334-N377 PolarHBondContact OG-N 3.25Å; W370-N377 WeakPolarHBondContact CH2-OD1 3.37Å; H375-N377 PolarHBondContact O-N 2.91Å; N377-L379 VanDerWaalsContact C-N 3.33Å; N377-L379 PolarHBondContact O-N 3.35Å; N377-G380 PolarHBondContact O-N 2.85Å; N377-D381 WeakPolarHBondContact O-CB 3.4Å; N377-D381 PolarHBondContact O-N 3.5Å
378	Y	97.1	Very high	96.7	Very high	25 Å²	25	21.4 Å²	21.4	10%	0.098	12%	0.12	C	C	.	.	H	α-helix	trans	-67.4	-35.6	176.8	-63.9	-10.6	0	0	0	111.8	H375 P376 D381 L382 L410 E414 I440	H375-Y378 HydrophobicContact CB-CD2 3.39Å; H375-Y378 HydrophobicContact CB-CE2 3.95Å; H375-Y378 HydrophobicContact CB-CG 3.78Å; H375-Y378 AromaticContact CE1-CE2 3.93Å; H375-Y378 AromaticContact CG-CD2 3.6Å; H375-Y378 AromaticContact CG-CE2 3.64Å; H375-Y378 AromaticContact ND1-CD2 3.71Å; H375-Y378 AromaticContact ND1-CE2 3.28Å; H375-Y378 VanDerWaalsContact ND1-CE2 3.28Å; H375-Y378 WeakPolarHBondContact ND1-CE2 3.34Å; H375-Y378 AromaticContact ND1-CZ 3.74Å; H375-Y378 PolarHBondContact O-N 3.46Å; H375-Y378 VanDerWaalsContact O-N 3.08Å; P376-Y378 VanDerWaalsContact C-N 3.33Å; P376-Y378 PolarHBondContact O-N 3.16Å; Y378-D381 WeakPolarHBondContact O-CB 3.22Å; Y378-D381 PolarHBondContact O-N 2.93Å; Y378-L382 WeakPolarHBondContact O-CG 3.34Å; Y378-L382 PolarHBondContact O-N 2.81Å; Y378-L410 HydrophobicContact CD1-CD2 3.7Å; Y378-L410 HydrophobicContact CD2-CB 4.45Å; Y378-L410 HydrophobicContact CD2-CD2 4.31Å; Y378-L410 HydrophobicContact CE1-CD2 3.99Å; Y378-L410 HydrophobicContact CG-CB 4.48Å; Y378-L410 HydrophobicContact CG-CD1 4.46Å; Y378-L410 HydrophobicContact CG-CD2 3.9Å; Y378-E414 HydrophobicContact CD2-CB 4.3Å; Y378-E414 HydrophobicContact CE2-CB 4.05Å; Y378-I440 HydrophobicContact CD2-CD1 4.26Å; Y378-I440 HydrophobicContact CD2-CG1 4.43Å
379	L	97.4	Very high	96.9	Very high	26 Å²	26	19.3 Å²	19.3	14%	0.136	10%	0.098	C	C	.	.	H	α-helix	trans	-61.3	-47.4	172.1	178.3	63.4	0	0	0	111.5	H375 P376 N377 D381 L382 L383 I440 F441	H375-L379 PolarHBondContact O-N 3.36Å; P376-L379 WeakPolarHBondContact O-CB 3.39Å; P376-L379 PolarHBondContact O-N 3.08Å; N377-L379 VanDerWaalsContact C-N 3.33Å; N377-L379 PolarHBondContact O-N 3.35Å; L379-D381 VanDerWaalsContact C-N 3.32Å; L379-D381 PolarHBondContact O-N 3.37Å; L379-L382 PolarHBondContact O-N 2.84Å; L379-L383 WeakPolarHBondContact O-CG 2.91Å; L379-L383 PolarHBondContact O-N 3.03Å; L379-L383 VanDerWaalsContact O-N 3.09Å; L379-I440 HydrophobicContact CB-CG2 4.34Å; L379-F441 HydrophobicContact CD1-CD1 3.87Å; L379-F441 HydrophobicContact CD1-CE1 4.08Å
380	G	97.6	Very high	97.1	Very high	0 Å²	0	17.3 Å²	17.3	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-59.4	-42.8	176.8	0	0	0	0	0	112.7	G327 P376 N377 L383 M384	G327-G380 CarbonylContact C-O 3.55Å; G327-G380 WeakPolarHBondContact CA-O 3.46Å; G327-G380 VanDerWaalsContact O-CA 3.25Å; G327-G380 WeakPolarHBondContact O-CA 3.41Å; P376-G380 PolarHBondContact O-N 3.46Å; P376-G380 VanDerWaalsContact O-N 3.08Å; N377-G380 PolarHBondContact O-N 2.85Å; G380-L383 PolarHBondContact O-N 3.41Å; G380-M384 WeakPolarHBondContact O-CG 3.48Å; G380-M384 PolarHBondContact O-N 2.86Å; G380-M384 VanDerWaalsContact O-N 3.07Å
381	D	96.8	Very high	97.2	Very high	10 Å²	10	16.2 Å²	16.2	5%	0.053	9%	0.088	C	C	.	.	H	α-helix	trans	-58.5	-44.3	174.7	-87.3	-22.2	0	0	0	112.6	F331 N377 Y378 L379 M384 A385 F406 L410	F331-D381 VanDerWaalsContact CD2-CG 3.41Å; F331-D381 WeakPolarHBondContact CD2-OD1 3.36Å; F331-D381 WeakPolarHBondContact CD2-OD2 3.17Å; F331-D381 WeakPolarHBondContact CE2-OD1 3.4Å; F331-D381 VanDerWaalsContact CE2-OD2 3.26Å; F331-D381 WeakPolarHBondContact CE2-OD2 3.42Å; N377-D381 WeakPolarHBondContact O-CB 3.4Å; N377-D381 PolarHBondContact O-N 3.5Å; Y378-D381 WeakPolarHBondContact O-CB 3.22Å; Y378-D381 PolarHBondContact O-N 2.93Å; L379-D381 VanDerWaalsContact C-N 3.32Å; L379-D381 PolarHBondContact O-N 3.37Å; D381-M384 PolarHBondContact O-N 3Å; D381-M384 VanDerWaalsContact OD1-CE 3.26Å; D381-M384 WeakPolarHBondContact OD1-CE 3.13Å; D381-A385 WeakPolarHBondContact O-CB 3.33Å; D381-A385 PolarHBondContact O-N 3.47Å; D381-F406 HydrophobicContact CB-CE1 3.78Å; D381-F406 HydrophobicContact CB-CZ 4.26Å; D381-L410 HydrophobicContact CB-CD1 4.19Å
382	L	98	Very high	97.3	Very high	12 Å²	12	15.1 Å²	15.1	6%	0.063	8%	0.076	C	C	.	.	H	α-helix	trans	-68.4	-34.5	178	-71.1	175.2	0	0	0	113.4	Y378 L379 A385 L386 F406 T407 L410 I440 F441	Y378-L382 WeakPolarHBondContact O-CG 3.34Å; Y378-L382 PolarHBondContact O-N 2.81Å; L379-L382 PolarHBondContact O-N 2.84Å; L382-A385 PolarHBondContact O-N 3.31Å; L382-L386 PolarHBondContact O-N 2.94Å; L382-F406 HydrophobicContact CD2-CD1 4.08Å; L382-T407 WeakPolarHBondContact CD2-OG1 3.42Å; L382-L410 HydrophobicContact CD1-CD1 4.33Å; L382-L410 HydrophobicContact CD2-CD1 3.82Å; L382-L410 HydrophobicContact CG-CD1 3.74Å; L382-I440 HydrophobicContact CD1-CG2 4.15Å; L382-F441 HydrophobicContact CD1-CE1 4.15Å; L382-F441 HydrophobicContact CD1-CE2 4.31Å; L382-F441 HydrophobicContact CD1-CZ 3.57Å
383	L	98.3	Very high	97.4	Very high	43 Å²	43	12.2 Å²	12.2	23%	0.225	7%	0.065	C	C	.	.	H	α-helix	trans	-66.3	-41.5	174.2	-67.5	174.5	0	0	0	111.4	L323 I330 L379 G380 A387	L323-L383 HydrophobicContact CD1-CB 4.48Å; L323-L383 HydrophobicContact CD1-CD2 3.96Å; I330-L383 HydrophobicContact CD1-CD1 3.9Å; L379-L383 WeakPolarHBondContact O-CG 2.91Å; L379-L383 PolarHBondContact O-N 3.03Å; L379-L383 VanDerWaalsContact O-N 3.09Å; G380-L383 PolarHBondContact O-N 3.41Å; L383-A387 WeakPolarHBondContact O-CB 3.35Å; L383-A387 PolarHBondContact O-N 3.39Å
384	M	98.4	Very high	97.3	Very high	2 Å²	2	20 Å²	20	1%	0.01	10%	0.099	C	C	.	.	H	α-helix	trans	-63.5	-46.9	172.7	-69.7	-174.4	-66.2	0	0	110.8	Y260 Y328 F331 G380 D381 L386 A387 W388	Y260-M384 HydrophobicContact CD2-CE 3.93Å; Y260-M384 HydrophobicContact CD2-SD 4.27Å; Y260-M384 HydrophobicContact CE2-CE 3.92Å; Y328-M384 VanDerWaalsContact CA-SD 3.57Å; Y328-M384 HydrophobicContact CD2-SD 4.06Å; Y328-M384 HydrophobicContact CG-SD 4.47Å; F331-M384 HydrophobicContact CB-CE 3.82Å; F331-M384 HydrophobicContact CD1-CE 4.16Å; F331-M384 HydrophobicContact CD2-CE 4.33Å; F331-M384 HydrophobicContact CG-CE 3.85Å; G380-M384 WeakPolarHBondContact O-CG 3.48Å; G380-M384 PolarHBondContact O-N 2.86Å; G380-M384 VanDerWaalsContact O-N 3.07Å; D381-M384 PolarHBondContact O-N 3Å; D381-M384 VanDerWaalsContact OD1-CE 3.26Å; D381-M384 WeakPolarHBondContact OD1-CE 3.13Å; M384-L386 VanDerWaalsContact C-N 3.29Å; M384-L386 PolarHBondContact O-N 3.48Å; M384-A387 CarbonylContact O-C 3.59Å; M384-A387 WeakPolarHBondContact O-CA 3.35Å; M384-A387 WeakPolarHBondContact O-CB 3.43Å; M384-A387 PolarHBondContact O-N 3.07Å; M384-W388 HydrophobicContact CB-CZ2 3.88Å; M384-W388 PolarHBondContact O-N 2.93Å; M384-W388 PolarHBondContact O-NE1 2.87Å
385	A	97.8	Very high	97	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-54.5	-45	177.8	0	0	0	0	0	112.6	D381 L382 W388 S389 Y402 F406	D381-A385 WeakPolarHBondContact O-CB 3.33Å; D381-A385 PolarHBondContact O-N 3.47Å; L382-A385 PolarHBondContact O-N 3.31Å; A385-W388 PolarHBondContact O-N 3.46Å; A385-S389 PolarHBondContact O-N 3.3Å; A385-Y402 HydrophobicContact CB-CD1 3.81Å; A385-Y402 HydrophobicContact CB-CE1 3.38Å; A385-F406 HydrophobicContact CB-CD1 3.92Å
386	L	98.3	Very high	96.9	Very high	62 Å²	62	25 Å²	25	33%	0.325	13%	0.131	S	C	.	.	H	α-helix	trans	-62.6	-46.1	174	179.9	60.5	0	0	0	111.4	L323 L382 M384 W388 S389 L390 Y400	L323-L386 HydrophobicContact CD2-CD2 4.17Å; L323-L386 HydrophobicContact CD2-CG 4.2Å; L382-L386 PolarHBondContact O-N 2.94Å; M384-L386 VanDerWaalsContact C-N 3.29Å; M384-L386 PolarHBondContact O-N 3.48Å; L386-W388 PolarHBondContact O-N 3.19Å; L386-S389 PolarHBondContact O-N 3.38Å; L386-S389 VanDerWaalsContact O-N 3.07Å; L386-L390 HydrophobicContact CD1-CD2 4.36Å; L386-L390 HydrophobicContact CD1-CG 4.26Å; L386-L390 HydrophobicContact CG-CD1 4.14Å; L386-L390 HydrophobicContact CG-CG 4.28Å; L386-L390 WeakPolarHBondContact O-CG 3.48Å; L386-L390 PolarHBondContact O-N 3.14Å; L386-L390 VanDerWaalsContact O-N 3.09Å; L386-Y400 HydrophobicContact CD1-CD1 4.48Å; L386-Y400 HydrophobicContact CD1-CE1 4.22Å
387	A	98.3	Very high	96.8	Very high	0 Å²	0	30 Å²	30	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-62	-25.6	179.2	0	0	0	0	0	113.7	I320 L323 N324 L383 M384 P391	I320-A387 HydrophobicContact CG2-CB 4.33Å; I320-A387 WeakPolarHBondContact CG2-O 3.49Å; L323-A387 HydrophobicContact CB-CB 4.37Å; L323-A387 HydrophobicContact CD2-CB 4Å; L323-A387 HydrophobicContact CG-CB 4.11Å; N324-A387 HydrophobicContact CB-CB 3.68Å; L383-A387 WeakPolarHBondContact O-CB 3.35Å; L383-A387 PolarHBondContact O-N 3.39Å; M384-A387 CarbonylContact O-C 3.59Å; M384-A387 WeakPolarHBondContact O-CA 3.35Å; M384-A387 WeakPolarHBondContact O-CB 3.43Å; M384-A387 PolarHBondContact O-N 3.07Å; A387-P391 WeakPolarHBondContact O-CD 3.31Å
388	W	98	Very high	96.8	Very high	2 Å²	2	29.6 Å²	29.6	1%	0.008	16%	0.155	C	C	.	.	H	α-helix	trans	-75.7	-28.2	175.5	-54.1	-11.1	0	0	0	112.6	W228 F256 Q257 Y260 N324 M384 A385 L386 P391 Y402	W228-W388 HydrophobicContact CH2-CE3 4.41Å; W228-W388 HydrophobicContact CH2-CH2 4.05Å; W228-W388 AromaticContact CH2-CZ3 3.71Å; W228-W388 HydrophobicContact CH2-CZ3 3.71Å; W228-W388 HydrophobicContact CZ2-CZ3 4.21Å; F256-W388 VanDerWaalsContact CB-CD1 3.47Å; F256-W388 HydrophobicContact CB-CG 4.45Å; F256-W388 AromaticContact CD2-CD1 3.9Å; Q257-W388 HydrophobicContact CG-CD2 3.99Å; Q257-W388 HydrophobicContact CG-CE3 4.06Å; Q257-W388 HydrophobicContact CG-CG 4.23Å; Y260-W388 AromaticContact CD1-CH2 3.95Å; Y260-W388 HydrophobicContact CD1-CH2 3.95Å; Y260-W388 AromaticContact CD2-CH2 3.69Å; Y260-W388 HydrophobicContact CD2-CH2 3.69Å; Y260-W388 AromaticContact CD2-CZ2 3.65Å; Y260-W388 HydrophobicContact CD2-CZ2 3.65Å; Y260-W388 HydrophobicContact CE1-CH2 4.33Å; Y260-W388 HydrophobicContact CE2-CH2 4.09Å; Y260-W388 HydrophobicContact CE2-CZ2 4.37Å; Y260-W388 AromaticContact CG-CH2 3.61Å; Y260-W388 HydrophobicContact CG-CH2 3.61Å; Y260-W388 AromaticContact CG-CZ2 3.73Å; Y260-W388 HydrophobicContact CG-CZ2 3.73Å; N324-W388 PolarHBondContact OD1-NE1 3.07Å; N324-W388 VanDerWaalsContact OD1-NE1 3.13Å; M384-W388 HydrophobicContact CB-CZ2 3.88Å; M384-W388 PolarHBondContact O-N 2.93Å; M384-W388 PolarHBondContact O-NE1 2.87Å; A385-W388 PolarHBondContact O-N 3.46Å; L386-W388 PolarHBondContact O-N 3.19Å; W388-P391 WeakPolarHBondContact O-CD 3.27Å; W388-Y402 HydrophobicContact CD2-CE1 4.49Å; W388-Y402 HydrophobicContact CE3-CD1 4.16Å; W388-Y402 AromaticContact CE3-CE1 3.43Å; W388-Y402 HydrophobicContact CE3-CE1 3.43Å; W388-Y402 VanDerWaalsContact CE3-CE1 3.43Å; W388-Y402 AromaticContact CE3-CZ 3.88Å; W388-Y402 AromaticContact CZ3-CE1 3.53Å; W388-Y402 HydrophobicContact CZ3-CE1 3.53Å; W388-Y402 AromaticContact CZ3-CZ 3.52Å; W388-Y402 WeakPolarHBondContact CZ3-OH 3.32Å
389	S	97.9	Very high	96.7	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-89.1	-28.8	-179.4	-61.5	0	0	0	0	113.6	Q301 A385 L386 P391 C392 P399	Q301-S389 PolarHBondContact NE2-OG 3.48Å; A385-S389 PolarHBondContact O-N 3.3Å; L386-S389 PolarHBondContact O-N 3.38Å; L386-S389 VanDerWaalsContact O-N 3.07Å; S389-P391 VanDerWaalsContact C-CD 3.44Å; S389-C392 VanDerWaalsContact O-CB 3.29Å; S389-C392 WeakPolarHBondContact O-CB 3.3Å; S389-C392 PolarHBondContact O-N 2.92Å; S389-P399 WeakPolarHBondContact CB-O 3.47Å; S389-P399 PolarHBondContact OG-O 3.48Å
390	L	98.1	Very high	96.7	Very high	28 Å²	28	28.7 Å²	28.7	15%	0.147	15%	0.15	C	C	.	.	G	3₁₀ helix	trans	-57.9	-34	-179.7	-71.1	170.6	0	0	0	115.2	I320 L323 L386 C392 G393 F394 Y400	I320-L390 HydrophobicContact CD1-CB 3.73Å; I320-L390 HydrophobicContact CG1-CB 3.84Å; I320-L390 HydrophobicContact CG1-CD1 4.15Å; L323-L390 HydrophobicContact CD2-CD1 3.57Å; L386-L390 HydrophobicContact CD1-CD2 4.36Å; L386-L390 HydrophobicContact CD1-CG 4.26Å; L386-L390 HydrophobicContact CG-CD1 4.14Å; L386-L390 HydrophobicContact CG-CG 4.28Å; L386-L390 WeakPolarHBondContact O-CG 3.48Å; L386-L390 PolarHBondContact O-N 3.14Å; L386-L390 VanDerWaalsContact O-N 3.09Å; L390-C392 PolarHBondContact O-N 3.11Å; L390-C392 VanDerWaalsContact O-N 3.13Å; L390-G393 PolarHBondContact O-N 3.46Å; L390-F394 HydrophobicContact CD2-CE1 3.6Å; L390-F394 HydrophobicContact CD2-CZ 3.46Å; L390-F394 VanDerWaalsContact CD2-CZ 3.46Å; L390-Y400 HydrophobicContact CD2-CE1 4.45Å
391	P	98	Very high	96.6	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	16%	0.161	C	C	.	.	G	3₁₀ helix	trans	-58.2	-22.2	173.1	-28.8	36.6	0	0	0	114.4	L252 V253 L312 I320 A387 W388 S389 G393	L252-P391 HydrophobicContact CB-CG 4.33Å; V253-P391 HydrophobicContact CG2-CB 3.79Å; V253-P391 HydrophobicContact CG2-CG 3.93Å; L312-P391 HydrophobicContact CD1-CB 4.01Å; I320-P391 HydrophobicContact CD1-CG 4.34Å; I320-P391 HydrophobicContact CG2-CG 4.23Å; A387-P391 WeakPolarHBondContact O-CD 3.31Å; W388-P391 WeakPolarHBondContact O-CD 3.27Å; S389-P391 VanDerWaalsContact C-CD 3.44Å; P391-G393 PolarHBondContact O-N 3.3Å
392	C	97.1	Very high	96.5	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	16%	0.159	C	C	.	.	G	3₁₀ helix	trans	-81.8	3.8	177.9	-55.2	0	0	0	0	113.5	F304 Q310 S389 L390 P399	F304-C392 HydrophobicContact CD1-CB 3.76Å; F304-C392 HydrophobicContact CE1-CB 3.79Å; Q310-C392 WeakPolarHBondContact CG-O 3.16Å; S389-C392 VanDerWaalsContact O-CB 3.29Å; S389-C392 WeakPolarHBondContact O-CB 3.3Å; S389-C392 PolarHBondContact O-N 2.92Å; L390-C392 PolarHBondContact O-N 3.11Å; L390-C392 VanDerWaalsContact O-N 3.13Å; C392-P399 HydrophobicContact CB-CB 3.51Å; C392-P399 HydrophobicContact CB-CG 3.45Å; C392-P399 VanDerWaalsContact CB-CG 3.45Å
393	G	95.3	Very high	96.4	Very high	14 Å²	14	31.4 Å²	31.4	14%	0.144	16%	0.163	C	C	.	.			trans	71.9	-165.1	-179.2	0	0	0	0	0	112.7	L390 P391 Y400	L390-G393 PolarHBondContact O-N 3.46Å; P391-G393 PolarHBondContact O-N 3.3Å; G393-Y400 WeakPolarHBondContact O-CE2 3.18Å; G393-Y400 PolarHBondContact O-OH 2.99Å
394	F	94.8	Very high	96.3	Very high	164 Å²	164	33.6 Å²	33.6	72%	0.719	18%	0.178	S	C	*	.	S	Bend	trans	-120.6	8.1	-174.6	-59.9	-82.1	0	0	0	113.5	L390 Y400	L390-F394 HydrophobicContact CD2-CE1 3.6Å; L390-F394 HydrophobicContact CD2-CZ 3.46Å; L390-F394 VanDerWaalsContact CD2-CZ 3.46Å; F394-Y400 VanDerWaalsContact CD1-OH 3.27Å; F394-Y400 WeakPolarHBondContact CD1-OH 3.44Å; F394-Y400 WeakPolarHBondContact CE1-OH 3.45Å
395	S	90.6	Very high	96.2	Very high	78 Å²	78	36 Å²	36	55%	0.545	19%	0.187	S	C	.	.	S	Bend	trans	-74.5	-27.5	-176.4	46.4	0	0	0	0	113.1
396	H	94	Very high	96	Very high	45 Å²	45	36.6 Å²	36.6	21%	0.208	19%	0.19	C	C	.	.			trans	-129.7	144.3	-174.2	-58.5	76.6	0	0	0	111.1	E68 F304 Y400	E68-H396 PolarHBondContact O-CD2 2.59Å; E68-H396 VanDerWaalsContact O-CD2 3.29Å; E68-H396 PolarHBondContact O-NE2 3.24Å; F304-H396 HydrophobicContact CE2-CB 3.82Å; F304-H396 AromaticContact CE2-CG 3.71Å; F304-H396 AromaticContact CE2-ND1 3.91Å; F304-H396 HydrophobicContact CZ-CB 3.94Å; F304-H396 AromaticContact CZ-CG 3.8Å; F304-H396 AromaticContact CZ-ND1 3.58Å; H396-Y400 WeakPolarHBondContact O-CD2 3.31Å
397	L	94.6	Very high	96	Very high	109 Å²	109	35.6 Å²	35.6	57%	0.571	19%	0.186	S	C	*	.	S	Bend	trans	-80.3	-24.6	178.7	-172.1	61.5	0	0	0	112.6	V71 Y400 F401	V71-L397 HydrophobicContact CG2-CB 4.18Å; V71-L397 HydrophobicContact CG2-CD2 3.99Å; V71-L397 HydrophobicContact CG2-CG 4.38Å; L397-Y400 WeakPolarHBondContact O-CA 3.32Å; L397-Y400 WeakPolarHBondContact O-CB 3.3Å; L397-Y400 PolarHBondContact O-N 2.94Å; L397-F401 PolarHBondContact O-N 3.27Å
398	L	95.4	Very high	95.8	Very high	1 Å²	1	40.2 Å²	40.2	1%	0.005	21%	0.214	C	C	.	.	G	3₁₀ helix	trans	-52.5	-49	-173.6	179.1	77.5	0	0	0	113.7	L60 V63 V71 F304 Y400 F401	L60-L398 HydrophobicContact CD2-CD1 3.66Å; V63-L398 HydrophobicContact CB-CD1 4.32Å; V63-L398 HydrophobicContact CG1-CD1 4.02Å; V63-L398 HydrophobicContact CG1-CD2 4.08Å; V63-L398 HydrophobicContact CG1-CG 4.49Å; V71-L398 HydrophobicContact CG1-CB 3.89Å; V71-L398 HydrophobicContact CG1-CD1 3.57Å; V71-L398 HydrophobicContact CG1-CG 4.36Å; F304-L398 HydrophobicContact CD2-CD2 4.25Å; L398-Y400 PolarHBondContact O-N 2.88Å; L398-Y400 VanDerWaalsContact O-N 3.11Å; L398-F401 WeakPolarHBondContact O-CB 3.37Å; L398-F401 PolarHBondContact O-N 3.35Å
399	P	96.3	Very high	95.6	Very high	1 Å²	1	42.8 Å²	42.8	1%	0.006	23%	0.228	C	C	.	.	G	3₁₀ helix	trans	-61.4	-24.2	179.4	-23.4	35.8	0	0	0	113.5	Q301 F304 S389 C392	Q301-P399 HydrophobicContact CG-CB 4.35Å; F304-P399 HydrophobicContact CB-CG 4.47Å; F304-P399 HydrophobicContact CD1-CG 3.75Å; F304-P399 HydrophobicContact CD2-CG 4.16Å; F304-P399 HydrophobicContact CE1-CG 3.95Å; F304-P399 HydrophobicContact CE2-CG 4.34Å; F304-P399 HydrophobicContact CG-CG 3.86Å; F304-P399 HydrophobicContact CZ-CG 4.24Å; S389-P399 WeakPolarHBondContact CB-O 3.47Å; S389-P399 PolarHBondContact OG-O 3.48Å; C392-P399 HydrophobicContact CB-CB 3.51Å; C392-P399 HydrophobicContact CB-CG 3.45Å; C392-P399 VanDerWaalsContact CB-CG 3.45Å
400	Y	96.9	Very high	95.5	Very high	31 Å²	31	43 Å²	43	12%	0.122	23%	0.229	C	C	.	.	G	3₁₀ helix	trans	-87.9	-6.4	179.3	-62.1	-87.5	0	0	0	113.4	L386 L390 G393 F394 H396 L397 L398 Y402 V403 V404	L386-Y400 HydrophobicContact CD1-CD1 4.48Å; L386-Y400 HydrophobicContact CD1-CE1 4.22Å; L390-Y400 HydrophobicContact CD2-CE1 4.45Å; G393-Y400 WeakPolarHBondContact O-CE2 3.18Å; G393-Y400 PolarHBondContact O-OH 2.99Å; F394-Y400 VanDerWaalsContact CD1-OH 3.27Å; F394-Y400 WeakPolarHBondContact CD1-OH 3.44Å; F394-Y400 WeakPolarHBondContact CE1-OH 3.45Å; H396-Y400 WeakPolarHBondContact O-CD2 3.31Å; L397-Y400 WeakPolarHBondContact O-CA 3.32Å; L397-Y400 WeakPolarHBondContact O-CB 3.3Å; L397-Y400 PolarHBondContact O-N 2.94Å; L398-Y400 PolarHBondContact O-N 2.88Å; L398-Y400 VanDerWaalsContact O-N 3.11Å; Y400-Y402 PolarHBondContact O-N 2.96Å; Y400-V403 HydrophobicContact CD1-CG2 4.44Å; Y400-V403 PolarHBondContact O-N 2.89Å; Y400-V403 VanDerWaalsContact O-N 3.08Å; Y400-V404 PolarHBondContact O-N 2.81Å; Y400-V404 VanDerWaalsContact O-N 3.14Å
401	F	95.8	Very high	95.3	Very high	54 Å²	54	44.1 Å²	44.1	24%	0.237	24%	0.237	C	C	.	.	H	α-helix	trans	-50.4	-43.3	169.4	171.3	-97	0	0	0	110.8	L60 W293 L300 L397 L398 V403 V404 Y405	L60-F401 HydrophobicContact CD1-CD1 3.75Å; L60-F401 HydrophobicContact CD1-CD2 4.47Å; L60-F401 HydrophobicContact CD1-CE1 3.41Å; L60-F401 VanDerWaalsContact CD1-CE1 3.41Å; L60-F401 HydrophobicContact CD1-CE2 4.18Å; L60-F401 HydrophobicContact CD1-CG 4.28Å; L60-F401 HydrophobicContact CD1-CZ 3.65Å; L60-F401 HydrophobicContact CD2-CD1 4.45Å; L60-F401 HydrophobicContact CD2-CD2 4.34Å; L60-F401 HydrophobicContact CD2-CG 4.24Å; W293-F401 HydrophobicContact CH2-CE1 4.28Å; W293-F401 AromaticContact CH2-CZ 3.92Å; W293-F401 HydrophobicContact CH2-CZ 3.92Å; W293-F401 HydrophobicContact CZ2-CE1 4.08Å; W293-F401 HydrophobicContact CZ2-CZ 4.03Å; L300-F401 HydrophobicContact CD1-CD1 4.15Å; L397-F401 PolarHBondContact O-N 3.27Å; L398-F401 WeakPolarHBondContact O-CB 3.37Å; L398-F401 PolarHBondContact O-N 3.35Å; F401-V403 PolarHBondContact O-N 2.64Å; F401-V404 PolarHBondContact O-N 3.35Å; F401-Y405 HydrophobicContact CE1-CG 4.45Å; F401-Y405 VanDerWaalsContact O-CB 3.27Å; F401-Y405 WeakPolarHBondContact O-CB 3.45Å; F401-Y405 PolarHBondContact O-N 2.85Å
402	Y	94.6	Very high	95	Very high	3 Å²	3	47.2 Å²	47.2	1%	0.012	25%	0.251	C	S	.	.	H	α-helix	trans	-55.6	-48.2	177.9	-179.2	-105.9	0	0	0	112.3	Y298 A385 W388 Y400 V404 F406	Y298-Y402 AromaticContact CD1-CD2 3.92Å; Y298-Y402 HydrophobicContact CD1-CD2 3.92Å; Y298-Y402 AromaticContact CD1-CE2 3.6Å; Y298-Y402 HydrophobicContact CD1-CE2 3.6Å; Y298-Y402 AromaticContact CD2-CE2 3.71Å; Y298-Y402 HydrophobicContact CD2-CE2 3.71Å; Y298-Y402 HydrophobicContact CE1-CD2 4.12Å; Y298-Y402 AromaticContact CE1-CE2 3.57Å; Y298-Y402 HydrophobicContact CE1-CE2 3.57Å; Y298-Y402 AromaticContact CE2-CE2 3.66Å; Y298-Y402 HydrophobicContact CE2-CE2 3.66Å; Y298-Y402 HydrophobicContact CG-CD2 4.2Å; Y298-Y402 AromaticContact CG-CE2 3.68Å; Y298-Y402 HydrophobicContact CG-CE2 3.68Å; Y298-Y402 AromaticContact CZ-CE2 3.59Å; A385-Y402 HydrophobicContact CB-CD1 3.81Å; A385-Y402 HydrophobicContact CB-CE1 3.38Å; W388-Y402 HydrophobicContact CD2-CE1 4.49Å; W388-Y402 HydrophobicContact CE3-CD1 4.16Å; W388-Y402 AromaticContact CE3-CE1 3.43Å; W388-Y402 HydrophobicContact CE3-CE1 3.43Å; W388-Y402 VanDerWaalsContact CE3-CE1 3.43Å; W388-Y402 AromaticContact CE3-CZ 3.88Å; W388-Y402 AromaticContact CZ3-CE1 3.53Å; W388-Y402 HydrophobicContact CZ3-CE1 3.53Å; W388-Y402 AromaticContact CZ3-CZ 3.52Å; W388-Y402 WeakPolarHBondContact CZ3-OH 3.32Å; Y400-Y402 PolarHBondContact O-N 2.96Å; Y402-V404 PolarHBondContact O-N 2.53Å; Y402-F406 HydrophobicContact CE1-CD1 4.45Å; Y402-F406 WeakPolarHBondContact O-CB 3.33Å; Y402-F406 PolarHBondContact O-N 2.7Å
403	V	96.6	Very high	94.8	Very high	23 Å²	23	50 Å²	50	14%	0.139	26%	0.262	C	S	.	.	H	α-helix	trans	-62.6	-44.4	-179.3	-173.9	0	0	0	0	110.9	Y400 F401 T407	Y400-V403 HydrophobicContact CD1-CG2 4.44Å; Y400-V403 PolarHBondContact O-N 2.89Å; Y400-V403 VanDerWaalsContact O-N 3.08Å; F401-V403 PolarHBondContact O-N 2.64Å; V403-T407 WeakPolarHBondContact O-CB 3.38Å; V403-T407 PolarHBondContact O-N 2.64Å; V403-T407 PolarHBondContact O-OG1 3.33Å
404	V	96.4	Very high	94.8	Very high	88 Å²	88	49.3 Å²	49.3	53%	0.533	26%	0.255	S	S	.	.	H	α-helix	trans	-65.4	-52.8	179.5	176	0	0	0	0	110.7	Y400 F401 Y402 F406 T407 V408	Y400-V404 PolarHBondContact O-N 2.81Å; Y400-V404 VanDerWaalsContact O-N 3.14Å; F401-V404 PolarHBondContact O-N 3.35Å; Y402-V404 PolarHBondContact O-N 2.53Å; V404-F406 VanDerWaalsContact C-N 3.33Å; V404-F406 PolarHBondContact O-N 2.81Å; V404-T407 PolarHBondContact O-N 3.21Å; V404-V408 WeakPolarHBondContact O-CG2 3.44Å; V404-V408 PolarHBondContact O-N 2.94Å
405	Y	94.9	Very high	94.6	Very high	53 Å²	53	42.7 Å²	42.7	21%	0.208	23%	0.23	C	C	.	.	H	α-helix	trans	-55	-49.4	177.2	158	-103	0	0	0	111.3	W293 Y298 F401 T407 V408 L409	W293-Y405 AromaticContact CE2-CE2 3.76Å; W293-Y405 AromaticContact CE2-CZ 3.66Å; W293-Y405 HydrophobicContact CZ2-CD1 4.35Å; W293-Y405 AromaticContact CZ2-CD2 3.61Å; W293-Y405 HydrophobicContact CZ2-CD2 3.61Å; W293-Y405 HydrophobicContact CZ2-CE1 4.28Å; W293-Y405 AromaticContact CZ2-CE2 3.5Å; W293-Y405 HydrophobicContact CZ2-CE2 3.5Å; W293-Y405 HydrophobicContact CZ2-CG 4.04Å; W293-Y405 AromaticContact CZ2-CZ 3.87Å; W293-Y405 AromaticContact NE1-CE1 3.28Å; W293-Y405 VanDerWaalsContact NE1-CE1 3.28Å; W293-Y405 AromaticContact NE1-CE2 3.65Å; W293-Y405 AromaticContact NE1-CZ 3.03Å; W293-Y405 PolarHBondContact NE1-OH 3.37Å; Y298-Y405 HydrophobicContact CE1-CE1 4.02Å; F401-Y405 HydrophobicContact CE1-CG 4.45Å; F401-Y405 VanDerWaalsContact O-CB 3.27Å; F401-Y405 WeakPolarHBondContact O-CB 3.45Å; F401-Y405 PolarHBondContact O-N 2.85Å; Y405-T407 VanDerWaalsContact C-N 3.33Å; Y405-T407 PolarHBondContact O-N 3.38Å; Y405-V408 PolarHBondContact O-N 3.33Å; Y405-L409 HydrophobicContact CE1-CD2 4.38Å; Y405-L409 WeakPolarHBondContact O-CB 3.33Å; Y405-L409 PolarHBondContact O-N 3.17Å
406	F	95	Very high	94.6	Very high	12 Å²	12	39.5 Å²	39.5	5%	0.053	21%	0.206	C	C	.	.	H	α-helix	trans	-69.1	-33.7	-175.2	-162.8	-129.3	0	0	0	111.7	D381 L382 A385 Y402 V404 L409 L410	D381-F406 HydrophobicContact CB-CE1 3.78Å; D381-F406 HydrophobicContact CB-CZ 4.26Å; L382-F406 HydrophobicContact CD2-CD1 4.08Å; A385-F406 HydrophobicContact CB-CD1 3.92Å; Y402-F406 HydrophobicContact CE1-CD1 4.45Å; Y402-F406 WeakPolarHBondContact O-CB 3.33Å; Y402-F406 PolarHBondContact O-N 2.7Å; V404-F406 VanDerWaalsContact C-N 3.33Å; V404-F406 PolarHBondContact O-N 2.81Å; F406-L409 HydrophobicContact CD2-CD2 3.9Å; F406-L409 HydrophobicContact CE2-CD2 4.09Å; F406-L409 PolarHBondContact O-N 2.99Å; F406-L410 HydrophobicContact CD1-CD1 3.93Å; F406-L410 HydrophobicContact CE1-CD1 3.82Å; F406-L410 HydrophobicContact CE2-CG 4.48Å; F406-L410 HydrophobicContact CG-CD1 4.42Å; F406-L410 HydrophobicContact CZ-CD1 4.15Å; F406-L410 HydrophobicContact CZ-CD2 4.45Å; F406-L410 HydrophobicContact CZ-CG 4.44Å; F406-L410 WeakPolarHBondContact O-CB 3.42Å; F406-L410 VanDerWaalsContact O-CG 3.28Å; F406-L410 WeakPolarHBondContact O-CG 2.93Å; F406-L410 PolarHBondContact O-N 3.12Å
407	T	96.7	Very high	94.5	Very high	41 Å²	41	39.4 Å²	39.4	25%	0.252	21%	0.207	S	C	.	.	H	α-helix	trans	-60.6	-48.8	170	-56.8	0	0	0	0	111.5	L382 V403 V404 Y405 L409 L410 V411	L382-T407 WeakPolarHBondContact CD2-OG1 3.42Å; V403-T407 WeakPolarHBondContact O-CB 3.38Å; V403-T407 PolarHBondContact O-N 2.64Å; V403-T407 PolarHBondContact O-OG1 3.33Å; V404-T407 PolarHBondContact O-N 3.21Å; Y405-T407 VanDerWaalsContact C-N 3.33Å; Y405-T407 PolarHBondContact O-N 3.38Å; T407-L409 VanDerWaalsContact C-N 3.33Å; T407-L409 PolarHBondContact O-N 3.46Å; T407-L410 PolarHBondContact O-N 3.48Å; T407-V411 HydrophobicContact CG2-CG2 4.46Å; T407-V411 WeakPolarHBondContact O-CB 3.38Å; T407-V411 WeakPolarHBondContact O-CG2 3.32Å; T407-V411 PolarHBondContact O-N 3.26Å
408	V	95.7	Very high	94.4	Very high	98 Å²	98	35.2 Å²	35.2	59%	0.594	19%	0.185	S	C	*	.	H	α-helix	trans	-61	-43.3	177.4	174	0	0	0	0	111	V404 Y405 H412	V404-V408 WeakPolarHBondContact O-CG2 3.44Å; V404-V408 PolarHBondContact O-N 2.94Å; Y405-V408 PolarHBondContact O-N 3.33Å; V408-H412 WeakPolarHBondContact O-CB 3.25Å; V408-H412 PolarHBondContact O-N 3.32Å
409	L	93.2	Very high	94.2	Very high	55 Å²	55	40.1 Å²	40.1	29%	0.288	20%	0.203	S	C	.	.	H	α-helix	trans	-59.2	-48.4	176.7	-177.6	72.6	0	0	0	111.6	Y405 F406 T407 H412 R413	Y405-L409 HydrophobicContact CE1-CD2 4.38Å; Y405-L409 WeakPolarHBondContact O-CB 3.33Å; Y405-L409 PolarHBondContact O-N 3.17Å; F406-L409 HydrophobicContact CD2-CD2 3.9Å; F406-L409 HydrophobicContact CE2-CD2 4.09Å; F406-L409 PolarHBondContact O-N 2.99Å; T407-L409 VanDerWaalsContact C-N 3.33Å; T407-L409 PolarHBondContact O-N 3.46Å; L409-H412 PolarHBondContact O-N 3.49Å; L409-R413 VanDerWaalsContact O-CB 3.28Å; L409-R413 WeakPolarHBondContact O-CB 3.38Å; L409-R413 PolarHBondContact O-N 3.44Å
410	L	95.1	Very high	93.8	Very high	6 Å²	6	42.6 Å²	42.6	3%	0.031	22%	0.215	C	C	.	.	H	α-helix	trans	-69.7	-37.4	-177.5	-70.4	177.7	0	0	0	112.5	Y378 D381 L382 F406 T407 R413 E414	Y378-L410 HydrophobicContact CD1-CD2 3.7Å; Y378-L410 HydrophobicContact CD2-CB 4.45Å; Y378-L410 HydrophobicContact CD2-CD2 4.31Å; Y378-L410 HydrophobicContact CE1-CD2 3.99Å; Y378-L410 HydrophobicContact CG-CB 4.48Å; Y378-L410 HydrophobicContact CG-CD1 4.46Å; Y378-L410 HydrophobicContact CG-CD2 3.9Å; D381-L410 HydrophobicContact CB-CD1 4.19Å; L382-L410 HydrophobicContact CD1-CD1 4.33Å; L382-L410 HydrophobicContact CD2-CD1 3.82Å; L382-L410 HydrophobicContact CG-CD1 3.74Å; F406-L410 HydrophobicContact CD1-CD1 3.93Å; F406-L410 HydrophobicContact CE1-CD1 3.82Å; F406-L410 HydrophobicContact CE2-CG 4.48Å; F406-L410 HydrophobicContact CG-CD1 4.42Å; F406-L410 HydrophobicContact CZ-CD1 4.15Å; F406-L410 HydrophobicContact CZ-CD2 4.45Å; F406-L410 HydrophobicContact CZ-CG 4.44Å; F406-L410 WeakPolarHBondContact O-CB 3.42Å; F406-L410 VanDerWaalsContact O-CG 3.28Å; F406-L410 WeakPolarHBondContact O-CG 2.93Å; F406-L410 PolarHBondContact O-N 3.12Å; T407-L410 PolarHBondContact O-N 3.48Å; L410-R413 PolarHBondContact O-N 3.09Å; L410-E414 VanDerWaalsContact O-CB 3.26Å; L410-E414 WeakPolarHBondContact O-CB 3.4Å; L410-E414 PolarHBondContact O-N 3.16Å
411	V	95.3	Very high	93.5	Very high	50 Å²	50	42 Å²	42	30%	0.303	22%	0.215	S	C	.	.	H	α-helix	trans	-63.4	-44.4	172.6	169.5	0	0	0	0	110.7	T407 E414 A415 I440 Y445	T407-V411 HydrophobicContact CG2-CG2 4.46Å; T407-V411 WeakPolarHBondContact O-CB 3.38Å; T407-V411 WeakPolarHBondContact O-CG2 3.32Å; T407-V411 PolarHBondContact O-N 3.26Å; V411-E414 PolarHBondContact O-N 3.38Å; V411-A415 WeakPolarHBondContact O-CB 3.4Å; V411-A415 PolarHBondContact O-N 2.93Å; V411-I440 HydrophobicContact CG2-CD1 4.25Å; V411-Y445 HydrophobicContact CG2-CE1 4.48Å
412	H	91.9	Very high	93.4	Very high	66 Å²	66	46.4 Å²	46.4	31%	0.306	23%	0.23	S	C	.	.	H	α-helix	trans	-63.7	-42.5	175.5	-178.8	-106.1	0	0	0	111.8	F40 V408 L409 A415 R416	F40-H412 AromaticContact CE1-CE1 3.78Å; F40-H412 AromaticContact CZ-CE1 3.93Å; V408-H412 WeakPolarHBondContact O-CB 3.25Å; V408-H412 PolarHBondContact O-N 3.32Å; L409-H412 PolarHBondContact O-N 3.49Å; H412-A415 PolarHBondContact O-N 3.29Å; H412-R416 WeakPolarHBondContact O-CG 3.49Å; H412-R416 PolarHBondContact O-N 3.36Å; H412-R416 VanDerWaalsContact O-N 3.08Å
413	R	91.9	Very high	93.2	Very high	57 Å²	57	50.6 Å²	50.6	22%	0.215	27%	0.265	C	S	.	.	H	α-helix	trans	-64.7	-42.9	178.6	-167.8	172.4	-167.2	141	11.9	111.9	D276 L409 L410 R416 D417	D276-R413 IonicContact OD1-CZ 3.08Å; D276-R413 IonicContact OD1-NH1 3.88Å; D276-R413 IonicContact OD1-NH2 2.87Å; D276-R413 PolarHBondContact OD1-NH2 2.91Å; D276-R413 IonicContact OD2-CZ 2.61Å; D276-R413 IonicContact OD2-NH1 3.27Å; D276-R413 PolarHBondContact OD2-NH1 3.41Å; D276-R413 VanDerWaalsContact OD2-NH1 3.16Å; D276-R413 IonicContact OD2-NH2 3.29Å; D276-R413 PolarHBondContact OD2-NH2 3.17Å; L409-R413 VanDerWaalsContact O-CB 3.28Å; L409-R413 WeakPolarHBondContact O-CB 3.38Å; L409-R413 PolarHBondContact O-N 3.44Å; L410-R413 PolarHBondContact O-N 3.09Å; R413-R416 PolarHBondContact O-N 2.87Å; R413-D417 PolarHBondContact O-N 3.12Å
414	E	94.4	Very high	92.8	Very high	0 Å²	0	54.9 Å²	54.9	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-59.5	-48.1	173.6	178.7	-88.3	155.7	0	0	111.1	H375 Y378 L410 V411 R416 D417 E418 R439 I440 Y445	H375-E414 WeakPolarHBondContact CD2-CG 3.49Å; Y378-E414 HydrophobicContact CD2-CB 4.3Å; Y378-E414 HydrophobicContact CE2-CB 4.05Å; L410-E414 VanDerWaalsContact O-CB 3.26Å; L410-E414 WeakPolarHBondContact O-CB 3.4Å; L410-E414 PolarHBondContact O-N 3.16Å; V411-E414 PolarHBondContact O-N 3.38Å; E414-R416 VanDerWaalsContact C-N 3.26Å; E414-R416 PolarHBondContact O-N 2.87Å; E414-D417 PolarHBondContact O-N 3.38Å; E414-D417 VanDerWaalsContact O-N 3.1Å; E414-E418 WeakPolarHBondContact O-CG 3.47Å; E414-E418 PolarHBondContact O-N 2.95Å; E414-E418 WeakPolarHBondContact OE1-CG 3.31Å; E414-R439 VanDerWaalsContact CD-NH1 3.35Å; E414-R439 HydrophobicContact CG-CB 4.25Å; E414-R439 WeakPolarHBondContact OE1-CD 3.38Å; E414-R439 WeakPolarHBondContact OE1-CG 3.37Å; E414-R439 IonicContact OE1-CZ 3.5Å; E414-R439 IonicContact OE1-NE 3.51Å; E414-R439 IonicContact OE1-NH1 2.94Å; E414-R439 PolarHBondContact OE1-NH1 3.22Å; E414-R439 IonicContact OE2-CZ 3.93Å; E414-R439 IonicContact OE2-NH1 2.92Å; E414-R439 PolarHBondContact OE2-NH1 3.44Å; E414-I440 HydrophobicContact CB-CD1 4.32Å; E414-I440 HydrophobicContact CG-CG1 4.47Å; E414-Y445 PolarHBondContact OE2-OH 3.12Å
415	A	92.3	Very high	92.7	Very high	25 Å²	25	52.3 Å²	52.3	21%	0.207	26%	0.263	C	S	.	.	H	α-helix	trans	-60.6	-35.1	178.5	0	0	0	0	0	113	V411 H412 R419	V411-A415 WeakPolarHBondContact O-CB 3.4Å; V411-A415 PolarHBondContact O-N 2.93Å; H412-A415 PolarHBondContact O-N 3.29Å; A415-R419 WeakPolarHBondContact O-CG 3.21Å; A415-R419 PolarHBondContact O-N 2.83Å; A415-R419 PolarHBondContact O-NH1 2.94Å
416	R	90.4	Very high	92.6	Very high	12 Å²	12	51.2 Å²	51.2	5%	0.045	27%	0.268	C	S	.	.	H	α-helix	trans	-66.8	-47.6	172.6	-70.2	175.6	74.3	-151.3	-0.4	111.3	E39 M275 D280 H412 R413 E414 E418 R419 Q420	E39-R416 VanDerWaalsContact CD-NH2 3.34Å; E39-R416 IonicContact OE1-CZ 3.58Å; E39-R416 IonicContact OE1-NE 3.87Å; E39-R416 PolarHBondContact OE1-NE 3.46Å; E39-R416 IonicContact OE1-NH2 3.11Å; E39-R416 PolarHBondContact OE1-NH2 3.3Å; E39-R416 IonicContact OE2-CZ 3.45Å; E39-R416 IonicContact OE2-NE 3.16Å; E39-R416 PolarHBondContact OE2-NE 2.68Å; E39-R416 VanDerWaalsContact OE2-NE 3.16Å; E39-R416 IonicContact OE2-NH2 3.79Å; E39-R416 PolarHBondContact OE2-NH2 3.2Å; M275-R416 HydrophobicContact CE-CB 4.13Å; M275-R416 HydrophobicContact SD-CB 4.18Å; M275-R416 PolarHBondContact SD-NH1 2.81Å; D280-R416 IonicContact OD1-CZ 3.03Å; D280-R416 IonicContact OD1-NH1 2.83Å; D280-R416 IonicContact OD1-NH2 3.58Å; D280-R416 PolarHBondContact OD1-NH2 2.94Å; D280-R416 IonicContact OD2-CZ 3.59Å; D280-R416 IonicContact OD2-NH1 2.81Å; D280-R416 PolarHBondContact OD2-NH1 2.88Å; D280-R416 IonicContact OD2-NH2 3.56Å; D280-R416 PolarHBondContact OD2-NH2 2.97Å; H412-R416 WeakPolarHBondContact O-CG 3.49Å; H412-R416 PolarHBondContact O-N 3.36Å; H412-R416 VanDerWaalsContact O-N 3.08Å; R413-R416 PolarHBondContact O-N 2.87Å; E414-R416 VanDerWaalsContact C-N 3.26Å; E414-R416 PolarHBondContact O-N 2.87Å; R416-E418 VanDerWaalsContact C-N 3.3Å; R416-E418 PolarHBondContact O-N 2.85Å; R416-R419 PolarHBondContact O-N 3.44Å; R416-Q420 WeakPolarHBondContact O-CG 3.37Å; R416-Q420 PolarHBondContact O-N 3.38Å
417	D	90.7	Very high	92.6	Very high	43 Å²	43	57.4 Å²	57.4	23%	0.23	30%	0.301	C	S	.	.	H	α-helix	trans	-62.5	-38.1	179.7	-165.4	50.9	0	0	0	111.6	M275 H375 R413 E414 Q420 C421	M275-D417 HydrophobicContact CE-CB 4.11Å; H375-D417 IonicContact CE1-OD2 2.81Å; H375-D417 PolarHBondContact CE1-OD2 3.39Å; H375-D417 VanDerWaalsContact CE1-OD2 3.27Å; H375-D417 IonicContact NE2-OD2 3.93Å; R413-D417 PolarHBondContact O-N 3.12Å; E414-D417 PolarHBondContact O-N 3.38Å; E414-D417 VanDerWaalsContact O-N 3.1Å; D417-Q420 PolarHBondContact O-N 3.35Å; D417-C421 VanDerWaalsContact O-CB 3.24Å; D417-C421 WeakPolarHBondContact O-CB 3.39Å; D417-C421 PolarHBondContact O-N 3.46Å; D417-C421 PolarHBondContact O-SG 2.9Å; D417-C421 VanDerWaalsContact O-SG 3.37Å
418	E	92.3	Very high	92.5	Very high	21 Å²	21	56.2 Å²	56.2	10%	0.098	30%	0.295	C	S	.	.	H	α-helix	trans	-58.1	-48.2	172.6	-78.8	-68.8	154	0	0	112.4	R374 E414 R416 Q420 C421 R422 W429	R374-E418 IonicContact CZ-OE1 2.78Å; R374-E418 IonicContact NE-OE1 2.64Å; R374-E418 PolarHBondContact NE-OE1 2.65Å; R374-E418 IonicContact NH2-OE1 2.99Å; R374-E418 PolarHBondContact NH2-OE1 2.84Å; E414-E418 WeakPolarHBondContact O-CG 3.47Å; E414-E418 PolarHBondContact O-N 2.95Å; E414-E418 WeakPolarHBondContact OE1-CG 3.31Å; R416-E418 VanDerWaalsContact C-N 3.3Å; R416-E418 PolarHBondContact O-N 2.85Å; E418-Q420 VanDerWaalsContact C-N 3.34Å; E418-Q420 PolarHBondContact O-N 2.8Å; E418-C421 PolarHBondContact O-N 3.12Å; E418-R422 WeakPolarHBondContact O-CB 3.13Å; E418-R422 PolarHBondContact O-N 2.89Å; E418-W429 WeakPolarHBondContact OE1-CZ2 3.29Å; E418-W429 PolarHBondContact OE2-NE1 3.03Å
419	R	91.2	Very high	92.6	Very high	103 Å²	103	52.2 Å²	52.2	39%	0.389	27%	0.269	S	S	.	.	H	α-helix	trans	-62.1	-43.8	178	-71.7	-168.3	-61.5	-79.8	6.4	111.1	E37 A415 R416 A423	E37-R419 IonicContact OE2-NE 3.48Å; A415-R419 WeakPolarHBondContact O-CG 3.21Å; A415-R419 PolarHBondContact O-N 2.83Å; A415-R419 PolarHBondContact O-NH1 2.94Å; R416-R419 PolarHBondContact O-N 3.44Å; R419-A423 WeakPolarHBondContact O-CB 3.49Å; R419-A423 PolarHBondContact O-N 3.2Å
420	Q	88.1	Confident	92.7	Very high	54 Å²	54	51.7 Å²	51.7	25%	0.252	27%	0.267	S	S	.	.	H	α-helix	trans	-66.4	-45.1	178.8	-68.9	179.3	10.2	0	0	112.1	R416 D417 E418 A423 K424	R416-Q420 WeakPolarHBondContact O-CG 3.37Å; R416-Q420 PolarHBondContact O-N 3.38Å; D417-Q420 PolarHBondContact O-N 3.35Å; E418-Q420 VanDerWaalsContact C-N 3.34Å; E418-Q420 PolarHBondContact O-N 2.8Å; Q420-A423 PolarHBondContact O-N 2.88Å; Q420-K424 WeakPolarHBondContact O-CB 3.26Å; Q420-K424 PolarHBondContact O-N 3.33Å
421	C	91.4	Very high	92.8	Very high	17 Å²	17	52.9 Å²	52.9	12%	0.115	28%	0.278	C	S	.	.	H	α-helix	trans	-66.1	-39.2	178.2	-76.2	0	0	0	0	111.6	D417 E418 K424 Y425 W429	D417-C421 VanDerWaalsContact O-CB 3.24Å; D417-C421 WeakPolarHBondContact O-CB 3.39Å; D417-C421 PolarHBondContact O-N 3.46Å; D417-C421 PolarHBondContact O-SG 2.9Å; D417-C421 VanDerWaalsContact O-SG 3.37Å; E418-C421 PolarHBondContact O-N 3.12Å; C421-K424 PolarHBondContact O-N 2.84Å; C421-Y425 HydrophobicContact CB-CD2 4.08Å; C421-Y425 HydrophobicContact CB-CE2 4.4Å; C421-Y425 WeakPolarHBondContact O-CB 3.46Å; C421-Y425 VanDerWaalsContact O-CD2 3.28Å; C421-Y425 WeakPolarHBondContact O-CD2 3.4Å; C421-Y425 PolarHBondContact O-N 3.07Å; C421-W429 HydrophobicContact CB-CD2 3.56Å; C421-W429 VanDerWaalsContact CB-CE2 3.49Å; C421-W429 HydrophobicContact CB-CE3 3.64Å; C421-W429 HydrophobicContact CB-CG 4.29Å; C421-W429 HydrophobicContact CB-CH2 3.62Å; C421-W429 HydrophobicContact CB-CZ2 3.53Å; C421-W429 HydrophobicContact CB-CZ3 3.67Å
422	R	92.6	Very high	92.8	Very high	147 Å²	147	50.9 Å²	50.9	56%	0.555	27%	0.265	S	S	*	.	H	α-helix	trans	-64.2	-45.9	174	-166.7	171.7	-165	-165.1	-4.9	112.2	E418 K424 G426 W429 D430	E418-R422 WeakPolarHBondContact O-CB 3.13Å; E418-R422 PolarHBondContact O-N 2.89Å; R422-K424 PolarHBondContact O-N 2.76Å; R422-G426 WeakPolarHBondContact O-CA 3.37Å; R422-G426 PolarHBondContact O-N 2.89Å; R422-W429 HydrophobicContact CB-CG 4.37Å; R422-D430 IonicContact CZ-OD1 3.28Å; R422-D430 IonicContact NE-OD1 2.85Å; R422-D430 PolarHBondContact NE-OD1 2.81Å; R422-D430 IonicContact NH2-OD1 3.21Å; R422-D430 PolarHBondContact NH2-OD1 2.91Å; R422-D430 IonicContact NH2-OD2 2.87Å
423	A	90.5	Very high	93	Very high	92 Å²	92	49.1 Å²	49.1	76%	0.76	26%	0.26	S	S	*	.	H	α-helix	trans	-61.1	-34.6	176.1	0	0	0	0	0	112.3	R419 Q420	R419-A423 WeakPolarHBondContact O-CB 3.49Å; R419-A423 PolarHBondContact O-N 3.2Å; Q420-A423 PolarHBondContact O-N 2.88Å
424	K	89.8	Confident	93.3	Very high	112 Å²	112	55.5 Å²	55.5	49%	0.487	28%	0.283	S	S	.	.	H	α-helix	trans	-84.6	-38.6	-176.5	-176.1	176.9	-176.1	175.6	0	114.6	Q420 C421 R422	Q420-K424 WeakPolarHBondContact O-CB 3.26Å; Q420-K424 PolarHBondContact O-N 3.33Å; C421-K424 PolarHBondContact O-N 2.84Å; R422-K424 PolarHBondContact O-N 2.76Å
425	Y	93	Very high	93.3	Very high	34 Å²	34	61.7 Å²	61.7	13%	0.133	31%	0.307	C	S	.	.	H	α-helix	trans	-112.1	-12	-170.6	-57.9	-62	0	0	0	113.5	T358 T360 K362 L364 C421 L427 A428 W429	T358-Y425 HydrophobicContact CG2-CD1 3.58Å; T358-Y425 HydrophobicContact CG2-CE1 4.07Å; T358-Y425 HydrophobicContact CG2-CG 4.21Å; T360-Y425 WeakPolarHBondContact OG1-CE1 3.29Å; K362-Y425 HydrophobicContact CB-CE1 4.43Å; L364-Y425 HydrophobicContact CD2-CD2 4.1Å; L364-Y425 HydrophobicContact CD2-CE1 4.47Å; L364-Y425 HydrophobicContact CD2-CE2 3.95Å; L364-Y425 HydrophobicContact CD2-CG 4.45Å; C421-Y425 HydrophobicContact CB-CD2 4.08Å; C421-Y425 HydrophobicContact CB-CE2 4.4Å; C421-Y425 WeakPolarHBondContact O-CB 3.46Å; C421-Y425 VanDerWaalsContact O-CD2 3.28Å; C421-Y425 WeakPolarHBondContact O-CD2 3.4Å; C421-Y425 PolarHBondContact O-N 3.07Å; Y425-L427 PolarHBondContact O-N 3.21Å; Y425-A428 WeakPolarHBondContact O-CB 3.35Å; Y425-A428 PolarHBondContact O-N 2.92Å; Y425-W429 HydrophobicContact CD2-CE3 4.23Å
426	G	93.6	Very high	93.6	Very high	31 Å²	31	60.5 Å²	60.5	32%	0.32	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.4	-126.6	173.8	0	0	0	0	0	112.9	R422 A428 W429 D430	R422-G426 WeakPolarHBondContact O-CA 3.37Å; R422-G426 PolarHBondContact O-N 2.89Å; G426-A428 PolarHBondContact O-N 3.01Å; G426-A428 VanDerWaalsContact O-N 3.13Å; G426-W429 WeakPolarHBondContact O-CA 3.44Å; G426-W429 VanDerWaalsContact O-CB 3.26Å; G426-W429 WeakPolarHBondContact O-CB 3.47Å; G426-W429 PolarHBondContact O-N 3.07Å; G426-D430 PolarHBondContact O-N 2.73Å
427	L	94.9	Very high	93.8	Very high	142 Å²	142	63.2 Å²	63.2	74%	0.743	32%	0.316	S	S	*	.	H	α-helix	trans	-57.7	-28.8	-177.9	-64.5	176.3	0	0	0	114.1	Y425 W429 D430 A431	Y425-L427 PolarHBondContact O-N 3.21Å; L427-W429 VanDerWaalsContact C-N 3.3Å; L427-D430 PolarHBondContact O-N 3.44Å; L427-A431 WeakPolarHBondContact O-CB 3.46Å; L427-A431 PolarHBondContact O-N 3.45Å
428	A	95.2	Very high	94.1	Very high	16 Å²	16	64.6 Å²	64.6	13%	0.132	32%	0.319	C	S	.	.	H	α-helix	trans	-68	-33.9	175.6	0	0	0	0	0	111.5	I356 T358 Y425 G426 Y432	I356-A428 HydrophobicContact CG2-CB 4.06Å; T358-A428 HydrophobicContact CG2-CB 4.01Å; Y425-A428 WeakPolarHBondContact O-CB 3.35Å; Y425-A428 PolarHBondContact O-N 2.92Å; G426-A428 PolarHBondContact O-N 3.01Å; G426-A428 VanDerWaalsContact O-N 3.13Å; A428-Y432 PolarHBondContact O-N 3.32Å
429	W	96.4	Very high	94.3	Very high	13 Å²	13	67.3 Å²	67.3	5%	0.049	33%	0.328	C	S	.	.	H	α-helix	trans	-68.5	-45.4	172.1	-166.6	-111.2	0	0	0	111.3	L364 E418 C421 R422 Y425 G426 L427 A431 Y432 C433	L364-W429 HydrophobicContact CD1-CE3 3.87Å; L364-W429 HydrophobicContact CD1-CZ3 4.35Å; L364-W429 HydrophobicContact CD2-CZ3 4.43Å; E418-W429 WeakPolarHBondContact OE1-CZ2 3.29Å; E418-W429 PolarHBondContact OE2-NE1 3.03Å; C421-W429 HydrophobicContact CB-CD2 3.56Å; C421-W429 VanDerWaalsContact CB-CE2 3.49Å; C421-W429 HydrophobicContact CB-CE3 3.64Å; C421-W429 HydrophobicContact CB-CG 4.29Å; C421-W429 HydrophobicContact CB-CH2 3.62Å; C421-W429 HydrophobicContact CB-CZ2 3.53Å; C421-W429 HydrophobicContact CB-CZ3 3.67Å; R422-W429 HydrophobicContact CB-CG 4.37Å; Y425-W429 HydrophobicContact CD2-CE3 4.23Å; G426-W429 WeakPolarHBondContact O-CA 3.44Å; G426-W429 VanDerWaalsContact O-CB 3.26Å; G426-W429 WeakPolarHBondContact O-CB 3.47Å; G426-W429 PolarHBondContact O-N 3.07Å; L427-W429 VanDerWaalsContact C-N 3.3Å; W429-A431 PolarHBondContact O-N 3.13Å; W429-Y432 HydrophobicContact CD2-CD1 4.23Å; W429-Y432 AromaticContact CE3-CD1 3.68Å; W429-Y432 HydrophobicContact CE3-CD1 3.68Å; W429-Y432 HydrophobicContact CE3-CE1 4.4Å; W429-Y432 HydrophobicContact CE3-CG 4.45Å; W429-Y432 AromaticContact CH2-CD1 3.65Å; W429-Y432 HydrophobicContact CH2-CD1 3.65Å; W429-Y432 AromaticContact CH2-CE1 3.6Å; W429-Y432 HydrophobicContact CH2-CE1 3.6Å; W429-Y432 HydrophobicContact CZ2-CD1 4.17Å; W429-Y432 HydrophobicContact CZ2-CE1 4.33Å; W429-Y432 AromaticContact CZ3-CD1 3.37Å; W429-Y432 HydrophobicContact CZ3-CD1 3.37Å; W429-Y432 AromaticContact CZ3-CE1 3.63Å; W429-Y432 HydrophobicContact CZ3-CE1 3.63Å; W429-Y432 HydrophobicContact CZ3-CG 4.4Å; W429-Y432 CarbonylContact O-C 3.53Å; W429-Y432 WeakPolarHBondContact O-CA 3.48Å; W429-Y432 VanDerWaalsContact O-CB 3.31Å; W429-Y432 WeakPolarHBondContact O-CB 3.47Å; W429-Y432 PolarHBondContact O-N 3.04Å; W429-C433 PolarHBondContact NE1-SG 3.15Å; W429-C433 VanDerWaalsContact NE1-SG 3.43Å; W429-C433 PolarHBondContact O-N 2.69Å; W429-C433 PolarHBondContact O-SG 2.78Å; W429-C433 VanDerWaalsContact O-SG 3.35Å
430	D	96	Very high	94.5	Very high	45 Å²	45	62.4 Å²	62.4	24%	0.241	31%	0.31	C	S	.	.	H	α-helix	trans	-60.8	-36.4	177.6	-64.6	-24	0	0	0	111.3	R422 G426 L427 R434	R422-D430 IonicContact CZ-OD1 3.28Å; R422-D430 IonicContact NE-OD1 2.85Å; R422-D430 PolarHBondContact NE-OD1 2.81Å; R422-D430 IonicContact NH2-OD1 3.21Å; R422-D430 PolarHBondContact NH2-OD1 2.91Å; R422-D430 IonicContact NH2-OD2 2.87Å; G426-D430 PolarHBondContact O-N 2.73Å; L427-D430 PolarHBondContact O-N 3.44Å; D430-R434 WeakPolarHBondContact O-CG 3.16Å; D430-R434 PolarHBondContact O-N 3.4Å; D430-R434 VanDerWaalsContact O-N 3.16Å
431	A	96.3	Very high	94.9	Very high	30 Å²	30	62.8 Å²	62.8	25%	0.248	31%	0.311	C	S	.	.	H	α-helix	trans	-65.5	-40.6	171.5	0	0	0	0	0	112.7	I356 L427 W429 R434 R435	I356-A431 HydrophobicContact CD1-CB 4.14Å; L427-A431 WeakPolarHBondContact O-CB 3.46Å; L427-A431 PolarHBondContact O-N 3.45Å; W429-A431 PolarHBondContact O-N 3.13Å; A431-R434 PolarHBondContact O-N 3.2Å; A431-R435 PolarHBondContact O-N 2.9Å
432	Y	96.6	Very high	94.9	Very high	9 Å²	9	63.8 Å²	63.8	4%	0.035	32%	0.317	C	S	.	.	H	α-helix	trans	-60.7	-49	174.1	177.1	-123	0	0	0	111.7	L365 V366 W370 R374 A428 W429 R434 R435 V436	L365-Y432 WeakPolarHBondContact O-CE2 3.32Å; V366-Y432 HydrophobicContact CB-CD2 4.2Å; V366-Y432 HydrophobicContact CB-CE2 4.3Å; V366-Y432 HydrophobicContact CG1-CD2 3.39Å; V366-Y432 HydrophobicContact CG1-CE2 3.79Å; V366-Y432 HydrophobicContact CG1-CG 4.5Å; W370-Y432 PolarHBondContact O-OH 3.05Å; R374-Y432 HydrophobicContact CB-CE1 4.13Å; R374-Y432 VanDerWaalsContact CD-CE1 3.47Å; R374-Y432 HydrophobicContact CG-CD1 4.39Å; R374-Y432 HydrophobicContact CG-CE1 3.62Å; A428-Y432 PolarHBondContact O-N 3.32Å; W429-Y432 HydrophobicContact CD2-CD1 4.23Å; W429-Y432 AromaticContact CE3-CD1 3.68Å; W429-Y432 HydrophobicContact CE3-CD1 3.68Å; W429-Y432 HydrophobicContact CE3-CE1 4.4Å; W429-Y432 HydrophobicContact CE3-CG 4.45Å; W429-Y432 AromaticContact CH2-CD1 3.65Å; W429-Y432 HydrophobicContact CH2-CD1 3.65Å; W429-Y432 AromaticContact CH2-CE1 3.6Å; W429-Y432 HydrophobicContact CH2-CE1 3.6Å; W429-Y432 HydrophobicContact CZ2-CD1 4.17Å; W429-Y432 HydrophobicContact CZ2-CE1 4.33Å; W429-Y432 AromaticContact CZ3-CD1 3.37Å; W429-Y432 HydrophobicContact CZ3-CD1 3.37Å; W429-Y432 AromaticContact CZ3-CE1 3.63Å; W429-Y432 HydrophobicContact CZ3-CE1 3.63Å; W429-Y432 HydrophobicContact CZ3-CG 4.4Å; W429-Y432 CarbonylContact O-C 3.53Å; W429-Y432 WeakPolarHBondContact O-CA 3.48Å; W429-Y432 VanDerWaalsContact O-CB 3.31Å; W429-Y432 WeakPolarHBondContact O-CB 3.47Å; W429-Y432 PolarHBondContact O-N 3.04Å; Y432-R434 VanDerWaalsContact C-N 3.25Å; Y432-R434 PolarHBondContact O-N 2.68Å; Y432-R435 PolarHBondContact O-N 3.42Å; Y432-V436 HydrophobicContact CD2-CG2 4.07Å; Y432-V436 HydrophobicContact CE2-CB 4.12Å; Y432-V436 HydrophobicContact CE2-CG2 3.69Å; Y432-V436 PolarHBondContact O-N 3.02Å
433	C	96.3	Very high	95	Very high	29 Å²	29	65 Å²	65	20%	0.196	32%	0.323	C	S	.	.	H	α-helix	trans	-63.5	-28.9	179.9	-62.4	0	0	0	0	113.1	W429 V436 P437	W429-C433 PolarHBondContact NE1-SG 3.15Å; W429-C433 VanDerWaalsContact NE1-SG 3.43Å; W429-C433 PolarHBondContact O-N 2.69Å; W429-C433 PolarHBondContact O-SG 2.78Å; W429-C433 VanDerWaalsContact O-SG 3.35Å; C433-V436 CarbonylContact O-C 3.43Å; C433-P437 VanDerWaalsContact O-CA 3.3Å; C433-P437 WeakPolarHBondContact O-CA 3.38Å
434	R	96.4	Very high	95.2	Very high	190 Å²	190	67.5 Å²	67.5	72%	0.717	32%	0.322	S	S	*	.	H	α-helix	trans	-70	-35.4	171.8	-76.6	-176.3	-68.5	-143.4	-1.6	113.1	D430 A431 Y432	D430-R434 WeakPolarHBondContact O-CG 3.16Å; D430-R434 PolarHBondContact O-N 3.4Å; D430-R434 VanDerWaalsContact O-N 3.16Å; A431-R434 PolarHBondContact O-N 3.2Å; Y432-R434 VanDerWaalsContact C-N 3.25Å; Y432-R434 PolarHBondContact O-N 2.68Å
435	R	96.1	Very high	95.3	Very high	130 Å²	130	66 Å²	66	49%	0.491	31%	0.313	S	S	.	.	H	α-helix	trans	-80	-35.8	-179.8	-172.2	166.2	-178.2	137.6	5.9	112.2	E354 A431 Y432 P437	E354-R435 IonicContact OE1-CZ 3.64Å; E354-R435 IonicContact OE1-NH2 2.86Å; E354-R435 PolarHBondContact OE1-NH2 2.99Å; E354-R435 IonicContact OE2-CZ 3.99Å; E354-R435 IonicContact OE2-NH2 2.6Å; E354-R435 PolarHBondContact OE2-NH2 2.98Å; A431-R435 PolarHBondContact O-N 2.9Å; Y432-R435 PolarHBondContact O-N 3.42Å; R435-P437 WeakPolarHBondContact O-CD 3.11Å
436	V	97	Very high	95.5	Very high	0 Å²	0	67.6 Å²	67.6	0%	0	32%	0.322	C	S	.	.	S	Bend	trans	-123.1	80.4	-178.9	-169.6	0	0	0	0	107.5	R374 Y432 C433 Y438	R374-V436 WeakPolarHBondContact CD-O 3.44Å; R374-V436 HydrophobicContact CG-CB 4.02Å; R374-V436 HydrophobicContact CG-CG1 3.73Å; R374-V436 WeakPolarHBondContact CG-O 3.25Å; R374-V436 PolarHBondContact NH1-O 2.96Å; Y432-V436 HydrophobicContact CD2-CG2 4.07Å; Y432-V436 HydrophobicContact CE2-CB 4.12Å; Y432-V436 HydrophobicContact CE2-CG2 3.69Å; Y432-V436 PolarHBondContact O-N 3.02Å; C433-V436 CarbonylContact O-C 3.43Å; V436-Y438 VanDerWaalsContact C-N 3.34Å; V436-Y438 PolarHBondContact O-N 3.27Å
437	P	95.7	Very high	95.6	Very high	70 Å²	70	69.5 Å²	69.5	46%	0.455	32%	0.323	S	S	.	.			trans	-69.7	-31.9	-170.9	26.5	-34.2	0	0	0	113	R374 C433 R435	R374-P437 VanDerWaalsContact NH1-C 3.31Å; R374-P437 PolarHBondContact NH1-O 3.22Å; C433-P437 VanDerWaalsContact O-CA 3.3Å; C433-P437 WeakPolarHBondContact O-CA 3.38Å; R435-P437 WeakPolarHBondContact O-CD 3.11Å
438	Y	97.4	Very high	95.6	Very high	71 Å²	71	65.4 Å²	65.4	28%	0.278	30%	0.299	S	S	.	.			trans	-81.6	136.7	-176	-51.8	-59.7	0	0	0	112.2	V373 R374 V436 Y443 Y445	V373-Y438 CarbonylContact C-O 3.24Å; V373-Y438 WeakPolarHBondContact CA-O 3.4Å; R374-Y438 PolarHBondContact N-O 3.06Å; V436-Y438 VanDerWaalsContact C-N 3.34Å; V436-Y438 PolarHBondContact O-N 3.27Å; Y438-Y443 AromaticContact CE2-CD1 3.68Å; Y438-Y443 HydrophobicContact CE2-CD1 3.68Å; Y438-Y443 AromaticContact CE2-CE1 3.94Å; Y438-Y443 HydrophobicContact CE2-CE1 3.94Å; Y438-Y443 HydrophobicContact CE2-CG 4.26Å; Y438-Y443 VanDerWaalsContact CZ-CA 3.48Å; Y438-Y443 AromaticContact CZ-CD1 3.67Å; Y438-Y443 WeakPolarHBondContact OH-CD1 3.45Å; Y438-Y445 CarbonylContact C-O 3.4Å; Y438-Y445 WeakPolarHBondContact CA-O 2.98Å
439	R	95.8	Very high	95.6	Very high	78 Å²	78	68.4 Å²	68.4	29%	0.294	31%	0.309	S	S	.	.	S	Bend	trans	-86.5	-58.1	-175.5	-67	166.5	176.8	-127	9.7	111.4	R374 H375 E414 Y445	R374-R439 PolarHBondContact N-O 3.37Å; H375-R439 WeakPolarHBondContact CB-O 3.27Å; H375-R439 PolarHBondContact N-O 3.26Å; E414-R439 VanDerWaalsContact CD-NH1 3.35Å; E414-R439 HydrophobicContact CG-CB 4.25Å; E414-R439 WeakPolarHBondContact OE1-CD 3.38Å; E414-R439 WeakPolarHBondContact OE1-CG 3.37Å; E414-R439 IonicContact OE1-CZ 3.5Å; E414-R439 IonicContact OE1-NE 3.51Å; E414-R439 IonicContact OE1-NH1 2.94Å; E414-R439 PolarHBondContact OE1-NH1 3.22Å; E414-R439 IonicContact OE2-CZ 3.93Å; E414-R439 IonicContact OE2-NH1 2.92Å; E414-R439 PolarHBondContact OE2-NH1 3.44Å; R439-Y445 HydrophobicContact CB-CD1 3.71Å; R439-Y445 HydrophobicContact CB-CE1 3.54Å; R439-Y445 WeakPolarHBondContact CB-O 3.49Å; R439-Y445 VanDerWaalsContact CD-CE1 3.45Å; R439-Y445 WeakPolarHBondContact CD-OH 3.49Å; R439-Y445 HydrophobicContact CG-CD1 4.49Å; R439-Y445 HydrophobicContact CG-CE1 4.14Å; R439-Y445 VanDerWaalsContact N-C 3.29Å; R439-Y445 PolarHBondContact N-O 3.24Å; R439-Y445 PolarHBondContact N-OXT 3.1Å; R439-Y445 PolarHBondContact NH1-OH 3.46Å
440	I	96.3	Very high	95.6	Very high	0 Å²	0	71.8 Å²	71.8	0%	0	33%	0.325	C	S	.	.	S	Bend	trans	-128.7	-48.8	-174	-56.5	177	0	0	0	110.2	H375 Y378 L379 L382 V411 E414 Y445	H375-I440 HydrophobicContact CB-CG1 4.33Å; Y378-I440 HydrophobicContact CD2-CD1 4.26Å; Y378-I440 HydrophobicContact CD2-CG1 4.43Å; L379-I440 HydrophobicContact CB-CG2 4.34Å; L382-I440 HydrophobicContact CD1-CG2 4.15Å; V411-I440 HydrophobicContact CG2-CD1 4.25Å; E414-I440 HydrophobicContact CB-CD1 4.32Å; E414-I440 HydrophobicContact CG-CG1 4.47Å; I440-Y445 HydrophobicContact CB-CD1 4.22Å; I440-Y445 HydrophobicContact CD1-CD1 4.48Å; I440-Y445 HydrophobicContact CD1-CE1 4.14Å; I440-Y445 HydrophobicContact CG1-CD1 4.29Å; I440-Y445 HydrophobicContact CG1-CE1 4.21Å; I440-Y445 PolarHBondContact N-OXT 3.37Å
441	F	95.1	Very high	95.5	Very high	63 Å²	63	73.6 Å²	73.6	28%	0.276	33%	0.331	S	S	.	.	S	Bend	trans	-103.4	111.9	-173.9	-63.3	-72.3	0	0	0	109.5	L379 L382 Y443 I444 Y445	L379-F441 HydrophobicContact CD1-CD1 3.87Å; L379-F441 HydrophobicContact CD1-CE1 4.08Å; L382-F441 HydrophobicContact CD1-CE1 4.15Å; L382-F441 HydrophobicContact CD1-CE2 4.31Å; L382-F441 HydrophobicContact CD1-CZ 3.57Å; F441-Y443 PolarHBondContact O-N 3.05Å; F441-I444 HydrophobicContact CB-CB 3.87Å; F441-I444 HydrophobicContact CB-CD1 4.45Å; F441-I444 HydrophobicContact CB-CG2 4.44Å; F441-I444 PolarHBondContact O-N 3.49Å; F441-I444 VanDerWaalsContact O-N 3.07Å; F441-Y445 PolarHBondContact N-OXT 3.38Å; F441-Y445 PolarHBondContact O-N 2.89Å
442	P	92.9	Very high	95.5	Very high	38 Å²	38	76.7 Å²	76.7	25%	0.247	34%	0.337	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.9	133.6	-177.5	26.3	-33.7	0	0	0	109.7	L372 V373 I444	L372-P442 HydrophobicContact CD1-CB 4.29Å; L372-P442 HydrophobicContact CG-CB 4.34Å; V373-P442 HydrophobicContact CG1-CB 3.86Å; V373-P442 HydrophobicContact CG1-CG 4.4Å; P442-I444 PolarHBondContact O-N 3.19Å
443	Y	93.6	Very high	95.4	Very high	173 Å²	173	81.9 Å²	81.9	68%	0.678	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.8	6.9	-179.6	-46.4	-76.2	0	0	0	116.3	Y438 F441	Y438-Y443 AromaticContact CE2-CD1 3.68Å; Y438-Y443 HydrophobicContact CE2-CD1 3.68Å; Y438-Y443 AromaticContact CE2-CE1 3.94Å; Y438-Y443 HydrophobicContact CE2-CE1 3.94Å; Y438-Y443 HydrophobicContact CE2-CG 4.26Å; Y438-Y443 VanDerWaalsContact CZ-CA 3.48Å; Y438-Y443 AromaticContact CZ-CD1 3.67Å; Y438-Y443 WeakPolarHBondContact OH-CD1 3.45Å; F441-Y443 PolarHBondContact O-N 3.05Å
444	I	94.9	Very high	95.3	Very high	144 Å²	144	86.3 Å²	86.3	74%	0.738	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-126.8	-54.9	-178.2	-58	172	0	0	0	111.7	F441 P442	F441-I444 HydrophobicContact CB-CB 3.87Å; F441-I444 HydrophobicContact CB-CD1 4.45Å; F441-I444 HydrophobicContact CB-CG2 4.44Å; F441-I444 PolarHBondContact O-N 3.49Å; F441-I444 VanDerWaalsContact O-N 3.07Å; P442-I444 PolarHBondContact O-N 3.19Å
445	Y	92.7	Very high	95.2	Very high	79 Å²	79	76.9 Å²	76.9	31%	0.31	34%	0.343	S	S	.	.			trans	-146.1	0	-174.6	175.4	-95.6	0	0	0	110.3	V411 E414 Y438 R439 I440 F441	V411-Y445 HydrophobicContact CG2-CE1 4.48Å; E414-Y445 PolarHBondContact OE2-OH 3.12Å; Y438-Y445 CarbonylContact C-O 3.4Å; Y438-Y445 WeakPolarHBondContact CA-O 2.98Å; R439-Y445 HydrophobicContact CB-CD1 3.71Å; R439-Y445 HydrophobicContact CB-CE1 3.54Å; R439-Y445 WeakPolarHBondContact CB-O 3.49Å; R439-Y445 VanDerWaalsContact CD-CE1 3.45Å; R439-Y445 WeakPolarHBondContact CD-OH 3.49Å; R439-Y445 HydrophobicContact CG-CD1 4.49Å; R439-Y445 HydrophobicContact CG-CE1 4.14Å; R439-Y445 VanDerWaalsContact N-C 3.29Å; R439-Y445 PolarHBondContact N-O 3.24Å; R439-Y445 PolarHBondContact N-OXT 3.1Å; R439-Y445 PolarHBondContact NH1-OH 3.46Å; I440-Y445 HydrophobicContact CB-CD1 4.22Å; I440-Y445 HydrophobicContact CD1-CD1 4.48Å; I440-Y445 HydrophobicContact CD1-CE1 4.14Å; I440-Y445 HydrophobicContact CG1-CD1 4.29Å; I440-Y445 HydrophobicContact CG1-CE1 4.21Å; I440-Y445 PolarHBondContact N-OXT 3.37Å; F441-Y445 PolarHBondContact N-OXT 3.38Å; F441-Y445 PolarHBondContact O-N 2.89Å

Retrieved 445 of 445 residues in 548.1 ms (Link to these results)

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