A0A077Z9Q0_TRITR Loading...

Sodium dependent acetylcholine transporter

AlphaFold DB , UniProt , Accession A0A077Z9Q0, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 652 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	36.8	Very low	33.8	Very low	243 Å²	243	155.7 Å²	155.7	100%	1.197	85%	0.849	S	S	*	*				0	116.8	0	-104.1	170.3	167.1	0	0	107.8
2	S	34.8	Very low	33.3	Very low	111 Å²	111	153.9 Å²	153.9	78%	0.776	85%	0.847	S	S	*	*			trans	55.6	132.4	156.9	-124.8	0	0	0	0	119.7
3	T	35.1	Very low	33.2	Very low	131 Å²	131	152.3 Å²	152.3	80%	0.804	84%	0.844	S	S	*	*			cis	-174.9	150.2	-7.1	10.4	0	0	0	0	104.9
4	A	35.5	Very low	33	Very low	97 Å²	97	150.8 Å²	150.8	80%	0.802	84%	0.841	S	S	*	*			trans	-66.6	157.5	-175.6	0	0	0	0	0	115.8
5	S	36.7	Very low	32.9	Very low	123 Å²	123	146.5 Å²	146.5	86%	0.86	83%	0.832	S	S	*	*				-149	133.1	129.7	60.9	0	0	0	0	110.4
6	F	32.9	Very low	32.9	Very low	190 Å²	190	143.9 Å²	143.9	83%	0.833	82%	0.823	S	S	*	*			trans	-96.3	173.1	178.8	-131.1	-101.2	0	0	0	109.3
7	D	33.4	Very low	32.8	Very low	139 Å²	139	142 Å²	142	74%	0.743	82%	0.817	S	S	*	*			trans	104.4	126.7	169.7	-61.1	-25.9	0	0	0	115
8	Q	32.6	Very low	32.9	Very low	171 Å²	171	140.4 Å²	140.4	80%	0.799	81%	0.81	S	S	*	*			cis	-159.8	158.8	-1.1	-104.2	-169.9	-3.3	0	0	107.5
9	P	30.6	Very low	32.8	Very low	120 Å²	120	140.3 Å²	140.3	78%	0.779	81%	0.806	S	S	*	*			trans	-82.3	136.4	-175.7	32.8	-30.9	0	0	0	112.6	Q11	P9-Q11 PolarHBondContact O-N 2.81Å
10	K	32.2	Very low	33	Very low	203 Å²	203	141.5 Å²	141.5	88%	0.883	80%	0.798	S	S	*	*			trans	-59.1	120.1	175.7	-70.4	176.6	176.5	178.2	0	111.2	T12	K10-T12 PolarHBondContact O-N 3.38Å
11	Q	30.8	Very low	32.9	Very low	185 Å²	185	142.1 Å²	142.1	86%	0.864	80%	0.795	S	S	*	*			trans	-72.4	110.7	161.9	-85.6	-179.4	-22.7	0	0	109.6	P9 V13	P9-Q11 PolarHBondContact O-N 2.81Å; Q11-V13 PolarHBondContact O-N 3.44Å
12	T	28.2	Very low	33	Very low	134 Å²	134	136.5 Å²	136.5	82%	0.822	77%	0.768	S	S	*	*			trans	-71.3	108.4	162.7	27.4	0	0	0	0	109.7	K10	K10-T12 PolarHBondContact O-N 3.38Å
13	V	31.9	Very low	32.9	Very low	133 Å²	133	137.8 Å²	137.8	81%	0.806	76%	0.762	S	S	*	*			trans	-84.5	106.6	167.2	178.1	0	0	0	0	107.9	Q11 A15	Q11-V13 PolarHBondContact O-N 3.44Å; V13-A15 PolarHBondContact O-N 3.2Å
14	T	29.9	Very low	33.2	Very low	131 Å²	131	137 Å²	137	80%	0.804	75%	0.745	S	S	*	*			trans	-71.3	110.4	168.7	42.2	0	0	0	0	109.6
15	A	31.9	Very low	33.7	Very low	86 Å²	86	134.6 Å²	134.6	71%	0.711	72%	0.721	S	S	*	*	P	Polyproline II helix	trans	-74.3	145	165.6	0	0	0	0	0	110	V13	V13-A15 PolarHBondContact O-N 3.2Å
16	P	33.2	Very low	34.1	Very low	105 Å²	105	133.5 Å²	133.5	68%	0.682	70%	0.701	S	S	*	*	P	Polyproline II helix	trans	-69.1	151.1	176.6	30.9	-33	0	0	0	110.2	V18	P16-V18 PolarHBondContact O-N 3.09Å
17	P	31.8	Very low	34.8	Very low	112 Å²	112	130 Å²	130	73%	0.727	69%	0.688	S	S	*	*	P	Polyproline II helix	trans	-70.7	122.3	-179.8	30.8	-31.1	0	0	0	108.6
18	V	33.7	Very low	35.3	Very low	113 Å²	113	130.3 Å²	130.3	69%	0.685	69%	0.689	S	S	*	*			trans	-97.2	84.4	168	178.4	0	0	0	0	106	P16 Y20	P16-V18 PolarHBondContact O-N 3.09Å; V18-Y20 HydrophobicContact CG1-CD2 3.49Å; V18-Y20 VanDerWaalsContact CG1-CD2 3.49Å; V18-Y20 HydrophobicContact CG1-CE2 3.87Å; V18-Y20 PolarHBondContact O-N 3Å; V18-Y20 VanDerWaalsContact O-N 3.07Å
19	D	31.2	Very low	36.1	Very low	139 Å²	139	126.3 Å²	126.3	74%	0.743	68%	0.676	S	S	*	*			trans	-73.9	92.1	170.3	-75.6	-21.9	0	0	0	108.8
20	Y	37.6	Very low	37	Very low	163 Å²	163	124.8 Å²	124.8	64%	0.639	67%	0.674	S	S	*	*			trans	-118.8	78.5	154.3	-73.4	-71.4	0	0	0	107.1	V18 I22	V18-Y20 HydrophobicContact CG1-CD2 3.49Å; V18-Y20 VanDerWaalsContact CG1-CD2 3.49Å; V18-Y20 HydrophobicContact CG1-CE2 3.87Å; V18-Y20 PolarHBondContact O-N 3Å; V18-Y20 VanDerWaalsContact O-N 3.07Å; Y20-I22 PolarHBondContact O-N 2.87Å; Y20-I22 VanDerWaalsContact O-N 3.08Å
21	E	29.2	Very low	37.7	Very low	156 Å²	156	123 Å²	123	73%	0.729	67%	0.674	S	S	*	*			trans	-62.5	109.5	161.1	-79.1	177.4	155.6	0	0	107.5	E23	E21-E23 PolarHBondContact O-N 3.08Å
22	I	39.1	Very low	39	Very low	124 Å²	124	115.8 Å²	115.8	64%	0.636	64%	0.644	S	S	*	*			trans	-67.2	85	153	-61	172.2	0	0	0	104.2	Y20 Y24	Y20-I22 PolarHBondContact O-N 2.87Å; Y20-I22 VanDerWaalsContact O-N 3.08Å; I22-Y24 PolarHBondContact O-N 3.23Å
23	E	34.5	Very low	40.9	Very low	139 Å²	139	115.1 Å²	115.1	65%	0.65	64%	0.64	S	S	*	*			trans	-78.7	109.7	179.1	-138.9	177.8	-173.6	0	0	107.2	E21 P25	E21-E23 PolarHBondContact O-N 3.08Å; E23-P25 WeakPolarHBondContact O-CD 3.3Å
24	Y	41.3	Very low	42.8	Very low	113 Å²	113	110.8 Å²	110.8	44%	0.443	61%	0.611	S	S	.	*			trans	-66.9	108	175.7	-65.5	-92.7	0	0	0	109	I22 F26 A596 P608	I22-Y24 PolarHBondContact O-N 3.23Å; Y24-F26 HydrophobicContact CD1-CE2 4.09Å; Y24-F26 HydrophobicContact CG-CE2 4.39Å; Y24-F26 PolarHBondContact O-N 2.94Å; Y24-A596 HydrophobicContact CD1-CB 4.25Å; Y24-P608 HydrophobicContact CD1-CG 4.5Å; Y24-P608 VanDerWaalsContact CE1-CD 3.43Å; Y24-P608 HydrophobicContact CE1-CG 3.67Å; Y24-P608 HydrophobicContact CE2-CG 4.18Å; Y24-P608 VanDerWaalsContact CZ-CG 3.47Å; Y24-P608 WeakPolarHBondContact OH-CG 3.29Å
25	P	44.3	Very low	45.2	Very low	48 Å²	48	106.9 Å²	106.9	31%	0.312	58%	0.583	S	S	.	*			trans	-92.7	82.9	171.8	24.2	-4	0	0	0	106.7	E23 E27 L595	E23-P25 WeakPolarHBondContact O-CD 3.3Å; P25-E27 PolarHBondContact O-N 3.03Å; P25-L595 HydrophobicContact CG-CD2 4.24Å
26	F	46.9	Very low	47.5	Very low	100 Å²	100	103.4 Å²	103.4	44%	0.439	55%	0.553	S	S	.	*			trans	-78	33	148	-56.6	-75	0	0	0	110	Y24 D28 I607 E609	Y24-F26 HydrophobicContact CD1-CE2 4.09Å; Y24-F26 HydrophobicContact CG-CE2 4.39Å; Y24-F26 PolarHBondContact O-N 2.94Å; F26-D28 PolarHBondContact O-N 2.01Å; F26-I607 HydrophobicContact CZ-CG2 3.8Å; F26-E609 VanDerWaalsContact CE2-CD 3.42Å; F26-E609 VanDerWaalsContact CE2-OE1 3.27Å; F26-E609 WeakPolarHBondContact CE2-OE1 2.95Å; F26-E609 WeakPolarHBondContact CE2-OE2 3.22Å; F26-E609 VanDerWaalsContact CZ-OE2 3.27Å; F26-E609 WeakPolarHBondContact CZ-OE2 3.04Å
27	E	46.5	Very low	49.5	Very low	117 Å²	117	103 Å²	103	55%	0.547	54%	0.54	S	S	.	.			trans	-68.3	117.3	167.8	-73.9	-168.5	160.7	0	0	107.4	P25 T29 K37	P25-E27 PolarHBondContact O-N 3.03Å; E27-T29 PolarHBondContact O-N 3.3Å; E27-K37 WeakPolarHBondContact OE2-CD 3.02Å; E27-K37 IonicContact OE2-NZ 3.07Å; E27-K37 PolarHBondContact OE2-NZ 3.08Å
28	D	43.9	Very low	51.4	Low	144 Å²	144	102.4 Å²	102.4	77%	0.77	53%	0.53	S	S	*	.			trans	-38	99.4	175.7	-77.2	-40.9	0	0	0	112.1	F26 A30	F26-D28 PolarHBondContact O-N 2.01Å; D28-A30 PolarHBondContact O-N 2.93Å
29	T	50.5	Low	53.4	Low	87 Å²	87	99.5 Å²	99.5	53%	0.534	51%	0.507	S	S	.	.	G	3₁₀ helix	trans	-73.5	-3.9	173.4	48.6	0	0	0	0	112.1	E27 N31 S32	E27-T29 PolarHBondContact O-N 3.3Å; T29-N31 PolarHBondContact O-N 3.38Å; T29-S32 WeakPolarHBondContact CA-OG 3.48Å; T29-S32 PolarHBondContact O-N 3.47Å; T29-S32 VanDerWaalsContact O-N 3.16Å
30	A	47.9	Very low	55.8	Low	89 Å²	89	93.5 Å²	93.5	74%	0.736	48%	0.478	S	S	*	.	G	3₁₀ helix	trans	-54.8	-27.5	179.7	0	0	0	0	0	113.2	D28	D28-A30 PolarHBondContact O-N 2.93Å
31	N	48.1	Very low	58.1	Low	165 Å²	165	86.2 Å²	86.2	88%	0.882	45%	0.45	S	S	*	.	G	3₁₀ helix	trans	-116.8	2.2	179.4	-72.3	-25.6	0	0	0	114.9	T29	T29-N31 PolarHBondContact O-N 3.38Å
32	S	56.7	Low	60.8	Low	33 Å²	33	79.5 Å²	79.5	23%	0.231	42%	0.418	C	S	.	.			trans	-104	125.7	178.4	63.9	0	0	0	0	112	T29 E34	T29-S32 WeakPolarHBondContact CA-OG 3.48Å; T29-S32 PolarHBondContact O-N 3.47Å; T29-S32 VanDerWaalsContact O-N 3.16Å; S32-E34 PolarHBondContact O-N 2.79Å; S32-E34 VanDerWaalsContact O-N 3.17Å; S32-E34 PolarHBondContact OG-O 3.46Å; S32-E34 VanDerWaalsContact OG-O 3.08Å
33	V	69.9	Low	62.9	Low	120 Å²	120	76.9 Å²	76.9	73%	0.727	41%	0.411	S	S	*	.	S	Bend	trans	-63	-20.1	175.2	-178.2	0	0	0	0	112.2
34	E	71.4	Confident	65.5	Low	42 Å²	42	72.1 Å²	72.1	20%	0.196	39%	0.393	C	S	.	.			trans	-102.2	130	-178.4	-56.7	-170	133.7	0	0	111	S32 R253	S32-E34 PolarHBondContact O-N 2.79Å; S32-E34 VanDerWaalsContact O-N 3.17Å; S32-E34 PolarHBondContact OG-O 3.46Å; S32-E34 VanDerWaalsContact OG-O 3.08Å; E34-R253 IonicContact OE1-CZ 2.66Å; E34-R253 IonicContact OE1-NE 3.07Å; E34-R253 PolarHBondContact OE1-NE 2.91Å; E34-R253 IonicContact OE1-NH2 3.71Å; E34-R253 PolarHBondContact OE1-NH2 3Å; E34-R253 IonicContact OE2-NH2 3.14Å; E34-R253 PolarHBondContact OE2-NH2 2.92Å
35	E	80.5	Confident	67.8	Low	49 Å²	49	72.1 Å²	72.1	23%	0.229	39%	0.392	C	S	.	.	S	Bend	trans	-79.1	-40.6	177.5	-175.1	-170	140.9	0	0	110.5	N41 R330 F331 L595 H598	E35-N41 PolarHBondContact N-OD1 3.14Å; E35-R330 VanDerWaalsContact OE2-CA 3.3Å; E35-R330 WeakPolarHBondContact OE2-CA 3.26Å; E35-R330 WeakPolarHBondContact OE2-CB 3.16Å; E35-R330 VanDerWaalsContact OE2-CG 3.23Å; E35-R330 WeakPolarHBondContact OE2-CG 3.4Å; E35-F331 WeakPolarHBondContact OE1-CB 3.44Å; E35-F331 PolarHBondContact OE1-N 3.4Å; E35-L595 HydrophobicContact CG-CD1 3.76Å; E35-L595 WeakPolarHBondContact O-CD1 3.27Å; E35-H598 IonicContact OE1-CD2 3.7Å; E35-H598 IonicContact OE1-CE1 3.39Å; E35-H598 PolarHBondContact OE1-CE1 3.16Å; E35-H598 IonicContact OE1-NE2 3.16Å; E35-H598 PolarHBondContact OE1-NE2 2.96Å
36	N	78.6	Confident	69.9	Low	13 Å²	13	73.6 Å²	73.6	7%	0.07	40%	0.4	C	S	.	.			trans	-117.1	94.6	177	-173.2	-21	0	0	0	109.9	I38 R39 G40 N41 L595	N36-I38 PolarHBondContact O-N 3.3Å; N36-I38 PolarHBondContact OD1-N 3.47Å; N36-I38 VanDerWaalsContact OD1-N 3.12Å; N36-R39 HydrophobicContact CB-CB 4.39Å; N36-R39 WeakPolarHBondContact ND2-CB 3.36Å; N36-R39 PolarHBondContact OD1-N 3.02Å; N36-G40 CarbonylContact O-C 3.59Å; N36-G40 WeakPolarHBondContact O-CA 3.44Å; N36-G40 PolarHBondContact O-N 2.82Å; N36-N41 PolarHBondContact N-OD1 3.33Å; N36-L595 HydrophobicContact CB-CD1 4.27Å; N36-L595 HydrophobicContact CB-CD2 4.47Å
37	K	75.3	Confident	71.9	Confident	96 Å²	96	69.4 Å²	69.4	42%	0.417	38%	0.382	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-25	178.4	-65.6	-179.2	-172.4	169.6	0	113.4	E27	E27-K37 WeakPolarHBondContact OE2-CD 3.02Å; E27-K37 IonicContact OE2-NZ 3.07Å; E27-K37 PolarHBondContact OE2-NZ 3.08Å
38	I	72.3	Confident	73.9	Confident	100 Å²	100	63.9 Å²	63.9	51%	0.513	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.6	-50.1	-176.2	-63.4	174.2	0	0	0	110.5	N36 R430	N36-I38 PolarHBondContact O-N 3.3Å; N36-I38 PolarHBondContact OD1-N 3.47Å; N36-I38 VanDerWaalsContact OD1-N 3.12Å; I38-R430 PolarHBondContact O-NH2 3.41Å
39	R	76.2	Confident	76.3	Confident	52 Å²	52	58 Å²	58	20%	0.196	33%	0.325	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78	-37.3	176.8	-167.8	68.6	174.6	140.9	-0.2	111.2	N36 S104 S327 Y328 D423	N36-R39 HydrophobicContact CB-CB 4.39Å; N36-R39 WeakPolarHBondContact ND2-CB 3.36Å; N36-R39 PolarHBondContact OD1-N 3.02Å; R39-S104 WeakPolarHBondContact CD-O 3.46Å; R39-S104 PolarHBondContact NE-O 2.66Å; R39-S327 PolarHBondContact NE-OG 3.25Å; R39-S327 PolarHBondContact NH2-OG 3.33Å; R39-Y328 HydrophobicContact CG-CD1 3.99Å; R39-Y328 HydrophobicContact CG-CE1 3.98Å; R39-Y328 PolarHBondContact NH1-OH 3.33Å; R39-Y328 WeakPolarHBondContact O-CE1 3.45Å; R39-D423 IonicContact CZ-OD2 2.62Å; R39-D423 IonicContact NH1-OD1 2.66Å; R39-D423 IonicContact NH1-OD2 3.28Å; R39-D423 PolarHBondContact NH1-OD2 3.28Å; R39-D423 IonicContact NH2-OD2 2.71Å; R39-D423 PolarHBondContact NH2-OD2 3.08Å
40	G	80.5	Confident	78.2	Confident	14 Å²	14	55.1 Å²	55.1	14%	0.144	31%	0.306	C	S	.	.			trans	82.5	160.8	-162.5	0	0	0	0	0	111	N36 Y328	N36-G40 CarbonylContact O-C 3.59Å; N36-G40 WeakPolarHBondContact O-CA 3.44Å; N36-G40 PolarHBondContact O-N 2.82Å; G40-Y328 WeakPolarHBondContact O-CD1 3.4Å
41	N	85.9	Confident	80.1	Confident	9 Å²	9	51.1 Å²	51.1	5%	0.048	27%	0.273	C	S	.	.			trans	-122.4	160.4	172.2	-69.1	103.8	0	0	0	111	E35 N36 Y328 N329	E35-N41 PolarHBondContact N-OD1 3.14Å; N36-N41 PolarHBondContact N-OD1 3.33Å; N41-Y328 VanDerWaalsContact CA-O 3.24Å; N41-Y328 WeakPolarHBondContact CA-O 3.08Å; N41-Y328 PolarHBondContact ND2-O 2.91Å; N41-Y328 VanDerWaalsContact ND2-O 3.15Å; N41-N329 PolarHBondContact ND2-O 3.48Å
42	W	86	Confident	82.1	Confident	15 Å²	15	43.2 Å²	43.2	6%	0.057	23%	0.23	C	C	.	.			trans	-57.3	142.3	161.6	-66.6	106.3	0	0	0	110.2	S44 E47 C48 S51 V252 L325 Y328 N329	W42-S44 PolarHBondContact O-N 3.4Å; W42-E47 HydrophobicContact CE3-CB 4.08Å; W42-C48 HydrophobicContact CB-CB 4.39Å; W42-C48 HydrophobicContact CD2-CB 3.94Å; W42-C48 HydrophobicContact CG-CB 3.71Å; W42-C48 PolarHBondContact NE1-SG 3.36Å; W42-S51 WeakPolarHBondContact CH2-OG 3.36Å; W42-V252 HydrophobicContact CD2-CG1 3.59Å; W42-V252 HydrophobicContact CE3-CG1 3.4Å; W42-V252 VanDerWaalsContact CE3-CG1 3.4Å; W42-V252 HydrophobicContact CG-CG1 4.48Å; W42-V252 HydrophobicContact CH2-CG1 3.45Å; W42-V252 VanDerWaalsContact CH2-CG1 3.45Å; W42-V252 HydrophobicContact CZ2-CG1 3.61Å; W42-V252 HydrophobicContact CZ3-CB 4.48Å; W42-V252 HydrophobicContact CZ3-CG1 3.32Å; W42-V252 WeakPolarHBondContact CZ3-O 3.35Å; W42-L325 HydrophobicContact CH2-CD2 4.09Å; W42-L325 HydrophobicContact CZ2-CB 4.44Å; W42-L325 HydrophobicContact CZ2-CD2 3.72Å; W42-L325 PolarHBondContact NE1-O 3.15Å; W42-Y328 PolarHBondContact N-O 2.99Å; W42-Y328 VanDerWaalsContact N-O 3.12Å; W42-N329 VanDerWaalsContact CD1-OD1 3.25Å
43	S	84.4	Confident	83.7	Confident	70 Å²	70	41.9 Å²	41.9	49%	0.49	22%	0.221	S	C	.	.	S	Bend	trans	-69.1	-26.5	179.2	83.4	0	0	0	0	111.9	E47	S43-E47 WeakPolarHBondContact CB-OE2 2.92Å; S43-E47 PolarHBondContact N-OE2 3.3Å; S43-E47 PolarHBondContact OG-OE1 3.17Å; S43-E47 PolarHBondContact OG-OE2 2.9Å
44	S	87.6	Confident	84.6	Confident	39 Å²	39	36.4 Å²	36.4	27%	0.273	19%	0.188	S	C	.	.	S	Bend	trans	-150.9	156	174.6	58.7	0	0	0	0	111.2	W42 T46 E47 C48	W42-S44 PolarHBondContact O-N 3.4Å; S44-T46 PolarHBondContact O-N 3.34Å; S44-T46 PolarHBondContact OG-OG1 3.37Å; S44-T46 VanDerWaalsContact OG-OG1 3.13Å; S44-E47 PolarHBondContact O-N 3.14Å; S44-E47 WeakPolarHBondContact OG-CG 3.41Å; S44-E47 PolarHBondContact OG-N 3.01Å; S44-C48 PolarHBondContact O-N 3.41Å
45	R	89.6	Confident	85.3	Confident	112 Å²	112	34.7 Å²	34.7	42%	0.423	18%	0.181	S	C	.	.	H	α-helix	trans	-60	-34.3	174.5	-177.3	-179.8	175.4	-172	3.5	112.3	C48 L49 D334 D338	R45-C48 WeakPolarHBondContact O-CB 3.27Å; R45-C48 PolarHBondContact O-N 3.04Å; R45-L49 HydrophobicContact CG-CD1 4.23Å; R45-L49 HydrophobicContact CG-CG 4.45Å; R45-L49 WeakPolarHBondContact O-CG 3.29Å; R45-L49 PolarHBondContact O-N 3.39Å; R45-D334 PolarHBondContact NH2-O 3.32Å; R45-D338 IonicContact CZ-OD1 2.95Å; R45-D338 IonicContact NE-OD1 3.24Å; R45-D338 PolarHBondContact NE-OD1 3.2Å; R45-D338 IonicContact NE-OD2 3.21Å; R45-D338 IonicContact NH2-OD1 3.98Å; R45-D338 PolarHBondContact NH2-OD1 3.15Å
46	T	89.2	Confident	85.7	Confident	79 Å²	79	32.5 Å²	32.5	49%	0.485	17%	0.17	S	C	.	.	H	α-helix	trans	-66.5	-35.7	179	47.3	0	0	0	0	112.5	S44 L49 L50 Y260	S44-T46 PolarHBondContact O-N 3.34Å; S44-T46 PolarHBondContact OG-OG1 3.37Å; S44-T46 VanDerWaalsContact OG-OG1 3.13Å; T46-L49 PolarHBondContact O-N 3.43Å; T46-L50 WeakPolarHBondContact O-CB 3.49Å; T46-L50 PolarHBondContact O-N 2.84Å; T46-Y260 PolarHBondContact OG1-OH 2.86Å
47	E	89.5	Confident	86	Confident	12 Å²	12	32.1 Å²	32.1	6%	0.056	17%	0.168	C	C	.	.	H	α-helix	trans	-62.9	-42	173.3	-79	-179.6	-178.6	0	0	112.3	W42 S43 S44 S51 Y260	W42-E47 HydrophobicContact CE3-CB 4.08Å; S43-E47 WeakPolarHBondContact CB-OE2 2.92Å; S43-E47 PolarHBondContact N-OE2 3.3Å; S43-E47 PolarHBondContact OG-OE1 3.17Å; S43-E47 PolarHBondContact OG-OE2 2.9Å; S44-E47 PolarHBondContact O-N 3.14Å; S44-E47 WeakPolarHBondContact OG-CG 3.41Å; S44-E47 PolarHBondContact OG-N 3.01Å; E47-S51 WeakPolarHBondContact O-CB 3.41Å; E47-S51 PolarHBondContact O-N 3.31Å; E47-S51 PolarHBondContact O-OG 3.46Å; E47-Y260 HydrophobicContact CG-CD2 4.32Å; E47-Y260 HydrophobicContact CG-CE2 3.4Å
48	C	88.9	Confident	86.3	Confident	1 Å²	1	27.9 Å²	27.9	1%	0.007	15%	0.15	C	C	.	.	H	α-helix	trans	-60.4	-55.7	173.9	-178.5	0	0	0	0	110.8	W42 S44 R45 L50 S51 C52 Y97 N329	W42-C48 HydrophobicContact CB-CB 4.39Å; W42-C48 HydrophobicContact CD2-CB 3.94Å; W42-C48 HydrophobicContact CG-CB 3.71Å; W42-C48 PolarHBondContact NE1-SG 3.36Å; S44-C48 PolarHBondContact O-N 3.41Å; R45-C48 WeakPolarHBondContact O-CB 3.27Å; R45-C48 PolarHBondContact O-N 3.04Å; C48-L50 VanDerWaalsContact C-N 3.29Å; C48-L50 PolarHBondContact O-N 3.22Å; C48-S51 WeakPolarHBondContact O-CB 3.3Å; C48-S51 PolarHBondContact O-N 2.79Å; C48-S51 VanDerWaalsContact O-N 3.17Å; C48-C52 PolarHBondContact O-N 3.49Å; C48-C52 PolarHBondContact O-SG 3.21Å; C48-Y97 PolarHBondContact SG-OH 3.01Å; C48-Y97 VanDerWaalsContact SG-OH 3.36Å; C48-N329 PolarHBondContact SG-OD1 3.16Å
49	L	92.6	Very high	86.8	Confident	20 Å²	20	23.2 Å²	23.2	11%	0.105	13%	0.126	C	C	.	.	H	α-helix	trans	-57.4	-43.8	-177.9	-73	177.8	0	0	0	111.7	R45 T46 C52 V53 D338 F341 L342	R45-L49 HydrophobicContact CG-CD1 4.23Å; R45-L49 HydrophobicContact CG-CG 4.45Å; R45-L49 WeakPolarHBondContact O-CG 3.29Å; R45-L49 PolarHBondContact O-N 3.39Å; T46-L49 PolarHBondContact O-N 3.43Å; L49-C52 WeakPolarHBondContact O-CB 3.38Å; L49-C52 PolarHBondContact O-N 3.47Å; L49-V53 VanDerWaalsContact O-CG2 3.28Å; L49-V53 WeakPolarHBondContact O-CG2 3.42Å; L49-V53 PolarHBondContact O-N 3.36Å; L49-D338 HydrophobicContact CD2-CB 3.75Å; L49-F341 HydrophobicContact CB-CD1 4.36Å; L49-F341 HydrophobicContact CB-CE1 4.11Å; L49-F341 HydrophobicContact CD1-CD1 4.1Å; L49-F341 HydrophobicContact CD1-CE1 4.31Å; L49-F341 HydrophobicContact CD2-CD1 3.94Å; L49-F341 HydrophobicContact CG-CD1 4.37Å; L49-L342 HydrophobicContact CD2-CD2 4.35Å; L49-L342 HydrophobicContact CD2-CG 4.44Å
50	L	90.7	Very high	87.2	Confident	28 Å²	28	22.2 Å²	22.2	15%	0.147	12%	0.122	C	C	.	.	H	α-helix	trans	-72.9	-30	-178.4	-163.9	63.7	0	0	0	113.4	T46 C48 G54 A259 Y260 T263 I264	T46-L50 WeakPolarHBondContact O-CB 3.49Å; T46-L50 PolarHBondContact O-N 2.84Å; C48-L50 VanDerWaalsContact C-N 3.29Å; C48-L50 PolarHBondContact O-N 3.22Å; L50-G54 PolarHBondContact O-N 3.12Å; L50-A259 HydrophobicContact CB-CB 4.47Å; L50-A259 WeakPolarHBondContact CD2-O 3.43Å; L50-A259 HydrophobicContact CG-CB 4.41Å; L50-A259 WeakPolarHBondContact CG-O 3.27Å; L50-Y260 HydrophobicContact CD2-CD1 3.45Å; L50-Y260 VanDerWaalsContact CD2-CD1 3.45Å; L50-Y260 HydrophobicContact CD2-CE1 3.97Å; L50-Y260 HydrophobicContact CD2-CG 3.93Å; L50-T263 HydrophobicContact CD1-CG2 3.45Å; L50-T263 VanDerWaalsContact CD1-CG2 3.45Å; L50-T263 HydrophobicContact CG-CG2 4.14Å; L50-T263 PolarHBondContact O-OG1 3.2Å; L50-T263 VanDerWaalsContact O-OG1 3.07Å; L50-I264 HydrophobicContact CD1-CG1 4.33Å; L50-I264 HydrophobicContact CD2-CD1 4.1Å; L50-I264 HydrophobicContact CD2-CG1 4.19Å
51	S	89	Confident	87.5	Confident	4 Å²	4	21.7 Å²	21.7	3%	0.028	12%	0.116	C	C	.	.	H	α-helix	trans	-66.9	-43.7	169.8	-56.4	0	0	0	0	110.8	W42 E47 C48 G54 F55 A259	W42-S51 WeakPolarHBondContact CH2-OG 3.36Å; E47-S51 WeakPolarHBondContact O-CB 3.41Å; E47-S51 PolarHBondContact O-N 3.31Å; E47-S51 PolarHBondContact O-OG 3.46Å; C48-S51 WeakPolarHBondContact O-CB 3.3Å; C48-S51 PolarHBondContact O-N 2.79Å; C48-S51 VanDerWaalsContact O-N 3.17Å; S51-G54 PolarHBondContact O-N 2.93Å; S51-F55 PolarHBondContact O-N 2.87Å; S51-A259 WeakPolarHBondContact OG-CB 3.43Å
52	C	90	Very high	87.6	Confident	0 Å²	0	21.7 Å²	21.7	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-61.7	-44.5	173.9	-74.2	0	0	0	0	111.8	C48 L49 G54 F55 L56 F322 L342	C48-C52 PolarHBondContact O-N 3.49Å; C48-C52 PolarHBondContact O-SG 3.21Å; L49-C52 WeakPolarHBondContact O-CB 3.38Å; L49-C52 PolarHBondContact O-N 3.47Å; C52-G54 VanDerWaalsContact C-N 3.35Å; C52-G54 PolarHBondContact O-N 2.84Å; C52-F55 WeakPolarHBondContact O-CB 3.39Å; C52-F55 PolarHBondContact O-N 3.14Å; C52-L56 WeakPolarHBondContact O-CG 3.4Å; C52-L56 PolarHBondContact O-N 3.44Å; C52-F322 HydrophobicContact CB-CE1 3.94Å; C52-L342 HydrophobicContact CB-CD1 3.93Å; C52-L342 HydrophobicContact CB-CD2 3.44Å; C52-L342 VanDerWaalsContact CB-CD2 3.44Å; C52-L342 HydrophobicContact CB-CG 4.34Å
53	V	90.5	Very high	87.9	Confident	4 Å²	4	21.8 Å²	21.8	2%	0.024	12%	0.116	C	C	.	.	H	α-helix	trans	-63.2	-40.8	174.9	171.6	0	0	0	0	111.6	L49 F55 L56 F57 T263 F341 L342 F349	L49-V53 VanDerWaalsContact O-CG2 3.28Å; L49-V53 WeakPolarHBondContact O-CG2 3.42Å; L49-V53 PolarHBondContact O-N 3.36Å; V53-F55 VanDerWaalsContact C-N 3.26Å; V53-F55 PolarHBondContact O-N 2.99Å; V53-L56 WeakPolarHBondContact O-CB 3.35Å; V53-L56 PolarHBondContact O-N 3.14Å; V53-F57 PolarHBondContact O-N 3.49Å; V53-T263 HydrophobicContact CB-CG2 4.08Å; V53-T263 HydrophobicContact CG1-CG2 3.5Å; V53-F341 HydrophobicContact CG2-CE1 3.96Å; V53-L342 HydrophobicContact CG2-CD2 3.8Å; V53-F349 HydrophobicContact CG1-CD2 4.07Å; V53-F349 HydrophobicContact CG1-CE2 3.4Å; V53-F349 HydrophobicContact CG1-CZ 4.31Å
54	G	87.5	Confident	88.2	Confident	5 Å²	5	18.7 Å²	18.7	5%	0.052	10%	0.095	C	C	.	.	H	α-helix	trans	-63.3	-33.3	175.1	0	0	0	0	0	112.7	L50 S51 C52 T263	L50-G54 PolarHBondContact O-N 3.12Å; S51-G54 PolarHBondContact O-N 2.93Å; C52-G54 VanDerWaalsContact C-N 3.35Å; C52-G54 PolarHBondContact O-N 2.84Å; G54-T263 VanDerWaalsContact CA-OG1 3.29Å; G54-T263 WeakPolarHBondContact CA-OG1 3.47Å
55	F	86.7	Confident	88.4	Confident	7 Å²	7	16.8 Å²	16.8	3%	0.031	8%	0.082	C	C	.	.	H	α-helix	trans	-72.2	-39.5	173.4	-179	-114.5	0	0	0	112.6	S51 C52 V53 T316 W319 T321 F322 A415 V417	S51-F55 PolarHBondContact O-N 2.87Å; C52-F55 WeakPolarHBondContact O-CB 3.39Å; C52-F55 PolarHBondContact O-N 3.14Å; V53-F55 VanDerWaalsContact C-N 3.26Å; V53-F55 PolarHBondContact O-N 2.99Å; F55-T316 WeakPolarHBondContact CD1-OG1 3.42Å; F55-T316 HydrophobicContact CE1-CG2 4.29Å; F55-T316 WeakPolarHBondContact CE1-OG1 3.19Å; F55-T316 HydrophobicContact CZ-CG2 4.35Å; F55-W319 HydrophobicContact CZ-CE3 4.16Å; F55-T321 HydrophobicContact CD1-CG2 3.76Å; F55-T321 HydrophobicContact CD2-CG2 3.95Å; F55-T321 VanDerWaalsContact CE1-CB 3.45Å; F55-T321 HydrophobicContact CE1-CG2 3.63Å; F55-T321 HydrophobicContact CE2-CG2 3.86Å; F55-T321 HydrophobicContact CG-CG2 3.92Å; F55-T321 VanDerWaalsContact CZ-CB 3.49Å; F55-T321 HydrophobicContact CZ-CG2 3.71Å; F55-T321 VanDerWaalsContact CZ-OG1 3.3Å; F55-T321 WeakPolarHBondContact CZ-OG1 3.49Å; F55-F322 AromaticContact CD1-CE2 3.88Å; F55-F322 HydrophobicContact CD1-CE2 3.88Å; F55-F322 AromaticContact CD1-CZ 3.87Å; F55-F322 HydrophobicContact CD1-CZ 3.87Å; F55-F322 HydrophobicContact CE1-CD2 4.43Å; F55-F322 AromaticContact CE1-CE2 3.92Å; F55-F322 HydrophobicContact CE1-CE2 3.92Å; F55-F322 HydrophobicContact CE1-CZ 4.38Å; F55-A415 HydrophobicContact CD2-CB 4.42Å; F55-A415 VanDerWaalsContact CD2-O 3.31Å; F55-A415 WeakPolarHBondContact CD2-O 3.08Å; F55-A415 WeakPolarHBondContact CE2-O 3.48Å; F55-V417 HydrophobicContact CE2-CG2 3.95Å; F55-V417 HydrophobicContact CZ-CG2 4.4Å
56	L	88.1	Confident	88.5	Confident	3 Å²	3	11.5 Å²	11.5	2%	0.016	6%	0.062	C	C	.	.	H	α-helix	trans	-60.2	-53.6	174.4	-71.5	170.9	0	0	0	110.6	C52 V53 N58 H61 L315 F322 L342 D346	C52-L56 WeakPolarHBondContact O-CG 3.4Å; C52-L56 PolarHBondContact O-N 3.44Å; V53-L56 WeakPolarHBondContact O-CB 3.35Å; V53-L56 PolarHBondContact O-N 3.14Å; L56-N58 VanDerWaalsContact C-N 3.27Å; L56-N58 PolarHBondContact O-N 3.35Å; L56-N58 PolarHBondContact O-ND2 2.67Å; L56-H61 PolarHBondContact O-CE1 3.36Å; L56-H61 PolarHBondContact O-ND1 3.13Å; L56-H61 VanDerWaalsContact O-ND1 3.14Å; L56-L315 HydrophobicContact CD2-CB 4.3Å; L56-L315 HydrophobicContact CD2-CD2 3.73Å; L56-F322 HydrophobicContact CD2-CE2 4.27Å; L56-F322 HydrophobicContact CD2-CZ 3.65Å; L56-F322 HydrophobicContact CG-CZ 3.94Å; L56-L342 HydrophobicContact CD1-CB 3.96Å; L56-L342 HydrophobicContact CD1-CD2 4.02Å; L56-L342 HydrophobicContact CD1-CG 4.49Å; L56-D346 HydrophobicContact CD1-CB 4.39Å
57	F	85.8	Confident	88.6	Confident	5 Å²	5	10.1 Å²	10.1	2%	0.022	5%	0.05	C	C	.	.	S	Bend	trans	-74.7	79.4	-178.1	-175.3	-122.7	0	0	0	111.6	V53 H61 L62 P266 L270 V353 I411	V53-F57 PolarHBondContact O-N 3.49Å; F57-H61 HydrophobicContact CD2-CB 4.02Å; F57-H61 HydrophobicContact CE2-CB 4.05Å; F57-L62 HydrophobicContact CE2-CD2 4.27Å; F57-L62 HydrophobicContact CZ-CD2 3.91Å; F57-P266 HydrophobicContact CE1-CB 4.2Å; F57-L270 HydrophobicContact CE1-CD1 4.42Å; F57-L270 HydrophobicContact CZ-CD1 3.85Å; F57-V353 HydrophobicContact CE2-CG2 3.52Å; F57-V353 HydrophobicContact CZ-CG2 4.04Å; F57-I411 HydrophobicContact CD1-CD1 4.03Å; F57-I411 HydrophobicContact CD1-CG1 3.79Å; F57-I411 HydrophobicContact CE1-CD1 3.28Å; F57-I411 HydrophobicContact CE1-CG1 3.51Å; F57-I411 HydrophobicContact CZ-CD1 3.76Å; F57-I411 HydrophobicContact CZ-CG1 4.44Å; F57-I411 WeakPolarHBondContact O-CG2 3.27Å
58	N	80.3	Confident	88.8	Confident	7 Å²	7	10.7 Å²	10.7	4%	0.037	5%	0.053	C	C	.	.			trans	-103.8	173.6	-177.7	62.3	44.1	0	0	0	112.6	L56 R60 H61 T316	L56-N58 VanDerWaalsContact C-N 3.27Å; L56-N58 PolarHBondContact O-N 3.35Å; L56-N58 PolarHBondContact O-ND2 2.67Å; N58-R60 PolarHBondContact O-N 3.1Å; N58-R60 VanDerWaalsContact O-N 3.07Å; N58-R60 VanDerWaalsContact OD1-CB 3.3Å; N58-R60 WeakPolarHBondContact OD1-CB 3.48Å; N58-R60 PolarHBondContact OD1-N 3.09Å; N58-H61 PolarHBondContact N-ND1 3.38Å; N58-H61 WeakPolarHBondContact O-CB 3.47Å; N58-H61 PolarHBondContact O-N 2.88Å; N58-H61 PolarHBondContact OD1-N 3.46Å; N58-H61 PolarHBondContact OD1-ND1 3.03Å; N58-T316 VanDerWaalsContact ND2-CG2 3.25Å; N58-T316 WeakPolarHBondContact ND2-CG2 3.3Å
59	Y	83.1	Confident	88.9	Confident	1 Å²	1	10.6 Å²	10.6	0%	0.004	5%	0.053	C	C	.	.	H	α-helix	trans	-40.2	-45.3	174.4	176.9	-124.7	0	0	0	115.3	H61 L62 W63 Y135 V138 P380 V383 F412 F460	Y59-H61 PolarHBondContact O-N 3.25Å; Y59-L62 WeakPolarHBondContact O-CB 3.33Å; Y59-L62 PolarHBondContact O-N 3.48Å; Y59-W63 AromaticContact CD1-NE1 3.57Å; Y59-W63 AromaticContact CE1-CD1 3.77Å; Y59-W63 AromaticContact CE1-NE1 3.14Å; Y59-W63 AromaticContact CE2-CD1 3.86Å; Y59-W63 AromaticContact CZ-CD1 3.58Å; Y59-W63 AromaticContact CZ-NE1 3.44Å; Y59-Y135 HydrophobicContact CD1-CE1 4.27Å; Y59-V138 HydrophobicContact CD2-CG1 3.94Å; Y59-V138 HydrophobicContact CE2-CG1 4Å; Y59-P380 WeakPolarHBondContact OH-CA 3.37Å; Y59-P380 VanDerWaalsContact OH-CB 3.23Å; Y59-P380 WeakPolarHBondContact OH-CB 3.35Å; Y59-P380 WeakPolarHBondContact OH-CD 3.41Å; Y59-V383 HydrophobicContact CE2-CB 4.5Å; Y59-V383 HydrophobicContact CE2-CG2 4.09Å; Y59-F412 HydrophobicContact CD2-CE2 4.48Å; Y59-F412 AromaticContact CD2-CZ 3.87Å; Y59-F412 HydrophobicContact CD2-CZ 3.87Å; Y59-F412 HydrophobicContact CG-CE1 4.35Å; Y59-F412 AromaticContact CG-CZ 3.73Å; Y59-F412 HydrophobicContact CG-CZ 3.73Å; Y59-F460 HydrophobicContact CE1-CE1 4.34Å; Y59-F460 AromaticContact CE1-CZ 3.8Å; Y59-F460 HydrophobicContact CE1-CZ 3.8Å
60	R	85.4	Confident	88.8	Confident	31 Å²	31	10.6 Å²	10.6	12%	0.117	5%	0.054	C	C	.	.	H	α-helix	trans	-65.8	-28	-173	-175.5	-179.2	153.4	158.3	2	111.6	N58 L62 W63 A64 F313	N58-R60 PolarHBondContact O-N 3.1Å; N58-R60 VanDerWaalsContact O-N 3.07Å; N58-R60 VanDerWaalsContact OD1-CB 3.3Å; N58-R60 WeakPolarHBondContact OD1-CB 3.48Å; N58-R60 PolarHBondContact OD1-N 3.09Å; R60-L62 PolarHBondContact O-N 3.24Å; R60-W63 HydrophobicContact CG-CZ2 4.06Å; R60-W63 PolarHBondContact O-N 3.3Å; R60-A64 HydrophobicContact CG-CB 3.66Å; R60-A64 WeakPolarHBondContact O-CB 3.43Å; R60-A64 PolarHBondContact O-N 3.03Å; R60-F313 VanDerWaalsContact CZ-CD2 3.5Å; R60-F313 VanDerWaalsContact NH2-CB 3.27Å
61	H	86.9	Confident	88.7	Confident	3 Å²	3	12.3 Å²	12.3	1%	0.014	7%	0.066	C	C	.	.	H	α-helix	trans	-61.5	-34.4	173.7	-71.1	72.1	0	0	0	112.4	L56 F57 N58 Y59 W63 S314 D346 S350 V353	L56-H61 PolarHBondContact O-CE1 3.36Å; L56-H61 PolarHBondContact O-ND1 3.13Å; L56-H61 VanDerWaalsContact O-ND1 3.14Å; F57-H61 HydrophobicContact CD2-CB 4.02Å; F57-H61 HydrophobicContact CE2-CB 4.05Å; N58-H61 PolarHBondContact N-ND1 3.38Å; N58-H61 WeakPolarHBondContact O-CB 3.47Å; N58-H61 PolarHBondContact O-N 2.88Å; N58-H61 PolarHBondContact OD1-N 3.46Å; N58-H61 PolarHBondContact OD1-ND1 3.03Å; Y59-H61 PolarHBondContact O-N 3.25Å; H61-W63 VanDerWaalsContact C-N 3.28Å; H61-W63 PolarHBondContact O-N 3.24Å; H61-S314 PolarHBondContact CE1-O 3.31Å; H61-S314 PolarHBondContact NE2-OG 3.15Å; H61-D346 IonicContact CE1-OD1 2.84Å; H61-D346 IonicContact NE2-OD1 3.76Å; H61-D346 PolarHBondContact NE2-OD1 3.29Å; H61-D346 VanDerWaalsContact NE2-OD1 3.07Å; H61-S350 PolarHBondContact CD2-OG 3.2Å; H61-V353 WeakPolarHBondContact O-CG1 3.48Å
62	L	88.3	Confident	88.8	Confident	10 Å²	10	13.3 Å²	13.3	5%	0.052	7%	0.069	C	C	.	.	H	α-helix	trans	-65.4	-30.1	-176.9	-61.7	177.1	0	0	0	112.9	F57 Y59 R60 V353 V383 I408 I411	F57-L62 HydrophobicContact CE2-CD2 4.27Å; F57-L62 HydrophobicContact CZ-CD2 3.91Å; Y59-L62 WeakPolarHBondContact O-CB 3.33Å; Y59-L62 PolarHBondContact O-N 3.48Å; R60-L62 PolarHBondContact O-N 3.24Å; L62-V353 HydrophobicContact CD2-CG1 4.36Å; L62-V383 HydrophobicContact CB-CG2 3.83Å; L62-V383 HydrophobicContact CD1-CG1 4.26Å; L62-V383 HydrophobicContact CD1-CG2 4.4Å; L62-I408 HydrophobicContact CD1-CG1 4.47Å; L62-I411 HydrophobicContact CD1-CD1 4.33Å; L62-I411 HydrophobicContact CD2-CD1 4.49Å
63	W	90.8	Very high	88.5	Confident	17 Å²	17	13.6 Å²	13.6	6%	0.064	7%	0.072	C	C	.	.	H	α-helix	trans	-122.4	-36.3	-174.2	68.2	-97.1	0	0	0	115.6	Y59 R60 H61 H67 K378 L382 V383 E464	Y59-W63 AromaticContact CD1-NE1 3.57Å; Y59-W63 AromaticContact CE1-CD1 3.77Å; Y59-W63 AromaticContact CE1-NE1 3.14Å; Y59-W63 AromaticContact CE2-CD1 3.86Å; Y59-W63 AromaticContact CZ-CD1 3.58Å; Y59-W63 AromaticContact CZ-NE1 3.44Å; R60-W63 HydrophobicContact CG-CZ2 4.06Å; R60-W63 PolarHBondContact O-N 3.3Å; H61-W63 VanDerWaalsContact C-N 3.28Å; H61-W63 PolarHBondContact O-N 3.24Å; W63-H67 WeakPolarHBondContact O-CB 3.4Å; W63-H67 PolarHBondContact O-N 3.4Å; W63-K378 HydrophobicContact CE3-CG 3.81Å; W63-K378 HydrophobicContact CH2-CG 4.15Å; W63-K378 HydrophobicContact CZ3-CD 4.2Å; W63-K378 HydrophobicContact CZ3-CG 3.33Å; W63-L382 HydrophobicContact CB-CB 4.19Å; W63-L382 HydrophobicContact CB-CD2 3.74Å; W63-V383 HydrophobicContact CB-CG2 4.28Å; W63-E464 HydrophobicContact CZ2-CG 4.42Å
64	A	91.6	Very high	88.5	Confident	4 Å²	4	13.6 Å²	13.6	3%	0.033	7%	0.073	C	C	.	.	H	α-helix	trans	-69.1	-46	-171.6	0	0	0	0	0	111.7	R60 H67 L68	R60-A64 HydrophobicContact CG-CB 3.66Å; R60-A64 WeakPolarHBondContact O-CB 3.43Å; R60-A64 PolarHBondContact O-N 3.03Å; A64-H67 PolarHBondContact O-N 3.08Å; A64-L68 WeakPolarHBondContact O-CB 3.38Å; A64-L68 VanDerWaalsContact O-CG 3.22Å; A64-L68 WeakPolarHBondContact O-CG 3.48Å; A64-L68 PolarHBondContact O-N 3.35Å
65	L	91.2	Very high	88.7	Confident	0 Å²	0	14.4 Å²	14.4	0%	0	8%	0.079	C	C	.	.	H	α-helix	trans	-67.6	-47.9	-178.4	-80.5	162.9	0	0	0	113.1	H67 L68 A69 F77 Y81 Q310 S350	L65-H67 VanDerWaalsContact C-N 3.29Å; L65-H67 PolarHBondContact O-N 3.19Å; L65-L68 PolarHBondContact O-N 3.26Å; L65-A69 VanDerWaalsContact O-CB 3.31Å; L65-A69 WeakPolarHBondContact O-CB 3.35Å; L65-A69 PolarHBondContact O-N 3.49Å; L65-F77 HydrophobicContact CD2-CE1 4.11Å; L65-Y81 HydrophobicContact CD2-CD2 4.39Å; L65-Y81 HydrophobicContact CD2-CE2 4.1Å; L65-Q310 HydrophobicContact CD2-CG 3.55Å; L65-Q310 HydrophobicContact CG-CG 4.04Å; L65-S350 VanDerWaalsContact CD1-CB 3.41Å; L65-S350 WeakPolarHBondContact CD1-OG 3.47Å
66	P	92.5	Very high	89	Confident	0 Å²	0	14.2 Å²	14.2	0%	0	8%	0.078	C	C	.	.	H	α-helix	trans	-59.2	-40.2	175.4	-25.8	34.1	0	0	0	113	S70 V353 T357 Y358 L376	P66-S70 PolarHBondContact O-N 3.4Å; P66-V353 HydrophobicContact CG-CG1 4.37Å; P66-T357 HydrophobicContact CB-CG2 3.57Å; P66-T357 HydrophobicContact CG-CG2 3.9Å; P66-Y358 HydrophobicContact CB-CE2 4.46Å; P66-L376 HydrophobicContact CB-CD2 4.11Å
67	H	91.8	Very high	89.2	Confident	50 Å²	50	14 Å²	14	23%	0.231	8%	0.078	C	C	.	.	H	α-helix	trans	-62.9	-50.6	176.6	178.4	68.1	0	0	0	111.7	W63 A64 L65 A69 S70 T71 L376	W63-H67 WeakPolarHBondContact O-CB 3.4Å; W63-H67 PolarHBondContact O-N 3.4Å; A64-H67 PolarHBondContact O-N 3.08Å; L65-H67 VanDerWaalsContact C-N 3.29Å; L65-H67 PolarHBondContact O-N 3.19Å; H67-A69 PolarHBondContact O-N 2.9Å; H67-S70 VanDerWaalsContact O-CB 3.32Å; H67-S70 WeakPolarHBondContact O-CB 3.45Å; H67-S70 PolarHBondContact O-N 3.14Å; H67-S70 VanDerWaalsContact O-N 3.12Å; H67-T71 PolarHBondContact O-N 3.37Å; H67-T71 VanDerWaalsContact O-N 3.08Å; H67-T71 PolarHBondContact O-OG1 2.98Å; H67-T71 VanDerWaalsContact O-OG1 3.12Å; H67-L376 PolarHBondContact ND1-O 3.07Å
68	L	92.4	Very high	89.6	Confident	24 Å²	24	14.5 Å²	14.5	13%	0.126	8%	0.079	C	C	.	.	H	α-helix	trans	-63	-41	178.5	-71.6	169.8	0	0	0	112.4	A64 L65 S70 T71 Y72 F77 D306 Q310	A64-L68 WeakPolarHBondContact O-CB 3.38Å; A64-L68 VanDerWaalsContact O-CG 3.22Å; A64-L68 WeakPolarHBondContact O-CG 3.48Å; A64-L68 PolarHBondContact O-N 3.35Å; L65-L68 PolarHBondContact O-N 3.26Å; L68-S70 VanDerWaalsContact C-N 3.29Å; L68-S70 PolarHBondContact O-N 2.99Å; L68-T71 PolarHBondContact O-N 3.32Å; L68-Y72 HydrophobicContact CD2-CD2 4.44Å; L68-Y72 HydrophobicContact CD2-CE2 3.97Å; L68-Y72 WeakPolarHBondContact O-CB 3.22Å; L68-Y72 VanDerWaalsContact O-CD2 3.3Å; L68-Y72 WeakPolarHBondContact O-CD2 3.39Å; L68-Y72 PolarHBondContact O-N 3.17Å; L68-F77 HydrophobicContact CB-CD1 4.45Å; L68-F77 HydrophobicContact CB-CE1 3.94Å; L68-F77 HydrophobicContact CB-CE2 4.21Å; L68-F77 HydrophobicContact CB-CZ 3.8Å; L68-F77 HydrophobicContact CD1-CE1 4.43Å; L68-F77 HydrophobicContact CD1-CZ 3.98Å; L68-F77 HydrophobicContact CG-CZ 4.42Å; L68-D306 HydrophobicContact CD2-CB 4.15Å; L68-Q310 HydrophobicContact CD1-CB 3.73Å; L68-Q310 HydrophobicContact CD1-CG 3.75Å
69	A	92.1	Very high	90.2	Very high	0 Å²	0	17.6 Å²	17.6	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-58.6	-43.2	173.7	0	0	0	0	0	110.5	L65 H67 T71 Y72 G73 G74 F290 Y358	L65-A69 VanDerWaalsContact O-CB 3.31Å; L65-A69 WeakPolarHBondContact O-CB 3.35Å; L65-A69 PolarHBondContact O-N 3.49Å; H67-A69 PolarHBondContact O-N 2.9Å; A69-T71 PolarHBondContact O-N 3.09Å; A69-Y72 PolarHBondContact O-N 3.13Å; A69-G73 PolarHBondContact O-N 3.48Å; A69-G74 WeakPolarHBondContact O-CA 3.36Å; A69-G74 PolarHBondContact O-N 3.29Å; A69-F290 HydrophobicContact CB-CE2 4.31Å; A69-Y358 HydrophobicContact CB-CE2 4.3Å
70	S	89.9	Confident	90.7	Very high	19 Å²	19	17.6 Å²	17.6	13%	0.133	10%	0.095	C	C	.	.	H	α-helix	trans	-59.8	-49.7	178.8	-166.1	0	0	0	0	111.7	P66 H67 L68 Y72 R297 Y358 L376	P66-S70 PolarHBondContact O-N 3.4Å; H67-S70 VanDerWaalsContact O-CB 3.32Å; H67-S70 WeakPolarHBondContact O-CB 3.45Å; H67-S70 PolarHBondContact O-N 3.14Å; H67-S70 VanDerWaalsContact O-N 3.12Å; L68-S70 VanDerWaalsContact C-N 3.29Å; L68-S70 PolarHBondContact O-N 2.99Å; S70-Y72 VanDerWaalsContact C-N 3.27Å; S70-Y72 PolarHBondContact O-N 2.82Å; S70-R297 PolarHBondContact O-NH1 2.99Å; S70-R297 VanDerWaalsContact O-NH1 3.16Å; S70-Y358 WeakPolarHBondContact CA-OH 3.33Å; S70-Y358 PolarHBondContact N-OH 3.35Å; S70-L376 WeakPolarHBondContact OG-CD1 3.28Å
71	T	89.4	Confident	91.1	Very high	65 Å²	65	16.1 Å²	16.1	40%	0.399	9%	0.09	S	C	.	.	H	α-helix	trans	-61.1	-35.6	-179.6	-55.7	0	0	0	0	112.1	H67 L68 A69 R297	H67-T71 PolarHBondContact O-N 3.37Å; H67-T71 VanDerWaalsContact O-N 3.08Å; H67-T71 PolarHBondContact O-OG1 2.98Å; H67-T71 VanDerWaalsContact O-OG1 3.12Å; L68-T71 PolarHBondContact O-N 3.32Å; A69-T71 PolarHBondContact O-N 3.09Å; T71-R297 PolarHBondContact O-NH1 3.09Å
72	Y	90.1	Very high	91.4	Very high	24 Å²	24	20 Å²	20	9%	0.094	11%	0.11	C	C	.	.	H	α-helix	trans	-108.9	8.4	-170.9	-62.6	-52.1	0	0	0	116.3	L68 A69 S70 F77 R297 V303 D306	L68-Y72 HydrophobicContact CD2-CD2 4.44Å; L68-Y72 HydrophobicContact CD2-CE2 3.97Å; L68-Y72 WeakPolarHBondContact O-CB 3.22Å; L68-Y72 VanDerWaalsContact O-CD2 3.3Å; L68-Y72 WeakPolarHBondContact O-CD2 3.39Å; L68-Y72 PolarHBondContact O-N 3.17Å; A69-Y72 PolarHBondContact O-N 3.13Å; S70-Y72 VanDerWaalsContact C-N 3.27Å; S70-Y72 PolarHBondContact O-N 2.82Å; Y72-F77 AromaticContact CD2-CD2 3.68Å; Y72-F77 HydrophobicContact CD2-CD2 3.68Å; Y72-F77 AromaticContact CD2-CE2 3.73Å; Y72-F77 HydrophobicContact CD2-CE2 3.73Å; Y72-F77 HydrophobicContact CE2-CE2 4.35Å; Y72-F77 HydrophobicContact CG-CD2 4.16Å; Y72-R297 WeakPolarHBondContact O-CD 3.46Å; Y72-V303 HydrophobicContact CD1-CB 4.26Å; Y72-V303 HydrophobicContact CD1-CG2 3.37Å; Y72-V303 HydrophobicContact CE1-CG2 3.81Å; Y72-V303 HydrophobicContact CG-CB 4.4Å; Y72-V303 HydrophobicContact CG-CG1 4.28Å; Y72-V303 HydrophobicContact CG-CG2 3.86Å; Y72-D306 HydrophobicContact CE2-CB 3.75Å; Y72-D306 WeakPolarHBondContact CE2-OD2 3.43Å; Y72-D306 VanDerWaalsContact CZ-OD2 3.31Å; Y72-D306 PolarHBondContact OH-OD2 3.17Å
73	G	84.7	Confident	91.7	Very high	7 Å²	7	23 Å²	23	7%	0.072	13%	0.125	C	C	.	.	T	Hydrogen-bonded Turn	trans	102.6	42.3	169.4	0	0	0	0	0	114.3	A69 A75 L76	A69-G73 PolarHBondContact O-N 3.48Å; G73-A75 PolarHBondContact O-N 2.67Å; G73-L76 VanDerWaalsContact O-CB 3.28Å; G73-L76 WeakPolarHBondContact O-CB 3.28Å; G73-L76 PolarHBondContact O-N 3.11Å
74	G	89	Confident	91.7	Very high	4 Å²	4	24 Å²	24	4%	0.041	13%	0.131	C	C	.	.	G	3₁₀ helix	trans	62.9	-127.5	175.4	0	0	0	0	0	112.9	A69 L76 F77 F290	A69-G74 WeakPolarHBondContact O-CA 3.36Å; A69-G74 PolarHBondContact O-N 3.29Å; G74-L76 PolarHBondContact O-N 3.3Å; G74-F77 WeakPolarHBondContact O-CB 3.47Å; G74-F77 PolarHBondContact O-N 3.43Å; G74-F77 VanDerWaalsContact O-N 3.16Å; G74-F290 CarbonylContact C-O 3.44Å; G74-F290 WeakPolarHBondContact CA-O 3.26Å
75	A	92.3	Very high	91.7	Very high	21 Å²	21	24 Å²	24	17%	0.174	13%	0.13	C	C	.	.	G	3₁₀ helix	trans	-56.9	-22.9	-179	0	0	0	0	0	113.6	G73 F77 F78 F290 F291 V293	G73-A75 PolarHBondContact O-N 2.67Å; A75-F77 PolarHBondContact O-N 3.45Å; A75-F78 WeakPolarHBondContact O-CB 3.32Å; A75-F78 PolarHBondContact O-N 2.99Å; A75-F78 VanDerWaalsContact O-N 3.08Å; A75-F290 HydrophobicContact CB-CD1 3.98Å; A75-F290 HydrophobicContact CB-CE1 3.59Å; A75-F290 HydrophobicContact CB-CE2 4.43Å; A75-F290 HydrophobicContact CB-CZ 3.85Å; A75-F290 WeakPolarHBondContact CB-O 3.29Å; A75-F290 PolarHBondContact N-O 2.96Å; A75-F291 HydrophobicContact CB-CD1 3.98Å; A75-F291 HydrophobicContact CB-CE1 4.34Å; A75-V293 HydrophobicContact CB-CG2 4.49Å
76	L	93	Very high	91.7	Very high	3 Å²	3	28.9 Å²	28.9	2%	0.016	16%	0.156	C	C	.	.	G	3₁₀ helix	trans	-58.2	-34	177.8	-171.8	57.8	0	0	0	112.8	G73 G74 F78 I79 P80 V293 D294 W295 R297 L298	G73-L76 VanDerWaalsContact O-CB 3.28Å; G73-L76 WeakPolarHBondContact O-CB 3.28Å; G73-L76 PolarHBondContact O-N 3.11Å; G74-L76 PolarHBondContact O-N 3.3Å; L76-F78 PolarHBondContact O-N 3.44Å; L76-I79 HydrophobicContact CD1-CD1 4.04Å; L76-I79 PolarHBondContact O-N 3.38Å; L76-P80 VanDerWaalsContact O-CD 3.25Å; L76-P80 WeakPolarHBondContact O-CD 3.47Å; L76-V293 HydrophobicContact CB-CG1 3.89Å; L76-V293 HydrophobicContact CB-CG2 4.22Å; L76-V293 HydrophobicContact CD1-CG1 3.68Å; L76-V293 HydrophobicContact CD2-CG1 3.9Å; L76-V293 HydrophobicContact CG-CG1 4.03Å; L76-D294 WeakPolarHBondContact CD2-O 3.49Å; L76-W295 HydrophobicContact CD1-CD2 4.26Å; L76-W295 HydrophobicContact CD1-CE3 3.73Å; L76-W295 HydrophobicContact CD1-CH2 4.42Å; L76-W295 HydrophobicContact CD1-CZ3 3.82Å; L76-R297 HydrophobicContact CD2-CB 4.31Å; L76-L298 HydrophobicContact CD1-CD1 3.53Å; L76-L298 HydrophobicContact CD1-CD2 4.05Å; L76-L298 HydrophobicContact CD1-CG 3.64Å; L76-L298 HydrophobicContact CD2-CD2 4.36Å; L76-L298 HydrophobicContact CD2-CG 3.88Å; L76-L298 HydrophobicContact CG-CD1 4.19Å; L76-L298 HydrophobicContact CG-CD2 3.83Å; L76-L298 HydrophobicContact CG-CG 3.71Å
77	F	93	Very high	91.4	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	18%	0.175	C	C	.	.	G	3₁₀ helix	trans	-62.7	-24.9	178.6	-179.8	-102.9	0	0	0	112.8	L65 L68 Y72 G74 A75 I79 P80 Y81 V303 A307 Q310	L65-F77 HydrophobicContact CD2-CE1 4.11Å; L68-F77 HydrophobicContact CB-CD1 4.45Å; L68-F77 HydrophobicContact CB-CE1 3.94Å; L68-F77 HydrophobicContact CB-CE2 4.21Å; L68-F77 HydrophobicContact CB-CZ 3.8Å; L68-F77 HydrophobicContact CD1-CE1 4.43Å; L68-F77 HydrophobicContact CD1-CZ 3.98Å; L68-F77 HydrophobicContact CG-CZ 4.42Å; Y72-F77 AromaticContact CD2-CD2 3.68Å; Y72-F77 HydrophobicContact CD2-CD2 3.68Å; Y72-F77 AromaticContact CD2-CE2 3.73Å; Y72-F77 HydrophobicContact CD2-CE2 3.73Å; Y72-F77 HydrophobicContact CE2-CE2 4.35Å; Y72-F77 HydrophobicContact CG-CD2 4.16Å; G74-F77 WeakPolarHBondContact O-CB 3.47Å; G74-F77 PolarHBondContact O-N 3.43Å; G74-F77 VanDerWaalsContact O-N 3.16Å; A75-F77 PolarHBondContact O-N 3.45Å; F77-I79 VanDerWaalsContact C-N 3.25Å; F77-I79 PolarHBondContact O-N 2.96Å; F77-P80 WeakPolarHBondContact O-CD 3.42Å; F77-P80 VanDerWaalsContact O-CG 3.27Å; F77-P80 WeakPolarHBondContact O-CG 3.5Å; F77-Y81 WeakPolarHBondContact O-CB 3.27Å; F77-Y81 PolarHBondContact O-N 3.45Å; F77-Y81 VanDerWaalsContact O-N 3.13Å; F77-V303 HydrophobicContact CD2-CG1 4.23Å; F77-A307 HydrophobicContact CE2-CB 3.75Å; F77-A307 HydrophobicContact CZ-CB 3.95Å; F77-Q310 HydrophobicContact CZ-CB 4.43Å
78	F	93.3	Very high	91	Very high	14 Å²	14	31 Å²	31	6%	0.061	17%	0.165	C	C	.	.	H	α-helix	trans	-71.2	-18.8	179.6	-78.9	-96.4	0	0	0	113.4	A75 L76 Y81 L82 F290 F347 L351 C354	A75-F78 WeakPolarHBondContact O-CB 3.32Å; A75-F78 PolarHBondContact O-N 2.99Å; A75-F78 VanDerWaalsContact O-N 3.08Å; L76-F78 PolarHBondContact O-N 3.44Å; F78-Y81 HydrophobicContact CD1-CD1 4.01Å; F78-Y81 HydrophobicContact CD1-CE1 4.45Å; F78-Y81 HydrophobicContact CE1-CD1 4.36Å; F78-Y81 HydrophobicContact CE1-CE1 4.44Å; F78-L82 WeakPolarHBondContact O-CB 3.46Å; F78-L82 PolarHBondContact O-N 2.75Å; F78-F290 HydrophobicContact CD2-CE2 4.37Å; F78-F290 AromaticContact CD2-CZ 3.89Å; F78-F290 HydrophobicContact CD2-CZ 3.89Å; F78-F290 AromaticContact CE2-CE2 3.88Å; F78-F290 HydrophobicContact CE2-CE2 3.88Å; F78-F290 AromaticContact CE2-CZ 3.62Å; F78-F290 HydrophobicContact CE2-CZ 3.62Å; F78-F347 HydrophobicContact CB-CE2 4.42Å; F78-F347 HydrophobicContact CD1-CD2 4.39Å; F78-F347 AromaticContact CD1-CE2 3.72Å; F78-F347 HydrophobicContact CD1-CE2 3.72Å; F78-F347 HydrophobicContact CD1-CZ 4.13Å; F78-L351 HydrophobicContact CD1-CB 4.48Å; F78-L351 HydrophobicContact CD1-CD1 4.18Å; F78-L351 HydrophobicContact CD2-CD1 4.27Å; F78-L351 HydrophobicContact CE1-CB 3.91Å; F78-L351 HydrophobicContact CE1-CD1 4.02Å; F78-L351 HydrophobicContact CE2-CD1 4.12Å; F78-L351 HydrophobicContact CG-CD1 4.3Å; F78-L351 HydrophobicContact CZ-CB 4.31Å; F78-L351 HydrophobicContact CZ-CD1 3.99Å; F78-C354 HydrophobicContact CE2-CB 4.27Å; F78-C354 HydrophobicContact CZ-CB 4.14Å
79	I	93.5	Very high	90.7	Very high	73 Å²	73	29.9 Å²	29.9	37%	0.374	16%	0.159	S	C	.	.	H	α-helix	trans	-66.2	-60.1	174	-58.5	-179.7	0	0	0	110.9	L76 F77 Y81 L82 M83 W295	L76-I79 HydrophobicContact CD1-CD1 4.04Å; L76-I79 PolarHBondContact O-N 3.38Å; F77-I79 VanDerWaalsContact C-N 3.25Å; F77-I79 PolarHBondContact O-N 2.96Å; I79-Y81 VanDerWaalsContact C-N 3.3Å; I79-Y81 PolarHBondContact O-N 2.89Å; I79-L82 PolarHBondContact O-N 3.11Å; I79-M83 HydrophobicContact CG2-SD 4.4Å; I79-M83 WeakPolarHBondContact O-CG 3.47Å; I79-M83 PolarHBondContact O-N 2.87Å; I79-M83 VanDerWaalsContact O-N 3.09Å; I79-W295 HydrophobicContact CD1-CH2 4.14Å; I79-W295 HydrophobicContact CD1-CZ3 3.93Å
80	P	94	Very high	90.6	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-63.8	-36.1	176.7	24.6	-32.9	0	0	0	111.7	L76 F77 M83 M84 L298 V303 W304 A307	L76-P80 VanDerWaalsContact O-CD 3.25Å; L76-P80 WeakPolarHBondContact O-CD 3.47Å; F77-P80 WeakPolarHBondContact O-CD 3.42Å; F77-P80 VanDerWaalsContact O-CG 3.27Å; F77-P80 WeakPolarHBondContact O-CG 3.5Å; P80-M83 PolarHBondContact O-N 3.17Å; P80-M84 WeakPolarHBondContact O-CB 3.02Å; P80-M84 WeakPolarHBondContact O-CG 3.46Å; P80-M84 PolarHBondContact O-N 3.26Å; P80-L298 HydrophobicContact CG-CD2 4.06Å; P80-V303 HydrophobicContact CG-CG1 3.77Å; P80-W304 HydrophobicContact CB-CD2 3.84Å; P80-W304 HydrophobicContact CB-CE3 3.5Å; P80-W304 VanDerWaalsContact CB-CE3 3.5Å; P80-W304 HydrophobicContact CB-CH2 4.17Å; P80-W304 HydrophobicContact CB-CZ2 4.42Å; P80-W304 HydrophobicContact CB-CZ3 3.7Å; P80-A307 HydrophobicContact CB-CB 3.84Å; P80-A307 HydrophobicContact CG-CB 4.14Å
81	Y	93.5	Very high	90.7	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-60.8	-47.2	176	173.2	-103	0	0	0	112.4	L65 F77 F78 I79 M83 M84 L85 Q310 A311 S314 D346 F347 S350	L65-Y81 HydrophobicContact CD2-CD2 4.39Å; L65-Y81 HydrophobicContact CD2-CE2 4.1Å; F77-Y81 WeakPolarHBondContact O-CB 3.27Å; F77-Y81 PolarHBondContact O-N 3.45Å; F77-Y81 VanDerWaalsContact O-N 3.13Å; F78-Y81 HydrophobicContact CD1-CD1 4.01Å; F78-Y81 HydrophobicContact CD1-CE1 4.45Å; F78-Y81 HydrophobicContact CE1-CD1 4.36Å; F78-Y81 HydrophobicContact CE1-CE1 4.44Å; I79-Y81 VanDerWaalsContact C-N 3.3Å; I79-Y81 PolarHBondContact O-N 2.89Å; Y81-M83 VanDerWaalsContact C-N 3.35Å; Y81-M83 PolarHBondContact O-N 2.95Å; Y81-M84 PolarHBondContact O-N 3.38Å; Y81-L85 WeakPolarHBondContact O-CB 3.35Å; Y81-L85 PolarHBondContact O-N 2.8Å; Y81-Q310 HydrophobicContact CD2-CG 4.31Å; Y81-Q310 HydrophobicContact CE2-CG 4.08Å; Y81-A311 HydrophobicContact CD2-CB 4.03Å; Y81-A311 HydrophobicContact CE2-CB 4.06Å; Y81-S314 PolarHBondContact OH-OG 3.42Å; Y81-D346 PolarHBondContact OH-OD2 3.24Å; Y81-F347 HydrophobicContact CD1-CD2 4.05Å; Y81-F347 HydrophobicContact CD1-CE2 4.23Å; Y81-F347 AromaticContact CE1-CD2 3.89Å; Y81-F347 HydrophobicContact CE1-CD2 3.89Å; Y81-F347 HydrophobicContact CE1-CE2 4.48Å; Y81-S350 PolarHBondContact OH-OG 2.95Å
82	L	93.9	Very high	90.8	Very high	84 Å²	84	26.5 Å²	26.5	44%	0.44	14%	0.137	S	C	.	.	H	α-helix	trans	-62.9	-40.5	176.6	-179.6	62	0	0	0	112.1	F78 I79 L85 L86 F347	F78-L82 WeakPolarHBondContact O-CB 3.46Å; F78-L82 PolarHBondContact O-N 2.75Å; I79-L82 PolarHBondContact O-N 3.11Å; L82-L85 PolarHBondContact O-N 3.24Å; L82-L86 WeakPolarHBondContact O-CB 3.49Å; L82-L86 PolarHBondContact O-N 2.88Å; L82-F347 HydrophobicContact CB-CD2 4.4Å; L82-F347 HydrophobicContact CB-CE2 3.86Å; L82-F347 HydrophobicContact CD1-CD2 3.88Å; L82-F347 HydrophobicContact CD1-CE2 3.93Å; L82-F347 HydrophobicContact CD1-CG 4.37Å; L82-F347 HydrophobicContact CD1-CZ 4.47Å; L82-F347 HydrophobicContact CD2-CE2 4.45Å; L82-F347 HydrophobicContact CD2-CZ 4.45Å; L82-F347 HydrophobicContact CG-CE2 4.29Å
83	M	93	Very high	90.9	Very high	75 Å²	75	25.4 Å²	25.4	37%	0.369	13%	0.133	S	C	.	.	H	α-helix	trans	-62.2	-46.5	176	-71.8	-179.2	66.5	0	0	111.1	I79 P80 Y81 L85 L86 F87 W304	I79-M83 HydrophobicContact CG2-SD 4.4Å; I79-M83 WeakPolarHBondContact O-CG 3.47Å; I79-M83 PolarHBondContact O-N 2.87Å; I79-M83 VanDerWaalsContact O-N 3.09Å; P80-M83 PolarHBondContact O-N 3.17Å; Y81-M83 VanDerWaalsContact C-N 3.35Å; Y81-M83 PolarHBondContact O-N 2.95Å; M83-L85 VanDerWaalsContact C-N 3.34Å; M83-L85 PolarHBondContact O-N 3.48Å; M83-L86 PolarHBondContact O-N 3.17Å; M83-F87 HydrophobicContact CB-CD2 4.26Å; M83-F87 HydrophobicContact CB-CE2 4.43Å; M83-F87 HydrophobicContact CE-CE2 4.19Å; M83-F87 WeakPolarHBondContact O-CB 3.47Å; M83-F87 WeakPolarHBondContact O-CD2 3.36Å; M83-F87 PolarHBondContact O-N 3.14Å; M83-W304 HydrophobicContact CB-CZ3 4.36Å; M83-W304 HydrophobicContact CE-CH2 4.05Å; M83-W304 HydrophobicContact CE-CZ3 4.05Å; M83-W304 HydrophobicContact SD-CH2 3.62Å; M83-W304 HydrophobicContact SD-CZ3 3.79Å
84	M	92.3	Very high	91.4	Very high	36 Å²	36	25.3 Å²	25.3	18%	0.177	13%	0.13	C	C	.	.	H	α-helix	trans	-68.4	-33.9	179.3	-66.4	-59.4	160.1	0	0	112.5	P80 Y81 I88 A89 W304 A308 A311	P80-M84 WeakPolarHBondContact O-CB 3.02Å; P80-M84 WeakPolarHBondContact O-CG 3.46Å; P80-M84 PolarHBondContact O-N 3.26Å; Y81-M84 PolarHBondContact O-N 3.38Å; M84-I88 HydrophobicContact CB-CD1 4.09Å; M84-I88 HydrophobicContact CG-CD1 4.34Å; M84-I88 VanDerWaalsContact O-CB 3.27Å; M84-I88 WeakPolarHBondContact O-CB 3.2Å; M84-I88 WeakPolarHBondContact O-CG1 3.45Å; M84-I88 PolarHBondContact O-N 3.1Å; M84-I88 HydrophobicContact SD-CD1 3.48Å; M84-I88 WeakPolarHBondContact SD-CD1 3.46Å; M84-I88 HydrophobicContact SD-CG1 4.3Å; M84-A89 PolarHBondContact O-N 2.85Å; M84-W304 HydrophobicContact CE-CE3 3.49Å; M84-W304 VanDerWaalsContact CE-CE3 3.49Å; M84-W304 HydrophobicContact CE-CZ3 4.04Å; M84-A308 HydrophobicContact CB-CB 4.12Å; M84-A308 HydrophobicContact CG-CB 3.69Å; M84-A308 HydrophobicContact SD-CB 3.78Å; M84-A311 HydrophobicContact CB-CB 4.01Å
85	L	91.7	Very high	91.6	Very high	6 Å²	6	25.4 Å²	25.4	3%	0.031	13%	0.13	C	C	.	.	I	π-helix	trans	-59.6	-47.7	171.3	-167	76.5	0	0	0	110.8	Y81 L82 M83 A89 V90 A311 L315 C343 F347	Y81-L85 WeakPolarHBondContact O-CB 3.35Å; Y81-L85 PolarHBondContact O-N 2.8Å; L82-L85 PolarHBondContact O-N 3.24Å; M83-L85 VanDerWaalsContact C-N 3.34Å; M83-L85 PolarHBondContact O-N 3.48Å; L85-A89 HydrophobicContact CD1-CB 3.94Å; L85-A89 WeakPolarHBondContact O-CB 3.29Å; L85-A89 PolarHBondContact O-N 3.31Å; L85-V90 WeakPolarHBondContact O-CG2 3.21Å; L85-V90 PolarHBondContact O-N 3.02Å; L85-A311 HydrophobicContact CB-CB 4.45Å; L85-A311 HydrophobicContact CD1-CB 4.45Å; L85-L315 HydrophobicContact CD1-CD1 3.73Å; L85-L315 HydrophobicContact CD1-CD2 4.09Å; L85-L315 HydrophobicContact CD1-CG 3.72Å; L85-C343 HydrophobicContact CD2-CB 4.38Å; L85-F347 HydrophobicContact CD2-CB 4.17Å
86	L	89.7	Confident	91.6	Very high	102 Å²	102	24.4 Å²	24.4	53%	0.534	12%	0.122	S	C	.	.	I	π-helix	trans	-69.5	-42	-178.9	-173.2	69.8	0	0	0	113.2	L82 M83 P91	L82-L86 WeakPolarHBondContact O-CB 3.49Å; L82-L86 PolarHBondContact O-N 2.88Å; M83-L86 PolarHBondContact O-N 3.17Å; L86-P91 WeakPolarHBondContact O-CD 3.47Å
87	F	86.5	Confident	91.7	Very high	93 Å²	93	24.3 Å²	24.3	41%	0.408	12%	0.121	S	C	.	.	I	π-helix	trans	-94.3	0.4	-173.6	-67.5	-61.4	0	0	0	114.9	M83 H513	M83-F87 HydrophobicContact CB-CD2 4.26Å; M83-F87 HydrophobicContact CB-CE2 4.43Å; M83-F87 HydrophobicContact CE-CE2 4.19Å; M83-F87 WeakPolarHBondContact O-CB 3.47Å; M83-F87 WeakPolarHBondContact O-CD2 3.36Å; M83-F87 PolarHBondContact O-N 3.14Å; F87-H513 VanDerWaalsContact C-NE2 3.34Å; F87-H513 PolarHBondContact O-CE1 2.88Å; F87-H513 PolarHBondContact O-NE2 3.4Å
88	I	84.7	Confident	91.7	Very high	2 Å²	2	24.9 Å²	24.9	1%	0.01	13%	0.125	C	C	.	.	I	π-helix	trans	-137.6	-58.3	179.6	-50.3	170.6	0	0	0	108.8	M84 P91 F92 A308 I521 L525	M84-I88 HydrophobicContact CB-CD1 4.09Å; M84-I88 HydrophobicContact CG-CD1 4.34Å; M84-I88 VanDerWaalsContact O-CB 3.27Å; M84-I88 WeakPolarHBondContact O-CB 3.2Å; M84-I88 WeakPolarHBondContact O-CG1 3.45Å; M84-I88 PolarHBondContact O-N 3.1Å; M84-I88 HydrophobicContact SD-CD1 3.48Å; M84-I88 WeakPolarHBondContact SD-CD1 3.46Å; M84-I88 HydrophobicContact SD-CG1 4.3Å; I88-P91 WeakPolarHBondContact O-CD 3.38Å; I88-F92 VanDerWaalsContact O-CB 3.25Å; I88-F92 WeakPolarHBondContact O-CB 3.28Å; I88-F92 PolarHBondContact O-N 2.78Å; I88-A308 HydrophobicContact CD1-CB 3.95Å; I88-I521 HydrophobicContact CD1-CG2 3.36Å; I88-I521 HydrophobicContact CG1-CD1 3.93Å; I88-I521 HydrophobicContact CG1-CG2 3.73Å; I88-I521 HydrophobicContact CG2-CG2 4.38Å; I88-L525 HydrophobicContact CD1-CD1 4.48Å
89	A	85.5	Confident	91.7	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	13%	0.125	C	C	.	.	I	π-helix	trans	-74.5	-40.9	-165.4	0	0	0	0	0	111.2	M84 L85 F92 L93 L315	M84-A89 PolarHBondContact O-N 2.85Å; L85-A89 HydrophobicContact CD1-CB 3.94Å; L85-A89 WeakPolarHBondContact O-CB 3.29Å; L85-A89 PolarHBondContact O-N 3.31Å; A89-F92 PolarHBondContact O-N 3.35Å; A89-L93 WeakPolarHBondContact O-CB 3.44Å; A89-L93 PolarHBondContact O-N 3.36Å; A89-L315 HydrophobicContact CB-CD1 3.34Å; A89-L315 HydrophobicContact CB-CG 4.08Å
90	V	90.6	Very high	91.7	Very high	8 Å²	8	21.2 Å²	21.2	5%	0.048	11%	0.107	C	C	.	.	H	α-helix	trans	-60.9	-52.6	177	168.3	0	0	0	0	112.2	L85 F92 L93 L94 I340 C343 W510	L85-V90 WeakPolarHBondContact O-CG2 3.21Å; L85-V90 PolarHBondContact O-N 3.02Å; V90-F92 VanDerWaalsContact C-N 3.3Å; V90-F92 PolarHBondContact O-N 2.7Å; V90-L93 PolarHBondContact O-N 2.8Å; V90-L94 WeakPolarHBondContact O-CB 3.43Å; V90-L94 PolarHBondContact O-N 3.19Å; V90-I340 HydrophobicContact CG1-CD1 4.16Å; V90-C343 HydrophobicContact CG2-CB 3.88Å; V90-C343 WeakPolarHBondContact CG2-SG 3.43Å; V90-W510 HydrophobicContact CG1-CH2 3.97Å; V90-W510 HydrophobicContact CG1-CZ3 4.44Å
91	P	90.2	Very high	91.7	Very high	3 Å²	3	21.2 Å²	21.2	2%	0.019	11%	0.107	C	C	.	.	H	α-helix	trans	-65.2	-35.5	179.4	-25.5	38.9	0	0	0	113.2	L86 I88 L95 W510 L514	L86-P91 WeakPolarHBondContact O-CD 3.47Å; I88-P91 WeakPolarHBondContact O-CD 3.38Å; P91-L95 PolarHBondContact O-N 3.2Å; P91-L95 VanDerWaalsContact O-N 3.12Å; P91-W510 HydrophobicContact CB-CE3 4.27Å; P91-W510 HydrophobicContact CB-CZ3 3.94Å; P91-W510 HydrophobicContact CG-CE3 4.37Å; P91-W510 HydrophobicContact CG-CZ3 3.82Å; P91-L514 HydrophobicContact CB-CD2 3.99Å
92	F	92	Very high	91.7	Very high	2 Å²	2	21.4 Å²	21.4	1%	0.009	11%	0.108	C	C	.	.	H	α-helix	trans	-68.7	-47.3	177.5	-163.4	-80.7	0	0	0	111.9	I88 A89 V90 L94 L95 E96 F312 C317 S318 A476 E479 C480 L522	I88-F92 VanDerWaalsContact O-CB 3.25Å; I88-F92 WeakPolarHBondContact O-CB 3.28Å; I88-F92 PolarHBondContact O-N 2.78Å; A89-F92 PolarHBondContact O-N 3.35Å; V90-F92 VanDerWaalsContact C-N 3.3Å; V90-F92 PolarHBondContact O-N 2.7Å; F92-L94 VanDerWaalsContact C-N 3.28Å; F92-L94 PolarHBondContact O-N 3.07Å; F92-L95 VanDerWaalsContact O-CB 3.28Å; F92-L95 WeakPolarHBondContact O-CB 3.4Å; F92-L95 PolarHBondContact O-N 3.16Å; F92-L95 VanDerWaalsContact O-N 3.11Å; F92-E96 PolarHBondContact O-N 3.39Å; F92-F312 HydrophobicContact CD1-CE2 4.2Å; F92-F312 HydrophobicContact CE1-CE2 4.44Å; F92-F312 HydrophobicContact CG-CE2 4.27Å; F92-C317 HydrophobicContact CD1-CB 3.65Å; F92-C317 HydrophobicContact CE1-CB 3.99Å; F92-S318 WeakPolarHBondContact CE1-OG 3.34Å; F92-S318 WeakPolarHBondContact CZ-OG 3.34Å; F92-A476 HydrophobicContact CE1-CB 4.45Å; F92-A476 HydrophobicContact CE2-CB 3.9Å; F92-A476 WeakPolarHBondContact CE2-O 3.24Å; F92-A476 HydrophobicContact CZ-CB 3.7Å; F92-E479 HydrophobicContact CZ-CB 4.26Å; F92-E479 HydrophobicContact CZ-CG 4.07Å; F92-E479 VanDerWaalsContact CZ-OE2 3.24Å; F92-E479 WeakPolarHBondContact CZ-OE2 3.43Å; F92-C480 HydrophobicContact CE2-CB 4.07Å; F92-L522 HydrophobicContact CD2-CD1 4.04Å; F92-L522 HydrophobicContact CE2-CD1 3.88Å
93	L	93.2	Very high	91.5	Very high	0 Å²	0	17.5 Å²	17.5	0%	0	9%	0.088	C	C	.	.	H	α-helix	trans	-62.5	-37.5	177.3	-177.9	60.3	0	0	0	111.3	A89 V90 L95 E96 Y97 L315 F322 V339 L342	A89-L93 WeakPolarHBondContact O-CB 3.44Å; A89-L93 PolarHBondContact O-N 3.36Å; V90-L93 PolarHBondContact O-N 2.8Å; L93-L95 VanDerWaalsContact C-N 3.32Å; L93-L95 PolarHBondContact O-N 3.23Å; L93-E96 PolarHBondContact O-N 2.98Å; L93-Y97 WeakPolarHBondContact O-CB 3.01Å; L93-Y97 PolarHBondContact O-N 2.94Å; L93-L315 HydrophobicContact CB-CD1 4.4Å; L93-L315 HydrophobicContact CD2-CD1 3.95Å; L93-F322 HydrophobicContact CD1-CB 4.13Å; L93-F322 HydrophobicContact CD1-CD1 3.92Å; L93-F322 HydrophobicContact CD1-CD2 3.47Å; L93-F322 VanDerWaalsContact CD1-CD2 3.47Å; L93-F322 HydrophobicContact CD1-CE1 4.2Å; L93-F322 HydrophobicContact CD1-CE2 3.82Å; L93-F322 HydrophobicContact CD1-CG 3.54Å; L93-F322 HydrophobicContact CD1-CZ 4.17Å; L93-V339 HydrophobicContact CB-CG1 4.25Å; L93-V339 HydrophobicContact CD2-CG1 4.12Å; L93-V339 HydrophobicContact CG-CG1 4.09Å; L93-V339 HydrophobicContact CG-CG2 4.43Å; L93-L342 HydrophobicContact CD2-CB 4.4Å
94	L	93.9	Very high	91.3	Very high	5 Å²	5	14.6 Å²	14.6	3%	0.026	8%	0.075	C	C	.	.	H	α-helix	trans	-61.4	-41.1	174.1	-175.9	62.1	0	0	0	112.1	V90 F92 S98 F336 V339 L496 L504 W510	V90-L94 WeakPolarHBondContact O-CB 3.43Å; V90-L94 PolarHBondContact O-N 3.19Å; F92-L94 VanDerWaalsContact C-N 3.28Å; F92-L94 PolarHBondContact O-N 3.07Å; L94-S98 WeakPolarHBondContact O-CB 3.31Å; L94-S98 PolarHBondContact O-N 3.29Å; L94-S98 PolarHBondContact O-OG 2.97Å; L94-F336 HydrophobicContact CD1-CB 4.43Å; L94-F336 HydrophobicContact CD1-CD2 4.2Å; L94-F336 HydrophobicContact CD2-CD2 3.92Å; L94-F336 HydrophobicContact CD2-CE2 4.41Å; L94-V339 HydrophobicContact CB-CG1 4.22Å; L94-V339 HydrophobicContact CD1-CB 4.33Å; L94-V339 HydrophobicContact CD1-CG2 4.03Å; L94-L496 HydrophobicContact CD1-CD1 4.34Å; L94-L496 HydrophobicContact CD1-CD2 4.48Å; L94-L496 HydrophobicContact CD2-CD2 4.1Å; L94-L496 HydrophobicContact CG-CD2 4.38Å; L94-L504 HydrophobicContact CD2-CD1 3.8Å; L94-L504 HydrophobicContact CD2-CD2 4.24Å; L94-W510 HydrophobicContact CD2-CE3 4.15Å; L94-W510 HydrophobicContact CD2-CH2 4.12Å; L94-W510 HydrophobicContact CD2-CZ3 3.75Å
95	L	93.4	Very high	91	Very high	7 Å²	7	14.5 Å²	14.5	4%	0.037	8%	0.075	C	C	.	.	H	α-helix	trans	-60.6	-53	174.7	-167.5	72.1	0	0	0	110.8	P91 F92 L93 Y97 S98 L99 I483	P91-L95 PolarHBondContact O-N 3.2Å; P91-L95 VanDerWaalsContact O-N 3.12Å; F92-L95 VanDerWaalsContact O-CB 3.28Å; F92-L95 WeakPolarHBondContact O-CB 3.4Å; F92-L95 PolarHBondContact O-N 3.16Å; F92-L95 VanDerWaalsContact O-N 3.11Å; L93-L95 VanDerWaalsContact C-N 3.32Å; L93-L95 PolarHBondContact O-N 3.23Å; L95-Y97 PolarHBondContact O-N 3.41Å; L95-S98 PolarHBondContact O-N 3.23Å; L95-S98 PolarHBondContact O-OG 3.28Å; L95-L99 HydrophobicContact CG-CD1 4.21Å; L95-L99 WeakPolarHBondContact O-CB 3.36Å; L95-L99 WeakPolarHBondContact O-CD1 3.44Å; L95-L99 WeakPolarHBondContact O-CG 3.31Å; L95-L99 PolarHBondContact O-N 2.93Å; L95-I483 HydrophobicContact CD1-CB 4.31Å; L95-I483 HydrophobicContact CD1-CG2 3.59Å; L95-I483 HydrophobicContact CD2-CB 4.16Å; L95-I483 HydrophobicContact CD2-CG2 4.36Å; L95-I483 HydrophobicContact CG-CG2 4.24Å
96	E	93.4	Very high	90.7	Very high	0 Å²	0	14.8 Å²	14.8	0%	0	8%	0.079	C	C	.	.	H	α-helix	trans	-62.7	-44.6	-177.8	-168.3	177.2	170.5	0	0	112	F92 L93 G100 S318 G320 F322 I323	F92-E96 PolarHBondContact O-N 3.39Å; L93-E96 PolarHBondContact O-N 2.98Å; E96-G100 PolarHBondContact O-N 2.92Å; E96-S318 PolarHBondContact OE2-N 2.9Å; E96-G320 WeakPolarHBondContact OE1-CA 3.45Å; E96-G320 PolarHBondContact OE1-N 2.79Å; E96-G320 VanDerWaalsContact OE1-N 3.07Å; E96-F322 HydrophobicContact CG-CB 4.16Å; E96-I323 HydrophobicContact CB-CG1 4.48Å; E96-I323 HydrophobicContact CG-CD1 3.9Å; E96-I323 HydrophobicContact CG-CG1 3.27Å
97	Y	94.1	Very high	90.6	Very high	0 Å²	0	10 Å²	10	0%	0	5%	0.054	C	C	.	.	H	α-helix	trans	-68.4	-40.2	-179.2	-160.3	-81	0	0	0	112.1	C48 L93 L95 Q101 F322 S326 N329 C335 D338 V339 L342	C48-Y97 PolarHBondContact SG-OH 3.01Å; C48-Y97 VanDerWaalsContact SG-OH 3.36Å; L93-Y97 WeakPolarHBondContact O-CB 3.01Å; L93-Y97 PolarHBondContact O-N 2.94Å; L95-Y97 PolarHBondContact O-N 3.41Å; Y97-Q101 PolarHBondContact O-N 3.14Å; Y97-Q101 VanDerWaalsContact O-N 3.16Å; Y97-F322 HydrophobicContact CD2-CB 4.41Å; Y97-F322 HydrophobicContact CD2-CD1 4.01Å; Y97-F322 HydrophobicContact CE2-CD1 4.37Å; Y97-S326 VanDerWaalsContact O-CB 3.3Å; Y97-S326 WeakPolarHBondContact O-CB 3.45Å; Y97-S326 PolarHBondContact O-OG 3.3Å; Y97-N329 WeakPolarHBondContact CE1-ND2 3.22Å; Y97-N329 PolarHBondContact OH-ND2 2.9Å; Y97-C335 HydrophobicContact CD1-CB 3.76Å; Y97-C335 HydrophobicContact CE1-CB 3.93Å; Y97-D338 HydrophobicContact CE1-CB 4.19Å; Y97-V339 HydrophobicContact CD1-CG2 4.3Å; Y97-V339 HydrophobicContact CD2-CG2 4.42Å; Y97-V339 HydrophobicContact CG-CG2 3.94Å; Y97-L342 HydrophobicContact CD2-CD1 4.32Å; Y97-L342 HydrophobicContact CE2-CD1 4.02Å
98	S	94.4	Very high	90.7	Very high	12 Å²	12	6.2 Å²	6.2	8%	0.084	4%	0.038	C	C	.	.	H	α-helix	trans	-68.9	-37.2	178	62.6	0	0	0	0	112.3	L94 L95 G100 Q101 F102	L94-S98 WeakPolarHBondContact O-CB 3.31Å; L94-S98 PolarHBondContact O-N 3.29Å; L94-S98 PolarHBondContact O-OG 2.97Å; L95-S98 PolarHBondContact O-N 3.23Å; L95-S98 PolarHBondContact O-OG 3.28Å; S98-G100 PolarHBondContact O-N 2.95Å; S98-Q101 PolarHBondContact O-N 3.08Å; S98-F102 WeakPolarHBondContact O-CB 3.07Å; S98-F102 PolarHBondContact O-N 2.89Å
99	L	93.4	Very high	90.8	Very high	10 Å²	10	6.9 Å²	6.9	5%	0.052	4%	0.043	C	C	.	.	H	α-helix	trans	-60.8	-42.8	176.7	-75.3	165.9	0	0	0	112.7	L95 S103 V110 I483 W591	L95-L99 HydrophobicContact CG-CD1 4.21Å; L95-L99 WeakPolarHBondContact O-CB 3.36Å; L95-L99 WeakPolarHBondContact O-CD1 3.44Å; L95-L99 WeakPolarHBondContact O-CG 3.31Å; L95-L99 PolarHBondContact O-N 2.93Å; L99-S103 PolarHBondContact O-N 3.23Å; L99-S103 PolarHBondContact O-OG 3.38Å; L99-V110 HydrophobicContact CB-CG2 3.99Å; L99-I483 HydrophobicContact CD1-CD1 3.99Å; L99-I483 HydrophobicContact CD1-CG1 3.87Å; L99-I483 HydrophobicContact CD2-CD1 3.86Å; L99-I483 HydrophobicContact CD2-CG1 4.46Å; L99-I483 HydrophobicContact CD2-CG2 4.47Å; L99-W591 HydrophobicContact CD2-CH2 3.94Å; L99-W591 HydrophobicContact CD2-CZ2 4.3Å
100	G	92	Very high	91	Very high	0 Å²	0	7 Å²	7	0%	0	4%	0.043	C	C	.	.	H	α-helix	trans	-67	-49.5	177.1	0	0	0	0	0	112.5	E96 S98 S104 I323 S326 S327	E96-G100 PolarHBondContact O-N 2.92Å; S98-G100 PolarHBondContact O-N 2.95Å; G100-S104 WeakPolarHBondContact O-CA 3.16Å; G100-S104 PolarHBondContact O-N 2.96Å; G100-I323 VanDerWaalsContact CA-O 3.3Å; G100-I323 WeakPolarHBondContact CA-O 3.5Å; G100-S326 WeakPolarHBondContact CA-OG 3.34Å; G100-S327 VanDerWaalsContact O-CA 3.26Å; G100-S327 WeakPolarHBondContact O-CA 3.25Å; G100-S327 WeakPolarHBondContact O-CB 3.27Å
101	Q	93.9	Very high	91.1	Very high	0 Å²	0	6.7 Å²	6.7	0%	0	4%	0.041	C	C	.	.	H	α-helix	trans	-62.8	-45.1	179.6	-176.2	170.3	-39.4	0	0	112.5	Y97 S98 S103 S104 S326 N329 R330 F331 S333 M499	Y97-Q101 PolarHBondContact O-N 3.14Å; Y97-Q101 VanDerWaalsContact O-N 3.16Å; S98-Q101 PolarHBondContact O-N 3.08Å; Q101-S103 PolarHBondContact O-N 3.3Å; Q101-S104 PolarHBondContact O-N 2.89Å; Q101-S326 WeakPolarHBondContact CA-O 3.4Å; Q101-S326 PolarHBondContact N-OG 2.94Å; Q101-N329 HydrophobicContact CG-CB 3.99Å; Q101-N329 PolarHBondContact OE1-ND2 3.31Å; Q101-N329 VanDerWaalsContact OE1-ND2 3.16Å; Q101-R330 PolarHBondContact NE2-O 2.88Å; Q101-F331 PolarHBondContact NE2-O 3.28Å; Q101-S333 PolarHBondContact NE2-O 3.22Å; Q101-M499 HydrophobicContact CB-SD 4.01Å; Q101-M499 HydrophobicContact CG-SD 3.83Å
102	F	93.4	Very high	91	Very high	5 Å²	5	8.2 Å²	8.2	2%	0.022	5%	0.048	C	C	.	.	H	α-helix	trans	-60.4	-48.5	-177.1	179.8	-110.1	0	0	0	112.1	S98 F331 N495 W498 M499 W591 P593	S98-F102 WeakPolarHBondContact O-CB 3.07Å; S98-F102 PolarHBondContact O-N 2.89Å; F102-F331 AromaticContact CD2-CE2 3.74Å; F102-F331 HydrophobicContact CD2-CE2 3.74Å; F102-F331 HydrophobicContact CD2-CZ 4.01Å; F102-F331 HydrophobicContact CE2-CE2 4.21Å; F102-F331 HydrophobicContact CE2-CZ 4.13Å; F102-N495 HydrophobicContact CD1-CB 4.44Å; F102-N495 HydrophobicContact CD2-CB 3.88Å; F102-N495 HydrophobicContact CE1-CB 4.34Å; F102-N495 HydrophobicContact CE2-CB 3.78Å; F102-N495 HydrophobicContact CG-CB 4.21Å; F102-N495 HydrophobicContact CZ-CB 4.01Å; F102-N495 VanDerWaalsContact CZ-CG 3.43Å; F102-N495 VanDerWaalsContact CZ-OD1 3.26Å; F102-N495 WeakPolarHBondContact CZ-OD1 3.42Å; F102-W498 HydrophobicContact CE2-CD2 4.37Å; F102-W498 AromaticContact CE2-CE3 3.66Å; F102-W498 HydrophobicContact CE2-CE3 3.66Å; F102-W498 HydrophobicContact CE2-CZ3 4.15Å; F102-W498 HydrophobicContact CZ-CE3 4.05Å; F102-W498 HydrophobicContact CZ-CZ3 4.15Å; F102-M499 WeakPolarHBondContact CA-SD 3.47Å; F102-M499 HydrophobicContact CB-CE 3.9Å; F102-M499 HydrophobicContact CB-SD 3.63Å; F102-M499 HydrophobicContact CD2-CE 4.46Å; F102-M499 HydrophobicContact CD2-CG 4.17Å; F102-M499 HydrophobicContact CD2-SD 4.2Å; F102-M499 HydrophobicContact CG-SD 4.44Å; F102-M499 PolarHBondContact N-SD 2.89Å; F102-M499 VanDerWaalsContact N-SD 3.4Å; F102-W591 HydrophobicContact CD1-CH2 4.28Å; F102-W591 AromaticContact CD1-CZ2 3.91Å; F102-W591 HydrophobicContact CD1-CZ2 3.91Å; F102-W591 HydrophobicContact CE1-CZ2 4.06Å; F102-P593 HydrophobicContact CD2-CG 4.5Å; F102-P593 HydrophobicContact CE2-CG 3.82Å; F102-P593 HydrophobicContact CZ-CG 4.03Å; F102-P593 WeakPolarHBondContact O-CA 3.43Å
103	S	89.9	Confident	91	Very high	2 Å²	2	8.1 Å²	8.1	1%	0.014	5%	0.047	C	C	.	.	H	α-helix	trans	-85.3	-19	-175.8	64.3	0	0	0	0	113.5	L99 Q101 L105	L99-S103 PolarHBondContact O-N 3.23Å; L99-S103 PolarHBondContact O-OG 3.38Å; Q101-S103 PolarHBondContact O-N 3.3Å; S103-L105 WeakPolarHBondContact O-CG 3.48Å; S103-L105 PolarHBondContact O-N 3.07Å; S103-L105 PolarHBondContact OG-N 3.2Å
104	S	88.8	Confident	91	Very high	14 Å²	14	8.1 Å²	8.1	10%	0.098	5%	0.047	C	C	.	.	T	Hydrogen-bonded Turn	trans	51.3	32.2	-166.1	-46.3	0	0	0	0	113.2	R39 G100 Q101	R39-S104 WeakPolarHBondContact CD-O 3.46Å; R39-S104 PolarHBondContact NE-O 2.66Å; G100-S104 WeakPolarHBondContact O-CA 3.16Å; G100-S104 PolarHBondContact O-N 2.96Å; Q101-S104 PolarHBondContact O-N 2.89Å
105	L	86.5	Confident	90.8	Very high	34 Å²	34	8.1 Å²	8.1	18%	0.178	5%	0.048	C	C	.	.			trans	-113.1	152.4	179.7	-61.8	178	0	0	0	111.9	S103 S109 K112 S327	S103-L105 WeakPolarHBondContact O-CG 3.48Å; S103-L105 PolarHBondContact O-N 3.07Å; S103-L105 PolarHBondContact OG-N 3.2Å; L105-S109 WeakPolarHBondContact CD1-O 3.45Å; L105-K112 HydrophobicContact CD1-CD 4.04Å; L105-S327 WeakPolarHBondContact O-CB 3.37Å
106	G	84.3	Confident	90.8	Very high	11 Å²	11	8.8 Å²	8.8	11%	0.113	5%	0.051	C	C	.	.			trans	-75.6	172.1	172.7	0	0	0	0	0	113.5	I108 S109 V110	G106-I108 VanDerWaalsContact C-N 3.31Å; G106-I108 PolarHBondContact O-N 3.11Å; G106-I108 VanDerWaalsContact O-N 3.1Å; G106-S109 PolarHBondContact O-N 3.17Å; G106-V110 PolarHBondContact O-N 2.86Å
107	C	88.5	Confident	90.8	Very high	3 Å²	3	10.3 Å²	10.3	2%	0.02	6%	0.058	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.8	-31.9	-170.9	61.6	0	0	0	0	116.5	V110 W111 G121 M124	C107-V110 WeakPolarHBondContact O-CG1 3.46Å; C107-W111 PolarHBondContact O-NE1 3.4Å; C107-G121 VanDerWaalsContact O-CA 3.28Å; C107-G121 WeakPolarHBondContact O-CA 3.33Å; C107-M124 HydrophobicContact CB-SD 4.37Å
108	I	88.4	Confident	90.7	Very high	13 Å²	13	13.4 Å²	13.4	7%	0.067	7%	0.072	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.1	-39.3	175	-63.7	169.6	0	0	0	111.2	G106 G121 I122 F125 H424	G106-I108 VanDerWaalsContact C-N 3.31Å; G106-I108 PolarHBondContact O-N 3.11Å; G106-I108 VanDerWaalsContact O-N 3.1Å; I108-G121 WeakPolarHBondContact CG1-O 3.41Å; I108-I122 HydrophobicContact CG2-CG1 4.3Å; I108-F125 HydrophobicContact CD1-CB 3.89Å; I108-F125 HydrophobicContact CD1-CD2 3.74Å; I108-F125 HydrophobicContact CD1-CE2 4.34Å; I108-F125 HydrophobicContact CD1-CG 3.87Å; I108-F125 HydrophobicContact CG1-CB 4.12Å; I108-H424 HydrophobicContact CD1-CB 4.12Å
109	S	86.2	Confident	90.7	Very high	16 Å²	16	12.8 Å²	12.8	11%	0.112	7%	0.068	C	C	.	.	G	3₁₀ helix	trans	-82.2	-21.9	-171.3	-61.1	0	0	0	0	113.1	L105 G106 W111 K112	L105-S109 WeakPolarHBondContact CD1-O 3.45Å; G106-S109 PolarHBondContact O-N 3.17Å; S109-W111 PolarHBondContact O-N 3.4Å; S109-K112 VanDerWaalsContact O-CG 3.27Å; S109-K112 WeakPolarHBondContact O-CG 3.45Å; S109-K112 PolarHBondContact O-N 2.93Å
110	V	90.7	Very high	90.8	Very high	1 Å²	1	12.3 Å²	12.3	1%	0.006	7%	0.066	C	C	.	.	G	3₁₀ helix	trans	-60	-27.3	174.4	77.5	0	0	0	0	112.2	L99 G106 C107 K112 V113 I323 W591	L99-V110 HydrophobicContact CB-CG2 3.99Å; G106-V110 PolarHBondContact O-N 2.86Å; C107-V110 WeakPolarHBondContact O-CG1 3.46Å; V110-K112 PolarHBondContact O-N 2.93Å; V110-V113 WeakPolarHBondContact O-CG1 3.31Å; V110-V113 PolarHBondContact O-N 3.06Å; V110-V113 VanDerWaalsContact O-N 3.14Å; V110-I323 HydrophobicContact CB-CG2 4.01Å; V110-I323 HydrophobicContact CG1-CD1 4.11Å; V110-I323 HydrophobicContact CG1-CG2 4.05Å; V110-I323 HydrophobicContact CG2-CG2 4.13Å; V110-W591 HydrophobicContact CG2-CH2 4.05Å; V110-W591 HydrophobicContact CG2-CZ3 3.82Å; V110-W591 WeakPolarHBondContact O-CZ3 3.44Å
111	W	92.5	Very high	90.8	Very high	2 Å²	2	12.3 Å²	12.3	1%	0.008	7%	0.066	C	C	.	.	G	3₁₀ helix	trans	-71.2	7.4	179.6	-66.6	98.4	0	0	0	115	C107 S109 V113 C114 F117 Q118 I120 G121 M124 E479 A482 I483	C107-W111 PolarHBondContact O-NE1 3.4Å; S109-W111 PolarHBondContact O-N 3.4Å; W111-V113 HydrophobicContact CE3-CG1 4.15Å; W111-V113 HydrophobicContact CZ3-CG1 4.44Å; W111-V113 PolarHBondContact O-N 2.86Å; W111-C114 CarbonylContact O-C 3.56Å; W111-C114 PolarHBondContact O-N 3.11Å; W111-F117 HydrophobicContact CE3-CB 4.04Å; W111-F117 HydrophobicContact CZ3-CB 4.2Å; W111-Q118 HydrophobicContact CB-CB 4.35Å; W111-Q118 HydrophobicContact CB-CG 4.35Å; W111-I120 HydrophobicContact CD2-CB 4.09Å; W111-I120 HydrophobicContact CE3-CD1 4.29Å; W111-I120 HydrophobicContact CH2-CB 4.12Å; W111-I120 HydrophobicContact CH2-CD1 3.55Å; W111-I120 HydrophobicContact CH2-CG1 4.43Å; W111-I120 HydrophobicContact CH2-CG2 3.93Å; W111-I120 HydrophobicContact CZ2-CB 3.59Å; W111-I120 HydrophobicContact CZ2-CD1 3.95Å; W111-I120 HydrophobicContact CZ2-CG1 4.39Å; W111-I120 HydrophobicContact CZ2-CG2 3.23Å; W111-I120 HydrophobicContact CZ3-CD1 3.72Å; W111-G121 VanDerWaalsContact CD1-N 3.25Å; W111-G121 VanDerWaalsContact NE1-CA 3.33Å; W111-M124 HydrophobicContact CZ2-CE 4.34Å; W111-E479 HydrophobicContact CH2-CB 4.13Å; W111-E479 HydrophobicContact CH2-CG 3.97Å; W111-E479 HydrophobicContact CZ2-CB 4.29Å; W111-E479 HydrophobicContact CZ2-CG 4.06Å; W111-A482 HydrophobicContact CH2-CB 4.27Å; W111-A482 HydrophobicContact CZ3-CB 3.71Å; W111-I483 HydrophobicContact CH2-CD1 4.34Å; W111-I483 HydrophobicContact CH2-CG1 4.38Å; W111-I483 HydrophobicContact CZ3-CD1 4.15Å
112	K	88.3	Confident	90.7	Very high	35 Å²	35	15 Å²	15	15%	0.152	8%	0.079	C	C	.	.	G	3₁₀ helix	trans	-57.1	-22	159	-72.4	-179.2	171.5	-168.2	0	112.8	L105 S109 V110 C114 P587 E588 A590 W591	L105-K112 HydrophobicContact CD1-CD 4.04Å; S109-K112 VanDerWaalsContact O-CG 3.27Å; S109-K112 WeakPolarHBondContact O-CG 3.45Å; S109-K112 PolarHBondContact O-N 2.93Å; V110-K112 PolarHBondContact O-N 2.93Å; K112-C114 PolarHBondContact O-N 3.21Å; K112-P587 WeakPolarHBondContact O-CA 3.36Å; K112-E588 HydrophobicContact CB-CB 4.44Å; K112-E588 WeakPolarHBondContact CG-OE2 3.29Å; K112-E588 PolarHBondContact O-N 3.31Å; K112-A590 HydrophobicContact CD-CB 4.13Å; K112-W591 HydrophobicContact CB-CB 4.5Å; K112-W591 HydrophobicContact CB-CE3 4.37Å
113	V	91.2	Very high	90.7	Very high	1 Å²	1	14.8 Å²	14.8	1%	0.006	8%	0.078	C	C	.	.	G	3₁₀ helix	trans	-58.2	-33.6	170.2	69	0	0	0	0	112.7	V110 W111 I483 Y487 P587 W591	V110-V113 WeakPolarHBondContact O-CG1 3.31Å; V110-V113 PolarHBondContact O-N 3.06Å; V110-V113 VanDerWaalsContact O-N 3.14Å; W111-V113 HydrophobicContact CE3-CG1 4.15Å; W111-V113 HydrophobicContact CZ3-CG1 4.44Å; W111-V113 PolarHBondContact O-N 2.86Å; V113-I483 HydrophobicContact CG1-CD1 3.75Å; V113-I483 HydrophobicContact CG2-CD1 4.32Å; V113-Y487 HydrophobicContact CG2-CD1 3.93Å; V113-Y487 HydrophobicContact CG2-CD2 3.26Å; V113-Y487 HydrophobicContact CG2-CE1 4.26Å; V113-Y487 HydrophobicContact CG2-CE2 3.68Å; V113-Y487 HydrophobicContact CG2-CG 3.4Å; V113-P587 WeakPolarHBondContact O-CA 3.39Å; V113-P587 WeakPolarHBondContact O-CG 3.09Å; V113-W591 HydrophobicContact CB-CD2 3.71Å; V113-W591 HydrophobicContact CB-CE3 3.79Å; V113-W591 HydrophobicContact CB-CG 4.44Å; V113-W591 HydrophobicContact CB-CH2 3.8Å; V113-W591 HydrophobicContact CB-CZ2 3.71Å; V113-W591 HydrophobicContact CB-CZ3 3.84Å; V113-W591 HydrophobicContact CG1-CH2 4.49Å; V113-W591 HydrophobicContact CG2-CD2 4.11Å; V113-W591 HydrophobicContact CG2-CH2 4.17Å; V113-W591 HydrophobicContact CG2-CZ2 3.61Å
114	C	93	Very high	90.7	Very high	0 Å²	0	14.7 Å²	14.7	0%	0	8%	0.078	C	C	.	.			trans	-153.6	92.3	176.9	-167	0	0	0	0	110.3	W111 K112 L116 F117	W111-C114 CarbonylContact O-C 3.56Å; W111-C114 PolarHBondContact O-N 3.11Å; K112-C114 PolarHBondContact O-N 3.21Å; C114-L116 PolarHBondContact O-N 3.29Å; C114-L116 VanDerWaalsContact O-N 3.09Å; C114-F117 HydrophobicContact CB-CD2 4.4Å; C114-F117 PolarHBondContact O-N 3.46Å
115	P	90.9	Very high	90.7	Very high	5 Å²	5	15.6 Å²	15.6	3%	0.032	8%	0.08	C	C	.	.	G	3₁₀ helix	trans	-56	-26.1	-178	-30.9	37.8	0	0	0	115	F117 Q118 N569 L584 I586 E588	P115-F117 PolarHBondContact O-N 3.47Å; P115-Q118 WeakPolarHBondContact O-CB 3.32Å; P115-Q118 PolarHBondContact O-N 3.12Å; P115-N569 PolarHBondContact O-ND2 3.4Å; P115-L584 HydrophobicContact CB-CD2 3.89Å; P115-L584 VanDerWaalsContact CD-O 3.3Å; P115-L584 WeakPolarHBondContact CD-O 3.34Å; P115-I586 WeakPolarHBondContact CD-O 3.18Å; P115-E588 HydrophobicContact CG-CG 3.55Å
116	L	92.3	Very high	90.9	Very high	21 Å²	21	15.9 Å²	15.9	11%	0.11	8%	0.083	C	C	.	.	G	3₁₀ helix	trans	-59.2	-37.8	173.6	-174	63.6	0	0	0	112.1	C114 G566 F581 L584 M585	C114-L116 PolarHBondContact O-N 3.29Å; C114-L116 VanDerWaalsContact O-N 3.09Å; L116-G566 WeakPolarHBondContact O-CA 3.39Å; L116-F581 HydrophobicContact CD1-CE2 4.5Å; L116-F581 HydrophobicContact CD2-CD2 4.25Å; L116-F581 HydrophobicContact CD2-CE2 3.62Å; L116-F581 HydrophobicContact CD2-CZ 4.07Å; L116-L584 HydrophobicContact CB-CB 4Å; L116-L584 WeakPolarHBondContact CB-O 3.43Å; L116-L584 HydrophobicContact CD1-CB 4.48Å; L116-L584 HydrophobicContact CD1-CD1 4.27Å; L116-L584 PolarHBondContact N-O 2.9Å; L116-M585 HydrophobicContact CD2-CE 3.89Å; L116-M585 HydrophobicContact CD2-CG 4.17Å
117	F	94.3	Very high	91.1	Very high	31 Å²	31	15.5 Å²	15.5	14%	0.136	8%	0.078	C	C	.	.	G	3₁₀ helix	trans	-100.3	18.6	-176	-70.9	-70.5	0	0	0	113.3	W111 C114 P115 G119 I120 F478 A482 V486 I562	W111-F117 HydrophobicContact CE3-CB 4.04Å; W111-F117 HydrophobicContact CZ3-CB 4.2Å; C114-F117 HydrophobicContact CB-CD2 4.4Å; C114-F117 PolarHBondContact O-N 3.46Å; P115-F117 PolarHBondContact O-N 3.47Å; F117-G119 PolarHBondContact O-N 2.87Å; F117-I120 HydrophobicContact CB-CD1 3.71Å; F117-I120 HydrophobicContact CB-CG1 4.2Å; F117-I120 HydrophobicContact CD1-CD1 4.05Å; F117-I120 HydrophobicContact CG-CD1 4.15Å; F117-I120 WeakPolarHBondContact O-CB 3.25Å; F117-I120 WeakPolarHBondContact O-CG1 3.48Å; F117-I120 PolarHBondContact O-N 3.18Å; F117-F478 HydrophobicContact CE1-CD1 4.18Å; F117-A482 HydrophobicContact CB-CB 4.18Å; F117-A482 HydrophobicContact CD2-CB 3.72Å; F117-A482 HydrophobicContact CE2-CB 4.29Å; F117-A482 HydrophobicContact CG-CB 3.91Å; F117-V486 HydrophobicContact CE2-CG2 3.99Å; F117-I562 HydrophobicContact CD1-CG2 4.25Å
118	Q	92.5	Very high	91	Very high	65 Å²	65	15.3 Å²	15.3	30%	0.304	8%	0.077	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55	-28.2	178.4	-169	178.1	20.1	0	0	113.8	W111 P115 I120 G121 N569	W111-Q118 HydrophobicContact CB-CB 4.35Å; W111-Q118 HydrophobicContact CB-CG 4.35Å; P115-Q118 WeakPolarHBondContact O-CB 3.32Å; P115-Q118 PolarHBondContact O-N 3.12Å; Q118-I120 PolarHBondContact O-N 3.47Å; Q118-G121 PolarHBondContact O-N 3.05Å; Q118-N569 PolarHBondContact OE1-ND2 3.08Å; Q118-N569 VanDerWaalsContact OE1-ND2 3.11Å
119	G	93.8	Very high	91	Very high	0 Å²	0	15.3 Å²	15.3	0%	0	8%	0.079	C	C	.	.	H	α-helix	trans	-61.7	-21.4	174.8	0	0	0	0	0	114.9	F117 G121 I122 S123 T565	F117-G119 PolarHBondContact O-N 2.87Å; G119-G121 VanDerWaalsContact C-N 3.32Å; G119-G121 PolarHBondContact O-N 3.36Å; G119-I122 PolarHBondContact O-N 2.03Å; G119-S123 WeakPolarHBondContact O-CB 3.38Å; G119-S123 PolarHBondContact O-N 3.38Å; G119-S123 PolarHBondContact O-OG 3.05Å; G119-S123 VanDerWaalsContact O-OG 3.08Å; G119-T565 WeakPolarHBondContact CA-OG1 3.32Å; G119-T565 PolarHBondContact N-OG1 3.32Å
120	I	95.2	Very high	91.1	Very high	0 Å²	0	17 Å²	17	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-60.8	-46.4	176.8	-61.7	176.3	0	0	0	109.4	W111 F117 Q118 I122 S123 M124 I475 F478 E479 A482 I562	W111-I120 HydrophobicContact CD2-CB 4.09Å; W111-I120 HydrophobicContact CE3-CD1 4.29Å; W111-I120 HydrophobicContact CH2-CB 4.12Å; W111-I120 HydrophobicContact CH2-CD1 3.55Å; W111-I120 HydrophobicContact CH2-CG1 4.43Å; W111-I120 HydrophobicContact CH2-CG2 3.93Å; W111-I120 HydrophobicContact CZ2-CB 3.59Å; W111-I120 HydrophobicContact CZ2-CD1 3.95Å; W111-I120 HydrophobicContact CZ2-CG1 4.39Å; W111-I120 HydrophobicContact CZ2-CG2 3.23Å; W111-I120 HydrophobicContact CZ3-CD1 3.72Å; F117-I120 HydrophobicContact CB-CD1 3.71Å; F117-I120 HydrophobicContact CB-CG1 4.2Å; F117-I120 HydrophobicContact CD1-CD1 4.05Å; F117-I120 HydrophobicContact CG-CD1 4.15Å; F117-I120 WeakPolarHBondContact O-CB 3.25Å; F117-I120 WeakPolarHBondContact O-CG1 3.48Å; F117-I120 PolarHBondContact O-N 3.18Å; Q118-I120 PolarHBondContact O-N 3.47Å; I120-I122 VanDerWaalsContact C-N 3.33Å; I120-I122 PolarHBondContact O-N 3.12Å; I120-S123 WeakPolarHBondContact O-CB 3.42Å; I120-S123 PolarHBondContact O-N 2.97Å; I120-M124 HydrophobicContact CG2-CE 3.87Å; I120-M124 HydrophobicContact CG2-SD 4.37Å; I120-M124 WeakPolarHBondContact O-CG 3.46Å; I120-M124 PolarHBondContact O-N 3.5Å; I120-I475 HydrophobicContact CG2-CG2 3.85Å; I120-F478 HydrophobicContact CD1-CB 3.77Å; I120-F478 HydrophobicContact CG1-CB 4.19Å; I120-E479 HydrophobicContact CG2-CB 4.23Å; I120-A482 HydrophobicContact CD1-CB 4.25Å; I120-I562 HydrophobicContact CG1-CD1 3.91Å; I120-I562 HydrophobicContact CG1-CG1 3.9Å; I120-I562 HydrophobicContact CG1-CG2 4.44Å
121	G	92	Very high	91	Very high	0 Å²	0	17.1 Å²	17.1	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-66.3	-34.4	177.7	0	0	0	0	0	113.4	C107 I108 W111 Q118 G119 F125	C107-G121 VanDerWaalsContact O-CA 3.28Å; C107-G121 WeakPolarHBondContact O-CA 3.33Å; I108-G121 WeakPolarHBondContact CG1-O 3.41Å; W111-G121 VanDerWaalsContact CD1-N 3.25Å; W111-G121 VanDerWaalsContact NE1-CA 3.33Å; Q118-G121 PolarHBondContact O-N 3.05Å; G119-G121 VanDerWaalsContact C-N 3.32Å; G119-G121 PolarHBondContact O-N 3.36Å; G121-F125 WeakPolarHBondContact O-CB 3.3Å; G121-F125 PolarHBondContact O-N 3.19Å
122	I	91.4	Very high	90.8	Very high	56 Å²	56	17 Å²	17	29%	0.287	9%	0.087	S	C	.	.	H	α-helix	trans	-67.3	-42.7	174.5	-59.6	-178.6	0	0	0	109.9	I108 G119 I120 F125 V126 I561 T565	I108-I122 HydrophobicContact CG2-CG1 4.3Å; G119-I122 PolarHBondContact O-N 2.03Å; I120-I122 VanDerWaalsContact C-N 3.33Å; I120-I122 PolarHBondContact O-N 3.12Å; I122-F125 WeakPolarHBondContact O-CB 3.21Å; I122-F125 PolarHBondContact O-N 3.36Å; I122-V126 HydrophobicContact CG2-CG2 4.44Å; I122-V126 WeakPolarHBondContact O-CG2 3.33Å; I122-V126 PolarHBondContact O-N 3.09Å; I122-I561 HydrophobicContact CB-CG2 3.87Å; I122-I561 HydrophobicContact CG2-CG2 3.72Å; I122-T565 HydrophobicContact CD1-CG2 3.89Å
123	S	93.3	Very high	90.8	Very high	0 Å²	0	16.1 Å²	16.1	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-62	-45.3	175.2	-67.7	0	0	0	0	112.4	G119 I120 F125 V126 I127 P558 I561	G119-S123 WeakPolarHBondContact O-CB 3.38Å; G119-S123 PolarHBondContact O-N 3.38Å; G119-S123 PolarHBondContact O-OG 3.05Å; G119-S123 VanDerWaalsContact O-OG 3.08Å; I120-S123 WeakPolarHBondContact O-CB 3.42Å; I120-S123 PolarHBondContact O-N 2.97Å; S123-F125 VanDerWaalsContact C-N 3.31Å; S123-F125 PolarHBondContact O-N 3.06Å; S123-V126 PolarHBondContact O-N 3.01Å; S123-I127 WeakPolarHBondContact O-CG1 3.46Å; S123-I127 PolarHBondContact O-N 3.07Å; S123-P558 WeakPolarHBondContact OG-CA 3.27Å; S123-P558 PolarHBondContact OG-O 3.33Å; S123-I561 WeakPolarHBondContact OG-CB 3.34Å; S123-I561 WeakPolarHBondContact OG-CG2 3.03Å
124	M	91.6	Very high	90.7	Very high	0 Å²	0	16.1 Å²	16.1	0%	0	8%	0.083	C	C	.	.	H	α-helix	trans	-54.2	-47.9	172.2	-73.5	171.9	169.8	0	0	111.4	C107 W111 I120 S128 I323 I475 E479	C107-M124 HydrophobicContact CB-SD 4.37Å; W111-M124 HydrophobicContact CZ2-CE 4.34Å; I120-M124 HydrophobicContact CG2-CE 3.87Å; I120-M124 HydrophobicContact CG2-SD 4.37Å; I120-M124 WeakPolarHBondContact O-CG 3.46Å; I120-M124 PolarHBondContact O-N 3.5Å; M124-S128 WeakPolarHBondContact O-CB 3.2Å; M124-S128 PolarHBondContact O-N 3.08Å; M124-S128 PolarHBondContact O-OG 3.16Å; M124-I323 HydrophobicContact CE-CD1 4.19Å; M124-I323 HydrophobicContact SD-CD1 4.01Å; M124-I475 HydrophobicContact CE-CG2 3.89Å; M124-I475 HydrophobicContact CG-CG2 3.66Å; M124-E479 HydrophobicContact CE-CG 4.29Å; M124-E479 WeakPolarHBondContact CE-OE2 3.24Å
125	F	88.5	Confident	90.6	Very high	33 Å²	33	16.6 Å²	16.6	15%	0.145	9%	0.085	C	C	.	.	H	α-helix	trans	-61.9	-44.4	177.6	173.3	-80.9	0	0	0	112.4	I108 G121 I122 S123 S128 A129 L421 F425	I108-F125 HydrophobicContact CD1-CB 3.89Å; I108-F125 HydrophobicContact CD1-CD2 3.74Å; I108-F125 HydrophobicContact CD1-CE2 4.34Å; I108-F125 HydrophobicContact CD1-CG 3.87Å; I108-F125 HydrophobicContact CG1-CB 4.12Å; G121-F125 WeakPolarHBondContact O-CB 3.3Å; G121-F125 PolarHBondContact O-N 3.19Å; I122-F125 WeakPolarHBondContact O-CB 3.21Å; I122-F125 PolarHBondContact O-N 3.36Å; S123-F125 VanDerWaalsContact C-N 3.31Å; S123-F125 PolarHBondContact O-N 3.06Å; F125-S128 WeakPolarHBondContact O-CB 3.33Å; F125-A129 WeakPolarHBondContact O-CB 3.39Å; F125-A129 PolarHBondContact O-N 2.9Å; F125-L421 HydrophobicContact CD1-CD2 3.99Å; F125-L421 HydrophobicContact CD2-CD2 3.71Å; F125-L421 HydrophobicContact CD2-CG 4.12Å; F125-L421 HydrophobicContact CE1-CD2 3.51Å; F125-L421 VanDerWaalsContact CE2-CA 3.49Å; F125-L421 HydrophobicContact CE2-CB 3.98Å; F125-L421 HydrophobicContact CE2-CD2 3.27Å; F125-L421 HydrophobicContact CE2-CG 3.83Å; F125-L421 HydrophobicContact CG-CD2 4.07Å; F125-L421 HydrophobicContact CZ-CB 4.43Å; F125-L421 HydrophobicContact CZ-CD2 3.13Å; F125-L421 HydrophobicContact CZ-CG 4.17Å; F125-F425 AromaticContact CZ-CE2 3.99Å; F125-F425 HydrophobicContact CZ-CE2 3.99Å
126	V	89.1	Confident	90.6	Very high	41 Å²	41	16.3 Å²	16.3	25%	0.248	8%	0.084	C	C	.	.	H	α-helix	trans	-66.2	-47	-178.6	169.5	0	0	0	0	111.2	I122 S123 S128 A129 L130 L557 I561	I122-V126 HydrophobicContact CG2-CG2 4.44Å; I122-V126 WeakPolarHBondContact O-CG2 3.33Å; I122-V126 PolarHBondContact O-N 3.09Å; S123-V126 PolarHBondContact O-N 3.01Å; V126-S128 VanDerWaalsContact C-N 3.35Å; V126-S128 PolarHBondContact O-N 3.26Å; V126-A129 WeakPolarHBondContact O-CB 3.39Å; V126-A129 PolarHBondContact O-N 3.01Å; V126-L130 HydrophobicContact CG1-CD1 4.24Å; V126-L130 WeakPolarHBondContact O-CG 3.19Å; V126-L130 PolarHBondContact O-N 3.45Å; V126-L557 HydrophobicContact CG1-CD2 4.38Å; V126-I561 HydrophobicContact CB-CD1 4.45Å; V126-I561 HydrophobicContact CG2-CD1 4.18Å
127	I	88.7	Confident	90.6	Very high	2 Å²	2	15.3 Å²	15.3	1%	0.01	8%	0.079	C	C	.	.	H	α-helix	trans	-62.2	-46.3	178.1	-66.3	-60.1	0	0	0	110.4	S123 A129 L130 V131 V467 V472 I475 P558	S123-I127 WeakPolarHBondContact O-CG1 3.46Å; S123-I127 PolarHBondContact O-N 3.07Å; I127-A129 VanDerWaalsContact C-N 3.31Å; I127-A129 PolarHBondContact O-N 3.12Å; I127-L130 PolarHBondContact O-N 3.33Å; I127-V131 HydrophobicContact CG2-CG2 4.36Å; I127-V131 WeakPolarHBondContact O-CG2 3.45Å; I127-V131 PolarHBondContact O-N 3.26Å; I127-V467 HydrophobicContact CD1-CG1 4Å; I127-V467 HydrophobicContact CG2-CG1 4.18Å; I127-V472 HydrophobicContact CG2-CG2 3.94Å; I127-I475 HydrophobicContact CG1-CD1 3.88Å; I127-P558 HydrophobicContact CD1-CG 3.9Å; I127-P558 HydrophobicContact CG1-CG 4.04Å
128	S	87.4	Confident	90.5	Very high	0 Å²	0	13.9 Å²	13.9	0%	0	7%	0.072	C	C	.	.	H	α-helix	trans	-56.5	-40	173.9	-80.4	0	0	0	0	114.3	M124 F125 V126 S132 W319 V417	M124-S128 WeakPolarHBondContact O-CB 3.2Å; M124-S128 PolarHBondContact O-N 3.08Å; M124-S128 PolarHBondContact O-OG 3.16Å; F125-S128 WeakPolarHBondContact O-CB 3.33Å; V126-S128 VanDerWaalsContact C-N 3.35Å; V126-S128 PolarHBondContact O-N 3.26Å; S128-S132 WeakPolarHBondContact O-CB 3.09Å; S128-S132 PolarHBondContact O-N 3.25Å; S128-S132 PolarHBondContact O-OG 3.28Å; S128-W319 PolarHBondContact OG-O 3.07Å; S128-V417 WeakPolarHBondContact OG-CG1 3.3Å
129	A	87.2	Confident	90.5	Very high	13 Å²	13	10.9 Å²	10.9	11%	0.107	6%	0.058	C	C	.	.	H	α-helix	trans	-63.8	-48.4	174.6	0	0	0	0	0	111.1	F125 V126 I127 V131 S132 I133 L421 F444	F125-A129 WeakPolarHBondContact O-CB 3.39Å; F125-A129 PolarHBondContact O-N 2.9Å; V126-A129 WeakPolarHBondContact O-CB 3.39Å; V126-A129 PolarHBondContact O-N 3.01Å; I127-A129 VanDerWaalsContact C-N 3.31Å; I127-A129 PolarHBondContact O-N 3.12Å; A129-V131 PolarHBondContact O-N 3.41Å; A129-S132 PolarHBondContact O-N 3.32Å; A129-I133 VanDerWaalsContact O-CG1 3.3Å; A129-I133 WeakPolarHBondContact O-CG1 3.42Å; A129-I133 PolarHBondContact O-N 3.29Å; A129-I133 VanDerWaalsContact O-N 3.15Å; A129-L421 HydrophobicContact CB-CD1 4.34Å; A129-L421 HydrophobicContact CB-CD2 3.65Å; A129-F444 HydrophobicContact CB-CE1 4.24Å; A129-F444 HydrophobicContact CB-CZ 4.24Å
130	L	89.2	Confident	90.6	Very high	52 Å²	52	10.9 Å²	10.9	27%	0.272	6%	0.058	S	C	.	.	H	α-helix	trans	-59.8	-47.6	178.7	-70	172	0	0	0	111.1	V126 I127 S132 I133 Y134 V467 L554	V126-L130 HydrophobicContact CG1-CD1 4.24Å; V126-L130 WeakPolarHBondContact O-CG 3.19Å; V126-L130 PolarHBondContact O-N 3.45Å; I127-L130 PolarHBondContact O-N 3.33Å; L130-S132 VanDerWaalsContact C-N 3.34Å; L130-S132 PolarHBondContact O-N 3Å; L130-I133 PolarHBondContact O-N 3.02Å; L130-I133 VanDerWaalsContact O-N 3.14Å; L130-Y134 WeakPolarHBondContact O-CD1 3.3Å; L130-Y134 PolarHBondContact O-N 3.47Å; L130-V467 HydrophobicContact CB-CG1 4.03Å; L130-V467 HydrophobicContact CD1-CG1 4.25Å; L130-L554 HydrophobicContact CD1-CD1 4.05Å
131	V	88.2	Confident	90.6	Very high	2 Å²	2	10.9 Å²	10.9	1%	0.012	6%	0.058	C	C	.	.	H	α-helix	trans	-61.4	-43.2	178.3	-179.6	0	0	0	0	111.9	I127 A129 I133 Y134 Y135 W319 V467 I468	I127-V131 HydrophobicContact CG2-CG2 4.36Å; I127-V131 WeakPolarHBondContact O-CG2 3.45Å; I127-V131 PolarHBondContact O-N 3.26Å; A129-V131 PolarHBondContact O-N 3.41Å; V131-I133 PolarHBondContact O-N 3.09Å; V131-Y134 VanDerWaalsContact CA-CE1 3.41Å; V131-Y134 HydrophobicContact CB-CE1 3.99Å; V131-Y134 HydrophobicContact CG1-CE1 4.11Å; V131-Y134 HydrophobicContact CG2-CE1 3.83Å; V131-Y134 PolarHBondContact O-N 3.23Å; V131-Y135 HydrophobicContact CG1-CD1 4.03Å; V131-Y135 HydrophobicContact CG1-CD2 3.45Å; V131-Y135 VanDerWaalsContact CG1-CD2 3.45Å; V131-Y135 HydrophobicContact CG1-CE1 4.13Å; V131-Y135 HydrophobicContact CG1-CE2 3.52Å; V131-Y135 HydrophobicContact CG1-CG 3.71Å; V131-Y135 VanDerWaalsContact O-CB 3.29Å; V131-Y135 WeakPolarHBondContact O-CB 3.43Å; V131-Y135 PolarHBondContact O-N 3.37Å; V131-W319 HydrophobicContact CB-CH2 4.17Å; V131-W319 HydrophobicContact CB-CZ3 3.81Å; V131-W319 HydrophobicContact CG1-CH2 3.62Å; V131-W319 HydrophobicContact CG1-CZ3 3.42Å; V131-W319 VanDerWaalsContact CG1-CZ3 3.42Å; V131-W319 HydrophobicContact CG2-CH2 3.86Å; V131-W319 HydrophobicContact CG2-CZ2 4.48Å; V131-W319 HydrophobicContact CG2-CZ3 3.9Å; V131-V467 HydrophobicContact CG2-CG1 4.16Å; V131-I468 HydrophobicContact CG2-CD1 4.32Å; V131-I468 HydrophobicContact CG2-CG1 4.02Å
132	S	87.7	Confident	90.7	Very high	1 Å²	1	10.9 Å²	10.9	1%	0.007	6%	0.058	C	C	.	.	H	α-helix	trans	-57.9	-36.2	176.9	-60.4	0	0	0	0	112.3	S128 A129 L130 N136 W241 V417	S128-S132 WeakPolarHBondContact O-CB 3.09Å; S128-S132 PolarHBondContact O-N 3.25Å; S128-S132 PolarHBondContact O-OG 3.28Å; A129-S132 PolarHBondContact O-N 3.32Å; L130-S132 VanDerWaalsContact C-N 3.34Å; L130-S132 PolarHBondContact O-N 3Å; S132-N136 WeakPolarHBondContact O-CB 3.34Å; S132-N136 PolarHBondContact O-N 2.95Å; S132-W241 WeakPolarHBondContact O-CH2 3.23Å; S132-V417 WeakPolarHBondContact OG-CB 3.41Å; S132-V417 PolarHBondContact OG-N 3.49Å
133	I	89.6	Confident	90.9	Very high	15 Å²	15	9.2 Å²	9.2	8%	0.077	5%	0.05	C	C	.	.	H	α-helix	trans	-67.6	-52.9	-179.3	-64.6	162.6	0	0	0	111	A129 L130 V131 F444 A447 F451	A129-I133 VanDerWaalsContact O-CG1 3.3Å; A129-I133 WeakPolarHBondContact O-CG1 3.42Å; A129-I133 PolarHBondContact O-N 3.29Å; A129-I133 VanDerWaalsContact O-N 3.15Å; L130-I133 PolarHBondContact O-N 3.02Å; L130-I133 VanDerWaalsContact O-N 3.14Å; V131-I133 PolarHBondContact O-N 3.09Å; I133-F444 HydrophobicContact CD1-CD1 3.96Å; I133-F444 HydrophobicContact CD1-CG 4.49Å; I133-F444 HydrophobicContact CG1-CB 3.94Å; I133-F444 HydrophobicContact CG1-CD1 3.94Å; I133-F444 HydrophobicContact CG1-CG 3.97Å; I133-A447 HydrophobicContact CD1-CB 3.99Å; I133-F451 HydrophobicContact CG2-CD2 4.24Å; I133-F451 HydrophobicContact CG2-CE2 3.81Å
134	Y	89.7	Confident	91.1	Very high	1 Å²	1	10.3 Å²	10.3	0%	0.004	6%	0.055	C	C	.	.	H	α-helix	trans	-82.4	-28.1	-172.8	82.2	-98.7	0	0	0	113.1	L130 V131 N136 V137 F451 F460 C463 E464 I468	L130-Y134 WeakPolarHBondContact O-CD1 3.3Å; L130-Y134 PolarHBondContact O-N 3.47Å; V131-Y134 VanDerWaalsContact CA-CE1 3.41Å; V131-Y134 HydrophobicContact CB-CE1 3.99Å; V131-Y134 HydrophobicContact CG1-CE1 4.11Å; V131-Y134 HydrophobicContact CG2-CE1 3.83Å; V131-Y134 PolarHBondContact O-N 3.23Å; Y134-N136 VanDerWaalsContact C-N 3.28Å; Y134-N136 PolarHBondContact O-N 3.02Å; Y134-V137 VanDerWaalsContact O-CB 3.28Å; Y134-V137 WeakPolarHBondContact O-CB 3.35Å; Y134-V137 WeakPolarHBondContact O-CG2 3.3Å; Y134-V137 PolarHBondContact O-N 2.79Å; Y134-F451 VanDerWaalsContact CB-CZ 3.43Å; Y134-F460 AromaticContact CD2-CD2 3.68Å; Y134-F460 HydrophobicContact CD2-CD2 3.68Å; Y134-F460 AromaticContact CD2-CE2 3.57Å; Y134-F460 HydrophobicContact CD2-CE2 3.57Å; Y134-F460 HydrophobicContact CD2-CG 4.49Å; Y134-F460 HydrophobicContact CD2-CZ 4.32Å; Y134-F460 HydrophobicContact CE2-CD2 4.47Å; Y134-F460 HydrophobicContact CE2-CE2 4.07Å; Y134-F460 HydrophobicContact CE2-CZ 4.39Å; Y134-C463 HydrophobicContact CD1-CB 3.81Å; Y134-C463 HydrophobicContact CD2-CB 4.34Å; Y134-C463 HydrophobicContact CE1-CB 4.03Å; Y134-C463 HydrophobicContact CG-CB 4.02Å; Y134-E464 HydrophobicContact CE2-CB 4.31Å; Y134-E464 VanDerWaalsContact CE2-OE2 3.22Å; Y134-E464 WeakPolarHBondContact CE2-OE2 3.4Å; Y134-E464 PolarHBondContact OH-OE2 3.31Å; Y134-I468 WeakPolarHBondContact OH-CD1 3.24Å
135	Y	89.1	Confident	91.3	Very high	10 Å²	10	10.3 Å²	10.3	4%	0.039	6%	0.055	C	C	.	.	H	α-helix	trans	-66.1	-30.3	171.2	-82.7	7.5	0	0	0	112.6	Y59 V131 V137 V138 W319 F412 E464 I468	Y59-Y135 HydrophobicContact CD1-CE1 4.27Å; V131-Y135 HydrophobicContact CG1-CD1 4.03Å; V131-Y135 HydrophobicContact CG1-CD2 3.45Å; V131-Y135 VanDerWaalsContact CG1-CD2 3.45Å; V131-Y135 HydrophobicContact CG1-CE1 4.13Å; V131-Y135 HydrophobicContact CG1-CE2 3.52Å; V131-Y135 HydrophobicContact CG1-CG 3.71Å; V131-Y135 VanDerWaalsContact O-CB 3.29Å; V131-Y135 WeakPolarHBondContact O-CB 3.43Å; V131-Y135 PolarHBondContact O-N 3.37Å; Y135-V137 PolarHBondContact O-N 3.16Å; Y135-V138 VanDerWaalsContact O-CB 3.32Å; Y135-V138 WeakPolarHBondContact O-CB 3.4Å; Y135-V138 PolarHBondContact O-N 3.19Å; Y135-W319 HydrophobicContact CE2-CH2 4.37Å; Y135-F412 HydrophobicContact CD2-CE1 4.3Å; Y135-F412 HydrophobicContact CG-CE1 4.24Å; Y135-E464 VanDerWaalsContact CE1-OE2 3.28Å; Y135-E464 WeakPolarHBondContact CE1-OE2 3.5Å; Y135-E464 PolarHBondContact OH-OE2 3.36Å; Y135-I468 WeakPolarHBondContact OH-CD1 3.05Å
136	N	90.8	Very high	91.6	Very high	0 Å²	0	10.5 Å²	10.5	0%	0	6%	0.057	C	C	.	.	H	α-helix	trans	-67.6	-16.1	176.7	-165.3	56.9	0	0	0	113	S132 Y134 V138 V139 A140 F237 W241	S132-N136 WeakPolarHBondContact O-CB 3.34Å; S132-N136 PolarHBondContact O-N 2.95Å; Y134-N136 VanDerWaalsContact C-N 3.28Å; Y134-N136 PolarHBondContact O-N 3.02Å; N136-V138 VanDerWaalsContact C-N 3.31Å; N136-V139 WeakPolarHBondContact O-CB 3.42Å; N136-V139 PolarHBondContact O-N 2.99Å; N136-A140 PolarHBondContact O-N 3.02Å; N136-F237 HydrophobicContact CB-CD2 4.44Å; N136-F237 HydrophobicContact CB-CE2 3.8Å; N136-F237 WeakPolarHBondContact ND2-CE2 3.35Å; N136-F237 PolarHBondContact ND2-O 3.36Å; N136-W241 HydrophobicContact CB-CH2 4.18Å; N136-W241 HydrophobicContact CB-CZ2 3.91Å; N136-W241 VanDerWaalsContact ND2-CD2 3.29Å; N136-W241 PolarHBondContact ND2-NE1 3.42Å; N136-W241 VanDerWaalsContact ND2-NE1 3.13Å
137	V	92.8	Very high	92	Very high	0 Å²	0	12.2 Å²	12.2	0%	0	6%	0.064	C	C	.	.	H	α-helix	trans	-68.3	-34.7	171.6	-174.7	0	0	0	0	110.8	Y134 Y135 V139 A140 W141 F237 F451	Y134-V137 VanDerWaalsContact O-CB 3.28Å; Y134-V137 WeakPolarHBondContact O-CB 3.35Å; Y134-V137 WeakPolarHBondContact O-CG2 3.3Å; Y134-V137 PolarHBondContact O-N 2.79Å; Y135-V137 PolarHBondContact O-N 3.16Å; V137-V139 VanDerWaalsContact C-N 3.26Å; V137-V139 PolarHBondContact O-N 3.4Å; V137-A140 WeakPolarHBondContact O-CA 3.08Å; V137-A140 VanDerWaalsContact O-CB 3.25Å; V137-A140 WeakPolarHBondContact O-CB 3.38Å; V137-A140 PolarHBondContact O-N 3.47Å; V137-W141 HydrophobicContact CG1-CD2 4.35Å; V137-W141 HydrophobicContact CG1-CH2 4.35Å; V137-W141 HydrophobicContact CG1-CZ2 3.66Å; V137-W141 PolarHBondContact O-N 3.46Å; V137-F237 HydrophobicContact CG2-CD2 4.16Å; V137-F237 HydrophobicContact CG2-CE2 3.74Å; V137-F237 HydrophobicContact CG2-CZ 4.47Å; V137-F451 HydrophobicContact CB-CB 4.29Å; V137-F451 HydrophobicContact CG1-CB 4.07Å; V137-F451 HydrophobicContact CG2-CB 3.31Å; V137-F451 HydrophobicContact CG2-CD2 3.94Å; V137-F451 HydrophobicContact CG2-CG 3.74Å
138	V	92.7	Very high	92.2	Very high	0 Å²	0	12.4 Å²	12.4	0%	0	7%	0.066	C	C	.	.	H	α-helix	trans	-63.5	-36.2	175.1	-171.9	0	0	0	0	111	Y59 Y135 N136 A140 W141 A142 F384 F412 F460	Y59-V138 HydrophobicContact CD2-CG1 3.94Å; Y59-V138 HydrophobicContact CE2-CG1 4Å; Y135-V138 VanDerWaalsContact O-CB 3.32Å; Y135-V138 WeakPolarHBondContact O-CB 3.4Å; Y135-V138 PolarHBondContact O-N 3.19Å; N136-V138 VanDerWaalsContact C-N 3.31Å; V138-A140 VanDerWaalsContact C-N 3.33Å; V138-W141 HydrophobicContact CB-CE3 4.39Å; V138-W141 HydrophobicContact CG1-CE3 4.42Å; V138-W141 HydrophobicContact CG2-CE3 4.25Å; V138-W141 HydrophobicContact CG2-CZ3 4.09Å; V138-W141 PolarHBondContact O-N 3.19Å; V138-A142 WeakPolarHBondContact O-CB 3.17Å; V138-A142 PolarHBondContact O-N 3.42Å; V138-F384 HydrophobicContact CG1-CE2 3.63Å; V138-F384 HydrophobicContact CG1-CZ 3.57Å; V138-F412 HydrophobicContact CB-CE1 4.16Å; V138-F412 HydrophobicContact CB-CE2 3.9Å; V138-F412 HydrophobicContact CB-CZ 3.47Å; V138-F412 VanDerWaalsContact CB-CZ 3.47Å; V138-F412 HydrophobicContact CG1-CE1 4.49Å; V138-F412 HydrophobicContact CG1-CE2 3.51Å; V138-F412 HydrophobicContact CG1-CZ 3.38Å; V138-F412 HydrophobicContact CG2-CZ 4.1Å; V138-F460 HydrophobicContact CG2-CE2 3.5Å; V138-F460 HydrophobicContact CG2-CZ 3.75Å
139	V	92.6	Very high	92.6	Very high	2 Å²	2	12.4 Å²	12.4	1%	0.012	7%	0.066	C	C	.	.	H	α-helix	trans	-63.1	-41.4	171.7	-176.3	0	0	0	0	110.7	N136 V137 A142 I143 I409 F412	N136-V139 WeakPolarHBondContact O-CB 3.42Å; N136-V139 PolarHBondContact O-N 2.99Å; V137-V139 VanDerWaalsContact C-N 3.26Å; V137-V139 PolarHBondContact O-N 3.4Å; V139-A142 PolarHBondContact O-N 3.27Å; V139-I143 HydrophobicContact CG1-CD1 3.92Å; V139-I143 HydrophobicContact CG1-CG1 4.36Å; V139-I143 VanDerWaalsContact O-CG1 3.29Å; V139-I143 WeakPolarHBondContact O-CG1 3.21Å; V139-I143 PolarHBondContact O-N 3.32Å; V139-I409 HydrophobicContact CG1-CG2 4.43Å; V139-F412 HydrophobicContact CG2-CB 3.27Å; V139-F412 HydrophobicContact CG2-CD1 4.18Å; V139-F412 HydrophobicContact CG2-CD2 3.79Å; V139-F412 HydrophobicContact CG2-CG 3.52Å
140	A	94.9	Very high	92.9	Very high	0 Å²	0	17.9 Å²	17.9	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-61.2	-44.6	176.8	0	0	0	0	0	111.9	N136 V137 V138 I143 H144 L233 F237	N136-A140 PolarHBondContact O-N 3.02Å; V137-A140 WeakPolarHBondContact O-CA 3.08Å; V137-A140 VanDerWaalsContact O-CB 3.25Å; V137-A140 WeakPolarHBondContact O-CB 3.38Å; V137-A140 PolarHBondContact O-N 3.47Å; V138-A140 VanDerWaalsContact C-N 3.33Å; A140-I143 PolarHBondContact O-N 3.22Å; A140-H144 PolarHBondContact O-N 3.13Å; A140-L233 HydrophobicContact CB-CD1 3.79Å; A140-F237 HydrophobicContact CB-CB 4.03Å; A140-F237 HydrophobicContact CB-CD2 4.4Å
141	W	95.5	Very high	92.9	Very high	0 Å²	0	22 Å²	22	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-60.3	-47	172.7	-59.9	-29.6	0	0	0	111.1	V137 V138 I143 H144 Y145 F212 L217 P380 F384 I457 F460	V137-W141 HydrophobicContact CG1-CD2 4.35Å; V137-W141 HydrophobicContact CG1-CH2 4.35Å; V137-W141 HydrophobicContact CG1-CZ2 3.66Å; V137-W141 PolarHBondContact O-N 3.46Å; V138-W141 HydrophobicContact CB-CE3 4.39Å; V138-W141 HydrophobicContact CG1-CE3 4.42Å; V138-W141 HydrophobicContact CG2-CE3 4.25Å; V138-W141 HydrophobicContact CG2-CZ3 4.09Å; V138-W141 PolarHBondContact O-N 3.19Å; W141-I143 VanDerWaalsContact C-N 3.32Å; W141-I143 PolarHBondContact O-N 2.89Å; W141-H144 VanDerWaalsContact O-CB 3.32Å; W141-H144 WeakPolarHBondContact O-CB 3.44Å; W141-H144 PolarHBondContact O-N 3.16Å; W141-H144 VanDerWaalsContact O-N 3.11Å; W141-Y145 VanDerWaalsContact O-CD2 3.32Å; W141-Y145 WeakPolarHBondContact O-CD2 3.3Å; W141-Y145 PolarHBondContact O-N 3.18Å; W141-F212 HydrophobicContact CD2-CE2 4.38Å; W141-F212 HydrophobicContact CE3-CZ 4.46Å; W141-L217 HydrophobicContact CZ2-CD2 3.76Å; W141-P380 HydrophobicContact CZ3-CB 4.09Å; W141-F384 HydrophobicContact CB-CD1 4.44Å; W141-F384 HydrophobicContact CB-CE1 3.88Å; W141-F384 HydrophobicContact CB-CZ 3.94Å; W141-F384 HydrophobicContact CE3-CD2 4.32Å; W141-F384 AromaticContact CE3-CE2 3.88Å; W141-F384 HydrophobicContact CE3-CE2 3.88Å; W141-F384 HydrophobicContact CE3-CZ 4.32Å; W141-I457 HydrophobicContact CH2-CD1 3.75Å; W141-I457 HydrophobicContact CZ2-CD1 4.24Å; W141-F460 HydrophobicContact CH2-CB 4.37Å; W141-F460 HydrophobicContact CH2-CD1 4.19Å; W141-F460 AromaticContact CH2-CD2 3.95Å; W141-F460 HydrophobicContact CH2-CD2 3.95Å; W141-F460 HydrophobicContact CH2-CE2 4.3Å; W141-F460 AromaticContact CH2-CG 3.9Å; W141-F460 HydrophobicContact CH2-CG 3.9Å; W141-F460 HydrophobicContact CZ3-CD2 4.42Å; W141-F460 HydrophobicContact CZ3-CE2 4.32Å; W141-F460 HydrophobicContact CZ3-CZ 4.39Å
142	A	95.1	Very high	92.9	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-61.5	-37.7	178.7	0	0	0	0	0	113	V138 V139 Y145 L146 F384 I408 I409	V138-A142 WeakPolarHBondContact O-CB 3.17Å; V138-A142 PolarHBondContact O-N 3.42Å; V139-A142 PolarHBondContact O-N 3.27Å; A142-Y145 PolarHBondContact O-N 2.6Å; A142-L146 VanDerWaalsContact O-CB 3.29Å; A142-L146 WeakPolarHBondContact O-CB 3.47Å; A142-L146 PolarHBondContact O-N 3.35Å; A142-F384 HydrophobicContact CB-CE1 4.29Å; A142-I408 HydrophobicContact CB-CB 4.14Å; A142-I408 HydrophobicContact CB-CG2 3.68Å; A142-I409 HydrophobicContact CB-CD1 4.4Å; A142-I409 HydrophobicContact CB-CG1 3.72Å
143	I	95.8	Very high	92.9	Very high	22 Å²	22	34.2 Å²	34.2	11%	0.113	17%	0.171	C	C	.	.	H	α-helix	trans	-64.9	-42.1	173.9	-68.5	167.8	0	0	0	110.7	V139 A140 W141 L146 I147 Y236 A239 I409	V139-I143 HydrophobicContact CG1-CD1 3.92Å; V139-I143 HydrophobicContact CG1-CG1 4.36Å; V139-I143 VanDerWaalsContact O-CG1 3.29Å; V139-I143 WeakPolarHBondContact O-CG1 3.21Å; V139-I143 PolarHBondContact O-N 3.32Å; A140-I143 PolarHBondContact O-N 3.22Å; W141-I143 VanDerWaalsContact C-N 3.32Å; W141-I143 PolarHBondContact O-N 2.89Å; I143-L146 PolarHBondContact O-N 3.03Å; I143-I147 HydrophobicContact CG2-CD1 3.91Å; I143-I147 WeakPolarHBondContact O-CG1 3.39Å; I143-I147 PolarHBondContact O-N 3.22Å; I143-Y236 HydrophobicContact CB-CD1 4.47Å; I143-Y236 HydrophobicContact CG2-CD1 3.54Å; I143-Y236 HydrophobicContact CG2-CE1 4.21Å; I143-Y236 HydrophobicContact CG2-CG 4.07Å; I143-A239 HydrophobicContact CD1-CB 4.06Å; I143-I409 HydrophobicContact CG1-CD1 3.75Å; I143-I409 HydrophobicContact CG1-CG1 4.2Å
144	H	95.9	Very high	93	Very high	23 Å²	23	33.7 Å²	33.7	11%	0.106	17%	0.169	C	C	.	.	H	α-helix	trans	-57.6	-50.9	175.2	-172.4	-61	0	0	0	111.2	A140 W141 L146 I147 A148 Y211 Y236	A140-H144 PolarHBondContact O-N 3.13Å; W141-H144 VanDerWaalsContact O-CB 3.32Å; W141-H144 WeakPolarHBondContact O-CB 3.44Å; W141-H144 PolarHBondContact O-N 3.16Å; W141-H144 VanDerWaalsContact O-N 3.11Å; H144-L146 VanDerWaalsContact C-N 3.34Å; H144-L146 PolarHBondContact O-N 3.24Å; H144-I147 PolarHBondContact O-N 2.95Å; H144-A148 WeakPolarHBondContact O-CB 3.31Å; H144-A148 PolarHBondContact O-N 3.48Å; H144-Y211 PolarHBondContact CE1-OH 2.9Å; H144-Y211 PolarHBondContact ND1-OH 3.5Å; H144-Y236 HydrophobicContact CB-CD2 3.84Å; H144-Y236 HydrophobicContact CB-CE2 3.88Å; H144-Y236 AromaticContact CD2-CD2 3.86Å; H144-Y236 AromaticContact CD2-CE2 3.37Å; H144-Y236 WeakPolarHBondContact CD2-CE2 3.3Å; H144-Y236 AromaticContact CG-CE2 3.84Å
145	Y	96.5	Very high	93	Very high	0 Å²	0	34 Å²	34	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-62.8	-38.4	177.3	-87.8	-90.2	0	0	0	112.5	W141 A142 A148 S149 W156 Y211 F212 V216 F384 A388 F405	W141-Y145 VanDerWaalsContact O-CD2 3.32Å; W141-Y145 WeakPolarHBondContact O-CD2 3.3Å; W141-Y145 PolarHBondContact O-N 3.18Å; A142-Y145 PolarHBondContact O-N 2.6Å; Y145-A148 PolarHBondContact O-N 2.93Å; Y145-S149 WeakPolarHBondContact O-CB 3.46Å; Y145-S149 PolarHBondContact O-N 3.34Å; Y145-W156 HydrophobicContact CD1-CD2 4.34Å; Y145-W156 AromaticContact CD1-CE3 3.73Å; Y145-W156 HydrophobicContact CD1-CE3 3.73Å; Y145-W156 AromaticContact CD1-CH2 3.65Å; Y145-W156 HydrophobicContact CD1-CH2 3.65Å; Y145-W156 HydrophobicContact CD1-CZ2 4.25Å; Y145-W156 AromaticContact CD1-CZ3 3.35Å; Y145-W156 HydrophobicContact CD1-CZ3 3.35Å; Y145-W156 HydrophobicContact CE1-CD2 4.17Å; Y145-W156 AromaticContact CE1-CE3 3.78Å; Y145-W156 HydrophobicContact CE1-CE3 3.78Å; Y145-W156 HydrophobicContact CE1-CH2 4.41Å; Y145-W156 AromaticContact CE1-CZ3 3.92Å; Y145-W156 HydrophobicContact CE1-CZ3 3.92Å; Y145-W156 HydrophobicContact CG-CZ3 4.32Å; Y145-Y211 HydrophobicContact CD1-CD1 4.44Å; Y145-Y211 AromaticContact CD1-CE1 3.94Å; Y145-Y211 HydrophobicContact CD1-CE1 3.94Å; Y145-Y211 AromaticContact CE1-CD1 3.6Å; Y145-Y211 HydrophobicContact CE1-CD1 3.6Å; Y145-Y211 AromaticContact CE1-CE1 3.52Å; Y145-Y211 HydrophobicContact CE1-CE1 3.52Å; Y145-Y211 HydrophobicContact CE2-CE1 4.32Å; Y145-Y211 HydrophobicContact CG-CE1 4.48Å; Y145-Y211 AromaticContact CZ-CD1 3.69Å; Y145-Y211 AromaticContact CZ-CE1 3.73Å; Y145-F212 AromaticContact CE2-CD2 4Å; Y145-F212 HydrophobicContact CE2-CD2 4Å; Y145-F212 WeakPolarHBondContact OH-CB 3.1Å; Y145-F212 WeakPolarHBondContact OH-CD2 3.16Å; Y145-V216 HydrophobicContact CE2-CG1 4.4Å; Y145-V216 HydrophobicContact CE2-CG2 3.93Å; Y145-F384 AromaticContact CD2-CD1 3.7Å; Y145-F384 HydrophobicContact CD2-CD1 3.7Å; Y145-F384 HydrophobicContact CD2-CE1 4.21Å; Y145-F384 HydrophobicContact CE2-CB 4.18Å; Y145-F384 AromaticContact CE2-CD1 3.66Å; Y145-F384 HydrophobicContact CE2-CD1 3.66Å; Y145-F384 HydrophobicContact CE2-CG 4.28Å; Y145-F384 HydrophobicContact CG-CD1 4.41Å; Y145-F384 PolarHBondContact OH-O 3.3Å; Y145-A388 HydrophobicContact CE1-CB 4.29Å; Y145-F405 VanDerWaalsContact CB-CE1 3.42Å; Y145-F405 AromaticContact CD1-CE1 3.79Å; Y145-F405 HydrophobicContact CD1-CE1 3.79Å; Y145-F405 AromaticContact CD1-CE2 3.78Å; Y145-F405 HydrophobicContact CD1-CE2 3.78Å; Y145-F405 AromaticContact CD1-CZ 3.26Å; Y145-F405 HydrophobicContact CD1-CZ 3.26Å; Y145-F405 HydrophobicContact CD2-CE1 4.28Å; Y145-F405 HydrophobicContact CE1-CZ 4.1Å; Y145-F405 HydrophobicContact CG-CD1 4.18Å; Y145-F405 AromaticContact CG-CE1 3.59Å; Y145-F405 HydrophobicContact CG-CE1 3.59Å; Y145-F405 HydrophobicContact CG-CE2 4.09Å; Y145-F405 AromaticContact CG-CZ 3.55Å; Y145-F405 HydrophobicContact CG-CZ 3.55Å
146	L	96.1	Very high	93.2	Very high	36 Å²	36	33.5 Å²	33.5	19%	0.188	17%	0.169	C	C	.	.	H	α-helix	trans	-60.7	-46.8	175.5	179.2	62.2	0	0	0	111.2	A142 I143 H144 A148 S149 V402 F405 I406 I409	A142-L146 VanDerWaalsContact O-CB 3.29Å; A142-L146 WeakPolarHBondContact O-CB 3.47Å; A142-L146 PolarHBondContact O-N 3.35Å; I143-L146 PolarHBondContact O-N 3.03Å; H144-L146 VanDerWaalsContact C-N 3.34Å; H144-L146 PolarHBondContact O-N 3.24Å; L146-A148 PolarHBondContact O-N 2.78Å; L146-S149 PolarHBondContact O-N 2.99Å; L146-S149 PolarHBondContact O-OG 3.42Å; L146-V402 HydrophobicContact CD1-CB 4.33Å; L146-V402 HydrophobicContact CD1-CG1 4.07Å; L146-V402 HydrophobicContact CD1-CG2 4.34Å; L146-F405 HydrophobicContact CB-CB 4.04Å; L146-F405 HydrophobicContact CD1-CB 4.46Å; L146-I406 HydrophobicContact CD1-CD1 4.38Å; L146-I406 HydrophobicContact CD1-CG1 3.88Å; L146-I406 HydrophobicContact CD2-CG1 4.18Å; L146-I409 HydrophobicContact CB-CD1 4.39Å; L146-I409 HydrophobicContact CD2-CD1 3.71Å
147	I	95.8	Very high	93.2	Very high	78 Å²	78	34.7 Å²	34.7	40%	0.4	18%	0.18	S	C	.	.	H	α-helix	trans	-65.4	-41.6	178.2	-68	164.9	0	0	0	110.8	I143 H144 S149 L150 Y236	I143-I147 HydrophobicContact CG2-CD1 3.91Å; I143-I147 WeakPolarHBondContact O-CG1 3.39Å; I143-I147 PolarHBondContact O-N 3.22Å; H144-I147 PolarHBondContact O-N 2.95Å; I147-S149 PolarHBondContact O-N 3.22Å; I147-L150 WeakPolarHBondContact O-CB 3.17Å; I147-L150 PolarHBondContact O-N 3.02Å; I147-Y236 HydrophobicContact CD1-CD1 4.02Å; I147-Y236 HydrophobicContact CD1-CE1 3.25Å
148	A	94.3	Very high	92.9	Very high	6 Å²	6	37.7 Å²	37.7	5%	0.05	20%	0.195	C	C	.	.	H	α-helix	trans	-64.6	-26.7	176.4	0	0	0	0	0	113.3	H144 Y145 L146 L150 A155 W156 Y211	H144-A148 WeakPolarHBondContact O-CB 3.31Å; H144-A148 PolarHBondContact O-N 3.48Å; Y145-A148 PolarHBondContact O-N 2.93Å; L146-A148 PolarHBondContact O-N 2.78Å; A148-L150 VanDerWaalsContact C-N 3.28Å; A148-L150 PolarHBondContact O-N 3.47Å; A148-A155 HydrophobicContact CB-CB 4.3Å; A148-W156 HydrophobicContact CB-CZ3 4.04Å; A148-Y211 WeakPolarHBondContact CB-OH 3.26Å
149	S	95	Very high	92.6	Very high	0 Å²	0	39 Å²	39	0%	0	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.7	-11.1	176.2	73.5	0	0	0	0	114.6	Y145 L146 I147 R151 P398 V402	Y145-S149 WeakPolarHBondContact O-CB 3.46Å; Y145-S149 PolarHBondContact O-N 3.34Å; L146-S149 PolarHBondContact O-N 2.99Å; L146-S149 PolarHBondContact O-OG 3.42Å; I147-S149 PolarHBondContact O-N 3.22Å; S149-R151 PolarHBondContact O-N 3.15Å; S149-P398 WeakPolarHBondContact O-CB 3.08Å; S149-V402 WeakPolarHBondContact OG-CG2 3.2Å
150	L	93	Very high	92.4	Very high	127 Å²	127	46 Å²	46	67%	0.665	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.9	-3.6	177	-59.9	178.2	0	0	0	113.5	I147 A148 V402	I147-L150 WeakPolarHBondContact O-CB 3.17Å; I147-L150 PolarHBondContact O-N 3.02Å; A148-L150 VanDerWaalsContact C-N 3.28Å; A148-L150 PolarHBondContact O-N 3.47Å; L150-V402 HydrophobicContact CD2-CG2 4.09Å
151	R	90.4	Very high	92.1	Very high	138 Å²	138	48.2 Å²	48.2	52%	0.521	25%	0.254	S	S	.	.	S	Bend	trans	-75.9	160	174	-64	-179	-177.1	-173.4	3.4	110.7	S149 Q153 P398	S149-R151 PolarHBondContact O-N 3.15Å; R151-Q153 WeakPolarHBondContact CB-O 3.37Å; R151-Q153 PolarHBondContact O-N 2.94Å; R151-P398 WeakPolarHBondContact O-CG 3.17Å
152	T	86.8	Confident	91.9	Very high	141 Å²	141	55 Å²	55	87%	0.865	30%	0.295	S	S	*	.	S	Bend	trans	-61.9	-31.3	178.1	48.5	0	0	0	0	113	P398	T152-P398 WeakPolarHBondContact O-CG 3.39Å
153	Q	88.6	Confident	91.7	Very high	119 Å²	119	56.7 Å²	56.7	56%	0.556	30%	0.302	S	S	*	.	S	Bend	trans	-125.7	142.4	168.1	-68.1	-176.8	-9	0	0	107.8	R151 N158	R151-Q153 WeakPolarHBondContact CB-O 3.37Å; R151-Q153 PolarHBondContact O-N 2.94Å; Q153-N158 PolarHBondContact OE1-ND2 3.45Å; Q153-N158 VanDerWaalsContact OE1-ND2 3.13Å
154	V	91.1	Very high	91.5	Very high	5 Å²	5	56.9 Å²	56.9	3%	0.03	30%	0.303	C	S	.	.			trans	-65.6	141.8	177.2	-63.1	0	0	0	0	109.9	W156 A157 A392 A397 P398 A401	V154-W156 HydrophobicContact CB-CD2 4.08Å; V154-W156 HydrophobicContact CB-CE3 4.41Å; V154-W156 HydrophobicContact CB-CH2 4.14Å; V154-W156 HydrophobicContact CB-CZ2 3.79Å; V154-W156 HydrophobicContact CB-CZ3 4.44Å; V154-W156 HydrophobicContact CG1-CH2 4.29Å; V154-W156 HydrophobicContact CG1-CZ2 3.94Å; V154-W156 HydrophobicContact CG2-CD2 4.28Å; V154-W156 HydrophobicContact CG2-CG 4.4Å; V154-W156 HydrophobicContact CG2-CZ2 4.3Å; V154-W156 PolarHBondContact O-N 3.47Å; V154-W156 VanDerWaalsContact O-N 3.14Å; V154-A157 HydrophobicContact CG2-CB 3.77Å; V154-A157 WeakPolarHBondContact O-CB 3.08Å; V154-A157 PolarHBondContact O-N 3.31Å; V154-A157 VanDerWaalsContact O-N 3.08Å; V154-A392 HydrophobicContact CG2-CB 3.91Å; V154-A397 HydrophobicContact CG1-CB 4.33Å; V154-A397 HydrophobicContact CG2-CB 4.41Å; V154-P398 HydrophobicContact CG1-CG 4.29Å; V154-A401 HydrophobicContact CG1-CB 3.97Å
155	A	91	Very high	91.2	Very high	6 Å²	6	59 Å²	59	5%	0.05	32%	0.317	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-25.5	-171.4	0	0	0	0	0	113.8	A148 N161 W163 Y211	A148-A155 HydrophobicContact CB-CB 4.3Å; A155-N161 PolarHBondContact O-ND2 2.82Å; A155-W163 HydrophobicContact CB-CZ2 4.42Å; A155-Y211 HydrophobicContact CB-CD2 4.12Å; A155-Y211 HydrophobicContact CB-CE2 3.53Å
156	W	92.7	Very high	90.6	Very high	0 Å²	0	67.5 Å²	67.5	0%	0	36%	0.363	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.6	13.9	179.2	57.2	88.4	0	0	0	114.3	Y145 A148 V154 P207 Y211 A388 A401 F405	Y145-W156 HydrophobicContact CD1-CD2 4.34Å; Y145-W156 AromaticContact CD1-CE3 3.73Å; Y145-W156 HydrophobicContact CD1-CE3 3.73Å; Y145-W156 AromaticContact CD1-CH2 3.65Å; Y145-W156 HydrophobicContact CD1-CH2 3.65Å; Y145-W156 HydrophobicContact CD1-CZ2 4.25Å; Y145-W156 AromaticContact CD1-CZ3 3.35Å; Y145-W156 HydrophobicContact CD1-CZ3 3.35Å; Y145-W156 HydrophobicContact CE1-CD2 4.17Å; Y145-W156 AromaticContact CE1-CE3 3.78Å; Y145-W156 HydrophobicContact CE1-CE3 3.78Å; Y145-W156 HydrophobicContact CE1-CH2 4.41Å; Y145-W156 AromaticContact CE1-CZ3 3.92Å; Y145-W156 HydrophobicContact CE1-CZ3 3.92Å; Y145-W156 HydrophobicContact CG-CZ3 4.32Å; A148-W156 HydrophobicContact CB-CZ3 4.04Å; V154-W156 HydrophobicContact CB-CD2 4.08Å; V154-W156 HydrophobicContact CB-CE3 4.41Å; V154-W156 HydrophobicContact CB-CH2 4.14Å; V154-W156 HydrophobicContact CB-CZ2 3.79Å; V154-W156 HydrophobicContact CB-CZ3 4.44Å; V154-W156 HydrophobicContact CG1-CH2 4.29Å; V154-W156 HydrophobicContact CG1-CZ2 3.94Å; V154-W156 HydrophobicContact CG2-CD2 4.28Å; V154-W156 HydrophobicContact CG2-CG 4.4Å; V154-W156 HydrophobicContact CG2-CZ2 4.3Å; V154-W156 PolarHBondContact O-N 3.47Å; V154-W156 VanDerWaalsContact O-N 3.14Å; W156-P207 WeakPolarHBondContact O-CB 3.42Å; W156-P207 WeakPolarHBondContact O-CG 3.37Å; W156-Y211 HydrophobicContact CB-CD1 4.02Å; W156-Y211 HydrophobicContact CB-CG 3.91Å; W156-Y211 HydrophobicContact CD2-CD1 4.43Å; W156-Y211 AromaticContact CE3-CD1 3.79Å; W156-Y211 HydrophobicContact CE3-CD1 3.79Å; W156-Y211 AromaticContact CE3-CE1 3.54Å; W156-Y211 HydrophobicContact CE3-CE1 3.54Å; W156-Y211 HydrophobicContact CZ3-CE1 4.05Å; W156-A388 HydrophobicContact CD2-CB 4.47Å; W156-A388 HydrophobicContact CG-CB 4.45Å; W156-A388 PolarHBondContact NE1-O 3.06Å; W156-A401 HydrophobicContact CH2-CB 4.22Å; W156-A401 HydrophobicContact CZ2-CB 3.91Å; W156-F405 HydrophobicContact CH2-CD2 4.36Å; W156-F405 AromaticContact CH2-CE2 3.56Å; W156-F405 HydrophobicContact CH2-CE2 3.56Å; W156-F405 HydrophobicContact CH2-CZ 4.26Å; W156-F405 AromaticContact CZ2-CE2 3.7Å; W156-F405 HydrophobicContact CZ2-CE2 3.7Å; W156-F405 HydrophobicContact CZ2-CZ 4.3Å
157	A	89.8	Confident	89.9	Confident	26 Å²	26	67.6 Å²	67.6	22%	0.215	37%	0.369	C	S	.	.	S	Bend	trans	-78.7	-34.2	178.1	0	0	0	0	0	113.4	V154 A392	V154-A157 HydrophobicContact CG2-CB 3.77Å; V154-A157 WeakPolarHBondContact O-CB 3.08Å; V154-A157 PolarHBondContact O-N 3.31Å; V154-A157 VanDerWaalsContact O-N 3.08Å; A157-A392 HydrophobicContact CB-CB 4.38Å
158	N	87.1	Confident	89.4	Confident	62 Å²	62	64.8 Å²	64.8	33%	0.332	36%	0.356	S	S	.	.			trans	-128.6	164.1	-169.9	-52.9	-22.4	0	0	0	110.8	Q153 N161	Q153-N158 PolarHBondContact OE1-ND2 3.45Å; Q153-N158 VanDerWaalsContact OE1-ND2 3.13Å; N158-N161 PolarHBondContact O-ND2 2.88Å
159	C	87.2	Confident	88.7	Confident	28 Å²	28	67.6 Å²	67.6	19%	0.189	37%	0.37	C	S	.	.	S	Bend	trans	-96.8	9.7	177.5	-65.9	0	0	0	0	114.2	N161 N164 C168 L169 A170	C159-N161 PolarHBondContact O-N 3.44Å; C159-N164 WeakPolarHBondContact CA-OD1 3.47Å; C159-N164 VanDerWaalsContact O-CB 3.24Å; C159-N164 WeakPolarHBondContact O-CB 3.13Å; C159-N164 PolarHBondContact O-OD1 3.48Å; C159-C168 HydrophobicContact CB-CB 3.63Å; C159-C168 WeakPolarHBondContact CB-SG 3.09Å; C159-C168 WeakPolarHBondContact SG-CB 3.22Å; C159-C168 CovalentContact SG-SG 2.03Å; C159-C168 PolarHBondContact SG-SG 3.12Å; C159-L169 PolarHBondContact SG-N 2.99Å; C159-A170 PolarHBondContact SG-N 3.06Å
160	D	87	Confident	87.7	Confident	150 Å²	150	69.2 Å²	69.2	80%	0.802	38%	0.383	S	S	*	.			trans	-85.9	23.5	-174.3	-61.8	-32.7	0	0	0	113.5
161	N	89.4	Confident	86.3	Confident	46 Å²	46	67.9 Å²	67.9	25%	0.246	37%	0.369	C	S	.	.	S	Bend	trans	-101.5	162	-176.9	-49.5	-81.6	0	0	0	112.2	A155 N158 C159 W163 N164	A155-N161 PolarHBondContact O-ND2 2.82Å; N158-N161 PolarHBondContact O-ND2 2.88Å; C159-N161 PolarHBondContact O-N 3.44Å; N161-W163 HydrophobicContact CB-CD2 3.55Å; N161-W163 HydrophobicContact CB-CE3 3.83Å; N161-W163 HydrophobicContact CB-CG 4.25Å; N161-W163 HydrophobicContact CB-CH2 3.58Å; N161-W163 HydrophobicContact CB-CZ2 3.27Å; N161-W163 HydrophobicContact CB-CZ3 3.85Å; N161-W163 WeakPolarHBondContact ND2-CZ2 3.49Å; N161-W163 PolarHBondContact O-N 3.07Å; N161-W163 WeakPolarHBondContact OD1-CH2 3.38Å; N161-W163 WeakPolarHBondContact OD1-CZ2 3.14Å; N161-N164 WeakPolarHBondContact CB-OD1 3.17Å; N161-N164 PolarHBondContact N-OD1 3.08Å; N161-N164 VanDerWaalsContact N-OD1 3.11Å; N161-N164 PolarHBondContact ND2-OD1 2.95Å; N161-N164 PolarHBondContact O-N 2.86Å; N161-N164 VanDerWaalsContact O-N 3.15Å
162	T	92	Very high	84.9	Confident	142 Å²	142	64.3 Å²	64.3	87%	0.871	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.5	-20.5	-177.3	51.1	0	0	0	0	114.4
163	W	91.2	Very high	83.3	Confident	35 Å²	35	61.8 Å²	61.8	13%	0.133	35%	0.346	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.6	-11.6	178.2	55.6	81.6	0	0	0	113	A155 N161 Y211 L214 E215	A155-W163 HydrophobicContact CB-CZ2 4.42Å; N161-W163 HydrophobicContact CB-CD2 3.55Å; N161-W163 HydrophobicContact CB-CE3 3.83Å; N161-W163 HydrophobicContact CB-CG 4.25Å; N161-W163 HydrophobicContact CB-CH2 3.58Å; N161-W163 HydrophobicContact CB-CZ2 3.27Å; N161-W163 HydrophobicContact CB-CZ3 3.85Å; N161-W163 WeakPolarHBondContact ND2-CZ2 3.49Å; N161-W163 PolarHBondContact O-N 3.07Å; N161-W163 WeakPolarHBondContact OD1-CH2 3.38Å; N161-W163 WeakPolarHBondContact OD1-CZ2 3.14Å; W163-Y211 AromaticContact CE2-CD2 3.81Å; W163-Y211 HydrophobicContact CH2-CD2 4.46Å; W163-Y211 HydrophobicContact CH2-CE2 4.32Å; W163-Y211 AromaticContact CZ2-CD2 3.61Å; W163-Y211 HydrophobicContact CZ2-CD2 3.61Å; W163-Y211 AromaticContact CZ2-CE2 3.89Å; W163-Y211 HydrophobicContact CZ2-CE2 3.89Å; W163-Y211 AromaticContact NE1-CD2 3.91Å; W163-L214 HydrophobicContact CB-CB 4.24Å; W163-L214 WeakPolarHBondContact O-CD1 3.2Å; W163-E215 HydrophobicContact CB-CB 4.24Å; W163-E215 HydrophobicContact CD2-CB 3.75Å; W163-E215 HydrophobicContact CD2-CG 3.96Å; W163-E215 HydrophobicContact CE3-CB 4.12Å; W163-E215 HydrophobicContact CE3-CG 3.83Å; W163-E215 HydrophobicContact CG-CB 3.81Å; W163-E215 HydrophobicContact CH2-CG 4.43Å; W163-E215 HydrophobicContact CZ3-CG 4.08Å
164	N	91.6	Very high	81.5	Confident	27 Å²	27	61.8 Å²	61.8	14%	0.144	35%	0.354	C	S	.	.			trans	-75.5	143.8	-173.9	-70.8	122.5	0	0	0	112.1	C159 N161 C168 E210	C159-N164 WeakPolarHBondContact CA-OD1 3.47Å; C159-N164 VanDerWaalsContact O-CB 3.24Å; C159-N164 WeakPolarHBondContact O-CB 3.13Å; C159-N164 PolarHBondContact O-OD1 3.48Å; N161-N164 WeakPolarHBondContact CB-OD1 3.17Å; N161-N164 PolarHBondContact N-OD1 3.08Å; N161-N164 VanDerWaalsContact N-OD1 3.11Å; N161-N164 PolarHBondContact ND2-OD1 2.95Å; N161-N164 PolarHBondContact O-N 2.86Å; N161-N164 VanDerWaalsContact O-N 3.15Å; N164-C168 HydrophobicContact CB-CB 4.23Å; N164-C168 PolarHBondContact ND2-SG 2.77Å; N164-C168 VanDerWaalsContact ND2-SG 3.38Å; N164-E210 WeakPolarHBondContact CA-OE2 3.39Å; N164-E210 WeakPolarHBondContact CB-OE2 3.49Å; N164-E210 PolarHBondContact ND2-OE2 3.07Å
165	T	88.7	Confident	79.7	Confident	66 Å²	66	67 Å²	67	41%	0.405	38%	0.376	S	S	.	.			trans	-95.4	167.1	174.6	79.1	0	0	0	0	111.4	A167 C168 E210 L214	T165-A167 PolarHBondContact O-N 2.94Å; T165-A167 PolarHBondContact OG1-N 2.73Å; T165-C168 VanDerWaalsContact O-CB 3.27Å; T165-C168 WeakPolarHBondContact O-CB 3.4Å; T165-C168 PolarHBondContact O-N 3.32Å; T165-E210 WeakPolarHBondContact CB-OE1 3.42Å; T165-E210 PolarHBondContact N-OE1 2.89Å; T165-E210 PolarHBondContact N-OE2 3.41Å; T165-E210 PolarHBondContact OG1-OE1 3.04Å; T165-L214 HydrophobicContact CG2-CD1 3.75Å
166	D	83.6	Confident	77.7	Confident	180 Å²	180	71.4 Å²	71.4	96%	0.963	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	-14.2	175.3	-64.4	-31.5	0	0	0	113.2
167	A	82.3	Confident	75.6	Confident	38 Å²	38	73.6 Å²	73.6	31%	0.314	42%	0.418	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.3	-10.1	176	0	0	0	0	0	113.4	T165 L169 F204 V205	T165-A167 PolarHBondContact O-N 2.94Å; T165-A167 PolarHBondContact OG1-N 2.73Å; A167-L169 PolarHBondContact O-N 3.32Å; A167-F204 WeakPolarHBondContact O-CA 3.44Å; A167-V205 PolarHBondContact O-N 2.95Å; A167-V205 VanDerWaalsContact O-N 3.09Å
168	C	85	Confident	73.8	Confident	18 Å²	18	73.8 Å²	73.8	12%	0.122	42%	0.418	C	S	.	.	B	Isolated β-bridge	trans	-67	125	179.6	-167.9	0	0	0	0	111	C159 N164 T165 V205 E210	C159-C168 HydrophobicContact CB-CB 3.63Å; C159-C168 WeakPolarHBondContact CB-SG 3.09Å; C159-C168 WeakPolarHBondContact SG-CB 3.22Å; C159-C168 CovalentContact SG-SG 2.03Å; C159-C168 PolarHBondContact SG-SG 3.12Å; N164-C168 HydrophobicContact CB-CB 4.23Å; N164-C168 PolarHBondContact ND2-SG 2.77Å; N164-C168 VanDerWaalsContact ND2-SG 3.38Å; T165-C168 VanDerWaalsContact O-CB 3.27Å; T165-C168 WeakPolarHBondContact O-CB 3.4Å; T165-C168 PolarHBondContact O-N 3.32Å; C168-V205 WeakPolarHBondContact CA-O 3.32Å; C168-E210 VanDerWaalsContact CB-OE2 3.25Å; C168-E210 WeakPolarHBondContact CB-OE2 3.39Å
169	L	78.9	Confident	72.2	Confident	65 Å²	65	71.5 Å²	71.5	34%	0.34	41%	0.405	S	S	.	.			trans	-124	106.7	173.8	-169	75.3	0	0	0	110.6	C159 A167 F204 V205	C159-L169 PolarHBondContact SG-N 2.99Å; A167-L169 PolarHBondContact O-N 3.32Å; L169-F204 HydrophobicContact CB-CB 3.98Å; L169-F204 HydrophobicContact CB-CD1 3.7Å; L169-F204 HydrophobicContact CB-CE1 4.25Å; L169-F204 HydrophobicContact CB-CG 3.9Å; L169-F204 HydrophobicContact CD1-CD1 4.49Å; L169-F204 HydrophobicContact CD1-CE1 4.19Å; L169-F204 HydrophobicContact CD2-CB 4.41Å; L169-F204 HydrophobicContact CD2-CD1 3.96Å; L169-F204 HydrophobicContact CD2-CD2 3.66Å; L169-F204 HydrophobicContact CD2-CE1 3.98Å; L169-F204 HydrophobicContact CD2-CE2 3.67Å; L169-F204 HydrophobicContact CD2-CG 3.8Å; L169-F204 HydrophobicContact CD2-CZ 3.83Å; L169-F204 HydrophobicContact CG-CD1 4.26Å; L169-F204 HydrophobicContact CG-CE1 4.37Å; L169-F204 HydrophobicContact CG-CG 4.44Å; L169-V205 PolarHBondContact N-O 2.97Å
170	A	73.3	Confident	70.5	Confident	34 Å²	34	72.6 Å²	72.6	28%	0.281	41%	0.414	S	S	.	.			trans	-74.4	133.5	167.1	0	0	0	0	0	108.8	C159 D172	C159-A170 PolarHBondContact SG-N 3.06Å; A170-D172 PolarHBondContact O-N 3.32Å
171	W	63.9	Low	68.5	Low	99 Å²	99	69.7 Å²	69.7	38%	0.375	40%	0.398	S	S	.	.			trans	-70.5	120.3	177.2	-178.5	84.2	0	0	0	110.2	P173 E367	W171-P173 HydrophobicContact CE3-CB 4.44Å; W171-P173 HydrophobicContact CE3-CG 4.45Å; W171-P173 HydrophobicContact CH2-CB 3.58Å; W171-P173 HydrophobicContact CH2-CG 4.33Å; W171-P173 HydrophobicContact CZ2-CB 4.27Å; W171-P173 HydrophobicContact CZ3-CB 3.67Å; W171-P173 HydrophobicContact CZ3-CG 3.9Å; W171-E367 WeakPolarHBondContact CH2-OE2 3.45Å; W171-E367 PolarHBondContact NE1-O 3.48Å
172	D	61.3	Low	66.5	Low	63 Å²	63	71.3 Å²	71.3	34%	0.337	43%	0.425	S	S	.	.			trans	-105.9	112.3	175.2	-176.6	-3.4	0	0	0	109.9	A170 V174 K175	A170-D172 PolarHBondContact O-N 3.32Å; D172-V174 PolarHBondContact O-N 3.33Å; D172-V174 VanDerWaalsContact O-N 3.08Å; D172-V174 VanDerWaalsContact OD1-CB 3.3Å; D172-V174 WeakPolarHBondContact OD1-CB 3.2Å; D172-V174 PolarHBondContact OD1-N 3.19Å; D172-K175 HydrophobicContact CB-CB 4.38Å; D172-K175 CarbonylContact O-C 3.51Å; D172-K175 PolarHBondContact O-N 3.39Å
173	P	53.1	Low	64.5	Low	88 Å²	88	69.5 Å²	69.5	57%	0.571	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.6	-20.4	177	20.2	-28.5	0	0	0	113.2	W171	W171-P173 HydrophobicContact CE3-CB 4.44Å; W171-P173 HydrophobicContact CE3-CG 4.45Å; W171-P173 HydrophobicContact CH2-CB 3.58Å; W171-P173 HydrophobicContact CH2-CG 4.33Å; W171-P173 HydrophobicContact CZ2-CB 4.27Å; W171-P173 HydrophobicContact CZ3-CB 3.67Å; W171-P173 HydrophobicContact CZ3-CG 3.9Å
174	V	51.4	Low	62.5	Low	119 Å²	119	71.2 Å²	71.2	72%	0.721	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.4	-20.8	179.9	-171.6	0	0	0	0	111.7	D172	D172-V174 PolarHBondContact O-N 3.33Å; D172-V174 VanDerWaalsContact O-N 3.08Å; D172-V174 VanDerWaalsContact OD1-CB 3.3Å; D172-V174 WeakPolarHBondContact OD1-CB 3.2Å; D172-V174 PolarHBondContact OD1-N 3.19Å
175	K	52.5	Low	60.5	Low	114 Å²	114	72.7 Å²	72.7	50%	0.496	46%	0.456	S	S	.	.			trans	-134.7	66	-178.4	-64.8	178.7	-174.9	169.4	0	111.8	D172 T177	D172-K175 HydrophobicContact CB-CB 4.38Å; D172-K175 CarbonylContact O-C 3.51Å; D172-K175 PolarHBondContact O-N 3.39Å; K175-T177 PolarHBondContact O-N 3.24Å
176	P	49.7	Very low	58.9	Low	99 Å²	99	73.1 Å²	73.1	64%	0.643	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.8	-6.5	-179.8	25.6	-33	0	0	0	114
177	T	48.2	Very low	57.6	Low	47 Å²	47	67.1 Å²	67.1	29%	0.288	43%	0.428	S	S	.	.	T	Hydrogen-bonded Turn	trans	-121.4	12.2	-166.3	55.3	0	0	0	0	114.6	K175 L179 S188 T189	K175-T177 PolarHBondContact O-N 3.24Å; T177-L179 PolarHBondContact O-N 2.73Å; T177-S188 CarbonylContact O-C 3.34Å; T177-S188 VanDerWaalsContact O-CA 3.27Å; T177-S188 WeakPolarHBondContact O-CA 3.4Å; T177-S188 PolarHBondContact OG1-OG 3.12Å; T177-T189 WeakPolarHBondContact CA-OG1 3.27Å; T177-T189 WeakPolarHBondContact CB-OG1 3.2Å; T177-T189 WeakPolarHBondContact CG2-OG1 3.34Å; T177-T189 WeakPolarHBondContact O-CG2 3.42Å; T177-T189 PolarHBondContact O-N 3.41Å
178	C	51.3	Low	56.2	Low	29 Å²	29	67.4 Å²	67.4	20%	0.196	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	112.5	-176.8	-91.1	0	0	0	0	113.7	C186	C178-C186 HydrophobicContact CB-CB 4.1Å; C178-C186 WeakPolarHBondContact CB-SG 3.41Å; C178-C186 WeakPolarHBondContact SG-CB 3.3Å; C178-C186 CovalentContact SG-SG 2.01Å; C178-C186 PolarHBondContact SG-SG 2.84Å
179	L	53.8	Low	54.8	Low	14 Å²	14	68.7 Å²	68.7	7%	0.073	44%	0.435	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	117.2	162.5	-48.2	166.1	0	0	0	107.6	T177 I187 T189 L197 F200 L202	T177-L179 PolarHBondContact O-N 2.73Å; L179-I187 PolarHBondContact N-O 2.93Å; L179-I187 PolarHBondContact O-N 2.87Å; L179-T189 HydrophobicContact CD1-CG2 3.91Å; L179-T189 HydrophobicContact CD2-CG2 3.95Å; L179-T189 HydrophobicContact CG-CG2 3.79Å; L179-L197 HydrophobicContact CD1-CD1 3.66Å; L179-L197 HydrophobicContact CD2-CD1 4.24Å; L179-F200 HydrophobicContact CB-CD1 4.49Å; L179-F200 HydrophobicContact CB-CE1 4.29Å; L179-F200 HydrophobicContact CB-CZ 4.46Å; L179-F200 HydrophobicContact CD1-CD2 4.18Å; L179-F200 HydrophobicContact CD1-CE2 4.48Å; L179-F200 HydrophobicContact CD1-CG 4.34Å; L179-L202 HydrophobicContact CB-CD1 4.15Å; L179-L202 HydrophobicContact CD2-CD1 3.11Å; L179-L202 HydrophobicContact CG-CD1 4.1Å
180	S	51.8	Low	53.6	Low	52 Å²	52	69.8 Å²	69.8	36%	0.364	45%	0.448	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	119.1	173.6	-176.5	0	0	0	0	109.3	G182	S180-G182 PolarHBondContact O-N 2.57Å; S180-G182 VanDerWaalsContact O-N 3.1Å
181	N	45.5	Very low	52.6	Low	88 Å²	88	74.9 Å²	74.9	47%	0.471	47%	0.471	S	S	.	.			trans	-85.9	41.5	-177.8	-163.7	19.6	0	0	0	113	T183 S185 I187 F200	N181-T183 PolarHBondContact O-N 3.03Å; N181-T183 PolarHBondContact O-OG1 3.43Å; N181-T183 VanDerWaalsContact O-OG1 3.09Å; N181-S185 PolarHBondContact N-O 3.38Å; N181-I187 HydrophobicContact CB-CD1 3.81Å; N181-F200 HydrophobicContact CB-CZ 4.24Å
182	G	47.9	Very low	52.2	Low	80 Å²	80	71.7 Å²	71.7	83%	0.825	46%	0.462	S	S	*	.	S	Bend	trans	59.2	6.7	-177.4	0	0	0	0	0	115.6	S180	S180-G182 PolarHBondContact O-N 2.57Å; S180-G182 VanDerWaalsContact O-N 3.1Å
183	T	48.7	Very low	51.9	Low	104 Å²	104	72 Å²	72	64%	0.638	47%	0.469	S	S	*	.	S	Bend	trans	-120.9	8.9	-174.4	45.2	0	0	0	0	112.2	N181 S185	N181-T183 PolarHBondContact O-N 3.03Å; N181-T183 PolarHBondContact O-OG1 3.43Å; N181-T183 VanDerWaalsContact O-OG1 3.09Å; T183-S185 PolarHBondContact O-N 2.9Å; T183-S185 PolarHBondContact OG1-OG 3.45Å; T183-S185 VanDerWaalsContact OG1-OG 3.1Å
184	G	50.9	Low	52	Low	72 Å²	72	76.2 Å²	76.2	74%	0.742	48%	0.481	S	S	*	.	S	Bend	trans	69.5	8.8	-174.6	0	0	0	0	0	114.3
185	S	49.1	Very low	52	Low	58 Å²	58	78.2 Å²	78.2	41%	0.406	48%	0.482	S	S	.	.			trans	-95.7	124.6	175.7	64.9	0	0	0	0	111.2	N181 T183 I187	N181-S185 PolarHBondContact N-O 3.38Å; T183-S185 PolarHBondContact O-N 2.9Å; T183-S185 PolarHBondContact OG1-OG 3.45Å; T183-S185 VanDerWaalsContact OG1-OG 3.1Å; S185-I187 PolarHBondContact O-N 3.33Å
186	C	54	Low	51.8	Low	74 Å²	74	79.4 Å²	79.4	50%	0.5	49%	0.488	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	108.3	179.4	-121.1	0	0	0	0	109.5	C178	C178-C186 HydrophobicContact CB-CB 4.1Å; C178-C186 WeakPolarHBondContact CB-SG 3.41Å; C178-C186 WeakPolarHBondContact SG-CB 3.3Å; C178-C186 CovalentContact SG-SG 2.01Å; C178-C186 PolarHBondContact SG-SG 2.84Å
187	I	56.3	Low	51.8	Low	54 Å²	54	78.4 Å²	78.4	28%	0.277	48%	0.476	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	116.3	172.7	-57.2	176.8	0	0	0	108.3	L179 N181 S185 T189 V192	L179-I187 PolarHBondContact N-O 2.93Å; L179-I187 PolarHBondContact O-N 2.87Å; N181-I187 HydrophobicContact CB-CD1 3.81Å; S185-I187 PolarHBondContact O-N 3.33Å; I187-T189 PolarHBondContact O-N 3.08Å; I187-V192 HydrophobicContact CG2-CG2 3.66Å
188	S	53.7	Low	51.6	Low	44 Å²	44	79.9 Å²	79.9	31%	0.308	49%	0.494	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.5	122.7	172.5	-175.2	0	0	0	0	110.5	T177 S190 N191	T177-S188 CarbonylContact O-C 3.34Å; T177-S188 VanDerWaalsContact O-CA 3.27Å; T177-S188 WeakPolarHBondContact O-CA 3.4Å; T177-S188 PolarHBondContact OG1-OG 3.12Å; S188-S190 PolarHBondContact O-N 2.85Å; S188-S190 PolarHBondContact OG-OG 3.09Å; S188-N191 PolarHBondContact O-N 3.33Å; S188-N191 VanDerWaalsContact O-N 3.09Å
189	T	55.5	Low	51	Low	45 Å²	45	85 Å²	85	28%	0.276	52%	0.519	S	S	.	.	G	3₁₀ helix	trans	-56.1	-17.2	175.6	53.3	0	0	0	0	113.3	T177 L179 I187 N191 V192 L197	T177-T189 WeakPolarHBondContact CA-OG1 3.27Å; T177-T189 WeakPolarHBondContact CB-OG1 3.2Å; T177-T189 WeakPolarHBondContact CG2-OG1 3.34Å; T177-T189 WeakPolarHBondContact O-CG2 3.42Å; T177-T189 PolarHBondContact O-N 3.41Å; L179-T189 HydrophobicContact CD1-CG2 3.91Å; L179-T189 HydrophobicContact CD2-CG2 3.95Å; L179-T189 HydrophobicContact CG-CG2 3.79Å; I187-T189 PolarHBondContact O-N 3.08Å; T189-N191 PolarHBondContact O-N 3.37Å; T189-V192 PolarHBondContact O-N 3.49Å; T189-L197 HydrophobicContact CG2-CD1 3.98Å
190	S	53.9	Low	50.5	Low	88 Å²	88	87.1 Å²	87.1	62%	0.615	53%	0.528	S	S	*	.	G	3₁₀ helix	trans	-61.8	-20.9	174	64.4	0	0	0	0	114.4	S188	S188-S190 PolarHBondContact O-N 2.85Å; S188-S190 PolarHBondContact OG-OG 3.09Å
191	N	52.1	Low	49.9	Very low	142 Å²	142	89.3 Å²	89.3	76%	0.759	54%	0.543	S	S	*	.	G	3₁₀ helix	trans	-111	8.5	-174.2	-67.6	3.3	0	0	0	113.4	S188 T189	S188-N191 PolarHBondContact O-N 3.33Å; S188-N191 VanDerWaalsContact O-N 3.09Å; T189-N191 PolarHBondContact O-N 3.37Å
192	V	55.9	Low	50	Low	31 Å²	31	87.6 Å²	87.6	19%	0.188	53%	0.534	C	S	.	.	S	Bend	trans	-111.5	123.4	-174.6	-173.9	0	0	0	0	108.9	I187 T189 K196	I187-V192 HydrophobicContact CG2-CG2 3.66Å; T189-V192 PolarHBondContact O-N 3.49Å; V192-K196 HydrophobicContact CG1-CB 3.38Å
193	S	54.4	Low	50.4	Low	69 Å²	69	90.4 Å²	90.4	48%	0.483	53%	0.53	S	S	.	.			trans	-60.4	145.3	173.3	50.5	0	0	0	0	110.5	E195 K196 L197	S193-E195 PolarHBondContact O-N 3.43Å; S193-K196 PolarHBondContact O-N 3.13Å; S193-L197 PolarHBondContact O-N 3.15Å; S193-L197 VanDerWaalsContact O-N 3.14Å
194	E	55.3	Low	51.3	Low	177 Å²	177	88.7 Å²	88.7	83%	0.827	51%	0.513	S	S	*	.	H	α-helix	trans	-49.4	-34.8	-179.6	-74.7	178.9	156.5	0	0	112.8	K196 L197 A198	E194-K196 PolarHBondContact O-N 2.89Å; E194-L197 PolarHBondContact O-N 3.37Å; E194-A198 PolarHBondContact O-N 3.06Å; E194-A198 VanDerWaalsContact O-N 3.08Å
195	E	51.6	Low	52.8	Low	162 Å²	162	87.4 Å²	87.4	76%	0.757	49%	0.491	S	S	*	.	H	α-helix	trans	-64.2	-34.6	175.6	-119.6	179.1	177.2	0	0	114.2	S193	S193-E195 PolarHBondContact O-N 3.43Å
196	K	48.4	Very low	54.6	Low	139 Å²	139	87 Å²	87	60%	0.604	48%	0.481	S	S	*	.	H	α-helix	trans	-82.2	-25.8	175.8	-87.9	-176.3	175.7	179.8	0	112.4	V192 S193 E194 A198 N199 F200	V192-K196 HydrophobicContact CG1-CB 3.38Å; S193-K196 PolarHBondContact O-N 3.13Å; E194-K196 PolarHBondContact O-N 2.89Å; K196-A198 VanDerWaalsContact C-N 3.34Å; K196-N199 PolarHBondContact O-N 3.35Å; K196-F200 PolarHBondContact O-N 3.01Å
197	L	49.1	Very low	56.4	Low	77 Å²	77	83.5 Å²	83.5	40%	0.403	46%	0.457	S	S	.	.	H	α-helix	trans	-69.3	-35.3	172.8	-163.4	70.5	0	0	0	111	L179 T189 S193 E194 N199 F200	L179-L197 HydrophobicContact CD1-CD1 3.66Å; L179-L197 HydrophobicContact CD2-CD1 4.24Å; T189-L197 HydrophobicContact CG2-CD1 3.98Å; S193-L197 PolarHBondContact O-N 3.15Å; S193-L197 VanDerWaalsContact O-N 3.14Å; E194-L197 PolarHBondContact O-N 3.37Å; L197-N199 VanDerWaalsContact C-N 3.33Å; L197-N199 PolarHBondContact O-N 3.23Å; L197-F200 PolarHBondContact O-N 2.52Å
198	A	44.2	Very low	58.1	Low	79 Å²	79	80.9 Å²	80.9	65%	0.653	44%	0.444	S	S	*	.	H	α-helix	trans	-68.2	-27.6	173.7	0	0	0	0	0	113.8	E194 K196	E194-A198 PolarHBondContact O-N 3.06Å; E194-A198 VanDerWaalsContact O-N 3.08Å; K196-A198 VanDerWaalsContact C-N 3.34Å
199	N	38.5	Very low	59.9	Low	137 Å²	137	79.8 Å²	79.8	73%	0.733	43%	0.434	S	S	*	.	H	α-helix	trans	-81.2	-14.9	173.6	-78.8	-18.7	0	0	0	113.4	K196 L197 S201	K196-N199 PolarHBondContact O-N 3.35Å; L197-N199 VanDerWaalsContact C-N 3.33Å; L197-N199 PolarHBondContact O-N 3.23Å; N199-S201 PolarHBondContact O-N 3.25Å
200	F	43.7	Very low	61.7	Low	57 Å²	57	77.8 Å²	77.8	25%	0.25	42%	0.421	C	S	.	.			trans	-83.8	75.5	163	-94.3	-82.9	0	0	0	107.6	L179 N181 K196 L197 L202	L179-F200 HydrophobicContact CB-CD1 4.49Å; L179-F200 HydrophobicContact CB-CE1 4.29Å; L179-F200 HydrophobicContact CB-CZ 4.46Å; L179-F200 HydrophobicContact CD1-CD2 4.18Å; L179-F200 HydrophobicContact CD1-CE2 4.48Å; L179-F200 HydrophobicContact CD1-CG 4.34Å; N181-F200 HydrophobicContact CB-CZ 4.24Å; K196-F200 PolarHBondContact O-N 3.01Å; L197-F200 PolarHBondContact O-N 2.52Å; F200-L202 HydrophobicContact CB-CD1 3.65Å; F200-L202 HydrophobicContact CB-CG 4.01Å; F200-L202 HydrophobicContact CD1-CD1 3.52Å; F200-L202 HydrophobicContact CD1-CD2 3.79Å; F200-L202 HydrophobicContact CD1-CG 3.64Å; F200-L202 HydrophobicContact CE1-CD1 4.44Å; F200-L202 HydrophobicContact CE1-CD2 4.33Å; F200-L202 HydrophobicContact CG-CD1 3.9Å; F200-L202 HydrophobicContact CG-CG 4.29Å; F200-L202 PolarHBondContact O-N 3.46Å
201	S	39.3	Very low	63.6	Low	98 Å²	98	73.9 Å²	73.9	69%	0.685	39%	0.393	S	S	*	.			trans	-67.7	80.3	157.2	46.9	0	0	0	0	106.8	N199 D203	N199-S201 PolarHBondContact O-N 3.25Å; S201-D203 VanDerWaalsContact C-N 3.32Å; S201-D203 PolarHBondContact O-N 2.7Å; S201-D203 VanDerWaalsContact O-N 3.09Å
202	L	48.2	Very low	65.7	Low	53 Å²	53	67.2 Å²	67.2	28%	0.277	36%	0.357	S	S	.	.			trans	-79.8	91.9	176	-79.2	150.7	0	0	0	107	L179 F200 F204	L179-L202 HydrophobicContact CB-CD1 4.15Å; L179-L202 HydrophobicContact CD2-CD1 3.11Å; L179-L202 HydrophobicContact CG-CD1 4.1Å; F200-L202 HydrophobicContact CB-CD1 3.65Å; F200-L202 HydrophobicContact CB-CG 4.01Å; F200-L202 HydrophobicContact CD1-CD1 3.52Å; F200-L202 HydrophobicContact CD1-CD2 3.79Å; F200-L202 HydrophobicContact CD1-CG 3.64Å; F200-L202 HydrophobicContact CE1-CD1 4.44Å; F200-L202 HydrophobicContact CE1-CD2 4.33Å; F200-L202 HydrophobicContact CG-CD1 3.9Å; F200-L202 HydrophobicContact CG-CG 4.29Å; F200-L202 PolarHBondContact O-N 3.46Å; L202-F204 HydrophobicContact CB-CD1 4.33Å; L202-F204 HydrophobicContact CB-CD2 3.36Å; L202-F204 HydrophobicContact CB-CE1 4.29Å; L202-F204 HydrophobicContact CB-CE2 3.31Å; L202-F204 HydrophobicContact CB-CG 3.9Å; L202-F204 HydrophobicContact CB-CZ 3.81Å; L202-F204 HydrophobicContact CD1-CD2 4.26Å; L202-F204 HydrophobicContact CD1-CE1 4.48Å; L202-F204 HydrophobicContact CD1-CE2 3.31Å; L202-F204 HydrophobicContact CD1-CZ 3.45Å; L202-F204 VanDerWaalsContact CD1-CZ 3.45Å; L202-F204 HydrophobicContact CD2-CD1 3.91Å; L202-F204 HydrophobicContact CD2-CD2 4.2Å; L202-F204 HydrophobicContact CD2-CE1 3.24Å; L202-F204 HydrophobicContact CD2-CE2 3.58Å; L202-F204 HydrophobicContact CD2-CG 4.34Å; L202-F204 HydrophobicContact CD2-CZ 3.05Å; L202-F204 HydrophobicContact CG-CD2 4.08Å; L202-F204 HydrophobicContact CG-CE1 4.14Å; L202-F204 HydrophobicContact CG-CE2 3.5Å; L202-F204 HydrophobicContact CG-CZ 3.54Å; L202-F204 PolarHBondContact O-N 3.21Å
203	D	55.6	Low	67.5	Low	139 Å²	139	66.8 Å²	66.8	74%	0.743	36%	0.356	S	S	*	.			trans	-67.7	59.3	159.6	-68	-24.5	0	0	0	108.3	S201	S201-D203 VanDerWaalsContact C-N 3.32Å; S201-D203 PolarHBondContact O-N 2.7Å; S201-D203 VanDerWaalsContact O-N 3.09Å
204	F	68.5	Low	69.3	Low	67 Å²	67	66.7 Å²	66.7	29%	0.294	35%	0.35	S	S	.	.			trans	-68.7	135.6	170.1	-66.9	-57.2	0	0	0	108.3	A167 L169 L202	A167-F204 WeakPolarHBondContact O-CA 3.44Å; L169-F204 HydrophobicContact CB-CB 3.98Å; L169-F204 HydrophobicContact CB-CD1 3.7Å; L169-F204 HydrophobicContact CB-CE1 4.25Å; L169-F204 HydrophobicContact CB-CG 3.9Å; L169-F204 HydrophobicContact CD1-CD1 4.49Å; L169-F204 HydrophobicContact CD1-CE1 4.19Å; L169-F204 HydrophobicContact CD2-CB 4.41Å; L169-F204 HydrophobicContact CD2-CD1 3.96Å; L169-F204 HydrophobicContact CD2-CD2 3.66Å; L169-F204 HydrophobicContact CD2-CE1 3.98Å; L169-F204 HydrophobicContact CD2-CE2 3.67Å; L169-F204 HydrophobicContact CD2-CG 3.8Å; L169-F204 HydrophobicContact CD2-CZ 3.83Å; L169-F204 HydrophobicContact CG-CD1 4.26Å; L169-F204 HydrophobicContact CG-CE1 4.37Å; L169-F204 HydrophobicContact CG-CG 4.44Å; L202-F204 HydrophobicContact CB-CD1 4.33Å; L202-F204 HydrophobicContact CB-CD2 3.36Å; L202-F204 HydrophobicContact CB-CE1 4.29Å; L202-F204 HydrophobicContact CB-CE2 3.31Å; L202-F204 HydrophobicContact CB-CG 3.9Å; L202-F204 HydrophobicContact CB-CZ 3.81Å; L202-F204 HydrophobicContact CD1-CD2 4.26Å; L202-F204 HydrophobicContact CD1-CE1 4.48Å; L202-F204 HydrophobicContact CD1-CE2 3.31Å; L202-F204 HydrophobicContact CD1-CZ 3.45Å; L202-F204 VanDerWaalsContact CD1-CZ 3.45Å; L202-F204 HydrophobicContact CD2-CD1 3.91Å; L202-F204 HydrophobicContact CD2-CD2 4.2Å; L202-F204 HydrophobicContact CD2-CE1 3.24Å; L202-F204 HydrophobicContact CD2-CE2 3.58Å; L202-F204 HydrophobicContact CD2-CG 4.34Å; L202-F204 HydrophobicContact CD2-CZ 3.05Å; L202-F204 HydrophobicContact CG-CD2 4.08Å; L202-F204 HydrophobicContact CG-CE1 4.14Å; L202-F204 HydrophobicContact CG-CE2 3.5Å; L202-F204 HydrophobicContact CG-CZ 3.54Å; L202-F204 PolarHBondContact O-N 3.21Å
205	V	82.4	Confident	71.1	Confident	45 Å²	45	61.3 Å²	61.3	27%	0.273	32%	0.324	S	S	.	.	B	Isolated β-bridge	trans	-109.8	138.7	177.2	-173.9	0	0	0	0	108.2	A167 C168 L169 E209 E210	A167-V205 PolarHBondContact O-N 2.95Å; A167-V205 VanDerWaalsContact O-N 3.09Å; C168-V205 WeakPolarHBondContact CA-O 3.32Å; L169-V205 PolarHBondContact N-O 2.97Å; V205-E209 HydrophobicContact CG1-CB 3.67Å; V205-E209 HydrophobicContact CG1-CG 3.7Å; V205-E210 HydrophobicContact CB-CG 4.18Å; V205-E210 HydrophobicContact CG1-CG 3.66Å
206	W	86.7	Confident	73.2	Confident	49 Å²	49	53.8 Å²	53.8	19%	0.186	29%	0.289	C	S	.	.			trans	-72.6	148.6	177.5	-68.4	-24.3	0	0	0	111.7	S208 E209 E210 L364 T368 V370 L375 I386 E389	W206-S208 PolarHBondContact O-N 2.95Å; W206-E209 HydrophobicContact CB-CB 4.44Å; W206-E209 WeakPolarHBondContact O-CB 3.36Å; W206-E209 PolarHBondContact O-N 2.89Å; W206-E210 PolarHBondContact O-N 3.26Å; W206-E210 VanDerWaalsContact O-N 3.12Å; W206-L364 HydrophobicContact CH2-CD2 3.95Å; W206-L364 HydrophobicContact CH2-CG 4.48Å; W206-L364 HydrophobicContact CZ3-CD2 4.04Å; W206-T368 HydrophobicContact CH2-CG2 4.5Å; W206-T368 HydrophobicContact CZ2-CG2 3.78Å; W206-V370 HydrophobicContact CZ2-CB 4.46Å; W206-V370 HydrophobicContact CZ2-CG2 3.85Å; W206-L375 HydrophobicContact CH2-CD2 3.49Å; W206-L375 VanDerWaalsContact CH2-CD2 3.49Å; W206-L375 HydrophobicContact CZ2-CD2 4.47Å; W206-L375 HydrophobicContact CZ3-CD2 4.23Å; W206-I386 HydrophobicContact CE3-CD1 4.48Å; W206-I386 HydrophobicContact CZ3-CD1 3.68Å; W206-E389 HydrophobicContact CD2-CG 4.25Å; W206-E389 HydrophobicContact CE3-CB 4.47Å; W206-E389 HydrophobicContact CE3-CG 4.03Å; W206-E389 HydrophobicContact CZ3-CG 4.42Å
207	P	90.8	Very high	75.3	Confident	1 Å²	1	47.4 Å²	47.4	1%	0.006	26%	0.262	C	S	.	.	H	α-helix	trans	-58.2	-31.7	176.4	24.6	-34.6	0	0	0	112.3	W156 Y211	W156-P207 WeakPolarHBondContact O-CB 3.42Å; W156-P207 WeakPolarHBondContact O-CG 3.37Å; P207-Y211 WeakPolarHBondContact O-CB 3.09Å; P207-Y211 PolarHBondContact O-N 3.26Å
208	S	92.5	Very high	77.4	Confident	0 Å²	0	46.9 Å²	46.9	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-66	-35.2	173.3	63.5	0	0	0	0	114.4	W206 F212 V385 E389	W206-S208 PolarHBondContact O-N 2.95Å; S208-F212 PolarHBondContact O-N 3.38Å; S208-F212 VanDerWaalsContact O-N 3.12Å; S208-V385 VanDerWaalsContact OG-CG1 3.31Å; S208-V385 WeakPolarHBondContact OG-CG1 3.23Å; S208-E389 PolarHBondContact OG-OE2 3.5Å
209	E	90.7	Very high	79.6	Confident	20 Å²	20	45.9 Å²	45.9	9%	0.093	24%	0.24	C	C	.	.	H	α-helix	trans	-73.1	-45.8	-180	-174.6	80.5	-120.7	0	0	109.8	V205 W206 Y211 F212 S213 R381 V385	V205-E209 HydrophobicContact CG1-CB 3.67Å; V205-E209 HydrophobicContact CG1-CG 3.7Å; W206-E209 HydrophobicContact CB-CB 4.44Å; W206-E209 WeakPolarHBondContact O-CB 3.36Å; W206-E209 PolarHBondContact O-N 2.89Å; E209-Y211 VanDerWaalsContact C-N 3.34Å; E209-F212 PolarHBondContact O-N 3.34Å; E209-S213 WeakPolarHBondContact O-CB 3.3Å; E209-S213 PolarHBondContact O-N 2.99Å; E209-S213 PolarHBondContact O-OG 3.32Å; E209-R381 IonicContact OE1-NE 3.11Å; E209-R381 PolarHBondContact OE1-NE 3.39Å; E209-R381 IonicContact OE2-CZ 3.51Å; E209-R381 IonicContact OE2-NE 2.75Å; E209-R381 PolarHBondContact OE2-NE 2.97Å; E209-R381 IonicContact OE2-NH2 3.45Å; E209-R381 PolarHBondContact OE2-NH2 2.98Å; E209-V385 HydrophobicContact CB-CG1 3.89Å
210	E	93.1	Very high	82.1	Confident	4 Å²	4	39.7 Å²	39.7	2%	0.019	21%	0.208	C	C	.	.	H	α-helix	trans	-65.3	-38.1	174.2	-69.5	-162.4	162.9	0	0	112.1	N164 T165 C168 V205 W206 F212 S213 L214	N164-E210 WeakPolarHBondContact CA-OE2 3.39Å; N164-E210 WeakPolarHBondContact CB-OE2 3.49Å; N164-E210 PolarHBondContact ND2-OE2 3.07Å; T165-E210 WeakPolarHBondContact CB-OE1 3.42Å; T165-E210 PolarHBondContact N-OE1 2.89Å; T165-E210 PolarHBondContact N-OE2 3.41Å; T165-E210 PolarHBondContact OG1-OE1 3.04Å; C168-E210 VanDerWaalsContact CB-OE2 3.25Å; C168-E210 WeakPolarHBondContact CB-OE2 3.39Å; V205-E210 HydrophobicContact CB-CG 4.18Å; V205-E210 HydrophobicContact CG1-CG 3.66Å; W206-E210 PolarHBondContact O-N 3.26Å; W206-E210 VanDerWaalsContact O-N 3.12Å; E210-F212 VanDerWaalsContact C-N 3.32Å; E210-F212 PolarHBondContact O-N 3.34Å; E210-S213 WeakPolarHBondContact CA-OG 3.29Å; E210-S213 PolarHBondContact O-N 3.02Å; E210-L214 HydrophobicContact CB-CD1 4.09Å; E210-L214 HydrophobicContact CG-CD1 4.16Å; E210-L214 WeakPolarHBondContact O-CA 3.32Å; E210-L214 VanDerWaalsContact O-CB 3.23Å; E210-L214 WeakPolarHBondContact O-CB 3.27Å; E210-L214 PolarHBondContact O-N 2.85Å
211	Y	95.3	Very high	84.2	Confident	5 Å²	5	41.5 Å²	41.5	2%	0.02	23%	0.227	C	C	.	.	I	π-helix	trans	-59.9	-44.1	175.2	-177.2	-105.6	0	0	0	111.6	H144 Y145 A148 A155 W156 W163 P207 E209 E215 V216	H144-Y211 PolarHBondContact CE1-OH 2.9Å; H144-Y211 PolarHBondContact ND1-OH 3.5Å; Y145-Y211 HydrophobicContact CD1-CD1 4.44Å; Y145-Y211 AromaticContact CD1-CE1 3.94Å; Y145-Y211 HydrophobicContact CD1-CE1 3.94Å; Y145-Y211 AromaticContact CE1-CD1 3.6Å; Y145-Y211 HydrophobicContact CE1-CD1 3.6Å; Y145-Y211 AromaticContact CE1-CE1 3.52Å; Y145-Y211 HydrophobicContact CE1-CE1 3.52Å; Y145-Y211 HydrophobicContact CE2-CE1 4.32Å; Y145-Y211 HydrophobicContact CG-CE1 4.48Å; Y145-Y211 AromaticContact CZ-CD1 3.69Å; Y145-Y211 AromaticContact CZ-CE1 3.73Å; A148-Y211 WeakPolarHBondContact CB-OH 3.26Å; A155-Y211 HydrophobicContact CB-CD2 4.12Å; A155-Y211 HydrophobicContact CB-CE2 3.53Å; W156-Y211 HydrophobicContact CB-CD1 4.02Å; W156-Y211 HydrophobicContact CB-CG 3.91Å; W156-Y211 HydrophobicContact CD2-CD1 4.43Å; W156-Y211 AromaticContact CE3-CD1 3.79Å; W156-Y211 HydrophobicContact CE3-CD1 3.79Å; W156-Y211 AromaticContact CE3-CE1 3.54Å; W156-Y211 HydrophobicContact CE3-CE1 3.54Å; W156-Y211 HydrophobicContact CZ3-CE1 4.05Å; W163-Y211 AromaticContact CE2-CD2 3.81Å; W163-Y211 HydrophobicContact CH2-CD2 4.46Å; W163-Y211 HydrophobicContact CH2-CE2 4.32Å; W163-Y211 AromaticContact CZ2-CD2 3.61Å; W163-Y211 HydrophobicContact CZ2-CD2 3.61Å; W163-Y211 AromaticContact CZ2-CE2 3.89Å; W163-Y211 HydrophobicContact CZ2-CE2 3.89Å; W163-Y211 AromaticContact NE1-CD2 3.91Å; P207-Y211 WeakPolarHBondContact O-CB 3.09Å; P207-Y211 PolarHBondContact O-N 3.26Å; E209-Y211 VanDerWaalsContact C-N 3.34Å; Y211-E215 HydrophobicContact CD2-CB 4.04Å; Y211-E215 HydrophobicContact CD2-CG 4.11Å; Y211-E215 HydrophobicContact CE2-CB 4.23Å; Y211-E215 HydrophobicContact CE2-CG 3.8Å; Y211-E215 WeakPolarHBondContact O-CB 3.41Å; Y211-E215 PolarHBondContact O-N 3.3Å; Y211-V216 HydrophobicContact CD1-CG2 3.96Å; Y211-V216 HydrophobicContact CE1-CG2 3.58Å; Y211-V216 WeakPolarHBondContact O-CG2 3.08Å; Y211-V216 PolarHBondContact O-N 3.45Å
212	F	95.2	Very high	86.6	Confident	2 Å²	2	36.9 Å²	36.9	1%	0.009	20%	0.195	C	C	.	.	I	π-helix	trans	-68.6	-49.3	178.2	-172.5	-122.2	0	0	0	112.5	W141 Y145 S208 E209 E210 V216 L217 P380 F384 V385	W141-F212 HydrophobicContact CD2-CE2 4.38Å; W141-F212 HydrophobicContact CE3-CZ 4.46Å; Y145-F212 AromaticContact CE2-CD2 4Å; Y145-F212 HydrophobicContact CE2-CD2 4Å; Y145-F212 WeakPolarHBondContact OH-CB 3.1Å; Y145-F212 WeakPolarHBondContact OH-CD2 3.16Å; S208-F212 PolarHBondContact O-N 3.38Å; S208-F212 VanDerWaalsContact O-N 3.12Å; E209-F212 PolarHBondContact O-N 3.34Å; E210-F212 VanDerWaalsContact C-N 3.32Å; E210-F212 PolarHBondContact O-N 3.34Å; F212-V216 HydrophobicContact CD2-CB 4.32Å; F212-V216 HydrophobicContact CD2-CG1 4.31Å; F212-L217 HydrophobicContact CD1-CD1 3.87Å; F212-L217 HydrophobicContact CD2-CD1 4.34Å; F212-L217 HydrophobicContact CD2-CG 4.37Å; F212-L217 HydrophobicContact CE1-CD1 3.46Å; F212-L217 VanDerWaalsContact CE1-CD1 3.46Å; F212-L217 HydrophobicContact CE1-CG 4.43Å; F212-L217 HydrophobicContact CE2-CD1 4Å; F212-L217 HydrophobicContact CE2-CD2 4.43Å; F212-L217 HydrophobicContact CE2-CG 4.12Å; F212-L217 HydrophobicContact CG-CD1 4.3Å; F212-L217 HydrophobicContact CZ-CD1 3.55Å; F212-L217 HydrophobicContact CZ-CD2 4.45Å; F212-L217 HydrophobicContact CZ-CG 4.15Å; F212-L217 WeakPolarHBondContact O-CB 3.07Å; F212-L217 VanDerWaalsContact O-CG 3.3Å; F212-L217 WeakPolarHBondContact O-CG 3.42Å; F212-L217 PolarHBondContact O-N 3.31Å; F212-P380 HydrophobicContact CZ-CB 4.24Å; F212-F384 HydrophobicContact CD2-CB 4.02Å; F212-F384 HydrophobicContact CE2-CB 3.95Å; F212-F384 HydrophobicContact CE2-CD2 4.46Å; F212-F384 HydrophobicContact CE2-CG 4.19Å; F212-F384 HydrophobicContact CZ-CB 4.41Å; F212-V385 HydrophobicContact CB-CG2 3.8Å; F212-V385 HydrophobicContact CD1-CG2 3.88Å; F212-V385 HydrophobicContact CG-CG2 4.04Å
213	S	93.2	Very high	88.5	Confident	22 Å²	22	34.4 Å²	34.4	15%	0.154	18%	0.182	C	C	.	.	I	π-helix	trans	-75	-41.6	-173.5	54.9	0	0	0	0	113.5	E209 E210 E218 M219	E209-S213 WeakPolarHBondContact O-CB 3.3Å; E209-S213 PolarHBondContact O-N 2.99Å; E209-S213 PolarHBondContact O-OG 3.32Å; E210-S213 WeakPolarHBondContact CA-OG 3.29Å; E210-S213 PolarHBondContact O-N 3.02Å; S213-E218 PolarHBondContact O-N 3.47Å; S213-M219 PolarHBondContact O-N 3.43Å
214	L	93.2	Very high	90.1	Very high	68 Å²	68	32.5 Å²	32.5	36%	0.356	18%	0.176	S	C	.	.	I	π-helix	trans	-97.2	-37.8	-171.5	-56.6	177.8	0	0	0	113.4	W163 T165 E210 E218	W163-L214 HydrophobicContact CB-CB 4.24Å; W163-L214 WeakPolarHBondContact O-CD1 3.2Å; T165-L214 HydrophobicContact CG2-CD1 3.75Å; E210-L214 HydrophobicContact CB-CD1 4.09Å; E210-L214 HydrophobicContact CG-CD1 4.16Å; E210-L214 WeakPolarHBondContact O-CA 3.32Å; E210-L214 VanDerWaalsContact O-CB 3.23Å; E210-L214 WeakPolarHBondContact O-CB 3.27Å; E210-L214 PolarHBondContact O-N 2.85Å; L214-E218 WeakPolarHBondContact O-CA 3.48Å; L214-E218 WeakPolarHBondContact O-CG 3.44Å
215	E	93.9	Very high	91.1	Very high	64 Å²	64	33 Å²	33	30%	0.299	18%	0.181	S	C	.	.	I	π-helix	trans	-96.1	-49.2	-177.7	178.4	68.7	-176.8	0	0	112.4	W163 Y211	W163-E215 HydrophobicContact CB-CB 4.24Å; W163-E215 HydrophobicContact CD2-CB 3.75Å; W163-E215 HydrophobicContact CD2-CG 3.96Å; W163-E215 HydrophobicContact CE3-CB 4.12Å; W163-E215 HydrophobicContact CE3-CG 3.83Å; W163-E215 HydrophobicContact CG-CB 3.81Å; W163-E215 HydrophobicContact CH2-CG 4.43Å; W163-E215 HydrophobicContact CZ3-CG 4.08Å; Y211-E215 HydrophobicContact CD2-CB 4.04Å; Y211-E215 HydrophobicContact CD2-CG 4.11Å; Y211-E215 HydrophobicContact CE2-CB 4.23Å; Y211-E215 HydrophobicContact CE2-CG 3.8Å; Y211-E215 WeakPolarHBondContact O-CB 3.41Å; Y211-E215 PolarHBondContact O-N 3.3Å
216	V	94.1	Very high	91.2	Very high	3 Å²	3	35.9 Å²	35.9	2%	0.018	19%	0.19	C	C	.	.	I	π-helix	trans	-75.7	-44.9	-176.1	177.4	0	0	0	0	111.9	Y145 Y211 F212	Y145-V216 HydrophobicContact CE2-CG1 4.4Å; Y145-V216 HydrophobicContact CE2-CG2 3.93Å; Y211-V216 HydrophobicContact CD1-CG2 3.96Å; Y211-V216 HydrophobicContact CE1-CG2 3.58Å; Y211-V216 WeakPolarHBondContact O-CG2 3.08Å; Y211-V216 PolarHBondContact O-N 3.45Å; F212-V216 HydrophobicContact CD2-CB 4.32Å; F212-V216 HydrophobicContact CD2-CG1 4.31Å
217	L	92.8	Very high	91.1	Very high	6 Å²	6	35.2 Å²	35.2	3%	0.031	20%	0.199	C	C	.	.	S	Bend	trans	-99.4	-20.8	-175.6	-65.6	178.1	0	0	0	114	W141 F212 M219 L230 I457	W141-L217 HydrophobicContact CZ2-CD2 3.76Å; F212-L217 HydrophobicContact CD1-CD1 3.87Å; F212-L217 HydrophobicContact CD2-CD1 4.34Å; F212-L217 HydrophobicContact CD2-CG 4.37Å; F212-L217 HydrophobicContact CE1-CD1 3.46Å; F212-L217 VanDerWaalsContact CE1-CD1 3.46Å; F212-L217 HydrophobicContact CE1-CG 4.43Å; F212-L217 HydrophobicContact CE2-CD1 4Å; F212-L217 HydrophobicContact CE2-CD2 4.43Å; F212-L217 HydrophobicContact CE2-CG 4.12Å; F212-L217 HydrophobicContact CG-CD1 4.3Å; F212-L217 HydrophobicContact CZ-CD1 3.55Å; F212-L217 HydrophobicContact CZ-CD2 4.45Å; F212-L217 HydrophobicContact CZ-CG 4.15Å; F212-L217 WeakPolarHBondContact O-CB 3.07Å; F212-L217 VanDerWaalsContact O-CG 3.3Å; F212-L217 WeakPolarHBondContact O-CG 3.42Å; F212-L217 PolarHBondContact O-N 3.31Å; L217-M219 PolarHBondContact O-N 3.46Å; L217-L230 WeakPolarHBondContact O-CD1 3.23Å; L217-I457 HydrophobicContact CD1-CB 4Å; L217-I457 HydrophobicContact CD1-CD1 4.33Å; L217-I457 HydrophobicContact CD1-CG1 4.1Å; L217-I457 HydrophobicContact CD1-CG2 4.39Å
218	E	92.5	Very high	90.9	Very high	65 Å²	65	41.9 Å²	41.9	30%	0.304	23%	0.234	S	C	.	.			trans	38.6	50.5	-167.7	-63.2	-172.4	-155	0	0	112.2	S213 L214 S220 L230 K454	S213-E218 PolarHBondContact O-N 3.47Å; L214-E218 WeakPolarHBondContact O-CA 3.48Å; L214-E218 WeakPolarHBondContact O-CG 3.44Å; E218-S220 PolarHBondContact O-N 3.29Å; E218-L230 HydrophobicContact CB-CD1 4.22Å; E218-L230 HydrophobicContact CB-CD2 3.95Å; E218-L230 HydrophobicContact CG-CD1 4.45Å; E218-L230 HydrophobicContact CG-CD2 3.86Å; E218-L230 WeakPolarHBondContact OE1-CD2 3.15Å; E218-L230 WeakPolarHBondContact OE2-CD2 3.41Å; E218-K454 HydrophobicContact CB-CD 4.25Å; E218-K454 HydrophobicContact CB-CG 4.2Å; E218-K454 VanDerWaalsContact O-CB 3.29Å; E218-K454 WeakPolarHBondContact O-CB 3.43Å; E218-K454 VanDerWaalsContact O-CD 3.3Å; E218-K454 WeakPolarHBondContact O-CD 3.28Å; E218-K454 VanDerWaalsContact O-CG 3.26Å; E218-K454 WeakPolarHBondContact O-CG 3.41Å; E218-K454 WeakPolarHBondContact OE2-CE 3.48Å; E218-K454 IonicContact OE2-NZ 3.56Å; E218-K454 PolarHBondContact OE2-NZ 2.96Å
219	M	90.5	Very high	90.8	Very high	58 Å²	58	46.6 Å²	46.6	29%	0.286	26%	0.257	S	S	.	.			trans	-55.1	134.1	-161.2	-170	173.4	78.5	0	0	113.3	S213 L217 I457 Y458 Y538	S213-M219 PolarHBondContact O-N 3.43Å; L217-M219 PolarHBondContact O-N 3.46Å; M219-I457 HydrophobicContact CG-CG2 3.88Å; M219-I457 HydrophobicContact SD-CG2 3.84Å; M219-Y458 HydrophobicContact CG-CE2 4.23Å; M219-Y538 HydrophobicContact SD-CE1 3.98Å
220	S	92.1	Very high	91	Very high	8 Å²	8	46 Å²	46	6%	0.056	26%	0.255	C	S	.	.			trans	-80.4	167.6	175.6	71.6	0	0	0	0	113	E218 G222 D225 K454 A455 Y458	E218-S220 PolarHBondContact O-N 3.29Å; S220-G222 PolarHBondContact O-N 3.28Å; S220-G222 PolarHBondContact OG-O 2.74Å; S220-D225 WeakPolarHBondContact CB-O 3.39Å; S220-D225 PolarHBondContact OG-O 3.28Å; S220-K454 PolarHBondContact N-O 3.19Å; S220-A455 WeakPolarHBondContact OG-CA 3.38Å; S220-Y458 WeakPolarHBondContact O-CE2 3.16Å; S220-Y458 PolarHBondContact O-OH 2.71Å
221	S	88.7	Confident	91	Very high	94 Å²	94	53.5 Å²	53.5	66%	0.657	28%	0.283	S	S	*	.	S	Bend	trans	-64.6	-18.9	178.4	59.6	0	0	0	0	114.2
222	G	89	Confident	91	Very high	2 Å²	2	56.3 Å²	56.3	2%	0.021	30%	0.296	C	S	.	.	S	Bend	trans	169.1	-178.4	-178.4	0	0	0	0	0	112.2	S220 T224 D225	S220-G222 PolarHBondContact O-N 3.28Å; S220-G222 PolarHBondContact OG-O 2.74Å; G222-T224 VanDerWaalsContact C-N 3.29Å; G222-T224 PolarHBondContact O-N 3.47Å; G222-D225 PolarHBondContact O-N 3.24Å; G222-D225 VanDerWaalsContact O-N 3.13Å
223	V	88.6	Confident	91	Very high	1 Å²	1	56.4 Å²	56.4	1%	0.006	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.5	-18.4	-167.8	-148.1	0	0	0	0	114.1	D225 Y458 Y459 Y541 Y543 M547	V223-D225 VanDerWaalsContact C-N 3.31Å; V223-Y458 HydrophobicContact CG2-CD1 4.49Å; V223-Y458 HydrophobicContact CG2-CD2 4.43Å; V223-Y458 HydrophobicContact CG2-CG 3.99Å; V223-Y459 HydrophobicContact CG1-CD1 4.06Å; V223-Y459 HydrophobicContact CG1-CD2 4.48Å; V223-Y459 HydrophobicContact CG1-CE1 3.5Å; V223-Y459 HydrophobicContact CG1-CE2 4Å; V223-Y459 VanDerWaalsContact CG1-CZ 3.46Å; V223-Y459 PolarHBondContact O-OH 2.98Å; V223-Y541 HydrophobicContact CG2-CE1 3.59Å; V223-Y541 PolarHBondContact N-OH 2.96Å; V223-Y543 HydrophobicContact CG2-CD1 3.82Å; V223-Y543 HydrophobicContact CG2-CE1 3.72Å; V223-M547 HydrophobicContact CB-CE 4.11Å; V223-M547 HydrophobicContact CB-SD 3.38Å; V223-M547 WeakPolarHBondContact CB-SD 3.47Å; V223-M547 HydrophobicContact CG1-CE 3.61Å; V223-M547 HydrophobicContact CG1-SD 3.53Å; V223-M547 VanDerWaalsContact CG1-SD 3.53Å; V223-M547 HydrophobicContact CG2-CE 3.99Å; V223-M547 HydrophobicContact CG2-SD 3.33Å; V223-M547 WeakPolarHBondContact CG2-SD 3.49Å
224	T	88.7	Confident	91.1	Very high	99 Å²	99	55.6 Å²	55.6	61%	0.607	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.4	-21.6	174.5	49.6	0	0	0	0	112.6	G222 F226	G222-T224 VanDerWaalsContact C-N 3.29Å; G222-T224 PolarHBondContact O-N 3.47Å; T224-F226 PolarHBondContact O-N 3.18Å
225	D	89.3	Confident	91.3	Very high	76 Å²	76	56.9 Å²	56.9	41%	0.406	30%	0.298	S	S	.	.			trans	-96.7	84.4	177.5	-176.5	17.5	0	0	0	109.1	S220 G222 V223 G227	S220-D225 WeakPolarHBondContact CB-O 3.39Å; S220-D225 PolarHBondContact OG-O 3.28Å; G222-D225 PolarHBondContact O-N 3.24Å; G222-D225 VanDerWaalsContact O-N 3.13Å; V223-D225 VanDerWaalsContact C-N 3.31Å; D225-G227 PolarHBondContact O-N 3.46Å; D225-G227 PolarHBondContact OD1-N 3.01Å
226	F	84	Confident	91.4	Very high	106 Å²	106	56.2 Å²	56.2	47%	0.465	29%	0.293	S	S	.	.			trans	-56.9	-31.6	179.3	-73.8	-90.5	0	0	0	112.2	T224 T453 K454 A455 Y459	T224-F226 PolarHBondContact O-N 3.18Å; F226-T453 WeakPolarHBondContact O-CB 3.18Å; F226-K454 PolarHBondContact O-N 3.4Å; F226-A455 PolarHBondContact O-N 3.42Å; F226-Y459 HydrophobicContact CD1-CE2 4.09Å; F226-Y459 AromaticContact CE1-CE2 3.98Å; F226-Y459 HydrophobicContact CE1-CE2 3.98Å; F226-Y459 AromaticContact CE1-CZ 3.69Å; F226-Y459 WeakPolarHBondContact CE1-OH 3.32Å; F226-Y459 WeakPolarHBondContact CZ-OH 3.46Å
227	G	84.5	Confident	91.4	Very high	36 Å²	36	56.1 Å²	56.1	37%	0.371	29%	0.293	S	S	.	.			trans	61	-168	-168.2	0	0	0	0	0	113.1	D225	D225-G227 PolarHBondContact O-N 3.46Å; D225-G227 PolarHBondContact OD1-N 3.01Å
228	L	87.4	Confident	91.5	Very high	141 Å²	141	58.9 Å²	58.9	74%	0.738	31%	0.307	S	S	*	.			trans	-83.3	153.5	173	-66.6	172.2	0	0	0	110.4	L230	L228-L230 PolarHBondContact O-N 3.01Å
229	M	90.8	Very high	91.6	Very high	98 Å²	98	57.6 Å²	57.6	48%	0.483	31%	0.307	S	S	.	.	B	Isolated β-bridge	trans	-70.3	126.6	171.7	-174.9	175.5	68.4	0	0	109.7	W231 A234 L449 C452	M229-W231 PolarHBondContact O-N 3.46Å; M229-W231 VanDerWaalsContact O-N 3.09Å; M229-A234 HydrophobicContact SD-CB 4.43Å; M229-L449 HydrophobicContact SD-CB 4.35Å; M229-L449 HydrophobicContact SD-CD1 4.43Å; M229-L449 HydrophobicContact SD-CD2 4.03Å; M229-L449 HydrophobicContact SD-CG 4.5Å; M229-C452 HydrophobicContact CG-CB 4.41Å
230	L	93.9	Very high	91.7	Very high	9 Å²	9	54.9 Å²	54.9	5%	0.047	29%	0.294	C	S	.	.			trans	-75.8	98.3	176.7	-60	176.4	0	0	0	108.6	L217 E218 L228 Q232 L233 A234 C452 K454	L217-L230 WeakPolarHBondContact O-CD1 3.23Å; E218-L230 HydrophobicContact CB-CD1 4.22Å; E218-L230 HydrophobicContact CB-CD2 3.95Å; E218-L230 HydrophobicContact CG-CD1 4.45Å; E218-L230 HydrophobicContact CG-CD2 3.86Å; E218-L230 WeakPolarHBondContact OE1-CD2 3.15Å; E218-L230 WeakPolarHBondContact OE2-CD2 3.41Å; L228-L230 PolarHBondContact O-N 3.01Å; L230-Q232 PolarHBondContact O-N 2.94Å; L230-L233 HydrophobicContact CB-CB 3.9Å; L230-L233 HydrophobicContact CD1-CD2 4.38Å; L230-L233 PolarHBondContact O-N 2.91Å; L230-L233 VanDerWaalsContact O-N 3.1Å; L230-A234 PolarHBondContact O-N 3.24Å; L230-C452 PolarHBondContact N-O 3.42Å; L230-K454 HydrophobicContact CD2-CG 4.34Å
231	W	93.9	Very high	91.7	Very high	160 Å²	160	54.8 Å²	54.8	61%	0.606	29%	0.293	S	S	*	.	H	α-helix	trans	-62.3	-31.5	-173.8	69	-89.2	0	0	0	112.1	M229 A234 L235	M229-W231 PolarHBondContact O-N 3.46Å; M229-W231 VanDerWaalsContact O-N 3.09Å; W231-A234 PolarHBondContact O-N 3.32Å; W231-L235 HydrophobicContact CE3-CD1 3.61Å; W231-L235 HydrophobicContact CE3-CG 4.43Å; W231-L235 HydrophobicContact CZ3-CD1 3.56Å; W231-L235 WeakPolarHBondContact O-CG 3.34Å; W231-L235 PolarHBondContact O-N 2.92Å
232	Q	94.3	Very high	91.8	Very high	65 Å²	65	54.3 Å²	54.3	30%	0.304	28%	0.282	S	S	.	.	H	α-helix	trans	-63.1	-47.9	174	-56.8	91.2	-31.4	0	0	110.6	L230 A234 L235 Y236	L230-Q232 PolarHBondContact O-N 2.94Å; Q232-A234 VanDerWaalsContact C-N 3.33Å; Q232-A234 PolarHBondContact O-N 2.99Å; Q232-L235 WeakPolarHBondContact O-CB 3.44Å; Q232-L235 PolarHBondContact O-N 2.77Å; Q232-Y236 HydrophobicContact CB-CE2 4.19Å; Q232-Y236 WeakPolarHBondContact O-CD2 3.47Å; Q232-Y236 PolarHBondContact O-N 3.14Å; Q232-Y236 VanDerWaalsContact O-N 3.08Å
233	L	94.9	Very high	91.8	Very high	4 Å²	4	57 Å²	57	2%	0.021	30%	0.296	C	S	.	.	H	α-helix	trans	-65.2	-38.2	178.8	-173.3	58.4	0	0	0	111.5	A140 L230 L235 Y236 F237 C452	A140-L233 HydrophobicContact CB-CD1 3.79Å; L230-L233 HydrophobicContact CB-CB 3.9Å; L230-L233 HydrophobicContact CD1-CD2 4.38Å; L230-L233 PolarHBondContact O-N 2.91Å; L230-L233 VanDerWaalsContact O-N 3.1Å; L233-L235 VanDerWaalsContact C-N 3.31Å; L233-L235 PolarHBondContact O-N 3.33Å; L233-Y236 PolarHBondContact O-N 2.93Å; L233-F237 WeakPolarHBondContact O-CB 3.29Å; L233-F237 PolarHBondContact O-N 3.43Å; L233-C452 HydrophobicContact CD2-CB 4.47Å; L233-C452 HydrophobicContact CG-CB 4.36Å
234	A	96	Very high	91.7	Very high	5 Å²	5	57.1 Å²	57.1	4%	0.041	30%	0.297	C	S	.	.	H	α-helix	trans	-61.4	-37.3	173.8	0	0	0	0	0	112.5	M229 L230 W231 Q232 F237 L238 L449 C452	M229-A234 HydrophobicContact SD-CB 4.43Å; L230-A234 PolarHBondContact O-N 3.24Å; W231-A234 PolarHBondContact O-N 3.32Å; Q232-A234 VanDerWaalsContact C-N 3.33Å; Q232-A234 PolarHBondContact O-N 2.99Å; A234-F237 PolarHBondContact O-N 3.03Å; A234-L238 PolarHBondContact O-N 3.07Å; A234-L449 HydrophobicContact CB-CD2 4.19Å; A234-C452 HydrophobicContact CB-CB 4.31Å
235	L	96.5	Very high	91.6	Very high	94 Å²	94	54.5 Å²	54.5	49%	0.492	28%	0.277	S	S	.	.	H	α-helix	trans	-66.7	-41.8	173.5	-71.2	174.8	0	0	0	112.2	W231 Q232 L233 F237 L238 A239	W231-L235 HydrophobicContact CE3-CD1 3.61Å; W231-L235 HydrophobicContact CE3-CG 4.43Å; W231-L235 HydrophobicContact CZ3-CD1 3.56Å; W231-L235 WeakPolarHBondContact O-CG 3.34Å; W231-L235 PolarHBondContact O-N 2.92Å; Q232-L235 WeakPolarHBondContact O-CB 3.44Å; Q232-L235 PolarHBondContact O-N 2.77Å; L233-L235 VanDerWaalsContact C-N 3.31Å; L233-L235 PolarHBondContact O-N 3.33Å; L235-F237 VanDerWaalsContact C-N 3.32Å; L235-L238 WeakPolarHBondContact O-CB 3.32Å; L235-L238 PolarHBondContact O-N 3.46Å; L235-A239 PolarHBondContact O-N 3.07Å
236	Y	95.9	Very high	91.4	Very high	51 Å²	51	57 Å²	57	20%	0.2	29%	0.285	C	S	.	.	H	α-helix	trans	-66.8	-35.5	175.2	-58.5	-43.1	0	0	0	112.2	I143 H144 I147 Q232 L233 A239 G240	I143-Y236 HydrophobicContact CB-CD1 4.47Å; I143-Y236 HydrophobicContact CG2-CD1 3.54Å; I143-Y236 HydrophobicContact CG2-CE1 4.21Å; I143-Y236 HydrophobicContact CG2-CG 4.07Å; H144-Y236 HydrophobicContact CB-CD2 3.84Å; H144-Y236 HydrophobicContact CB-CE2 3.88Å; H144-Y236 AromaticContact CD2-CD2 3.86Å; H144-Y236 AromaticContact CD2-CE2 3.37Å; H144-Y236 WeakPolarHBondContact CD2-CE2 3.3Å; H144-Y236 AromaticContact CG-CE2 3.84Å; I147-Y236 HydrophobicContact CD1-CD1 4.02Å; I147-Y236 HydrophobicContact CD1-CE1 3.25Å; Q232-Y236 HydrophobicContact CB-CE2 4.19Å; Q232-Y236 WeakPolarHBondContact O-CD2 3.47Å; Q232-Y236 PolarHBondContact O-N 3.14Å; Q232-Y236 VanDerWaalsContact O-N 3.08Å; L233-Y236 PolarHBondContact O-N 2.93Å; Y236-A239 WeakPolarHBondContact O-CB 3.44Å; Y236-A239 PolarHBondContact O-N 3.27Å; Y236-G240 PolarHBondContact O-N 3.27Å
237	F	94.7	Very high	91.4	Very high	0 Å²	0	52.7 Å²	52.7	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-64	-42.3	173.1	-172.8	-120	0	0	0	111.8	N136 V137 A140 L233 A234 L235 A239 G240 W241 Y445	N136-F237 HydrophobicContact CB-CD2 4.44Å; N136-F237 HydrophobicContact CB-CE2 3.8Å; N136-F237 WeakPolarHBondContact ND2-CE2 3.35Å; N136-F237 PolarHBondContact ND2-O 3.36Å; V137-F237 HydrophobicContact CG2-CD2 4.16Å; V137-F237 HydrophobicContact CG2-CE2 3.74Å; V137-F237 HydrophobicContact CG2-CZ 4.47Å; A140-F237 HydrophobicContact CB-CB 4.03Å; A140-F237 HydrophobicContact CB-CD2 4.4Å; L233-F237 WeakPolarHBondContact O-CB 3.29Å; L233-F237 PolarHBondContact O-N 3.43Å; A234-F237 PolarHBondContact O-N 3.03Å; L235-F237 VanDerWaalsContact C-N 3.32Å; F237-A239 VanDerWaalsContact C-N 3.35Å; F237-G240 PolarHBondContact O-N 2.89Å; F237-W241 AromaticContact CD1-NE1 3.77Å; F237-W241 AromaticContact CE1-CD1 3.92Å; F237-W241 AromaticContact CE1-NE1 3.18Å; F237-W241 HydrophobicContact CE2-CZ2 4.45Å; F237-W241 AromaticContact CE2-NE1 3.57Å; F237-W241 AromaticContact CZ-CE2 3.82Å; F237-W241 HydrophobicContact CZ-CZ2 4Å; F237-W241 AromaticContact CZ-NE1 3.06Å; F237-W241 PolarHBondContact O-N 3.49Å; F237-W241 VanDerWaalsContact O-N 3.16Å; F237-Y445 AromaticContact CD1-CD2 3.57Å; F237-Y445 HydrophobicContact CD1-CD2 3.57Å; F237-Y445 AromaticContact CD1-CE2 3.84Å; F237-Y445 HydrophobicContact CD1-CE2 3.84Å; F237-Y445 AromaticContact CE1-CD2 3.97Å; F237-Y445 HydrophobicContact CE1-CD2 3.97Å; F237-Y445 WeakPolarHBondContact CE1-O 3.34Å
238	L	95.4	Very high	91.2	Very high	64 Å²	64	51.5 Å²	51.5	34%	0.335	25%	0.252	S	S	.	.	H	α-helix	trans	-60.1	-44.2	171.3	-178.2	63.6	0	0	0	111.4	A234 L235 G240 W241 L242 Y445	A234-L238 PolarHBondContact O-N 3.07Å; L235-L238 WeakPolarHBondContact O-CB 3.32Å; L235-L238 PolarHBondContact O-N 3.46Å; L238-G240 VanDerWaalsContact C-N 3.3Å; L238-G240 PolarHBondContact O-N 3.25Å; L238-W241 PolarHBondContact O-N 3.01Å; L238-W241 VanDerWaalsContact O-N 3.15Å; L238-L242 HydrophobicContact CG-CD1 4.27Å; L238-L242 HydrophobicContact CG-CG 4.47Å; L238-L242 WeakPolarHBondContact O-CG 3.44Å; L238-L242 PolarHBondContact O-N 2.82Å; L238-Y445 HydrophobicContact CB-CD2 4.21Å; L238-Y445 HydrophobicContact CB-CE2 3.63Å; L238-Y445 HydrophobicContact CD1-CD2 4.11Å; L238-Y445 HydrophobicContact CD1-CE2 4.08Å; L238-Y445 HydrophobicContact CD1-CG 4.34Å; L238-Y445 HydrophobicContact CG-CE2 4.41Å
239	A	94.5	Very high	90.9	Very high	38 Å²	38	48.3 Å²	48.3	31%	0.314	23%	0.232	S	C	.	.	H	α-helix	trans	-60.1	-39.1	176.9	0	0	0	0	0	112.2	I143 L235 Y236 F237 L242 L243	I143-A239 HydrophobicContact CD1-CB 4.06Å; L235-A239 PolarHBondContact O-N 3.07Å; Y236-A239 WeakPolarHBondContact O-CB 3.44Å; Y236-A239 PolarHBondContact O-N 3.27Å; F237-A239 VanDerWaalsContact C-N 3.35Å; A239-L242 PolarHBondContact O-N 3Å; A239-L243 WeakPolarHBondContact O-CB 3.47Å; A239-L243 PolarHBondContact O-N 3.01Å
240	G	92.5	Very high	90.3	Very high	1 Å²	1	47.6 Å²	47.6	1%	0.01	23%	0.231	C	C	.	.	H	α-helix	trans	-58.3	-46.6	172	0	0	0	0	0	112.5	Y236 F237 L238 L243 Q244	Y236-G240 PolarHBondContact O-N 3.27Å; F237-G240 PolarHBondContact O-N 2.89Å; L238-G240 VanDerWaalsContact C-N 3.3Å; L238-G240 PolarHBondContact O-N 3.25Å; G240-L243 WeakPolarHBondContact O-CB 3.42Å; G240-L243 PolarHBondContact O-N 3.29Å; G240-Q244 WeakPolarHBondContact O-CG 3.16Å; G240-Q244 PolarHBondContact O-N 3.07Å
241	W	91.7	Very high	89.4	Confident	6 Å²	6	49 Å²	49	2%	0.023	24%	0.237	C	C	.	.	H	α-helix	trans	-67.6	-35.5	176.5	-70.4	115.8	0	0	0	113.7	S132 N136 F237 L238 L243 Q244 F245 V418 L441 F444 Y445	S132-W241 WeakPolarHBondContact O-CH2 3.23Å; N136-W241 HydrophobicContact CB-CH2 4.18Å; N136-W241 HydrophobicContact CB-CZ2 3.91Å; N136-W241 VanDerWaalsContact ND2-CD2 3.29Å; N136-W241 PolarHBondContact ND2-NE1 3.42Å; N136-W241 VanDerWaalsContact ND2-NE1 3.13Å; F237-W241 AromaticContact CD1-NE1 3.77Å; F237-W241 AromaticContact CE1-CD1 3.92Å; F237-W241 AromaticContact CE1-NE1 3.18Å; F237-W241 HydrophobicContact CE2-CZ2 4.45Å; F237-W241 AromaticContact CE2-NE1 3.57Å; F237-W241 AromaticContact CZ-CE2 3.82Å; F237-W241 HydrophobicContact CZ-CZ2 4Å; F237-W241 AromaticContact CZ-NE1 3.06Å; F237-W241 PolarHBondContact O-N 3.49Å; F237-W241 VanDerWaalsContact O-N 3.16Å; L238-W241 PolarHBondContact O-N 3.01Å; L238-W241 VanDerWaalsContact O-N 3.15Å; W241-L243 VanDerWaalsContact C-N 3.33Å; W241-Q244 HydrophobicContact CE3-CG 4.47Å; W241-Q244 WeakPolarHBondContact O-CB 3.44Å; W241-Q244 PolarHBondContact O-N 2.91Å; W241-F245 PolarHBondContact O-N 3.26Å; W241-V418 HydrophobicContact CZ3-CG2 4.13Å; W241-L441 HydrophobicContact CD2-CD2 4.39Å; W241-L441 HydrophobicContact CE3-CD2 3.45Å; W241-L441 VanDerWaalsContact CE3-CD2 3.45Å; W241-L441 HydrophobicContact CZ3-CD2 3.82Å; W241-F444 HydrophobicContact CH2-CB 3.45Å; W241-F444 VanDerWaalsContact CH2-CB 3.45Å; W241-F444 AromaticContact CH2-CD2 3.64Å; W241-F444 HydrophobicContact CH2-CD2 3.64Å; W241-F444 AromaticContact CH2-CG 3.96Å; W241-F444 HydrophobicContact CH2-CG 3.96Å; W241-F444 HydrophobicContact CZ2-CB 3.41Å; W241-F444 VanDerWaalsContact CZ2-CB 3.41Å; W241-F444 HydrophobicContact CZ2-CD2 4.47Å; W241-F444 HydrophobicContact CZ2-CG 4.37Å; W241-F444 HydrophobicContact CZ3-CB 4.09Å; W241-F444 AromaticContact CZ3-CD2 3.82Å; W241-F444 HydrophobicContact CZ3-CD2 3.82Å; W241-F444 HydrophobicContact CZ3-CG 4.47Å; W241-Y445 AromaticContact CD1-CD2 3.79Å
242	L	91.4	Very high	88.5	Confident	84 Å²	84	41.8 Å²	41.8	44%	0.44	21%	0.211	S	C	.	.	H	α-helix	trans	-64.4	-40.6	173.5	-70.5	175.2	0	0	0	111.1	L238 A239 Q244 F245 F246	L238-L242 HydrophobicContact CG-CD1 4.27Å; L238-L242 HydrophobicContact CG-CG 4.47Å; L238-L242 WeakPolarHBondContact O-CG 3.44Å; L238-L242 PolarHBondContact O-N 2.82Å; A239-L242 PolarHBondContact O-N 3Å; L242-Q244 VanDerWaalsContact C-N 3.31Å; L242-Q244 PolarHBondContact O-N 2.88Å; L242-F245 WeakPolarHBondContact O-CB 3.35Å; L242-F245 PolarHBondContact O-N 2.88Å; L242-F246 HydrophobicContact CB-CE2 4.32Å; L242-F246 WeakPolarHBondContact O-CD2 3.23Å; L242-F246 PolarHBondContact O-N 3.18Å
243	L	89.4	Confident	87.6	Confident	59 Å²	59	45.4 Å²	45.4	31%	0.309	22%	0.221	S	C	.	.	H	α-helix	trans	-59.9	-43.8	174.7	-174.4	62.6	0	0	0	111	A239 G240 W241 F246 C247 I409 V413	A239-L243 WeakPolarHBondContact O-CB 3.47Å; A239-L243 PolarHBondContact O-N 3.01Å; G240-L243 WeakPolarHBondContact O-CB 3.42Å; G240-L243 PolarHBondContact O-N 3.29Å; W241-L243 VanDerWaalsContact C-N 3.33Å; L243-F246 PolarHBondContact O-N 2.93Å; L243-C247 PolarHBondContact O-N 3Å; L243-C247 PolarHBondContact O-SG 3.44Å; L243-I409 HydrophobicContact CD2-CG2 3.53Å; L243-V413 HydrophobicContact CD1-CG2 4.48Å; L243-V413 HydrophobicContact CD2-CG2 3.32Å; L243-V413 HydrophobicContact CG-CG2 3.72Å
244	Q	86.1	Confident	87	Confident	3 Å²	3	46.3 Å²	46.3	1%	0.014	23%	0.228	C	C	.	.	H	α-helix	trans	-61.3	-43.8	173.6	-66.8	-66	-20	0	0	112.3	G240 W241 L242 F246 C247 L248 F412 V413 N416	G240-Q244 WeakPolarHBondContact O-CG 3.16Å; G240-Q244 PolarHBondContact O-N 3.07Å; W241-Q244 HydrophobicContact CE3-CG 4.47Å; W241-Q244 WeakPolarHBondContact O-CB 3.44Å; W241-Q244 PolarHBondContact O-N 2.91Å; L242-Q244 VanDerWaalsContact C-N 3.31Å; L242-Q244 PolarHBondContact O-N 2.88Å; Q244-F246 VanDerWaalsContact C-N 3.34Å; Q244-F246 PolarHBondContact O-N 3.49Å; Q244-C247 PolarHBondContact O-N 3.29Å; Q244-L248 WeakPolarHBondContact O-CB 3.48Å; Q244-L248 WeakPolarHBondContact O-CG 3.14Å; Q244-L248 PolarHBondContact O-N 3.47Å; Q244-F412 PolarHBondContact NE2-O 2.86Å; Q244-V413 PolarHBondContact OE1-O 3.37Å; Q244-N416 PolarHBondContact NE2-ND2 3.16Å
245	F	86.2	Confident	86.3	Confident	44 Å²	44	46.8 Å²	46.8	19%	0.193	23%	0.232	C	C	.	.	H	α-helix	trans	-56.7	-47.3	176.1	179.3	-102.4	0	0	0	111.9	W241 L242 L248 F249 L437 L441	W241-F245 PolarHBondContact O-N 3.26Å; L242-F245 WeakPolarHBondContact O-CB 3.35Å; L242-F245 PolarHBondContact O-N 2.88Å; F245-L248 CarbonylContact O-C 3.6Å; F245-L248 PolarHBondContact O-N 3.42Å; F245-F249 HydrophobicContact CD1-CD2 4.42Å; F245-F249 AromaticContact CE1-CD2 3.69Å; F245-F249 HydrophobicContact CE1-CD2 3.69Å; F245-F249 AromaticContact CE1-CE2 3.99Å; F245-F249 HydrophobicContact CE1-CE2 3.99Å; F245-F249 AromaticContact CZ-CD2 3.86Å; F245-F249 HydrophobicContact CZ-CD2 3.86Å; F245-F249 HydrophobicContact CZ-CE2 4.02Å; F245-F249 WeakPolarHBondContact O-CA 3.43Å; F245-F249 PolarHBondContact O-N 2.86Å; F245-L437 HydrophobicContact CD2-CD2 3.85Å; F245-L437 HydrophobicContact CD2-CG 4.02Å; F245-L437 HydrophobicContact CE2-CD2 4.13Å; F245-L437 HydrophobicContact CE2-CG 4.38Å; F245-L441 HydrophobicContact CB-CD1 3.49Å; F245-L441 VanDerWaalsContact CB-CD1 3.49Å; F245-L441 HydrophobicContact CD2-CD1 3.76Å; F245-L441 HydrophobicContact CG-CD1 4.11Å
246	F	86.3	Confident	85.6	Confident	130 Å²	130	42.3 Å²	42.3	57%	0.57	21%	0.209	S	C	*	.	H	α-helix	trans	-67.5	-37.6	179.8	-69.6	-59.4	0	0	0	112.3	L242 L243 Q244 L248 F249	L242-F246 HydrophobicContact CB-CE2 4.32Å; L242-F246 WeakPolarHBondContact O-CD2 3.23Å; L242-F246 PolarHBondContact O-N 3.18Å; L243-F246 PolarHBondContact O-N 2.93Å; Q244-F246 VanDerWaalsContact C-N 3.34Å; Q244-F246 PolarHBondContact O-N 3.49Å; F246-L248 VanDerWaalsContact C-N 3.32Å; F246-L248 PolarHBondContact O-N 2.84Å; F246-F249 WeakPolarHBondContact O-CB 3.35Å; F246-F249 PolarHBondContact O-N 3.41Å
247	C	83.9	Confident	85.2	Confident	15 Å²	15	46.3 Å²	46.3	10%	0.101	23%	0.227	C	C	.	.	H	α-helix	trans	-67.7	-34.2	178.1	-65	0	0	0	0	112.2	L243 Q244 S254 V258 V413	L243-C247 PolarHBondContact O-N 3Å; L243-C247 PolarHBondContact O-SG 3.44Å; Q244-C247 PolarHBondContact O-N 3.29Å; C247-S254 WeakPolarHBondContact O-CB 3.22Å; C247-S254 PolarHBondContact O-OG 2.95Å; C247-V258 HydrophobicContact CB-CG1 4.49Å; C247-V258 HydrophobicContact CB-CG2 4.41Å; C247-V413 HydrophobicContact CB-CG1 3.9Å; C247-V413 WeakPolarHBondContact SG-CG1 2.99Å
248	L	80.4	Confident	84.8	Confident	11 Å²	11	48 Å²	48	6%	0.058	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.1	9.2	178.3	-60.4	178.5	0	0	0	113.9	Q244 F245 F246 N250 H251 A255 V418 T419 L437	Q244-L248 WeakPolarHBondContact O-CB 3.48Å; Q244-L248 WeakPolarHBondContact O-CG 3.14Å; Q244-L248 PolarHBondContact O-N 3.47Å; F245-L248 CarbonylContact O-C 3.6Å; F245-L248 PolarHBondContact O-N 3.42Å; F246-L248 VanDerWaalsContact C-N 3.32Å; F246-L248 PolarHBondContact O-N 2.84Å; L248-N250 VanDerWaalsContact C-N 3.26Å; L248-N250 PolarHBondContact O-N 3.34Å; L248-H251 WeakPolarHBondContact O-CA 3.48Å; L248-H251 PolarHBondContact O-N 3.42Å; L248-A255 HydrophobicContact CD2-CB 4.15Å; L248-V418 HydrophobicContact CD1-CB 3.66Å; L248-V418 HydrophobicContact CD1-CG1 3.81Å; L248-T419 WeakPolarHBondContact CD2-OG1 3.39Å; L248-L437 HydrophobicContact CB-CD1 4.35Å; L248-L437 HydrophobicContact CB-CD2 3.92Å; L248-L437 HydrophobicContact CD1-CD1 4.26Å
249	F	80.6	Confident	84.4	Confident	73 Å²	73	45 Å²	45	32%	0.32	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-36.3	-172.4	-172.9	-96.5	0	0	0	113.5	F245 F246	F245-F249 HydrophobicContact CD1-CD2 4.42Å; F245-F249 AromaticContact CE1-CD2 3.69Å; F245-F249 HydrophobicContact CE1-CD2 3.69Å; F245-F249 AromaticContact CE1-CE2 3.99Å; F245-F249 HydrophobicContact CE1-CE2 3.99Å; F245-F249 AromaticContact CZ-CD2 3.86Å; F245-F249 HydrophobicContact CZ-CD2 3.86Å; F245-F249 HydrophobicContact CZ-CE2 4.02Å; F245-F249 WeakPolarHBondContact O-CA 3.43Å; F245-F249 PolarHBondContact O-N 2.86Å; F246-F249 WeakPolarHBondContact O-CB 3.35Å; F246-F249 PolarHBondContact O-N 3.41Å
250	N	77.9	Confident	84.2	Confident	84 Å²	84	47.2 Å²	47.2	45%	0.449	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-111.4	31.9	171.1	-61.8	-45.1	0	0	0	111.9	L248 R253	L248-N250 VanDerWaalsContact C-N 3.26Å; L248-N250 PolarHBondContact O-N 3.34Å; N250-R253 PolarHBondContact O-N 2.83Å
251	H	75.2	Confident	84.1	Confident	38 Å²	38	51.9 Å²	51.9	18%	0.176	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	54.2	-135.8	177.8	-54.6	-76.4	0	0	0	112.5	L248 R253 S254 A255 Q433	L248-H251 WeakPolarHBondContact O-CA 3.48Å; L248-H251 PolarHBondContact O-N 3.42Å; H251-R253 VanDerWaalsContact C-N 3.28Å; H251-R253 PolarHBondContact O-N 3.48Å; H251-S254 PolarHBondContact O-N 3.28Å; H251-S254 VanDerWaalsContact O-N 3.13Å; H251-A255 PolarHBondContact O-N 3.17Å; H251-Q433 WeakPolarHBondContact NE2-CB 3.27Å
252	V	74.1	Confident	84	Confident	9 Å²	9	52 Å²	52	6%	0.055	25%	0.248	C	C	.	.	H	α-helix	trans	-57.7	-35.2	-174.8	-179.3	0	0	0	0	112.9	W42 S254 A255 G256 Y328 T419	W42-V252 HydrophobicContact CD2-CG1 3.59Å; W42-V252 HydrophobicContact CE3-CG1 3.4Å; W42-V252 VanDerWaalsContact CE3-CG1 3.4Å; W42-V252 HydrophobicContact CG-CG1 4.48Å; W42-V252 HydrophobicContact CH2-CG1 3.45Å; W42-V252 VanDerWaalsContact CH2-CG1 3.45Å; W42-V252 HydrophobicContact CZ2-CG1 3.61Å; W42-V252 HydrophobicContact CZ3-CB 4.48Å; W42-V252 HydrophobicContact CZ3-CG1 3.32Å; W42-V252 WeakPolarHBondContact CZ3-O 3.35Å; V252-S254 PolarHBondContact O-N 2.94Å; V252-A255 PolarHBondContact O-N 2.9Å; V252-G256 PolarHBondContact O-N 3.31Å; V252-Y328 HydrophobicContact CB-CD1 4.43Å; V252-Y328 HydrophobicContact CB-CE1 4.42Å; V252-Y328 HydrophobicContact CG1-CD1 4.27Å; V252-Y328 HydrophobicContact CG1-CD2 4.41Å; V252-Y328 HydrophobicContact CG1-CG 4.11Å; V252-Y328 HydrophobicContact CG2-CD1 4.01Å; V252-Y328 HydrophobicContact CG2-CD2 3.92Å; V252-Y328 HydrophobicContact CG2-CE1 3.67Å; V252-Y328 HydrophobicContact CG2-CE2 3.62Å; V252-Y328 HydrophobicContact CG2-CG 4.13Å; V252-Y328 VanDerWaalsContact CG2-CZ 3.48Å; V252-T419 HydrophobicContact CG2-CG2 4.19Å
253	R	77.3	Confident	83.8	Confident	140 Å²	140	48.1 Å²	48.1	53%	0.528	23%	0.228	S	C	.	.	H	α-helix	trans	-69.1	-31.7	179.3	-66.8	-171	-174.2	164.8	5.3	113.3	E34 N250 H251 K257	E34-R253 IonicContact OE1-CZ 2.66Å; E34-R253 IonicContact OE1-NE 3.07Å; E34-R253 PolarHBondContact OE1-NE 2.91Å; E34-R253 IonicContact OE1-NH2 3.71Å; E34-R253 PolarHBondContact OE1-NH2 3Å; E34-R253 IonicContact OE2-NH2 3.14Å; E34-R253 PolarHBondContact OE2-NH2 2.92Å; N250-R253 PolarHBondContact O-N 2.83Å; H251-R253 VanDerWaalsContact C-N 3.28Å; H251-R253 PolarHBondContact O-N 3.48Å; R253-K257 WeakPolarHBondContact O-CG 3.29Å
254	S	82.3	Confident	83.9	Confident	23 Å²	23	49.1 Å²	49.1	16%	0.161	23%	0.232	C	C	.	.	H	α-helix	trans	-79.4	-44.3	173.7	-176.5	0	0	0	0	110.2	C247 H251 V252 G256 K257 V258	C247-S254 WeakPolarHBondContact O-CB 3.22Å; C247-S254 PolarHBondContact O-OG 2.95Å; H251-S254 PolarHBondContact O-N 3.28Å; H251-S254 VanDerWaalsContact O-N 3.13Å; V252-S254 PolarHBondContact O-N 2.94Å; S254-G256 VanDerWaalsContact C-N 3.33Å; S254-G256 PolarHBondContact O-N 3.12Å; S254-K257 PolarHBondContact O-N 3.3Å; S254-K257 VanDerWaalsContact O-N 3.1Å; S254-V258 WeakPolarHBondContact O-CG2 3.48Å; S254-V258 PolarHBondContact O-N 2.82Å
255	A	80.7	Confident	84.3	Confident	15 Å²	15	51 Å²	51	12%	0.124	24%	0.244	C	C	.	.	H	α-helix	trans	-55.2	-46.1	178.7	0	0	0	0	0	112.3	L248 H251 V252 K257 V258 A259	L248-A255 HydrophobicContact CD2-CB 4.15Å; H251-A255 PolarHBondContact O-N 3.17Å; V252-A255 PolarHBondContact O-N 2.9Å; A255-K257 VanDerWaalsContact C-N 3.31Å; A255-K257 PolarHBondContact O-N 2.68Å; A255-V258 PolarHBondContact O-N 3.45Å; A255-A259 WeakPolarHBondContact O-CB 3.08Å; A255-A259 PolarHBondContact O-N 3.13Å
256	G	81.8	Confident	84.6	Confident	0 Å²	0	49 Å²	49	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-62.8	-34.9	178.5	0	0	0	0	0	113.6	V252 S254 A259 Y260	V252-G256 PolarHBondContact O-N 3.31Å; S254-G256 VanDerWaalsContact C-N 3.33Å; S254-G256 PolarHBondContact O-N 3.12Å; G256-A259 WeakPolarHBondContact O-CB 3.43Å; G256-Y260 WeakPolarHBondContact O-CD2 3.35Å
257	K	87.1	Confident	84.8	Confident	136 Å²	136	43.9 Å²	43.9	59%	0.591	21%	0.213	S	C	*	.	H	α-helix	trans	-72.7	-41.7	175.8	-68.7	-179.5	-178.2	-174.7	0	112	R253 S254 A255 A259 Y260	R253-K257 WeakPolarHBondContact O-CG 3.29Å; S254-K257 PolarHBondContact O-N 3.3Å; S254-K257 VanDerWaalsContact O-N 3.1Å; A255-K257 VanDerWaalsContact C-N 3.31Å; A255-K257 PolarHBondContact O-N 2.68Å; K257-A259 VanDerWaalsContact C-N 3.26Å; K257-A259 PolarHBondContact O-N 3.37Å; K257-Y260 PolarHBondContact O-N 3.2Å
258	V	87.4	Confident	85.3	Confident	36 Å²	36	47.7 Å²	47.7	22%	0.218	23%	0.232	C	C	.	.	H	α-helix	trans	-63.8	-36	175.6	175.3	0	0	0	0	110.5	C247 S254 A255 Y260 I261 S262 V413 V414	C247-V258 HydrophobicContact CB-CG1 4.49Å; C247-V258 HydrophobicContact CB-CG2 4.41Å; S254-V258 WeakPolarHBondContact O-CG2 3.48Å; S254-V258 PolarHBondContact O-N 2.82Å; A255-V258 PolarHBondContact O-N 3.45Å; V258-Y260 PolarHBondContact O-N 3.47Å; V258-I261 PolarHBondContact O-N 3.24Å; V258-S262 PolarHBondContact O-N 2.73Å; V258-S262 PolarHBondContact O-OG 3.28Å; V258-V413 HydrophobicContact CG1-CG1 3.7Å; V258-V414 HydrophobicContact CG1-CG2 4.05Å
259	A	87	Confident	85.9	Confident	0 Å²	0	48 Å²	48	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-55.6	-33.3	177.1	0	0	0	0	0	113.7	L50 S51 A255 G256 K257 I261 S262 T263 V414	L50-A259 HydrophobicContact CB-CB 4.47Å; L50-A259 WeakPolarHBondContact CD2-O 3.43Å; L50-A259 HydrophobicContact CG-CB 4.41Å; L50-A259 WeakPolarHBondContact CG-O 3.27Å; S51-A259 WeakPolarHBondContact OG-CB 3.43Å; A255-A259 WeakPolarHBondContact O-CB 3.08Å; A255-A259 PolarHBondContact O-N 3.13Å; G256-A259 WeakPolarHBondContact O-CB 3.43Å; K257-A259 VanDerWaalsContact C-N 3.26Å; K257-A259 PolarHBondContact O-N 3.37Å; A259-I261 VanDerWaalsContact C-N 3.29Å; A259-I261 PolarHBondContact O-N 3.25Å; A259-S262 VanDerWaalsContact CA-OG 3.32Å; A259-S262 WeakPolarHBondContact CA-OG 3.43Å; A259-T263 VanDerWaalsContact O-CB 3.26Å; A259-T263 WeakPolarHBondContact O-CB 3.46Å; A259-T263 PolarHBondContact O-N 3.31Å; A259-T263 PolarHBondContact O-OG1 3.35Å; A259-V414 HydrophobicContact CB-CG1 4.47Å; A259-V414 HydrophobicContact CB-CG2 4.38Å
260	Y	89.5	Confident	86.6	Confident	84 Å²	84	44.8 Å²	44.8	33%	0.329	22%	0.219	S	C	.	.	H	α-helix	trans	-56.1	-44.7	172.2	-76.9	-71.5	0	0	0	112.9	T46 E47 L50 G256 K257 V258 I264	T46-Y260 PolarHBondContact OG1-OH 2.86Å; E47-Y260 HydrophobicContact CG-CD2 4.32Å; E47-Y260 HydrophobicContact CG-CE2 3.4Å; L50-Y260 HydrophobicContact CD2-CD1 3.45Å; L50-Y260 VanDerWaalsContact CD2-CD1 3.45Å; L50-Y260 HydrophobicContact CD2-CE1 3.97Å; L50-Y260 HydrophobicContact CD2-CG 3.93Å; G256-Y260 WeakPolarHBondContact O-CD2 3.35Å; K257-Y260 PolarHBondContact O-N 3.2Å; V258-Y260 PolarHBondContact O-N 3.47Å; Y260-I264 HydrophobicContact CD1-CD1 4.31Å; Y260-I264 VanDerWaalsContact O-CB 3.24Å; Y260-I264 WeakPolarHBondContact O-CB 3.46Å; Y260-I264 WeakPolarHBondContact O-CD1 3.2Å; Y260-I264 VanDerWaalsContact O-CG1 3.23Å; Y260-I264 WeakPolarHBondContact O-CG1 3.33Å
261	I	90.2	Very high	87.4	Confident	100 Å²	100	45 Å²	45	51%	0.513	22%	0.22	S	C	.	.	H	α-helix	trans	-80.6	-50.6	-178	-60.1	177.3	0	0	0	109.3	V258 A259 T263 V265 M410	V258-I261 PolarHBondContact O-N 3.24Å; A259-I261 VanDerWaalsContact C-N 3.29Å; A259-I261 PolarHBondContact O-N 3.25Å; I261-T263 VanDerWaalsContact C-N 3.28Å; I261-T263 PolarHBondContact O-N 2.93Å; I261-V265 HydrophobicContact CG2-CG2 3.9Å; I261-V265 WeakPolarHBondContact O-CB 3.44Å; I261-V265 VanDerWaalsContact O-CG2 3.3Å; I261-V265 WeakPolarHBondContact O-CG2 2.93Å; I261-V265 PolarHBondContact O-N 3.02Å; I261-M410 HydrophobicContact CG2-CE 4.01Å; I261-M410 HydrophobicContact CG2-SD 4.49Å
262	S	88.4	Confident	88.3	Confident	7 Å²	7	46.3 Å²	46.3	5%	0.049	23%	0.23	C	C	.	.	H	α-helix	trans	-68.5	-22.8	-171.1	66.6	0	0	0	0	114.3	V258 A259 P266 M410 V414	V258-S262 PolarHBondContact O-N 2.73Å; V258-S262 PolarHBondContact O-OG 3.28Å; A259-S262 VanDerWaalsContact CA-OG 3.32Å; A259-S262 WeakPolarHBondContact CA-OG 3.43Å; S262-P266 WeakPolarHBondContact O-CD 3.42Å; S262-P266 WeakPolarHBondContact O-CG 3.47Å; S262-M410 WeakPolarHBondContact CB-O 3.38Å; S262-V414 WeakPolarHBondContact OG-CG2 3.03Å
263	T	89	Confident	89.2	Confident	4 Å²	4	46 Å²	46	3%	0.025	23%	0.228	C	C	.	.	H	α-helix	trans	-97.3	-38.5	179.4	-53.2	0	0	0	0	111.5	L50 V53 G54 A259 I261 Q267	L50-T263 HydrophobicContact CD1-CG2 3.45Å; L50-T263 VanDerWaalsContact CD1-CG2 3.45Å; L50-T263 HydrophobicContact CG-CG2 4.14Å; L50-T263 PolarHBondContact O-OG1 3.2Å; L50-T263 VanDerWaalsContact O-OG1 3.07Å; V53-T263 HydrophobicContact CB-CG2 4.08Å; V53-T263 HydrophobicContact CG1-CG2 3.5Å; G54-T263 VanDerWaalsContact CA-OG1 3.29Å; G54-T263 WeakPolarHBondContact CA-OG1 3.47Å; A259-T263 VanDerWaalsContact O-CB 3.26Å; A259-T263 WeakPolarHBondContact O-CB 3.46Å; A259-T263 PolarHBondContact O-N 3.31Å; A259-T263 PolarHBondContact O-OG1 3.35Å; I261-T263 VanDerWaalsContact C-N 3.28Å; I261-T263 PolarHBondContact O-N 2.93Å; T263-Q267 WeakPolarHBondContact O-CG 3.32Å
264	I	91.6	Very high	90.1	Very high	79 Å²	79	40.8 Å²	40.8	41%	0.405	21%	0.21	S	C	.	.	H	α-helix	trans	-78.9	-45.1	-176.8	-59.8	175.8	0	0	0	111.4	L50 Y260 Q267 I268	L50-I264 HydrophobicContact CD1-CG1 4.33Å; L50-I264 HydrophobicContact CD2-CD1 4.1Å; L50-I264 HydrophobicContact CD2-CG1 4.19Å; Y260-I264 HydrophobicContact CD1-CD1 4.31Å; Y260-I264 VanDerWaalsContact O-CB 3.24Å; Y260-I264 WeakPolarHBondContact O-CB 3.46Å; Y260-I264 WeakPolarHBondContact O-CD1 3.2Å; Y260-I264 VanDerWaalsContact O-CG1 3.23Å; Y260-I264 WeakPolarHBondContact O-CG1 3.33Å; I264-Q267 PolarHBondContact O-N 2.89Å; I264-I268 HydrophobicContact CG2-CD1 3.82Å; I264-I268 HydrophobicContact CG2-CG1 4.35Å; I264-I268 WeakPolarHBondContact O-CG1 3.35Å; I264-I268 PolarHBondContact O-N 2.68Å; I264-I268 VanDerWaalsContact O-N 3.13Å
265	V	92.8	Very high	90.7	Very high	44 Å²	44	43.5 Å²	43.5	27%	0.267	23%	0.225	S	C	.	.	H	α-helix	trans	-61.8	-43.7	-175.2	174.4	0	0	0	0	111.8	I261 Q267 I268 I269 M410	I261-V265 HydrophobicContact CG2-CG2 3.9Å; I261-V265 WeakPolarHBondContact O-CB 3.44Å; I261-V265 VanDerWaalsContact O-CG2 3.3Å; I261-V265 WeakPolarHBondContact O-CG2 2.93Å; I261-V265 PolarHBondContact O-N 3.02Å; V265-Q267 VanDerWaalsContact C-N 3.29Å; V265-Q267 PolarHBondContact O-N 3.31Å; V265-I268 PolarHBondContact O-N 3.01Å; V265-I268 VanDerWaalsContact O-N 3.16Å; V265-I269 HydrophobicContact CG1-CD1 3.66Å; V265-I269 HydrophobicContact CG1-CG1 4.21Å; V265-I269 WeakPolarHBondContact O-CG1 3.13Å; V265-I269 PolarHBondContact O-N 3.16Å; V265-M410 HydrophobicContact CB-SD 3.78Å; V265-M410 HydrophobicContact CG1-CE 4.13Å; V265-M410 HydrophobicContact CG1-SD 3.61Å
266	P	92.3	Very high	91.4	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-56.3	-39.7	174.5	-35.6	43.9	0	0	0	114.8	F57 S262 I269 L270 M407 M410 I411	F57-P266 HydrophobicContact CE1-CB 4.2Å; S262-P266 WeakPolarHBondContact O-CD 3.42Å; S262-P266 WeakPolarHBondContact O-CG 3.47Å; P266-I269 PolarHBondContact O-N 3.17Å; P266-L270 WeakPolarHBondContact O-CG 3.29Å; P266-L270 PolarHBondContact O-N 2.88Å; P266-M407 HydrophobicContact CB-CG 3.65Å; P266-M407 HydrophobicContact CG-CG 4.24Å; P266-M410 HydrophobicContact CG-CB 3.83Å; P266-I411 HydrophobicContact CB-CD1 4.39Å; P266-I411 HydrophobicContact CB-CG1 4.04Å; P266-I411 HydrophobicContact CG-CG1 4.06Å
267	Q	90.9	Very high	92	Very high	24 Å²	24	44.8 Å²	44.8	11%	0.112	23%	0.228	C	C	.	.	H	α-helix	trans	-68.4	-37.2	178.9	-60	-57.5	-32.4	0	0	111.8	T263 I264 V265 L271 F349	T263-Q267 WeakPolarHBondContact O-CG 3.32Å; I264-Q267 PolarHBondContact O-N 2.89Å; V265-Q267 VanDerWaalsContact C-N 3.29Å; V265-Q267 PolarHBondContact O-N 3.31Å; Q267-L271 WeakPolarHBondContact O-CB 3.32Å; Q267-L271 PolarHBondContact O-N 3.46Å; Q267-F349 VanDerWaalsContact CD-CD1 3.44Å; Q267-F349 HydrophobicContact CG-CD1 4.14Å; Q267-F349 HydrophobicContact CG-CE1 3.76Å; Q267-F349 HydrophobicContact CG-CZ 4.26Å; Q267-F349 VanDerWaalsContact OE1-CD1 3.27Å
268	I	94.6	Very high	92.4	Very high	95 Å²	95	41.4 Å²	41.4	49%	0.487	22%	0.216	S	C	.	.	H	α-helix	trans	-63.9	-44.2	173.1	-64.7	171.9	0	0	0	110.4	I264 V265 L271 V272	I264-I268 HydrophobicContact CG2-CD1 3.82Å; I264-I268 HydrophobicContact CG2-CG1 4.35Å; I264-I268 WeakPolarHBondContact O-CG1 3.35Å; I264-I268 PolarHBondContact O-N 2.68Å; I264-I268 VanDerWaalsContact O-N 3.13Å; V265-I268 PolarHBondContact O-N 3.01Å; V265-I268 VanDerWaalsContact O-N 3.16Å; I268-L271 WeakPolarHBondContact O-CB 3.37Å; I268-L271 PolarHBondContact O-N 3.07Å; I268-V272 WeakPolarHBondContact O-CG2 3.39Å; I268-V272 PolarHBondContact O-N 3.19Å
269	I	94.4	Very high	92.6	Very high	16 Å²	16	44.5 Å²	44.5	8%	0.082	24%	0.235	C	C	.	.	H	α-helix	trans	-62.4	-47.9	178.7	-67.9	169.4	0	0	0	110.1	V265 P266 L271 V272 F273 M403 M407	V265-I269 HydrophobicContact CG1-CD1 3.66Å; V265-I269 HydrophobicContact CG1-CG1 4.21Å; V265-I269 WeakPolarHBondContact O-CG1 3.13Å; V265-I269 PolarHBondContact O-N 3.16Å; P266-I269 PolarHBondContact O-N 3.17Å; I269-L271 VanDerWaalsContact C-N 3.26Å; I269-L271 PolarHBondContact O-N 3.17Å; I269-V272 PolarHBondContact O-N 2.87Å; I269-V272 VanDerWaalsContact O-N 3.14Å; I269-F273 HydrophobicContact CG2-CD2 3.64Å; I269-F273 HydrophobicContact CG2-CE2 3.78Å; I269-F273 WeakPolarHBondContact O-CD2 3.29Å; I269-F273 PolarHBondContact O-N 3.35Å; I269-M403 HydrophobicContact CG2-CB 4.12Å; I269-M407 HydrophobicContact CB-CB 4.29Å; I269-M407 HydrophobicContact CB-SD 4.45Å; I269-M407 HydrophobicContact CD1-CB 3.94Å; I269-M407 HydrophobicContact CG2-CB 3.99Å; I269-M407 HydrophobicContact CG2-CG 4.41Å; I269-M407 HydrophobicContact CG2-SD 4.07Å
270	L	93.4	Very high	92.9	Very high	6 Å²	6	46 Å²	46	3%	0.031	24%	0.244	C	C	.	.	H	α-helix	trans	-56.3	-39.5	174.9	-74.8	176.2	0	0	0	112.3	F57 P266 F273 F274 F352 V353 V356 M407	F57-L270 HydrophobicContact CE1-CD1 4.42Å; F57-L270 HydrophobicContact CZ-CD1 3.85Å; P266-L270 WeakPolarHBondContact O-CG 3.29Å; P266-L270 PolarHBondContact O-N 2.88Å; L270-F273 PolarHBondContact O-N 3.36Å; L270-F274 VanDerWaalsContact O-CB 3.3Å; L270-F274 WeakPolarHBondContact O-CB 3.49Å; L270-F274 PolarHBondContact O-N 3.11Å; L270-F352 HydrophobicContact CB-CD1 4.37Å; L270-F352 HydrophobicContact CB-CE1 3.7Å; L270-V353 HydrophobicContact CD1-CG2 4.1Å; L270-V356 HydrophobicContact CB-CG2 4.4Å; L270-V356 HydrophobicContact CD2-CG1 4.19Å; L270-M407 HydrophobicContact CD1-SD 4.45Å; L270-M407 HydrophobicContact CD2-CE 4.1Å; L270-M407 HydrophobicContact CD2-SD 3.54Å; L270-M407 VanDerWaalsContact CD2-SD 3.54Å; L270-M407 HydrophobicContact CG-SD 3.59Å; L270-M407 VanDerWaalsContact CG-SD 3.59Å
271	L	95.2	Very high	93	Very high	89 Å²	89	47.7 Å²	47.7	47%	0.466	26%	0.259	S	S	.	.	H	α-helix	trans	-64.5	-44.4	175.6	-178.6	65.7	0	0	0	113	Q267 I268 I269 F273 F274 V275 F352	Q267-L271 WeakPolarHBondContact O-CB 3.32Å; Q267-L271 PolarHBondContact O-N 3.46Å; I268-L271 WeakPolarHBondContact O-CB 3.37Å; I268-L271 PolarHBondContact O-N 3.07Å; I269-L271 VanDerWaalsContact C-N 3.26Å; I269-L271 PolarHBondContact O-N 3.17Å; L271-F273 VanDerWaalsContact C-N 3.32Å; L271-F273 PolarHBondContact O-N 3.23Å; L271-F274 PolarHBondContact O-N 3.19Å; L271-V275 HydrophobicContact CD1-CG2 4.49Å; L271-V275 WeakPolarHBondContact O-CG2 3.32Å; L271-V275 PolarHBondContact O-N 3.28Å; L271-F352 HydrophobicContact CB-CE1 4.48Å; L271-F352 HydrophobicContact CB-CZ 4.04Å; L271-F352 HydrophobicContact CD1-CE2 4.44Å; L271-F352 HydrophobicContact CD1-CZ 3.99Å
272	V	95	Very high	93.1	Very high	65 Å²	65	43.7 Å²	43.7	39%	0.394	24%	0.242	S	C	.	.	H	α-helix	trans	-63	-41.9	176	174.8	0	0	0	0	110.6	I268 I269 K276 W400	I268-V272 WeakPolarHBondContact O-CG2 3.39Å; I268-V272 PolarHBondContact O-N 3.19Å; I269-V272 PolarHBondContact O-N 2.87Å; I269-V272 VanDerWaalsContact O-N 3.14Å; V272-K276 WeakPolarHBondContact O-CB 3.22Å; V272-K276 PolarHBondContact O-N 2.71Å; V272-W400 HydrophobicContact CG1-CH2 4.22Å; V272-W400 HydrophobicContact CG1-CZ3 3.89Å
273	F	93.4	Very high	93.3	Very high	3 Å²	3	43.4 Å²	43.4	1%	0.013	24%	0.24	C	C	.	.	H	α-helix	trans	-61.7	-44.9	174.2	-95.7	-82.9	0	0	0	112.8	I269 L270 L271 K276 C277 I391 F394 W400 M403	I269-F273 HydrophobicContact CG2-CD2 3.64Å; I269-F273 HydrophobicContact CG2-CE2 3.78Å; I269-F273 WeakPolarHBondContact O-CD2 3.29Å; I269-F273 PolarHBondContact O-N 3.35Å; L270-F273 PolarHBondContact O-N 3.36Å; L271-F273 VanDerWaalsContact C-N 3.32Å; L271-F273 PolarHBondContact O-N 3.23Å; F273-K276 WeakPolarHBondContact O-CB 3.48Å; F273-K276 PolarHBondContact O-N 2.88Å; F273-C277 PolarHBondContact O-N 3.36Å; F273-C277 PolarHBondContact O-SG 3.01Å; F273-I391 HydrophobicContact CE1-CD1 4.02Å; F273-I391 HydrophobicContact CE1-CG1 3.79Å; F273-I391 HydrophobicContact CZ-CD1 4.09Å; F273-I391 HydrophobicContact CZ-CG1 4.23Å; F273-F394 HydrophobicContact CD1-CE2 4.34Å; F273-F394 HydrophobicContact CE1-CE2 4.21Å; F273-W400 HydrophobicContact CD1-CE3 4.31Å; F273-W400 HydrophobicContact CE1-CB 4.31Å; F273-W400 AromaticContact CE1-CE3 3.98Å; F273-W400 HydrophobicContact CE1-CE3 3.98Å; F273-W400 HydrophobicContact CE2-CE3 4.25Å; F273-W400 HydrophobicContact CZ-CB 3.98Å; F273-W400 AromaticContact CZ-CE3 3.95Å; F273-W400 HydrophobicContact CZ-CE3 3.95Å; F273-W400 VanDerWaalsContact CZ-O 3.29Å; F273-W400 WeakPolarHBondContact CZ-O 3.45Å; F273-M403 HydrophobicContact CE2-CB 4.22Å
274	F	95.4	Very high	93.5	Very high	31 Å²	31	50.5 Å²	50.5	14%	0.136	27%	0.268	C	S	.	.	H	α-helix	trans	-61.1	-50.4	178.8	-177.6	-123	0	0	0	111.5	L270 L271 K276 C277 L278 V287 F352 L355 V356	L270-F274 VanDerWaalsContact O-CB 3.3Å; L270-F274 WeakPolarHBondContact O-CB 3.49Å; L270-F274 PolarHBondContact O-N 3.11Å; L271-F274 PolarHBondContact O-N 3.19Å; F274-K276 VanDerWaalsContact C-N 3.27Å; F274-K276 PolarHBondContact O-N 3.48Å; F274-C277 PolarHBondContact O-N 3.32Å; F274-L278 HydrophobicContact CD1-CD1 4.08Å; F274-L278 HydrophobicContact CD2-CG 4.46Å; F274-L278 HydrophobicContact CE1-CD1 3.66Å; F274-L278 HydrophobicContact CE1-CG 4.49Å; F274-L278 HydrophobicContact CE2-CD1 4.2Å; F274-L278 HydrophobicContact CE2-CD2 4.24Å; F274-L278 HydrophobicContact CE2-CG 4.2Å; F274-L278 HydrophobicContact CZ-CD1 3.72Å; F274-L278 HydrophobicContact CZ-CD2 4.32Å; F274-L278 HydrophobicContact CZ-CG 4.22Å; F274-L278 WeakPolarHBondContact O-CG 3.25Å; F274-L278 PolarHBondContact O-N 3.17Å; F274-V287 HydrophobicContact CE2-CG2 3.92Å; F274-V287 HydrophobicContact CZ-CG2 4.39Å; F274-F352 HydrophobicContact CB-CE2 4.48Å; F274-F352 HydrophobicContact CB-CZ 4.39Å; F274-F352 HydrophobicContact CD1-CE2 4.03Å; F274-F352 HydrophobicContact CG-CE2 4.3Å; F274-L355 HydrophobicContact CE2-CB 4.02Å; F274-L355 HydrophobicContact CZ-CB 4.29Å; F274-V356 HydrophobicContact CB-CG2 3.82Å; F274-V356 HydrophobicContact CD2-CG2 4.12Å; F274-V356 HydrophobicContact CG-CG2 4.18Å
275	V	95.7	Very high	93.6	Very high	80 Å²	80	51.2 Å²	51.2	49%	0.485	27%	0.269	S	S	.	.	H	α-helix	trans	-58.5	-42.6	176.5	174.3	0	0	0	0	110.4	L271 L278 T279	L271-V275 HydrophobicContact CD1-CG2 4.49Å; L271-V275 WeakPolarHBondContact O-CG2 3.32Å; L271-V275 PolarHBondContact O-N 3.28Å; V275-L278 PolarHBondContact O-N 2.65Å; V275-T279 WeakPolarHBondContact O-CG2 3.49Å; V275-T279 PolarHBondContact O-N 3.41Å
276	K	94.5	Very high	93.6	Very high	41 Å²	41	49.1 Å²	49.1	18%	0.178	26%	0.257	C	S	.	.	H	α-helix	trans	-59.6	-48.8	176.1	176.6	57.8	-173.9	161.3	0	111.7	V272 F273 F274 L278 T279 V280 F394 W400	V272-K276 WeakPolarHBondContact O-CB 3.22Å; V272-K276 PolarHBondContact O-N 2.71Å; F273-K276 WeakPolarHBondContact O-CB 3.48Å; F273-K276 PolarHBondContact O-N 2.88Å; F274-K276 VanDerWaalsContact C-N 3.27Å; F274-K276 PolarHBondContact O-N 3.48Å; K276-L278 VanDerWaalsContact C-N 3.29Å; K276-L278 PolarHBondContact O-N 3.37Å; K276-T279 PolarHBondContact O-N 2.83Å; K276-T279 VanDerWaalsContact O-N 3.08Å; K276-T279 PolarHBondContact O-OG1 3.5Å; K276-V280 HydrophobicContact CD-CG2 4.49Å; K276-F394 HydrophobicContact CG-CD2 4.37Å; K276-F394 HydrophobicContact CG-CE1 4.31Å; K276-F394 HydrophobicContact CG-CE2 4.14Å; K276-F394 HydrophobicContact CG-CZ 4.12Å; K276-W400 HydrophobicContact CB-CH2 3.52Å; K276-W400 HydrophobicContact CB-CZ2 4.31Å; K276-W400 HydrophobicContact CB-CZ3 3.67Å; K276-W400 HydrophobicContact CD-CH2 3.86Å; K276-W400 HydrophobicContact CD-CZ2 3.8Å; K276-W400 HydrophobicContact CG-CE3 4.41Å; K276-W400 HydrophobicContact CG-CH2 3.51Å; K276-W400 HydrophobicContact CG-CZ2 3.8Å; K276-W400 HydrophobicContact CG-CZ3 3.82Å
277	C	93.9	Very high	93.7	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-60.7	-39.4	180	-64.4	0	0	0	0	111.7	F273 F274 T279 V280 G283 S359 V360	F273-C277 PolarHBondContact O-N 3.36Å; F273-C277 PolarHBondContact O-SG 3.01Å; F274-C277 PolarHBondContact O-N 3.32Å; C277-T279 PolarHBondContact O-N 3.3Å; C277-V280 PolarHBondContact O-N 3.31Å; C277-V280 VanDerWaalsContact O-N 3.15Å; C277-G283 WeakPolarHBondContact O-CA 3.39Å; C277-S359 WeakPolarHBondContact CB-OG 3.5Å; C277-V360 WeakPolarHBondContact SG-CG2 3.43Å
278	L	95	Very high	93.8	Very high	65 Å²	65	55.2 Å²	55.2	34%	0.34	28%	0.28	S	S	.	.	H	α-helix	trans	-64.5	-24.9	176.7	-68.4	-179.8	0	0	0	114.1	F274 V275 K276 V280 V287	F274-L278 HydrophobicContact CD1-CD1 4.08Å; F274-L278 HydrophobicContact CD2-CG 4.46Å; F274-L278 HydrophobicContact CE1-CD1 3.66Å; F274-L278 HydrophobicContact CE1-CG 4.49Å; F274-L278 HydrophobicContact CE2-CD1 4.2Å; F274-L278 HydrophobicContact CE2-CD2 4.24Å; F274-L278 HydrophobicContact CE2-CG 4.2Å; F274-L278 HydrophobicContact CZ-CD1 3.72Å; F274-L278 HydrophobicContact CZ-CD2 4.32Å; F274-L278 HydrophobicContact CZ-CG 4.22Å; F274-L278 WeakPolarHBondContact O-CG 3.25Å; F274-L278 PolarHBondContact O-N 3.17Å; V275-L278 PolarHBondContact O-N 2.65Å; K276-L278 VanDerWaalsContact C-N 3.29Å; K276-L278 PolarHBondContact O-N 3.37Å; L278-V280 VanDerWaalsContact C-N 3.34Å; L278-V287 HydrophobicContact CD2-CG2 3.88Å
279	T	93.3	Very high	93.6	Very high	101 Å²	101	52.7 Å²	52.7	62%	0.62	27%	0.271	S	S	*	.	H	α-helix	trans	-81.2	-12.4	176.4	63.1	0	0	0	0	114	V275 K276 C277	V275-T279 WeakPolarHBondContact O-CG2 3.49Å; V275-T279 PolarHBondContact O-N 3.41Å; K276-T279 PolarHBondContact O-N 2.83Å; K276-T279 VanDerWaalsContact O-N 3.08Å; K276-T279 PolarHBondContact O-OG1 3.5Å; C277-T279 PolarHBondContact O-N 3.3Å
280	V	92.1	Very high	93.5	Very high	31 Å²	31	51.9 Å²	51.9	19%	0.188	27%	0.267	C	S	.	.	S	Bend	trans	-102.2	151.6	-177.9	-169.1	0	0	0	0	110	K276 C277 L278 G283 F363 F394	K276-V280 HydrophobicContact CD-CG2 4.49Å; C277-V280 PolarHBondContact O-N 3.31Å; C277-V280 VanDerWaalsContact O-N 3.15Å; L278-V280 VanDerWaalsContact C-N 3.34Å; V280-G283 PolarHBondContact O-N 3.26Å; V280-F363 HydrophobicContact CB-CD2 3.96Å; V280-F363 HydrophobicContact CB-CE2 4.23Å; V280-F363 HydrophobicContact CG1-CD2 3.34Å; V280-F363 HydrophobicContact CG1-CE2 3.27Å; V280-F363 HydrophobicContact CG1-CG 4.41Å; V280-F363 HydrophobicContact CG1-CZ 4.3Å; V280-F394 HydrophobicContact CG2-CE1 4.25Å
281	N	91.8	Very high	93.5	Very high	121 Å²	121	57.4 Å²	57.4	65%	0.647	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.4	139.8	178.4	-64.4	-30	0	0	0	110.9	G283	N281-G283 PolarHBondContact O-N 2.93Å
282	G	91.8	Very high	93.2	Very high	16 Å²	16	58.6 Å²	58.6	17%	0.165	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	81.5	-23.3	-177.9	0	0	0	0	0	115.5	Y284 E285 G286 G362	G282-Y284 PolarHBondContact O-N 3.2Å; G282-E285 PolarHBondContact O-N 2.93Å; G282-E285 VanDerWaalsContact O-N 3.14Å; G282-G286 PolarHBondContact O-N 3.17Å; G282-G362 VanDerWaalsContact C-C 3.49Å; G282-G362 CarbonylContact C-O 3.59Å; G282-G362 CarbonylContact O-C 3.55Å
283	G	92.9	Very high	92.7	Very high	0 Å²	0	58 Å²	58	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-62.4	-42.6	-177.6	0	0	0	0	0	113.7	C277 V280 N281 G286 V287 S359	C277-G283 WeakPolarHBondContact O-CA 3.39Å; V280-G283 PolarHBondContact O-N 3.26Å; N281-G283 PolarHBondContact O-N 2.93Å; G283-G286 PolarHBondContact O-N 3.41Å; G283-V287 PolarHBondContact O-N 2.91Å; G283-S359 WeakPolarHBondContact CA-O 3.28Å
284	Y	94.2	Very high	92.4	Very high	154 Å²	154	61.3 Å²	61.3	60%	0.604	31%	0.311	S	S	*	.	H	α-helix	trans	-67.8	-35.3	173.8	-178.2	-100.4	0	0	0	112.8	G282 G286 V287 R288	G282-Y284 PolarHBondContact O-N 3.2Å; Y284-G286 VanDerWaalsContact C-N 3.29Å; Y284-G286 PolarHBondContact O-N 2.95Å; Y284-V287 PolarHBondContact O-N 3.03Å; Y284-R288 WeakPolarHBondContact O-CB 3.3Å; Y284-R288 PolarHBondContact O-N 3.44Å
285	E	92.7	Very high	92.1	Very high	94 Å²	94	67.9 Å²	67.9	44%	0.439	34%	0.335	S	S	.	.	H	α-helix	trans	-67.7	-31.3	177.1	-65.8	-59.2	153.2	0	0	111.9	G282 R288 S289	G282-E285 PolarHBondContact O-N 2.93Å; G282-E285 VanDerWaalsContact O-N 3.14Å; E285-R288 PolarHBondContact O-N 3.05Å; E285-R288 IonicContact OE1-NH1 2.63Å; E285-R288 WeakPolarHBondContact OE2-CD 3.25Å; E285-R288 IonicContact OE2-NH1 3.38Å; E285-R288 PolarHBondContact OE2-NH1 3.02Å; E285-S289 WeakPolarHBondContact O-CB 3.37Å; E285-S289 PolarHBondContact O-N 3.39Å; E285-S289 PolarHBondContact O-OG 2.96Å
286	G	92.9	Very high	91.8	Very high	0 Å²	0	71.7 Å²	71.7	0%	0	35%	0.345	C	S	.	.	H	α-helix	trans	-61.2	-47.4	169.3	0	0	0	0	0	112.5	G282 G283 Y284 R288 S289 F290 Y358	G282-G286 PolarHBondContact O-N 3.17Å; G283-G286 PolarHBondContact O-N 3.41Å; Y284-G286 VanDerWaalsContact C-N 3.29Å; Y284-G286 PolarHBondContact O-N 2.95Å; G286-R288 VanDerWaalsContact C-N 3.33Å; G286-R288 PolarHBondContact O-N 3.33Å; G286-S289 WeakPolarHBondContact O-CB 3.33Å; G286-S289 PolarHBondContact O-N 3.38Å; G286-F290 PolarHBondContact O-N 3.32Å; G286-F290 VanDerWaalsContact O-N 3.12Å; G286-Y358 VanDerWaalsContact CA-O 3.3Å; G286-Y358 WeakPolarHBondContact CA-O 3.3Å
287	V	94.2	Very high	91.5	Very high	16 Å²	16	73.7 Å²	73.7	10%	0.097	35%	0.352	C	S	.	.	H	α-helix	trans	-63.9	-39.1	174.6	177.1	0	0	0	0	111.5	F274 L278 G283 Y284 S289 F290 F291 L355	F274-V287 HydrophobicContact CE2-CG2 3.92Å; F274-V287 HydrophobicContact CZ-CG2 4.39Å; L278-V287 HydrophobicContact CD2-CG2 3.88Å; G283-V287 PolarHBondContact O-N 2.91Å; Y284-V287 PolarHBondContact O-N 3.03Å; V287-S289 VanDerWaalsContact C-N 3.29Å; V287-S289 PolarHBondContact O-N 3.05Å; V287-F290 VanDerWaalsContact O-CB 3.29Å; V287-F290 WeakPolarHBondContact O-CB 3.03Å; V287-F290 PolarHBondContact O-N 3.06Å; V287-F291 HydrophobicContact CG1-CD2 4.28Å; V287-F291 HydrophobicContact CG1-CE2 3.92Å; V287-F291 VanDerWaalsContact O-CD2 3.27Å; V287-F291 WeakPolarHBondContact O-CD2 3.36Å; V287-F291 PolarHBondContact O-N 3.25Å; V287-L355 HydrophobicContact CG1-CD2 4.2Å
288	R	93.7	Very high	91.3	Very high	136 Å²	136	75.2 Å²	75.2	51%	0.513	36%	0.36	S	S	.	.	H	α-helix	trans	-60.8	-42.4	174.7	-172.4	-173	-177.8	-179.7	-0.6	111	Y284 E285 G286 F290 F291 L292	Y284-R288 WeakPolarHBondContact O-CB 3.3Å; Y284-R288 PolarHBondContact O-N 3.44Å; E285-R288 PolarHBondContact O-N 3.05Å; E285-R288 IonicContact OE1-NH1 2.63Å; E285-R288 WeakPolarHBondContact OE2-CD 3.25Å; E285-R288 IonicContact OE2-NH1 3.38Å; E285-R288 PolarHBondContact OE2-NH1 3.02Å; G286-R288 VanDerWaalsContact C-N 3.33Å; G286-R288 PolarHBondContact O-N 3.33Å; R288-F290 VanDerWaalsContact C-N 3.26Å; R288-F290 PolarHBondContact O-N 3.34Å; R288-F291 PolarHBondContact O-N 3.23Å; R288-L292 PolarHBondContact O-N 3.17Å
289	S	90.9	Very high	91.1	Very high	41 Å²	41	83 Å²	83	29%	0.287	38%	0.384	S	S	.	.	H	α-helix	trans	-62.3	-32.2	177.7	-59.3	0	0	0	0	112.4	E285 G286 V287 F291 L292	E285-S289 WeakPolarHBondContact O-CB 3.37Å; E285-S289 PolarHBondContact O-N 3.39Å; E285-S289 PolarHBondContact O-OG 2.96Å; G286-S289 WeakPolarHBondContact O-CB 3.33Å; G286-S289 PolarHBondContact O-N 3.38Å; V287-S289 VanDerWaalsContact C-N 3.29Å; V287-S289 PolarHBondContact O-N 3.05Å; S289-F291 VanDerWaalsContact C-N 3.28Å; S289-F291 PolarHBondContact O-N 2.79Å; S289-L292 PolarHBondContact O-N 2.66Å
290	F	92.4	Very high	91	Very high	0 Å²	0	80.1 Å²	80.1	0%	0	37%	0.366	C	S	.	.	H	α-helix	trans	-59.9	-37.1	171.4	-178.8	-108.6	0	0	0	112.7	A69 G74 A75 F78 G286 V287 R288 L351 C354 L355 Y358	A69-F290 HydrophobicContact CB-CE2 4.31Å; G74-F290 CarbonylContact C-O 3.44Å; G74-F290 WeakPolarHBondContact CA-O 3.26Å; A75-F290 HydrophobicContact CB-CD1 3.98Å; A75-F290 HydrophobicContact CB-CE1 3.59Å; A75-F290 HydrophobicContact CB-CE2 4.43Å; A75-F290 HydrophobicContact CB-CZ 3.85Å; A75-F290 WeakPolarHBondContact CB-O 3.29Å; A75-F290 PolarHBondContact N-O 2.96Å; F78-F290 HydrophobicContact CD2-CE2 4.37Å; F78-F290 AromaticContact CD2-CZ 3.89Å; F78-F290 HydrophobicContact CD2-CZ 3.89Å; F78-F290 AromaticContact CE2-CE2 3.88Å; F78-F290 HydrophobicContact CE2-CE2 3.88Å; F78-F290 AromaticContact CE2-CZ 3.62Å; F78-F290 HydrophobicContact CE2-CZ 3.62Å; G286-F290 PolarHBondContact O-N 3.32Å; G286-F290 VanDerWaalsContact O-N 3.12Å; V287-F290 VanDerWaalsContact O-CB 3.29Å; V287-F290 WeakPolarHBondContact O-CB 3.03Å; V287-F290 PolarHBondContact O-N 3.06Å; R288-F290 VanDerWaalsContact C-N 3.26Å; R288-F290 PolarHBondContact O-N 3.34Å; F290-L351 HydrophobicContact CE1-CD1 3.82Å; F290-L351 HydrophobicContact CZ-CD1 3.71Å; F290-C354 HydrophobicContact CE2-CB 3.87Å; F290-C354 HydrophobicContact CZ-CB 4.24Å; F290-L355 HydrophobicContact CD1-CD2 3.55Å; F290-L355 HydrophobicContact CE1-CD2 3.84Å; F290-L355 HydrophobicContact CG-CD2 4.27Å; F290-Y358 HydrophobicContact CB-CD1 3.45Å; F290-Y358 VanDerWaalsContact CB-CD1 3.45Å; F290-Y358 HydrophobicContact CB-CE1 3.9Å; F290-Y358 HydrophobicContact CB-CG 3.91Å; F290-Y358 AromaticContact CD2-CD1 3.97Å; F290-Y358 HydrophobicContact CD2-CD1 3.97Å; F290-Y358 HydrophobicContact CD2-CD2 4.03Å; F290-Y358 AromaticContact CD2-CE1 3.87Å; F290-Y358 HydrophobicContact CD2-CE1 3.87Å; F290-Y358 AromaticContact CD2-CE2 3.93Å; F290-Y358 HydrophobicContact CD2-CE2 3.93Å; F290-Y358 HydrophobicContact CD2-CG 4.04Å; F290-Y358 AromaticContact CD2-CZ 3.83Å; F290-Y358 HydrophobicContact CG-CD1 4.19Å; F290-Y358 HydrophobicContact CG-CE1 4.4Å; F290-Y358 HydrophobicContact CG-CG 4.37Å
291	F	92.9	Very high	90.9	Very high	122 Å²	122	85.7 Å²	85.7	54%	0.535	38%	0.384	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.3	-0	179.6	-65.7	-71.6	0	0	0	113.9	A75 V287 R288 S289 V293 L355	A75-F291 HydrophobicContact CB-CD1 3.98Å; A75-F291 HydrophobicContact CB-CE1 4.34Å; V287-F291 HydrophobicContact CG1-CD2 4.28Å; V287-F291 HydrophobicContact CG1-CE2 3.92Å; V287-F291 VanDerWaalsContact O-CD2 3.27Å; V287-F291 WeakPolarHBondContact O-CD2 3.36Å; V287-F291 PolarHBondContact O-N 3.25Å; R288-F291 PolarHBondContact O-N 3.23Å; S289-F291 VanDerWaalsContact C-N 3.28Å; S289-F291 PolarHBondContact O-N 2.79Å; F291-V293 PolarHBondContact O-N 3.46Å; F291-V293 VanDerWaalsContact O-N 3.13Å; F291-L355 HydrophobicContact CE2-CD2 4Å; F291-L355 HydrophobicContact CZ-CD2 4.05Å
292	L	87.9	Confident	90.9	Very high	114 Å²	114	85.2 Å²	85.2	60%	0.597	37%	0.373	S	S	*	.			trans	-77	99.9	172	-69.2	-180	0	0	0	109.4	R288 S289	R288-L292 PolarHBondContact O-N 3.17Å; S289-L292 PolarHBondContact O-N 2.66Å
293	V	85.3	Confident	91	Very high	53 Å²	53	84.5 Å²	84.5	32%	0.321	37%	0.366	S	S	.	.			trans	-101.6	128.8	-170.3	167.3	0	0	0	0	111.5	A75 L76 F291 W295	A75-V293 HydrophobicContact CB-CG2 4.49Å; L76-V293 HydrophobicContact CB-CG1 3.89Å; L76-V293 HydrophobicContact CB-CG2 4.22Å; L76-V293 HydrophobicContact CD1-CG1 3.68Å; L76-V293 HydrophobicContact CD2-CG1 3.9Å; L76-V293 HydrophobicContact CG-CG1 4.03Å; F291-V293 PolarHBondContact O-N 3.46Å; F291-V293 VanDerWaalsContact O-N 3.13Å; V293-W295 HydrophobicContact CG1-CD2 4.05Å; V293-W295 HydrophobicContact CG1-CG 4.18Å; V293-W295 HydrophobicContact CG1-CZ2 4.28Å
294	D	86.5	Confident	91	Very high	72 Å²	72	88.2 Å²	88.2	39%	0.385	38%	0.38	S	S	.	.			trans	-107.7	95.2	166.6	-177.6	5.4	0	0	0	111.2	L76 K296 R297	L76-D294 WeakPolarHBondContact CD2-O 3.49Å; D294-K296 PolarHBondContact O-N 3.49Å; D294-K296 VanDerWaalsContact OD1-CB 3.32Å; D294-K296 WeakPolarHBondContact OD1-CB 3.4Å; D294-K296 WeakPolarHBondContact OD1-CG 3.43Å; D294-K296 PolarHBondContact OD1-N 2.95Å; D294-K296 VanDerWaalsContact OD1-N 3.07Å; D294-R297 HydrophobicContact CB-CG 4.34Å; D294-R297 WeakPolarHBondContact O-CB 3.42Å; D294-R297 PolarHBondContact O-N 3.46Å
295	W	89.2	Confident	90.9	Very high	168 Å²	168	81.4 Å²	81.4	64%	0.636	36%	0.356	S	S	*	.	G	3₁₀ helix	trans	-54.7	-20.8	-179.6	-65.2	95.7	0	0	0	114.6	L76 I79 V293 R297 L298	L76-W295 HydrophobicContact CD1-CD2 4.26Å; L76-W295 HydrophobicContact CD1-CE3 3.73Å; L76-W295 HydrophobicContact CD1-CH2 4.42Å; L76-W295 HydrophobicContact CD1-CZ3 3.82Å; I79-W295 HydrophobicContact CD1-CH2 4.14Å; I79-W295 HydrophobicContact CD1-CZ3 3.93Å; V293-W295 HydrophobicContact CG1-CD2 4.05Å; V293-W295 HydrophobicContact CG1-CG 4.18Å; V293-W295 HydrophobicContact CG1-CZ2 4.28Å; W295-R297 PolarHBondContact O-N 3.45Å; W295-L298 HydrophobicContact CE3-CD1 4Å; W295-L298 HydrophobicContact CZ3-CD1 4.2Å; W295-L298 PolarHBondContact O-N 3.41Å
296	K	90.6	Very high	90.9	Very high	160 Å²	160	78.6 Å²	78.6	70%	0.696	34%	0.344	S	S	*	.	G	3₁₀ helix	trans	-64.7	-29.3	177.1	-64.1	176.8	-177.8	173.2	0	111.7	D294 L298 R299	D294-K296 PolarHBondContact O-N 3.49Å; D294-K296 VanDerWaalsContact OD1-CB 3.32Å; D294-K296 WeakPolarHBondContact OD1-CB 3.4Å; D294-K296 WeakPolarHBondContact OD1-CG 3.43Å; D294-K296 PolarHBondContact OD1-N 2.95Å; D294-K296 VanDerWaalsContact OD1-N 3.07Å; K296-L298 VanDerWaalsContact C-N 3.3Å; K296-L298 PolarHBondContact O-N 3.3Å; K296-R299 WeakPolarHBondContact O-CB 2.93Å; K296-R299 PolarHBondContact O-N 2.75Å
297	R	87	Confident	90.9	Very high	84 Å²	84	78.6 Å²	78.6	32%	0.317	34%	0.344	S	S	.	.	G	3₁₀ helix	trans	-62.2	-33.8	180	-66.1	-167.8	-179.3	-176.2	7.6	112.3	S70 T71 Y72 L76 D294 W295 R299 D300 V303	S70-R297 PolarHBondContact O-NH1 2.99Å; S70-R297 VanDerWaalsContact O-NH1 3.16Å; T71-R297 PolarHBondContact O-NH1 3.09Å; Y72-R297 WeakPolarHBondContact O-CD 3.46Å; L76-R297 HydrophobicContact CD2-CB 4.31Å; D294-R297 HydrophobicContact CB-CG 4.34Å; D294-R297 WeakPolarHBondContact O-CB 3.42Å; D294-R297 PolarHBondContact O-N 3.46Å; W295-R297 PolarHBondContact O-N 3.45Å; R297-R299 PolarHBondContact O-N 3.2Å; R297-D300 WeakPolarHBondContact O-CB 3.25Å; R297-D300 PolarHBondContact O-N 3.11Å; R297-V303 WeakPolarHBondContact O-CG2 3.46Å
298	L	89.7	Confident	90.8	Very high	32 Å²	32	78 Å²	78	17%	0.168	34%	0.341	C	S	.	.	G	3₁₀ helix	trans	-60.7	-16.7	177.3	-74.4	-175.4	0	0	0	114.9	L76 P80 W295 K296 D300 V303 W304	L76-L298 HydrophobicContact CD1-CD1 3.53Å; L76-L298 HydrophobicContact CD1-CD2 4.05Å; L76-L298 HydrophobicContact CD1-CG 3.64Å; L76-L298 HydrophobicContact CD2-CD2 4.36Å; L76-L298 HydrophobicContact CD2-CG 3.88Å; L76-L298 HydrophobicContact CG-CD1 4.19Å; L76-L298 HydrophobicContact CG-CD2 3.83Å; L76-L298 HydrophobicContact CG-CG 3.71Å; P80-L298 HydrophobicContact CG-CD2 4.06Å; W295-L298 HydrophobicContact CE3-CD1 4Å; W295-L298 HydrophobicContact CZ3-CD1 4.2Å; W295-L298 PolarHBondContact O-N 3.41Å; K296-L298 VanDerWaalsContact C-N 3.3Å; K296-L298 PolarHBondContact O-N 3.3Å; L298-D300 VanDerWaalsContact C-N 3.29Å; L298-V303 HydrophobicContact CD2-CG1 4.38Å; L298-W304 PolarHBondContact O-NE1 3.28Å
299	R	91	Very high	90.7	Very high	227 Å²	227	72.8 Å²	72.8	86%	0.857	32%	0.323	S	S	*	.	G	3₁₀ helix	trans	-76.6	-18.4	175.1	-66	-175.4	177.2	-177.7	-1.2	112.8	K296 R297 Y301	K296-R299 WeakPolarHBondContact O-CB 2.93Å; K296-R299 PolarHBondContact O-N 2.75Å; R297-R299 PolarHBondContact O-N 3.2Å; R299-Y301 PolarHBondContact O-N 3.07Å
300	D	91.3	Very high	90.8	Very high	42 Å²	42	71 Å²	71	23%	0.225	31%	0.31	C	S	.	.			trans	-75.1	121.9	175.7	-169.2	-15.5	0	0	0	109.6	R297 L298 R302 V303	R297-D300 WeakPolarHBondContact O-CB 3.25Å; R297-D300 PolarHBondContact O-N 3.11Å; L298-D300 VanDerWaalsContact C-N 3.29Å; D300-R302 PolarHBondContact O-N 3.21Å; D300-R302 WeakPolarHBondContact OD1-CB 3.48Å; D300-R302 WeakPolarHBondContact OD1-CG 3.33Å; D300-R302 PolarHBondContact OD1-N 2.99Å; D300-R302 IonicContact OD1-NE 2.67Å; D300-R302 PolarHBondContact OD1-NE 3.37Å; D300-R302 IonicContact OD2-CZ 2.73Å; D300-R302 VanDerWaalsContact OD2-CZ 3.24Å; D300-R302 IonicContact OD2-NE 3.19Å; D300-R302 PolarHBondContact OD2-NE 3.44Å; D300-R302 IonicContact OD2-NH2 3.41Å; D300-R302 PolarHBondContact OD2-NH2 3.34Å; D300-V303 HydrophobicContact CB-CG2 4.08Å; D300-V303 WeakPolarHBondContact O-CB 3.39Å; D300-V303 PolarHBondContact O-N 2.82Å
301	Y	90.6	Very high	90.7	Very high	147 Å²	147	71 Å²	71	58%	0.576	31%	0.31	S	S	*	.	H	α-helix	trans	-64.3	-24.3	-179.6	72.8	-86.2	0	0	0	112.2	R299 V303 W304 G305 Y528 Q532	R299-Y301 PolarHBondContact O-N 3.07Å; Y301-V303 VanDerWaalsContact C-N 3.25Å; Y301-V303 PolarHBondContact O-N 3.43Å; Y301-W304 PolarHBondContact O-N 3.18Å; Y301-W304 VanDerWaalsContact O-N 3.15Å; Y301-G305 PolarHBondContact O-N 2.95Å; Y301-G305 VanDerWaalsContact O-N 3.12Å; Y301-Y528 HydrophobicContact CD2-CE2 4.33Å; Y301-Y528 HydrophobicContact CE2-CE2 4.14Å; Y301-Q532 PolarHBondContact OH-NE2 3.47Å
302	R	92.1	Very high	90.6	Very high	111 Å²	111	65.2 Å²	65.2	42%	0.419	29%	0.285	S	S	.	.	H	α-helix	trans	-61.8	-34.4	177.3	-66	179.3	-70	178.2	2.6	112.1	D300 W304 G305 D306 Y528	D300-R302 PolarHBondContact O-N 3.21Å; D300-R302 WeakPolarHBondContact OD1-CB 3.48Å; D300-R302 WeakPolarHBondContact OD1-CG 3.33Å; D300-R302 PolarHBondContact OD1-N 2.99Å; D300-R302 IonicContact OD1-NE 2.67Å; D300-R302 PolarHBondContact OD1-NE 3.37Å; D300-R302 IonicContact OD2-CZ 2.73Å; D300-R302 VanDerWaalsContact OD2-CZ 3.24Å; D300-R302 IonicContact OD2-NE 3.19Å; D300-R302 PolarHBondContact OD2-NE 3.44Å; D300-R302 IonicContact OD2-NH2 3.41Å; D300-R302 PolarHBondContact OD2-NH2 3.34Å; R302-W304 VanDerWaalsContact C-N 3.28Å; R302-W304 PolarHBondContact O-N 3.05Å; R302-G305 PolarHBondContact O-N 2.76Å; R302-D306 WeakPolarHBondContact O-CB 3.14Å; R302-D306 PolarHBondContact O-N 2.88Å; R302-Y528 PolarHBondContact O-OH 2.82Å
303	V	93.1	Very high	90.6	Very high	1 Å²	1	60.4 Å²	60.4	1%	0.006	26%	0.259	C	S	.	.	H	α-helix	trans	-57.5	-44.3	175.3	-178.5	0	0	0	0	110.6	Y72 F77 P80 R297 L298 D300 Y301 A307	Y72-V303 HydrophobicContact CD1-CB 4.26Å; Y72-V303 HydrophobicContact CD1-CG2 3.37Å; Y72-V303 HydrophobicContact CE1-CG2 3.81Å; Y72-V303 HydrophobicContact CG-CB 4.4Å; Y72-V303 HydrophobicContact CG-CG1 4.28Å; Y72-V303 HydrophobicContact CG-CG2 3.86Å; F77-V303 HydrophobicContact CD2-CG1 4.23Å; P80-V303 HydrophobicContact CG-CG1 3.77Å; R297-V303 WeakPolarHBondContact O-CG2 3.46Å; L298-V303 HydrophobicContact CD2-CG1 4.38Å; D300-V303 HydrophobicContact CB-CG2 4.08Å; D300-V303 WeakPolarHBondContact O-CB 3.39Å; D300-V303 PolarHBondContact O-N 2.82Å; Y301-V303 VanDerWaalsContact C-N 3.25Å; Y301-V303 PolarHBondContact O-N 3.43Å; V303-A307 WeakPolarHBondContact O-CB 3.35Å; V303-A307 PolarHBondContact O-N 3.21Å
304	W	92.9	Very high	90.8	Very high	79 Å²	79	58 Å²	58	30%	0.299	24%	0.244	S	C	.	.	H	α-helix	trans	-73.5	-38.6	-178	-67	90	0	0	0	112.2	P80 M83 M84 L298 Y301 R302 A308	P80-W304 HydrophobicContact CB-CD2 3.84Å; P80-W304 HydrophobicContact CB-CE3 3.5Å; P80-W304 VanDerWaalsContact CB-CE3 3.5Å; P80-W304 HydrophobicContact CB-CH2 4.17Å; P80-W304 HydrophobicContact CB-CZ2 4.42Å; P80-W304 HydrophobicContact CB-CZ3 3.7Å; M83-W304 HydrophobicContact CB-CZ3 4.36Å; M83-W304 HydrophobicContact CE-CH2 4.05Å; M83-W304 HydrophobicContact CE-CZ3 4.05Å; M83-W304 HydrophobicContact SD-CH2 3.62Å; M83-W304 HydrophobicContact SD-CZ3 3.79Å; M84-W304 HydrophobicContact CE-CE3 3.49Å; M84-W304 VanDerWaalsContact CE-CE3 3.49Å; M84-W304 HydrophobicContact CE-CZ3 4.04Å; L298-W304 PolarHBondContact O-NE1 3.28Å; Y301-W304 PolarHBondContact O-N 3.18Å; Y301-W304 VanDerWaalsContact O-N 3.15Å; R302-W304 VanDerWaalsContact C-N 3.28Å; R302-W304 PolarHBondContact O-N 3.05Å; W304-A308 VanDerWaalsContact O-CB 3.29Å; W304-A308 WeakPolarHBondContact O-CB 3.46Å; W304-A308 PolarHBondContact O-N 3.36Å
305	G	92.2	Very high	90.9	Very high	10 Å²	10	54.5 Å²	54.5	10%	0.103	23%	0.226	C	C	.	.	H	α-helix	trans	-62.5	-49.2	174.7	0	0	0	0	0	112.1	Y301 R302 A308 L309	Y301-G305 PolarHBondContact O-N 2.95Å; Y301-G305 VanDerWaalsContact O-N 3.12Å; R302-G305 PolarHBondContact O-N 2.76Å; G305-A308 PolarHBondContact O-N 3.29Å; G305-L309 WeakPolarHBondContact O-CG 3.33Å; G305-L309 PolarHBondContact O-N 2.8Å
306	D	92.5	Very high	90.9	Very high	36 Å²	36	46.6 Å²	46.6	19%	0.193	20%	0.196	C	C	.	.	H	α-helix	trans	-70.9	-35	-179.8	-71.5	3.9	0	0	0	112.4	L68 Y72 R302 A308 Q310 Y528	L68-D306 HydrophobicContact CD2-CB 4.15Å; Y72-D306 HydrophobicContact CE2-CB 3.75Å; Y72-D306 WeakPolarHBondContact CE2-OD2 3.43Å; Y72-D306 VanDerWaalsContact CZ-OD2 3.31Å; Y72-D306 PolarHBondContact OH-OD2 3.17Å; R302-D306 WeakPolarHBondContact O-CB 3.14Å; R302-D306 PolarHBondContact O-N 2.88Å; D306-A308 VanDerWaalsContact C-N 3.33Å; D306-Q310 WeakPolarHBondContact O-CB 3.23Å; D306-Q310 PolarHBondContact O-N 2.81Å; D306-Y528 WeakPolarHBondContact OD1-CE1 3.35Å; D306-Y528 PolarHBondContact OD1-OH 3.07Å
307	A	93.6	Very high	90.7	Very high	0 Å²	0	39 Å²	39	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-62.4	-40.4	171.7	0	0	0	0	0	112	F77 P80 V303 Q310 A311	F77-A307 HydrophobicContact CE2-CB 3.75Å; F77-A307 HydrophobicContact CZ-CB 3.95Å; P80-A307 HydrophobicContact CB-CB 3.84Å; P80-A307 HydrophobicContact CG-CB 4.14Å; V303-A307 WeakPolarHBondContact O-CB 3.35Å; V303-A307 PolarHBondContact O-N 3.21Å; A307-Q310 PolarHBondContact O-N 3.31Å; A307-A311 WeakPolarHBondContact O-CB 3.48Å; A307-A311 PolarHBondContact O-N 3.18Å
308	A	92.4	Very high	90.8	Very high	3 Å²	3	35 Å²	35	3%	0.025	15%	0.148	C	C	.	.	H	α-helix	trans	-69.9	-43.8	178.1	0	0	0	0	0	112.5	M84 I88 W304 G305 D306 Q310 A311 F312 L525	M84-A308 HydrophobicContact CB-CB 4.12Å; M84-A308 HydrophobicContact CG-CB 3.69Å; M84-A308 HydrophobicContact SD-CB 3.78Å; I88-A308 HydrophobicContact CD1-CB 3.95Å; W304-A308 VanDerWaalsContact O-CB 3.29Å; W304-A308 WeakPolarHBondContact O-CB 3.46Å; W304-A308 PolarHBondContact O-N 3.36Å; G305-A308 PolarHBondContact O-N 3.29Å; D306-A308 VanDerWaalsContact C-N 3.33Å; A308-Q310 VanDerWaalsContact C-N 3.34Å; A308-A311 PolarHBondContact O-N 2.88Å; A308-F312 WeakPolarHBondContact O-CB 3.3Å; A308-F312 PolarHBondContact O-N 2.98Å; A308-L525 HydrophobicContact CB-CD1 4.31Å; A308-L525 HydrophobicContact CB-CD2 3.45Å; A308-L525 VanDerWaalsContact CB-CD2 3.45Å; A308-L525 HydrophobicContact CB-CG 4.46Å
309	L	91.2	Very high	90.7	Very high	26 Å²	26	34 Å²	34	14%	0.136	14%	0.142	C	C	.	.	H	α-helix	trans	-58	-49	171.2	-72.4	179.1	0	0	0	110.5	G305 A311 F312 F313 L473 L525 Y528	G305-L309 WeakPolarHBondContact O-CG 3.33Å; G305-L309 PolarHBondContact O-N 2.8Å; L309-A311 PolarHBondContact O-N 2.87Å; L309-F312 PolarHBondContact O-N 2.92Å; L309-F313 HydrophobicContact CB-CD2 4.16Å; L309-F313 HydrophobicContact CB-CE2 3.97Å; L309-F313 HydrophobicContact CD2-CE2 4.01Å; L309-F313 HydrophobicContact CD2-CZ 4.41Å; L309-F313 HydrophobicContact CG-CE2 4.49Å; L309-F313 WeakPolarHBondContact O-CB 3.37Å; L309-F313 WeakPolarHBondContact O-CD2 3.38Å; L309-F313 WeakPolarHBondContact O-CG 3.27Å; L309-F313 PolarHBondContact O-N 2.86Å; L309-L473 HydrophobicContact CD2-CD1 3.61Å; L309-L473 HydrophobicContact CD2-CD2 4.31Å; L309-L525 HydrophobicContact CD2-CB 4.3Å; L309-L525 HydrophobicContact CD2-CD2 4.31Å; L309-L525 HydrophobicContact CG-CD2 4.4Å; L309-Y528 HydrophobicContact CD1-CD1 3.91Å; L309-Y528 HydrophobicContact CD1-CE1 3.84Å; L309-Y528 HydrophobicContact CG-CD1 4.45Å
310	Q	92.3	Very high	90.5	Very high	3 Å²	3	23.2 Å²	23.2	1%	0.014	10%	0.101	C	C	.	.	H	α-helix	trans	-62.8	-43.4	-179.6	-176.3	55	34.2	0	0	111.7	L65 L68 F77 Y81 D306 A307 A308 F312 F313 S314	L65-Q310 HydrophobicContact CD2-CG 3.55Å; L65-Q310 HydrophobicContact CG-CG 4.04Å; L68-Q310 HydrophobicContact CD1-CB 3.73Å; L68-Q310 HydrophobicContact CD1-CG 3.75Å; F77-Q310 HydrophobicContact CZ-CB 4.43Å; Y81-Q310 HydrophobicContact CD2-CG 4.31Å; Y81-Q310 HydrophobicContact CE2-CG 4.08Å; D306-Q310 WeakPolarHBondContact O-CB 3.23Å; D306-Q310 PolarHBondContact O-N 2.81Å; A307-Q310 PolarHBondContact O-N 3.31Å; A308-Q310 VanDerWaalsContact C-N 3.34Å; Q310-F312 VanDerWaalsContact C-N 3.33Å; Q310-F312 PolarHBondContact O-N 3.42Å; Q310-F313 PolarHBondContact O-N 2.77Å; Q310-S314 WeakPolarHBondContact O-CA 3.45Å; Q310-S314 WeakPolarHBondContact O-CB 3.37Å; Q310-S314 PolarHBondContact O-N 3.35Å
311	A	91.4	Very high	90.3	Very high	0 Å²	0	21.7 Å²	21.7	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-59	-43.5	176.1	0	0	0	0	0	112.2	Y81 M84 L85 A307 A308 L309 L315	Y81-A311 HydrophobicContact CD2-CB 4.03Å; Y81-A311 HydrophobicContact CE2-CB 4.06Å; M84-A311 HydrophobicContact CB-CB 4.01Å; L85-A311 HydrophobicContact CB-CB 4.45Å; L85-A311 HydrophobicContact CD1-CB 4.45Å; A307-A311 WeakPolarHBondContact O-CB 3.48Å; A307-A311 PolarHBondContact O-N 3.18Å; A308-A311 PolarHBondContact O-N 2.88Å; L309-A311 PolarHBondContact O-N 2.87Å; A311-L315 PolarHBondContact O-N 3.25Å
312	F	89.3	Confident	90.3	Very high	1 Å²	1	14.7 Å²	14.7	0%	0.004	7%	0.066	C	C	.	.	H	α-helix	trans	-64.8	-43.6	178.9	-171.8	-93.5	0	0	0	112.2	F92 A308 L309 Q310 T316 C317 V472 L473 A476 L522	F92-F312 HydrophobicContact CD1-CE2 4.2Å; F92-F312 HydrophobicContact CE1-CE2 4.44Å; F92-F312 HydrophobicContact CG-CE2 4.27Å; A308-F312 WeakPolarHBondContact O-CB 3.3Å; A308-F312 PolarHBondContact O-N 2.98Å; L309-F312 PolarHBondContact O-N 2.92Å; Q310-F312 VanDerWaalsContact C-N 3.33Å; Q310-F312 PolarHBondContact O-N 3.42Å; F312-T316 PolarHBondContact O-N 2.89Å; F312-C317 HydrophobicContact CD2-CB 4.15Å; F312-C317 HydrophobicContact CE1-CB 4.21Å; F312-C317 HydrophobicContact CE2-CB 3.58Å; F312-C317 HydrophobicContact CZ-CB 3.57Å; F312-V472 HydrophobicContact CE1-CG1 3.77Å; F312-V472 HydrophobicContact CZ-CG1 4.46Å; F312-L473 HydrophobicContact CD1-CD2 3.67Å; F312-L473 HydrophobicContact CE1-CD2 3.97Å; F312-L473 HydrophobicContact CG-CD2 4.15Å; F312-A476 HydrophobicContact CE1-CB 4.24Å; F312-A476 HydrophobicContact CE2-CB 3.92Å; F312-A476 HydrophobicContact CZ-CB 3.36Å; F312-L522 HydrophobicContact CD2-CD2 4.18Å; F312-L522 HydrophobicContact CE2-CD2 3.89Å; F312-L522 HydrophobicContact CZ-CD2 4.48Å
313	F	88.1	Confident	90.2	Very high	14 Å²	14	9.4 Å²	9.4	6%	0.061	5%	0.046	C	C	.	.	H	α-helix	trans	-79	-27.8	179.7	-63.4	-51.4	0	0	0	114.1	R60 L309 Q310 T316 I468 V472 L473	R60-F313 VanDerWaalsContact CZ-CD2 3.5Å; R60-F313 VanDerWaalsContact NH2-CB 3.27Å; L309-F313 HydrophobicContact CB-CD2 4.16Å; L309-F313 HydrophobicContact CB-CE2 3.97Å; L309-F313 HydrophobicContact CD2-CE2 4.01Å; L309-F313 HydrophobicContact CD2-CZ 4.41Å; L309-F313 HydrophobicContact CG-CE2 4.49Å; L309-F313 WeakPolarHBondContact O-CB 3.37Å; L309-F313 WeakPolarHBondContact O-CD2 3.38Å; L309-F313 WeakPolarHBondContact O-CG 3.27Å; L309-F313 PolarHBondContact O-N 2.86Å; Q310-F313 PolarHBondContact O-N 2.77Å; F313-T316 PolarHBondContact O-N 3.36Å; F313-T316 VanDerWaalsContact O-N 3.11Å; F313-I468 HydrophobicContact CD1-CG2 3.59Å; F313-I468 HydrophobicContact CE1-CG2 3.56Å; F313-I468 HydrophobicContact CG-CG2 4.33Å; F313-I468 HydrophobicContact CZ-CG2 4.23Å; F313-V472 HydrophobicContact CE1-CB 4.41Å; F313-L473 HydrophobicContact CZ-CD1 4.41Å; F313-L473 HydrophobicContact CZ-CG 4.29Å
314	S	90.6	Very high	90	Very high	1 Å²	1	9.5 Å²	9.5	1%	0.007	5%	0.047	C	C	.	.	H	α-helix	trans	-58.4	-50.4	173.3	-155.6	0	0	0	0	109.5	H61 Y81 Q310 T316 D346	H61-S314 PolarHBondContact CE1-O 3.31Å; H61-S314 PolarHBondContact NE2-OG 3.15Å; Y81-S314 PolarHBondContact OH-OG 3.42Å; Q310-S314 WeakPolarHBondContact O-CA 3.45Å; Q310-S314 WeakPolarHBondContact O-CB 3.37Å; Q310-S314 PolarHBondContact O-N 3.35Å; S314-T316 PolarHBondContact O-N 3.16Å; S314-D346 PolarHBondContact OG-OD1 2.86Å; S314-D346 PolarHBondContact OG-OD2 3.12Å
315	L	88.5	Confident	89.8	Confident	0 Å²	0	6.4 Å²	6.4	0%	0	4%	0.036	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.5	-1.9	176.8	-66.7	-167.1	0	0	0	114.1	L56 L85 A89 L93 A311 C317 F322 C343 D346	L56-L315 HydrophobicContact CD2-CB 4.3Å; L56-L315 HydrophobicContact CD2-CD2 3.73Å; L85-L315 HydrophobicContact CD1-CD1 3.73Å; L85-L315 HydrophobicContact CD1-CD2 4.09Å; L85-L315 HydrophobicContact CD1-CG 3.72Å; A89-L315 HydrophobicContact CB-CD1 3.34Å; A89-L315 HydrophobicContact CB-CG 4.08Å; L93-L315 HydrophobicContact CB-CD1 4.4Å; L93-L315 HydrophobicContact CD2-CD1 3.95Å; A311-L315 PolarHBondContact O-N 3.25Å; L315-C317 PolarHBondContact O-N 3.45Å; L315-C317 VanDerWaalsContact O-N 3.09Å; L315-F322 WeakPolarHBondContact O-CE2 3.44Å; L315-C343 VanDerWaalsContact CD1-SG 3.59Å; L315-D346 HydrophobicContact CD2-CB 3.65Å; L315-D346 VanDerWaalsContact CD2-CG 3.49Å; L315-D346 WeakPolarHBondContact CD2-OD2 3.07Å
316	T	87.7	Confident	89.8	Confident	1 Å²	1	6 Å²	6	1%	0.006	3%	0.031	C	C	.	.	T	Hydrogen-bonded Turn	trans	51.2	34.5	178.9	55.8	0	0	0	0	113.8	F55 N58 F312 F313 S314 F322	F55-T316 WeakPolarHBondContact CD1-OG1 3.42Å; F55-T316 HydrophobicContact CE1-CG2 4.29Å; F55-T316 WeakPolarHBondContact CE1-OG1 3.19Å; F55-T316 HydrophobicContact CZ-CG2 4.35Å; N58-T316 VanDerWaalsContact ND2-CG2 3.25Å; N58-T316 WeakPolarHBondContact ND2-CG2 3.3Å; F312-T316 PolarHBondContact O-N 2.89Å; F313-T316 PolarHBondContact O-N 3.36Å; F313-T316 VanDerWaalsContact O-N 3.11Å; S314-T316 PolarHBondContact O-N 3.16Å; T316-F322 WeakPolarHBondContact OG1-CE2 3.38Å
317	C	87.3	Confident	89.6	Confident	1 Å²	1	4.3 Å²	4.3	1%	0.007	2%	0.022	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.2	146.3	-179.9	-68.2	0	0	0	0	111.7	F92 F312 L315 W319 V472	F92-C317 HydrophobicContact CD1-CB 3.65Å; F92-C317 HydrophobicContact CE1-CB 3.99Å; F312-C317 HydrophobicContact CD2-CB 4.15Å; F312-C317 HydrophobicContact CE1-CB 4.21Å; F312-C317 HydrophobicContact CE2-CB 3.58Å; F312-C317 HydrophobicContact CZ-CB 3.57Å; L315-C317 PolarHBondContact O-N 3.45Å; L315-C317 VanDerWaalsContact O-N 3.09Å; C317-W319 VanDerWaalsContact C-N 3.32Å; C317-W319 VanDerWaalsContact O-CD1 3.24Å; C317-W319 PolarHBondContact O-N 2.58Å; C317-V472 WeakPolarHBondContact O-CG1 3.43Å
318	S	88.9	Confident	89.3	Confident	1 Å²	1	5 Å²	5	1%	0.007	3%	0.025	C	C	.	.	T	Hydrogen-bonded Turn	trans	66.1	24.3	179.4	-60.8	0	0	0	0	115.8	F92 E96 A476 E479	F92-S318 WeakPolarHBondContact CE1-OG 3.34Å; F92-S318 WeakPolarHBondContact CZ-OG 3.34Å; E96-S318 PolarHBondContact OE2-N 2.9Å; S318-A476 WeakPolarHBondContact OG-CA 3.47Å; S318-A476 WeakPolarHBondContact OG-CB 3.45Å; S318-E479 PolarHBondContact OG-OE2 3.28Å
319	W	87	Confident	89.3	Confident	10 Å²	10	5.1 Å²	5.1	4%	0.038	3%	0.026	C	C	.	.	S	Bend	trans	-90.2	-14.7	169.3	-67.2	37.1	0	0	0	110.5	F55 S128 V131 Y135 C317 T321 V417 I468	F55-W319 HydrophobicContact CZ-CE3 4.16Å; S128-W319 PolarHBondContact OG-O 3.07Å; V131-W319 HydrophobicContact CB-CH2 4.17Å; V131-W319 HydrophobicContact CB-CZ3 3.81Å; V131-W319 HydrophobicContact CG1-CH2 3.62Å; V131-W319 HydrophobicContact CG1-CZ3 3.42Å; V131-W319 VanDerWaalsContact CG1-CZ3 3.42Å; V131-W319 HydrophobicContact CG2-CH2 3.86Å; V131-W319 HydrophobicContact CG2-CZ2 4.48Å; V131-W319 HydrophobicContact CG2-CZ3 3.9Å; Y135-W319 HydrophobicContact CE2-CH2 4.37Å; C317-W319 VanDerWaalsContact C-N 3.32Å; C317-W319 VanDerWaalsContact O-CD1 3.24Å; C317-W319 PolarHBondContact O-N 2.58Å; W319-T321 PolarHBondContact O-N 3.34Å; W319-V417 HydrophobicContact CE3-CG2 4.38Å; W319-I468 HydrophobicContact CH2-CD1 3.82Å; W319-I468 HydrophobicContact CH2-CG1 4.3Å; W319-I468 HydrophobicContact CZ2-CD1 3.82Å; W319-I468 HydrophobicContact CZ2-CG1 4Å; W319-I468 HydrophobicContact CZ2-CG2 4.25Å
320	G	87.3	Confident	89.3	Confident	0 Å²	0	9.7 Å²	9.7	0%	0	4%	0.041	C	C	.	.	S	Bend	trans	80.7	-0.8	-177.5	0	0	0	0	0	113.3	E96 T324	E96-G320 WeakPolarHBondContact OE1-CA 3.45Å; E96-G320 PolarHBondContact OE1-N 2.79Å; E96-G320 VanDerWaalsContact OE1-N 3.07Å; G320-T324 PolarHBondContact O-N 3.34Å; G320-T324 VanDerWaalsContact O-N 3.09Å; G320-T324 PolarHBondContact O-OG1 2.94Å
321	T	86.8	Confident	89.2	Confident	11 Å²	11	9.7 Å²	9.7	7%	0.067	4%	0.041	C	C	.	.	H	α-helix	trans	-69.2	-42.7	176.9	-55.3	0	0	0	0	110.9	F55 W319 I323 T324 L325 V417	F55-T321 HydrophobicContact CD1-CG2 3.76Å; F55-T321 HydrophobicContact CD2-CG2 3.95Å; F55-T321 VanDerWaalsContact CE1-CB 3.45Å; F55-T321 HydrophobicContact CE1-CG2 3.63Å; F55-T321 HydrophobicContact CE2-CG2 3.86Å; F55-T321 HydrophobicContact CG-CG2 3.92Å; F55-T321 VanDerWaalsContact CZ-CB 3.49Å; F55-T321 HydrophobicContact CZ-CG2 3.71Å; F55-T321 VanDerWaalsContact CZ-OG1 3.3Å; F55-T321 WeakPolarHBondContact CZ-OG1 3.49Å; W319-T321 PolarHBondContact O-N 3.34Å; T321-I323 PolarHBondContact O-N 3.5Å; T321-T324 CarbonylContact O-C 3.11Å; T321-T324 PolarHBondContact O-N 3.35Å; T321-T324 VanDerWaalsContact O-N 3.12Å; T321-L325 HydrophobicContact CG2-CD1 3.78Å; T321-L325 HydrophobicContact CG2-CG 4.05Å; T321-L325 WeakPolarHBondContact O-CB 3.45Å; T321-L325 WeakPolarHBondContact O-CG 3.35Å; T321-L325 PolarHBondContact O-N 3.34Å; T321-V417 WeakPolarHBondContact OG1-CG1 3.38Å
322	F	90.2	Very high	89.2	Confident	0 Å²	0	14 Å²	14	0%	0	6%	0.061	C	C	.	.	H	α-helix	trans	-66	-37.9	176.7	-74.3	-71	0	0	0	112.4	C52 F55 L56 L93 E96 Y97 L315 T316 T324 L325 S326 L342	C52-F322 HydrophobicContact CB-CE1 3.94Å; F55-F322 AromaticContact CD1-CE2 3.88Å; F55-F322 HydrophobicContact CD1-CE2 3.88Å; F55-F322 AromaticContact CD1-CZ 3.87Å; F55-F322 HydrophobicContact CD1-CZ 3.87Å; F55-F322 HydrophobicContact CE1-CD2 4.43Å; F55-F322 AromaticContact CE1-CE2 3.92Å; F55-F322 HydrophobicContact CE1-CE2 3.92Å; F55-F322 HydrophobicContact CE1-CZ 4.38Å; L56-F322 HydrophobicContact CD2-CE2 4.27Å; L56-F322 HydrophobicContact CD2-CZ 3.65Å; L56-F322 HydrophobicContact CG-CZ 3.94Å; L93-F322 HydrophobicContact CD1-CB 4.13Å; L93-F322 HydrophobicContact CD1-CD1 3.92Å; L93-F322 HydrophobicContact CD1-CD2 3.47Å; L93-F322 VanDerWaalsContact CD1-CD2 3.47Å; L93-F322 HydrophobicContact CD1-CE1 4.2Å; L93-F322 HydrophobicContact CD1-CE2 3.82Å; L93-F322 HydrophobicContact CD1-CG 3.54Å; L93-F322 HydrophobicContact CD1-CZ 4.17Å; E96-F322 HydrophobicContact CG-CB 4.16Å; Y97-F322 HydrophobicContact CD2-CB 4.41Å; Y97-F322 HydrophobicContact CD2-CD1 4.01Å; Y97-F322 HydrophobicContact CE2-CD1 4.37Å; L315-F322 WeakPolarHBondContact O-CE2 3.44Å; T316-F322 WeakPolarHBondContact OG1-CE2 3.38Å; F322-T324 VanDerWaalsContact C-N 3.26Å; F322-T324 PolarHBondContact O-N 3.45Å; F322-L325 PolarHBondContact O-N 3Å; F322-S326 WeakPolarHBondContact O-CB 3.18Å; F322-S326 PolarHBondContact O-N 3.41Å; F322-S326 PolarHBondContact O-OG 3.13Å; F322-L342 HydrophobicContact CD1-CD1 4.44Å; F322-L342 HydrophobicContact CE1-CD1 3.98Å
323	I	91.4	Very high	89.2	Confident	0 Å²	0	15.1 Å²	15.1	0%	0	7%	0.069	C	C	.	.	H	α-helix	trans	-55.6	-47.9	171	-51.7	-175.4	0	0	0	109.5	E96 G100 V110 M124 T321 S326 S327	E96-I323 HydrophobicContact CB-CG1 4.48Å; E96-I323 HydrophobicContact CG-CD1 3.9Å; E96-I323 HydrophobicContact CG-CG1 3.27Å; G100-I323 VanDerWaalsContact CA-O 3.3Å; G100-I323 WeakPolarHBondContact CA-O 3.5Å; V110-I323 HydrophobicContact CB-CG2 4.01Å; V110-I323 HydrophobicContact CG1-CD1 4.11Å; V110-I323 HydrophobicContact CG1-CG2 4.05Å; V110-I323 HydrophobicContact CG2-CG2 4.13Å; M124-I323 HydrophobicContact CE-CD1 4.19Å; M124-I323 HydrophobicContact SD-CD1 4.01Å; T321-I323 PolarHBondContact O-N 3.5Å; I323-S326 PolarHBondContact O-OG 3.03Å; I323-S327 WeakPolarHBondContact O-CB 3.31Å; I323-S327 PolarHBondContact O-N 3.27Å; I323-S327 VanDerWaalsContact O-N 3.11Å
324	T	88	Confident	89.5	Confident	2 Å²	2	15.4 Å²	15.4	1%	0.012	7%	0.071	C	C	.	.	H	α-helix	trans	-68.2	-46.8	-177.7	-55.2	0	0	0	0	112	G320 T321 F322 S327 Y328 S420	G320-T324 PolarHBondContact O-N 3.34Å; G320-T324 VanDerWaalsContact O-N 3.09Å; G320-T324 PolarHBondContact O-OG1 2.94Å; T321-T324 CarbonylContact O-C 3.11Å; T321-T324 PolarHBondContact O-N 3.35Å; T321-T324 VanDerWaalsContact O-N 3.12Å; F322-T324 VanDerWaalsContact C-N 3.26Å; F322-T324 PolarHBondContact O-N 3.45Å; T324-S327 WeakPolarHBondContact O-CB 3.46Å; T324-S327 PolarHBondContact O-N 3.36Å; T324-S327 PolarHBondContact O-OG 3.1Å; T324-Y328 HydrophobicContact CG2-CE2 4.33Å; T324-Y328 WeakPolarHBondContact O-CD2 3.32Å; T324-Y328 WeakPolarHBondContact O-CE2 3.5Å; T324-S420 WeakPolarHBondContact OG1-CB 3.36Å
325	L	89	Confident	89.6	Confident	15 Å²	15	15.3 Å²	15.3	8%	0.079	7%	0.071	C	C	.	.	H	α-helix	trans	-67.1	-42.3	-178.1	-67.9	175.4	0	0	0	112	W42 T321 F322 S327 Y328	W42-L325 HydrophobicContact CH2-CD2 4.09Å; W42-L325 HydrophobicContact CZ2-CB 4.44Å; W42-L325 HydrophobicContact CZ2-CD2 3.72Å; W42-L325 PolarHBondContact NE1-O 3.15Å; T321-L325 HydrophobicContact CG2-CD1 3.78Å; T321-L325 HydrophobicContact CG2-CG 4.05Å; T321-L325 WeakPolarHBondContact O-CB 3.45Å; T321-L325 WeakPolarHBondContact O-CG 3.35Å; T321-L325 PolarHBondContact O-N 3.34Å; F322-L325 PolarHBondContact O-N 3Å; L325-S327 VanDerWaalsContact C-N 3.28Å; L325-S327 PolarHBondContact O-N 3.44Å; L325-Y328 PolarHBondContact O-N 3.06Å
326	S	91.2	Very high	89.8	Confident	0 Å²	0	16.7 Å²	16.7	0%	0	8%	0.077	C	C	.	.	H	α-helix	trans	-69.1	-25.1	177.3	62.6	0	0	0	0	112.6	Y97 G100 Q101 F322 I323 Y328 N329	Y97-S326 VanDerWaalsContact O-CB 3.3Å; Y97-S326 WeakPolarHBondContact O-CB 3.45Å; Y97-S326 PolarHBondContact O-OG 3.3Å; G100-S326 WeakPolarHBondContact CA-OG 3.34Å; Q101-S326 WeakPolarHBondContact CA-O 3.4Å; Q101-S326 PolarHBondContact N-OG 2.94Å; F322-S326 WeakPolarHBondContact O-CB 3.18Å; F322-S326 PolarHBondContact O-N 3.41Å; F322-S326 PolarHBondContact O-OG 3.13Å; I323-S326 PolarHBondContact O-OG 3.03Å; S326-Y328 PolarHBondContact O-N 3.29Å; S326-Y328 VanDerWaalsContact O-N 3.09Å; S326-N329 WeakPolarHBondContact O-CB 3.2Å; S326-N329 PolarHBondContact O-N 3.12Å
327	S	89.5	Confident	90.1	Very high	1 Å²	1	22.2 Å²	22.2	1%	0.007	10%	0.1	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-13.6	177.3	77.5	0	0	0	0	115.4	R39 G100 L105 I323 T324 L325	R39-S327 PolarHBondContact NE-OG 3.25Å; R39-S327 PolarHBondContact NH2-OG 3.33Å; G100-S327 VanDerWaalsContact O-CA 3.26Å; G100-S327 WeakPolarHBondContact O-CA 3.25Å; G100-S327 WeakPolarHBondContact O-CB 3.27Å; L105-S327 WeakPolarHBondContact O-CB 3.37Å; I323-S327 WeakPolarHBondContact O-CB 3.31Å; I323-S327 PolarHBondContact O-N 3.27Å; I323-S327 VanDerWaalsContact O-N 3.11Å; T324-S327 WeakPolarHBondContact O-CB 3.46Å; T324-S327 PolarHBondContact O-N 3.36Å; T324-S327 PolarHBondContact O-OG 3.1Å; L325-S327 VanDerWaalsContact C-N 3.28Å; L325-S327 PolarHBondContact O-N 3.44Å
328	Y	87.8	Confident	90.5	Very high	14 Å²	14	22.2 Å²	22.2	6%	0.055	10%	0.1	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.2	-1.5	174	-66.5	-86.1	0	0	0	112.5	R39 G40 N41 W42 V252 T324 L325 S326 D423	R39-Y328 HydrophobicContact CG-CD1 3.99Å; R39-Y328 HydrophobicContact CG-CE1 3.98Å; R39-Y328 PolarHBondContact NH1-OH 3.33Å; R39-Y328 WeakPolarHBondContact O-CE1 3.45Å; G40-Y328 WeakPolarHBondContact O-CD1 3.4Å; N41-Y328 VanDerWaalsContact CA-O 3.24Å; N41-Y328 WeakPolarHBondContact CA-O 3.08Å; N41-Y328 PolarHBondContact ND2-O 2.91Å; N41-Y328 VanDerWaalsContact ND2-O 3.15Å; W42-Y328 PolarHBondContact N-O 2.99Å; W42-Y328 VanDerWaalsContact N-O 3.12Å; V252-Y328 HydrophobicContact CB-CD1 4.43Å; V252-Y328 HydrophobicContact CB-CE1 4.42Å; V252-Y328 HydrophobicContact CG1-CD1 4.27Å; V252-Y328 HydrophobicContact CG1-CD2 4.41Å; V252-Y328 HydrophobicContact CG1-CG 4.11Å; V252-Y328 HydrophobicContact CG2-CD1 4.01Å; V252-Y328 HydrophobicContact CG2-CD2 3.92Å; V252-Y328 HydrophobicContact CG2-CE1 3.67Å; V252-Y328 HydrophobicContact CG2-CE2 3.62Å; V252-Y328 HydrophobicContact CG2-CG 4.13Å; V252-Y328 VanDerWaalsContact CG2-CZ 3.48Å; T324-Y328 HydrophobicContact CG2-CE2 4.33Å; T324-Y328 WeakPolarHBondContact O-CD2 3.32Å; T324-Y328 WeakPolarHBondContact O-CE2 3.5Å; L325-Y328 PolarHBondContact O-N 3.06Å; S326-Y328 PolarHBondContact O-N 3.29Å; S326-Y328 VanDerWaalsContact O-N 3.09Å; Y328-D423 PolarHBondContact OH-OD1 2.96Å; Y328-D423 PolarHBondContact OH-OD2 3.49Å
329	N	91.3	Very high	90.7	Very high	7 Å²	7	22.1 Å²	22.1	4%	0.037	10%	0.1	C	C	.	.	S	Bend	trans	-68.8	158.2	173	-73.6	-10.6	0	0	0	111	N41 W42 C48 Y97 Q101 S326	N41-N329 PolarHBondContact ND2-O 3.48Å; W42-N329 VanDerWaalsContact CD1-OD1 3.25Å; C48-N329 PolarHBondContact SG-OD1 3.16Å; Y97-N329 WeakPolarHBondContact CE1-ND2 3.22Å; Y97-N329 PolarHBondContact OH-ND2 2.9Å; Q101-N329 HydrophobicContact CG-CB 3.99Å; Q101-N329 PolarHBondContact OE1-ND2 3.31Å; Q101-N329 VanDerWaalsContact OE1-ND2 3.16Å; S326-N329 WeakPolarHBondContact O-CB 3.2Å; S326-N329 PolarHBondContact O-N 3.12Å
330	R	90.5	Very high	91	Very high	121 Å²	121	24.8 Å²	24.8	46%	0.457	11%	0.114	S	C	.	.			trans	-66.5	145.7	164.5	-65.3	-172.5	-176.5	-179.3	-4	109.5	E35 Q101 H332 S333	E35-R330 VanDerWaalsContact OE2-CA 3.3Å; E35-R330 WeakPolarHBondContact OE2-CA 3.26Å; E35-R330 WeakPolarHBondContact OE2-CB 3.16Å; E35-R330 VanDerWaalsContact OE2-CG 3.23Å; E35-R330 WeakPolarHBondContact OE2-CG 3.4Å; Q101-R330 PolarHBondContact NE2-O 2.88Å; R330-H332 VanDerWaalsContact C-N 3.35Å; R330-H332 PolarHBondContact O-N 2.96Å; R330-S333 WeakPolarHBondContact O-CB 3.13Å; R330-S333 PolarHBondContact O-N 2.94Å; R330-S333 VanDerWaalsContact O-N 3.14Å; R330-S333 PolarHBondContact O-OG 3.08Å
331	F	90.4	Very high	91.4	Very high	3 Å²	3	29.6 Å²	29.6	1%	0.013	14%	0.135	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-44.5	-171.9	-175.4	-105.9	0	0	0	112.3	E35 Q101 F102 S333 W498 M499 P593 H598	E35-F331 WeakPolarHBondContact OE1-CB 3.44Å; E35-F331 PolarHBondContact OE1-N 3.4Å; Q101-F331 PolarHBondContact NE2-O 3.28Å; F102-F331 AromaticContact CD2-CE2 3.74Å; F102-F331 HydrophobicContact CD2-CE2 3.74Å; F102-F331 HydrophobicContact CD2-CZ 4.01Å; F102-F331 HydrophobicContact CE2-CE2 4.21Å; F102-F331 HydrophobicContact CE2-CZ 4.13Å; F331-S333 VanDerWaalsContact C-N 3.3Å; F331-S333 PolarHBondContact O-N 3.43Å; F331-W498 AromaticContact CE1-CD1 3.81Å; F331-W498 HydrophobicContact CE1-CG 4.19Å; F331-W498 AromaticContact CE1-NE1 3.96Å; F331-W498 HydrophobicContact CZ-CD2 4.2Å; F331-W498 HydrophobicContact CZ-CG 4.11Å; F331-M499 HydrophobicContact CD2-CG 4.2Å; F331-M499 HydrophobicContact CE1-CG 4.26Å; F331-M499 HydrophobicContact CE2-CG 3.82Å; F331-M499 HydrophobicContact CZ-CG 3.85Å; F331-P593 HydrophobicContact CD2-CB 4.44Å; F331-P593 HydrophobicContact CE2-CB 3.77Å; F331-P593 HydrophobicContact CE2-CG 3.83Å; F331-P593 HydrophobicContact CZ-CB 4.05Å; F331-P593 HydrophobicContact CZ-CG 3.74Å; F331-H598 VanDerWaalsContact CB-CD2 3.41Å; F331-H598 WeakPolarHBondContact CB-CD2 3.42Å; F331-H598 WeakPolarHBondContact CB-NE2 3.37Å; F331-H598 HydrophobicContact CD1-CB 3.99Å; F331-H598 AromaticContact CD1-CD2 3.79Å; F331-H598 AromaticContact CD1-CG 3.59Å; F331-H598 AromaticContact CD1-ND1 3.82Å; F331-H598 HydrophobicContact CE1-CB 3.97Å; F331-H598 HydrophobicContact CG-CB 4.33Å; F331-H598 AromaticContact CG-CD2 3.48Å; F331-H598 VanDerWaalsContact CG-CD2 3.48Å; F331-H598 WeakPolarHBondContact CG-CD2 3.44Å; F331-H598 AromaticContact CG-CG 3.78Å; F331-H598 AromaticContact CG-NE2 3.8Å; F331-H598 HydrophobicContact CZ-CB 4.28Å
332	H	91.2	Very high	91.8	Very high	92 Å²	92	29 Å²	29	43%	0.426	13%	0.132	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.5	17.4	179.1	-57.1	-68.6	0	0	0	115.2	R330 D334 M499 H598 E601	R330-H332 VanDerWaalsContact C-N 3.35Å; R330-H332 PolarHBondContact O-N 2.96Å; H332-D334 PolarHBondContact O-N 3.24Å; H332-M499 VanDerWaalsContact CA-O 3.3Å; H332-M499 WeakPolarHBondContact CA-O 3.44Å; H332-H598 AromaticContact NE2-CE1 3.82Å; H332-H598 AromaticContact NE2-ND1 3.76Å; H332-E601 IonicContact CE1-OE1 2.68Å; H332-E601 IonicContact CE1-OE2 2.71Å; H332-E601 PolarHBondContact CE1-OE2 2.93Å; H332-E601 VanDerWaalsContact CE1-OE2 3.28Å; H332-E601 IonicContact NE2-OE1 3.76Å; H332-E601 PolarHBondContact NE2-OE1 2.82Å; H332-E601 VanDerWaalsContact NE2-OE1 3.16Å; H332-E601 IonicContact NE2-OE2 2.73Å
333	S	91.1	Very high	91.9	Very high	24 Å²	24	29.3 Å²	29.3	17%	0.168	13%	0.134	C	C	.	.	S	Bend	trans	-65.8	135.3	169.3	-77.1	0	0	0	0	109.9	Q101 R330 F331 C335	Q101-S333 PolarHBondContact NE2-O 3.22Å; R330-S333 WeakPolarHBondContact O-CB 3.13Å; R330-S333 PolarHBondContact O-N 2.94Å; R330-S333 VanDerWaalsContact O-N 3.14Å; R330-S333 PolarHBondContact O-OG 3.08Å; F331-S333 VanDerWaalsContact C-N 3.3Å; F331-S333 PolarHBondContact O-N 3.43Å; S333-C335 VanDerWaalsContact C-N 3.34Å; S333-C335 PolarHBondContact O-N 3.26Å
334	D	93	Very high	92	Very high	19 Å²	19	33 Å²	33	10%	0.102	16%	0.156	C	C	.	.			trans	-72.5	87.9	179.3	-170.1	-25.9	0	0	0	111.2	R45 H332 F336 K337 D338 Y502	R45-D334 PolarHBondContact NH2-O 3.32Å; H332-D334 PolarHBondContact O-N 3.24Å; D334-F336 VanDerWaalsContact C-N 3.26Å; D334-F336 PolarHBondContact O-N 3.42Å; D334-F336 PolarHBondContact OD1-N 3.1Å; D334-K337 HydrophobicContact CB-CB 4.32Å; D334-K337 HydrophobicContact CB-CD 4.3Å; D334-K337 HydrophobicContact CB-CG 4.43Å; D334-K337 PolarHBondContact O-N 3.18Å; D334-K337 PolarHBondContact OD1-N 3.45Å; D334-K337 WeakPolarHBondContact OD2-CD 3.42Å; D334-K337 VanDerWaalsContact OD2-CE 3.23Å; D334-K337 WeakPolarHBondContact OD2-CE 3.29Å; D334-K337 WeakPolarHBondContact OD2-CG 2.96Å; D334-K337 IonicContact OD2-NZ 2.7Å; D334-K337 PolarHBondContact OD2-NZ 3.5Å; D334-D338 PolarHBondContact O-N 3.06Å; D334-D338 VanDerWaalsContact O-N 3.17Å; D334-Y502 VanDerWaalsContact CG-OH 3.31Å; D334-Y502 PolarHBondContact OD1-OH 3.3Å; D334-Y502 VanDerWaalsContact OD1-OH 3.05Å; D334-Y502 PolarHBondContact OD2-OH 3.46Å
335	C	93.1	Very high	92.3	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-66.9	-25.4	-178	61.4	0	0	0	0	113	Y97 S333 D338 V339 L496	Y97-C335 HydrophobicContact CD1-CB 3.76Å; Y97-C335 HydrophobicContact CE1-CB 3.93Å; S333-C335 VanDerWaalsContact C-N 3.34Å; S333-C335 PolarHBondContact O-N 3.26Å; C335-D338 PolarHBondContact O-N 2.84Å; C335-V339 VanDerWaalsContact O-CG2 3.26Å; C335-V339 WeakPolarHBondContact O-CG2 3.28Å; C335-V339 PolarHBondContact O-N 3.35Å; C335-L496 WeakPolarHBondContact SG-CD1 3.38Å
336	F	93.2	Very high	92.5	Very high	29 Å²	29	33 Å²	33	13%	0.127	16%	0.157	C	C	.	.	H	α-helix	trans	-66.5	-46.7	175.7	178.2	-112.3	0	0	0	110.6	L94 D334 D338 V339 I340 L504 P505 W510	L94-F336 HydrophobicContact CD1-CB 4.43Å; L94-F336 HydrophobicContact CD1-CD2 4.2Å; L94-F336 HydrophobicContact CD2-CD2 3.92Å; L94-F336 HydrophobicContact CD2-CE2 4.41Å; D334-F336 VanDerWaalsContact C-N 3.26Å; D334-F336 PolarHBondContact O-N 3.42Å; D334-F336 PolarHBondContact OD1-N 3.1Å; F336-D338 VanDerWaalsContact C-N 3.28Å; F336-D338 PolarHBondContact O-N 2.77Å; F336-V339 PolarHBondContact O-N 3.16Å; F336-I340 HydrophobicContact CD2-CG1 4.49Å; F336-I340 HydrophobicContact CE1-CG1 4.27Å; F336-I340 HydrophobicContact CE2-CD1 4.16Å; F336-I340 HydrophobicContact CE2-CG1 4.1Å; F336-I340 HydrophobicContact CZ-CD1 4.15Å; F336-I340 HydrophobicContact CZ-CG1 3.98Å; F336-I340 WeakPolarHBondContact O-CG1 3.3Å; F336-I340 PolarHBondContact O-N 3.36Å; F336-L504 HydrophobicContact CB-CD2 3.99Å; F336-L504 HydrophobicContact CD1-CD2 4.15Å; F336-L504 HydrophobicContact CD2-CD2 3.31Å; F336-L504 HydrophobicContact CE2-CD2 3.75Å; F336-L504 HydrophobicContact CG-CD2 3.54Å; F336-L504 HydrophobicContact CZ-CD2 4.33Å; F336-P505 HydrophobicContact CE1-CG 4.12Å; F336-P505 HydrophobicContact CZ-CG 4.17Å; F336-W510 AromaticContact CE2-CH2 3.84Å; F336-W510 HydrophobicContact CE2-CH2 3.84Å; F336-W510 AromaticContact CE2-CZ2 3.62Å; F336-W510 HydrophobicContact CE2-CZ2 3.62Å; F336-W510 HydrophobicContact CZ-CZ2 4.12Å
337	K	93.7	Very high	92.6	Very high	116 Å²	116	35.2 Å²	35.2	50%	0.504	17%	0.167	S	C	.	.	H	α-helix	trans	-62	-37.1	174	-72.7	-178	-174.8	121.6	0	112.2	D334 F341	D334-K337 HydrophobicContact CB-CB 4.32Å; D334-K337 HydrophobicContact CB-CD 4.3Å; D334-K337 HydrophobicContact CB-CG 4.43Å; D334-K337 PolarHBondContact O-N 3.18Å; D334-K337 PolarHBondContact OD1-N 3.45Å; D334-K337 WeakPolarHBondContact OD2-CD 3.42Å; D334-K337 VanDerWaalsContact OD2-CE 3.23Å; D334-K337 WeakPolarHBondContact OD2-CE 3.29Å; D334-K337 WeakPolarHBondContact OD2-CG 2.96Å; D334-K337 IonicContact OD2-NZ 2.7Å; D334-K337 PolarHBondContact OD2-NZ 3.5Å; K337-F341 WeakPolarHBondContact O-CB 3.47Å; K337-F341 PolarHBondContact O-N 3.42Å
338	D	94.8	Very high	92.8	Very high	1 Å²	1	39.6 Å²	39.6	1%	0.005	19%	0.189	C	C	.	.	H	α-helix	trans	-62.3	-48.9	176.5	-68.5	-24	0	0	0	111.2	R45 L49 Y97 D334 C335 F336 I340 F341 L342	R45-D338 IonicContact CZ-OD1 2.95Å; R45-D338 IonicContact NE-OD1 3.24Å; R45-D338 PolarHBondContact NE-OD1 3.2Å; R45-D338 IonicContact NE-OD2 3.21Å; R45-D338 IonicContact NH2-OD1 3.98Å; R45-D338 PolarHBondContact NH2-OD1 3.15Å; L49-D338 HydrophobicContact CD2-CB 3.75Å; Y97-D338 HydrophobicContact CE1-CB 4.19Å; D334-D338 PolarHBondContact O-N 3.06Å; D334-D338 VanDerWaalsContact O-N 3.17Å; C335-D338 PolarHBondContact O-N 2.84Å; F336-D338 VanDerWaalsContact C-N 3.28Å; F336-D338 PolarHBondContact O-N 2.77Å; D338-I340 PolarHBondContact O-N 3.37Å; D338-F341 WeakPolarHBondContact O-CB 3.42Å; D338-F341 PolarHBondContact O-N 3.19Å; D338-L342 VanDerWaalsContact O-CG 3.28Å; D338-L342 WeakPolarHBondContact O-CG 3.38Å; D338-L342 PolarHBondContact O-N 2.94Å
339	V	94.6	Very high	93	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-62.6	-42.4	179.4	171.3	0	0	0	0	111.9	L93 L94 Y97 C335 F336 F341 L342 C343	L93-V339 HydrophobicContact CB-CG1 4.25Å; L93-V339 HydrophobicContact CD2-CG1 4.12Å; L93-V339 HydrophobicContact CG-CG1 4.09Å; L93-V339 HydrophobicContact CG-CG2 4.43Å; L94-V339 HydrophobicContact CB-CG1 4.22Å; L94-V339 HydrophobicContact CD1-CB 4.33Å; L94-V339 HydrophobicContact CD1-CG2 4.03Å; Y97-V339 HydrophobicContact CD1-CG2 4.3Å; Y97-V339 HydrophobicContact CD2-CG2 4.42Å; Y97-V339 HydrophobicContact CG-CG2 3.94Å; C335-V339 VanDerWaalsContact O-CG2 3.26Å; C335-V339 WeakPolarHBondContact O-CG2 3.28Å; C335-V339 PolarHBondContact O-N 3.35Å; F336-V339 PolarHBondContact O-N 3.16Å; V339-F341 VanDerWaalsContact C-N 3.34Å; V339-F341 PolarHBondContact O-N 3.21Å; V339-L342 PolarHBondContact O-N 3.09Å; V339-C343 PolarHBondContact O-N 3.45Å; V339-C343 PolarHBondContact O-SG 2.89Å; V339-C343 VanDerWaalsContact O-SG 3.33Å
340	I	93.7	Very high	93	Very high	66 Å²	66	40.8 Å²	40.8	34%	0.338	19%	0.194	S	C	.	.	H	α-helix	trans	-62	-42.9	175.3	-64.7	-61.5	0	0	0	111.1	V90 F336 D338 L342 C343 V344	V90-I340 HydrophobicContact CG1-CD1 4.16Å; F336-I340 HydrophobicContact CD2-CG1 4.49Å; F336-I340 HydrophobicContact CE1-CG1 4.27Å; F336-I340 HydrophobicContact CE2-CD1 4.16Å; F336-I340 HydrophobicContact CE2-CG1 4.1Å; F336-I340 HydrophobicContact CZ-CD1 4.15Å; F336-I340 HydrophobicContact CZ-CG1 3.98Å; F336-I340 WeakPolarHBondContact O-CG1 3.3Å; F336-I340 PolarHBondContact O-N 3.36Å; D338-I340 PolarHBondContact O-N 3.37Å; I340-L342 VanDerWaalsContact C-N 3.33Å; I340-L342 PolarHBondContact O-N 3.29Å; I340-C343 PolarHBondContact O-N 3.48Å; I340-V344 HydrophobicContact CG2-CG2 4.39Å; I340-V344 VanDerWaalsContact O-CG2 3.31Å; I340-V344 WeakPolarHBondContact O-CG2 3.19Å; I340-V344 PolarHBondContact O-N 3.41Å
341	F	94.9	Very high	93.2	Very high	100 Å²	100	37.6 Å²	37.6	44%	0.439	19%	0.186	S	C	.	.	H	α-helix	trans	-60.3	-42.8	175.5	173.8	-91.4	0	0	0	111.9	L49 V53 K337 D338 V339 S345	L49-F341 HydrophobicContact CB-CD1 4.36Å; L49-F341 HydrophobicContact CB-CE1 4.11Å; L49-F341 HydrophobicContact CD1-CD1 4.1Å; L49-F341 HydrophobicContact CD1-CE1 4.31Å; L49-F341 HydrophobicContact CD2-CD1 3.94Å; L49-F341 HydrophobicContact CG-CD1 4.37Å; V53-F341 HydrophobicContact CG2-CE1 3.96Å; K337-F341 WeakPolarHBondContact O-CB 3.47Å; K337-F341 PolarHBondContact O-N 3.42Å; D338-F341 WeakPolarHBondContact O-CB 3.42Å; D338-F341 PolarHBondContact O-N 3.19Å; V339-F341 VanDerWaalsContact C-N 3.34Å; V339-F341 PolarHBondContact O-N 3.21Å; F341-S345 VanDerWaalsContact O-CB 3.29Å; F341-S345 WeakPolarHBondContact O-CB 3.28Å; F341-S345 PolarHBondContact O-N 2.78Å; F341-S345 PolarHBondContact O-OG 2.92Å
342	L	94.2	Very high	93.4	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-62.1	-46.9	178	-69.9	178.4	0	0	0	112	L49 C52 V53 L56 L93 Y97 F322 D338 V339 I340 S345 D346	L49-L342 HydrophobicContact CD2-CD2 4.35Å; L49-L342 HydrophobicContact CD2-CG 4.44Å; C52-L342 HydrophobicContact CB-CD1 3.93Å; C52-L342 HydrophobicContact CB-CD2 3.44Å; C52-L342 VanDerWaalsContact CB-CD2 3.44Å; C52-L342 HydrophobicContact CB-CG 4.34Å; V53-L342 HydrophobicContact CG2-CD2 3.8Å; L56-L342 HydrophobicContact CD1-CB 3.96Å; L56-L342 HydrophobicContact CD1-CD2 4.02Å; L56-L342 HydrophobicContact CD1-CG 4.49Å; L93-L342 HydrophobicContact CD2-CB 4.4Å; Y97-L342 HydrophobicContact CD2-CD1 4.32Å; Y97-L342 HydrophobicContact CE2-CD1 4.02Å; F322-L342 HydrophobicContact CD1-CD1 4.44Å; F322-L342 HydrophobicContact CE1-CD1 3.98Å; D338-L342 VanDerWaalsContact O-CG 3.28Å; D338-L342 WeakPolarHBondContact O-CG 3.38Å; D338-L342 PolarHBondContact O-N 2.94Å; V339-L342 PolarHBondContact O-N 3.09Å; I340-L342 VanDerWaalsContact C-N 3.33Å; I340-L342 PolarHBondContact O-N 3.29Å; L342-S345 PolarHBondContact O-N 2.98Å; L342-D346 WeakPolarHBondContact O-CB 3.16Å; L342-D346 PolarHBondContact O-N 2.89Å
343	C	93.4	Very high	93.5	Very high	6 Å²	6	35.2 Å²	35.2	4%	0.041	18%	0.175	C	C	.	.	H	α-helix	trans	-67.5	-38.3	179.3	-63.3	0	0	0	0	113.1	L85 V90 L315 V339 I340 S345 F347	L85-C343 HydrophobicContact CD2-CB 4.38Å; V90-C343 HydrophobicContact CG2-CB 3.88Å; V90-C343 WeakPolarHBondContact CG2-SG 3.43Å; L315-C343 VanDerWaalsContact CD1-SG 3.59Å; V339-C343 PolarHBondContact O-N 3.45Å; V339-C343 PolarHBondContact O-SG 2.89Å; V339-C343 VanDerWaalsContact O-SG 3.33Å; I340-C343 PolarHBondContact O-N 3.48Å; C343-S345 VanDerWaalsContact C-N 3.34Å; C343-F347 PolarHBondContact O-N 3.47Å
344	V	94.1	Very high	93.6	Very high	78 Å²	78	34 Å²	34	47%	0.473	17%	0.167	S	C	.	.	H	α-helix	trans	-65.8	-41.2	174.8	171.2	0	0	0	0	110.6	I340 F347 I348	I340-V344 HydrophobicContact CG2-CG2 4.39Å; I340-V344 VanDerWaalsContact O-CG2 3.31Å; I340-V344 WeakPolarHBondContact O-CG2 3.19Å; I340-V344 PolarHBondContact O-N 3.41Å; V344-F347 PolarHBondContact O-N 3.41Å; V344-I348 HydrophobicContact CG1-CD1 3.74Å; V344-I348 HydrophobicContact CG1-CG1 4.44Å; V344-I348 VanDerWaalsContact O-CG1 3.3Å; V344-I348 WeakPolarHBondContact O-CG1 3.22Å; V344-I348 PolarHBondContact O-N 2.97Å
345	S	93.3	Very high	93.7	Very high	13 Å²	13	34.5 Å²	34.5	9%	0.091	17%	0.169	C	C	.	.	H	α-helix	trans	-63	-46.9	177.2	-60.3	0	0	0	0	111.5	F341 L342 C343 F347 I348 F349	F341-S345 VanDerWaalsContact O-CB 3.29Å; F341-S345 WeakPolarHBondContact O-CB 3.28Å; F341-S345 PolarHBondContact O-N 2.78Å; F341-S345 PolarHBondContact O-OG 2.92Å; L342-S345 PolarHBondContact O-N 2.98Å; C343-S345 VanDerWaalsContact C-N 3.34Å; S345-F347 PolarHBondContact O-N 2.92Å; S345-I348 PolarHBondContact O-N 2.75Å; S345-F349 WeakPolarHBondContact O-CD2 3.33Å; S345-F349 WeakPolarHBondContact O-CG 3.44Å; S345-F349 PolarHBondContact O-N 3.01Å
346	D	92.7	Very high	93.8	Very high	4 Å²	4	34.6 Å²	34.6	2%	0.021	17%	0.169	C	C	.	.	H	α-helix	trans	-55	-49	174.7	176	71	0	0	0	111.8	L56 H61 Y81 S314 L315 L342 I348 F349 S350	L56-D346 HydrophobicContact CD1-CB 4.39Å; H61-D346 IonicContact CE1-OD1 2.84Å; H61-D346 IonicContact NE2-OD1 3.76Å; H61-D346 PolarHBondContact NE2-OD1 3.29Å; H61-D346 VanDerWaalsContact NE2-OD1 3.07Å; Y81-D346 PolarHBondContact OH-OD2 3.24Å; S314-D346 PolarHBondContact OG-OD1 2.86Å; S314-D346 PolarHBondContact OG-OD2 3.12Å; L315-D346 HydrophobicContact CD2-CB 3.65Å; L315-D346 VanDerWaalsContact CD2-CG 3.49Å; L315-D346 WeakPolarHBondContact CD2-OD2 3.07Å; L342-D346 WeakPolarHBondContact O-CB 3.16Å; L342-D346 PolarHBondContact O-N 2.89Å; D346-I348 PolarHBondContact O-N 3.38Å; D346-F349 PolarHBondContact O-N 3.45Å; D346-S350 WeakPolarHBondContact O-CB 3.14Å; D346-S350 PolarHBondContact O-N 3.36Å; D346-S350 PolarHBondContact O-OG 3.23Å
347	F	93.6	Very high	93.9	Very high	46 Å²	46	33.3 Å²	33.3	20%	0.202	16%	0.164	C	C	.	.	H	α-helix	trans	-61.7	-45.1	178.5	-179.2	-94.8	0	0	0	112.7	F78 Y81 L82 L85 C343 V344 S345 L351	F78-F347 HydrophobicContact CB-CE2 4.42Å; F78-F347 HydrophobicContact CD1-CD2 4.39Å; F78-F347 AromaticContact CD1-CE2 3.72Å; F78-F347 HydrophobicContact CD1-CE2 3.72Å; F78-F347 HydrophobicContact CD1-CZ 4.13Å; Y81-F347 HydrophobicContact CD1-CD2 4.05Å; Y81-F347 HydrophobicContact CD1-CE2 4.23Å; Y81-F347 AromaticContact CE1-CD2 3.89Å; Y81-F347 HydrophobicContact CE1-CD2 3.89Å; Y81-F347 HydrophobicContact CE1-CE2 4.48Å; L82-F347 HydrophobicContact CB-CD2 4.4Å; L82-F347 HydrophobicContact CB-CE2 3.86Å; L82-F347 HydrophobicContact CD1-CD2 3.88Å; L82-F347 HydrophobicContact CD1-CE2 3.93Å; L82-F347 HydrophobicContact CD1-CG 4.37Å; L82-F347 HydrophobicContact CD1-CZ 4.47Å; L82-F347 HydrophobicContact CD2-CE2 4.45Å; L82-F347 HydrophobicContact CD2-CZ 4.45Å; L82-F347 HydrophobicContact CG-CE2 4.29Å; L85-F347 HydrophobicContact CD2-CB 4.17Å; C343-F347 PolarHBondContact O-N 3.47Å; V344-F347 PolarHBondContact O-N 3.41Å; S345-F347 PolarHBondContact O-N 2.92Å; F347-L351 WeakPolarHBondContact O-CB 3.48Å; F347-L351 PolarHBondContact O-N 3.11Å
348	I	93.7	Very high	93.9	Very high	92 Å²	92	28 Å²	28	47%	0.472	14%	0.141	S	C	.	.	H	α-helix	trans	-64.4	-47.4	-179.8	-70	170	0	0	0	110.7	V344 S345 D346 L351 F352	V344-I348 HydrophobicContact CG1-CD1 3.74Å; V344-I348 HydrophobicContact CG1-CG1 4.44Å; V344-I348 VanDerWaalsContact O-CG1 3.3Å; V344-I348 WeakPolarHBondContact O-CG1 3.22Å; V344-I348 PolarHBondContact O-N 2.97Å; S345-I348 PolarHBondContact O-N 2.75Å; D346-I348 PolarHBondContact O-N 3.38Å; I348-L351 PolarHBondContact O-N 3.37Å; I348-F352 WeakPolarHBondContact O-CB 3.28Å; I348-F352 PolarHBondContact O-N 2.81Å
349	F	91.9	Very high	93.9	Very high	46 Å²	46	28 Å²	28	20%	0.202	14%	0.141	C	C	.	.	H	α-helix	trans	-66.6	-40.2	179.5	-63.9	-41.6	0	0	0	111.8	V53 Q267 S345 D346 L351 F352 V353	V53-F349 HydrophobicContact CG1-CD2 4.07Å; V53-F349 HydrophobicContact CG1-CE2 3.4Å; V53-F349 HydrophobicContact CG1-CZ 4.31Å; Q267-F349 VanDerWaalsContact CD-CD1 3.44Å; Q267-F349 HydrophobicContact CG-CD1 4.14Å; Q267-F349 HydrophobicContact CG-CE1 3.76Å; Q267-F349 HydrophobicContact CG-CZ 4.26Å; Q267-F349 VanDerWaalsContact OE1-CD1 3.27Å; S345-F349 WeakPolarHBondContact O-CD2 3.33Å; S345-F349 WeakPolarHBondContact O-CG 3.44Å; S345-F349 PolarHBondContact O-N 3.01Å; D346-F349 PolarHBondContact O-N 3.45Å; F349-L351 PolarHBondContact O-N 2.61Å; F349-F352 PolarHBondContact O-N 3.42Å; F349-V353 WeakPolarHBondContact O-CB 3.46Å; F349-V353 WeakPolarHBondContact O-CG2 3.2Å; F349-V353 PolarHBondContact O-N 3.46Å
350	S	92.5	Very high	93.9	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-57.3	-47.5	173.7	-73.3	0	0	0	0	112.5	H61 L65 Y81 D346 F352 C354	H61-S350 PolarHBondContact CD2-OG 3.2Å; L65-S350 VanDerWaalsContact CD1-CB 3.41Å; L65-S350 WeakPolarHBondContact CD1-OG 3.47Å; Y81-S350 PolarHBondContact OH-OG 2.95Å; D346-S350 WeakPolarHBondContact O-CB 3.14Å; D346-S350 PolarHBondContact O-N 3.36Å; D346-S350 PolarHBondContact O-OG 3.23Å; S350-F352 VanDerWaalsContact C-N 3.35Å; S350-C354 PolarHBondContact O-N 2.9Å
351	L	93.7	Very high	93.9	Very high	54 Å²	54	25 Å²	25	28%	0.283	13%	0.125	S	C	.	.	H	α-helix	trans	-63.3	-43.2	175.8	-178.1	63.6	0	0	0	111.3	F78 F290 F347 I348 F349 C354 L355	F78-L351 HydrophobicContact CD1-CB 4.48Å; F78-L351 HydrophobicContact CD1-CD1 4.18Å; F78-L351 HydrophobicContact CD2-CD1 4.27Å; F78-L351 HydrophobicContact CE1-CB 3.91Å; F78-L351 HydrophobicContact CE1-CD1 4.02Å; F78-L351 HydrophobicContact CE2-CD1 4.12Å; F78-L351 HydrophobicContact CG-CD1 4.3Å; F78-L351 HydrophobicContact CZ-CB 4.31Å; F78-L351 HydrophobicContact CZ-CD1 3.99Å; F290-L351 HydrophobicContact CE1-CD1 3.82Å; F290-L351 HydrophobicContact CZ-CD1 3.71Å; F347-L351 WeakPolarHBondContact O-CB 3.48Å; F347-L351 PolarHBondContact O-N 3.11Å; I348-L351 PolarHBondContact O-N 3.37Å; F349-L351 PolarHBondContact O-N 2.61Å; L351-C354 WeakPolarHBondContact O-CB 3.37Å; L351-C354 PolarHBondContact O-N 3.2Å; L351-L355 WeakPolarHBondContact O-CG 3.14Å; L351-L355 PolarHBondContact O-N 3.32Å
352	F	94.2	Very high	93.9	Very high	43 Å²	43	20.4 Å²	20.4	19%	0.189	11%	0.107	C	C	.	.	H	α-helix	trans	-64.7	-44.5	-178.5	-173.2	-125.9	0	0	0	112.4	L270 L271 F274 I348 F349 S350 C354 L355 V356	L270-F352 HydrophobicContact CB-CD1 4.37Å; L270-F352 HydrophobicContact CB-CE1 3.7Å; L271-F352 HydrophobicContact CB-CE1 4.48Å; L271-F352 HydrophobicContact CB-CZ 4.04Å; L271-F352 HydrophobicContact CD1-CE2 4.44Å; L271-F352 HydrophobicContact CD1-CZ 3.99Å; F274-F352 HydrophobicContact CB-CE2 4.48Å; F274-F352 HydrophobicContact CB-CZ 4.39Å; F274-F352 HydrophobicContact CD1-CE2 4.03Å; F274-F352 HydrophobicContact CG-CE2 4.3Å; I348-F352 WeakPolarHBondContact O-CB 3.28Å; I348-F352 PolarHBondContact O-N 2.81Å; F349-F352 PolarHBondContact O-N 3.42Å; S350-F352 VanDerWaalsContact C-N 3.35Å; F352-C354 VanDerWaalsContact C-N 3.31Å; F352-C354 PolarHBondContact O-N 2.92Å; F352-L355 WeakPolarHBondContact O-CB 3.39Å; F352-L355 PolarHBondContact O-N 3.45Å; F352-L355 VanDerWaalsContact O-N 3.11Å; F352-V356 HydrophobicContact CD1-CG2 4.46Å; F352-V356 HydrophobicContact CD2-CG2 4.45Å; F352-V356 HydrophobicContact CE1-CG2 4.24Å; F352-V356 HydrophobicContact CE2-CG2 4.21Å; F352-V356 HydrophobicContact CZ-CG2 4.1Å; F352-V356 VanDerWaalsContact O-CG2 3.28Å; F352-V356 WeakPolarHBondContact O-CG2 3.43Å; F352-V356 PolarHBondContact O-N 2.94Å
353	V	93.6	Very high	93.8	Very high	2 Å²	2	20.6 Å²	20.6	1%	0.012	11%	0.108	C	C	.	.	H	α-helix	trans	-59.3	-42.7	175.6	172.2	0	0	0	0	110.9	F57 H61 L62 P66 L270 F349 L355 V356 T357	F57-V353 HydrophobicContact CE2-CG2 3.52Å; F57-V353 HydrophobicContact CZ-CG2 4.04Å; H61-V353 WeakPolarHBondContact O-CG1 3.48Å; L62-V353 HydrophobicContact CD2-CG1 4.36Å; P66-V353 HydrophobicContact CG-CG1 4.37Å; L270-V353 HydrophobicContact CD1-CG2 4.1Å; F349-V353 WeakPolarHBondContact O-CB 3.46Å; F349-V353 WeakPolarHBondContact O-CG2 3.2Å; F349-V353 PolarHBondContact O-N 3.46Å; V353-L355 PolarHBondContact O-N 3.32Å; V353-V356 PolarHBondContact O-N 3.32Å; V353-T357 WeakPolarHBondContact O-CB 3.09Å; V353-T357 PolarHBondContact O-N 3.5Å; V353-T357 PolarHBondContact O-OG1 3.2Å; V353-T357 VanDerWaalsContact O-OG1 3.06Å
354	C	94.3	Very high	93.8	Very high	0 Å²	0	20.3 Å²	20.3	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-58.9	-45.5	173.2	-75.6	0	0	0	0	112.3	F78 F290 S350 L351 F352 V356 T357 Y358	F78-C354 HydrophobicContact CE2-CB 4.27Å; F78-C354 HydrophobicContact CZ-CB 4.14Å; F290-C354 HydrophobicContact CE2-CB 3.87Å; F290-C354 HydrophobicContact CZ-CB 4.24Å; S350-C354 PolarHBondContact O-N 2.9Å; L351-C354 WeakPolarHBondContact O-CB 3.37Å; L351-C354 PolarHBondContact O-N 3.2Å; F352-C354 VanDerWaalsContact C-N 3.31Å; F352-C354 PolarHBondContact O-N 2.92Å; C354-V356 VanDerWaalsContact C-N 3.35Å; C354-V356 PolarHBondContact O-N 3.46Å; C354-T357 PolarHBondContact O-N 2.82Å; C354-Y358 WeakPolarHBondContact O-CB 3.48Å; C354-Y358 WeakPolarHBondContact O-CD2 3.15Å; C354-Y358 PolarHBondContact O-N 3.02Å
355	L	95.1	Very high	93.6	Very high	29 Å²	29	17.5 Å²	17.5	15%	0.152	9%	0.09	C	C	.	.	H	α-helix	trans	-61.4	-42.5	177.2	-68	171.8	0	0	0	112	F274 V287 F290 F291 L351 F352 V353 S359	F274-L355 HydrophobicContact CE2-CB 4.02Å; F274-L355 HydrophobicContact CZ-CB 4.29Å; V287-L355 HydrophobicContact CG1-CD2 4.2Å; F290-L355 HydrophobicContact CD1-CD2 3.55Å; F290-L355 HydrophobicContact CE1-CD2 3.84Å; F290-L355 HydrophobicContact CG-CD2 4.27Å; F291-L355 HydrophobicContact CE2-CD2 4Å; F291-L355 HydrophobicContact CZ-CD2 4.05Å; L351-L355 WeakPolarHBondContact O-CG 3.14Å; L351-L355 PolarHBondContact O-N 3.32Å; F352-L355 WeakPolarHBondContact O-CB 3.39Å; F352-L355 PolarHBondContact O-N 3.45Å; F352-L355 VanDerWaalsContact O-N 3.11Å; V353-L355 PolarHBondContact O-N 3.32Å; L355-S359 WeakPolarHBondContact O-CB 3.3Å; L355-S359 PolarHBondContact O-N 3.48Å; L355-S359 PolarHBondContact O-OG 3.43Å
356	V	94.9	Very high	93.4	Very high	1 Å²	1	20.1 Å²	20.1	1%	0.006	11%	0.109	C	C	.	.	H	α-helix	trans	-62.6	-52.8	176.2	-177.2	0	0	0	0	110.4	L270 F274 F352 V353 C354 Y358 S359 V360	L270-V356 HydrophobicContact CB-CG2 4.4Å; L270-V356 HydrophobicContact CD2-CG1 4.19Å; F274-V356 HydrophobicContact CB-CG2 3.82Å; F274-V356 HydrophobicContact CD2-CG2 4.12Å; F274-V356 HydrophobicContact CG-CG2 4.18Å; F352-V356 HydrophobicContact CD1-CG2 4.46Å; F352-V356 HydrophobicContact CD2-CG2 4.45Å; F352-V356 HydrophobicContact CE1-CG2 4.24Å; F352-V356 HydrophobicContact CE2-CG2 4.21Å; F352-V356 HydrophobicContact CZ-CG2 4.1Å; F352-V356 VanDerWaalsContact O-CG2 3.28Å; F352-V356 WeakPolarHBondContact O-CG2 3.43Å; F352-V356 PolarHBondContact O-N 2.94Å; V353-V356 PolarHBondContact O-N 3.32Å; C354-V356 VanDerWaalsContact C-N 3.35Å; C354-V356 PolarHBondContact O-N 3.46Å; V356-Y358 PolarHBondContact O-N 3.01Å; V356-S359 PolarHBondContact O-N 3.12Å; V356-S359 VanDerWaalsContact O-N 3.11Å; V356-S359 PolarHBondContact O-OG 2.84Å; V356-V360 HydrophobicContact CG1-CG2 4.39Å; V356-V360 WeakPolarHBondContact O-CG2 3.48Å; V356-V360 PolarHBondContact O-N 3.2Å
357	T	94.2	Very high	93.1	Very high	3 Å²	3	22.2 Å²	22.2	2%	0.018	12%	0.119	C	C	.	.	H	α-helix	trans	-59.3	-44.2	-179.5	-60	0	0	0	0	112.1	P66 V353 C354 S359 V360 C361 L376 L382 F387	P66-T357 HydrophobicContact CB-CG2 3.57Å; P66-T357 HydrophobicContact CG-CG2 3.9Å; V353-T357 WeakPolarHBondContact O-CB 3.09Å; V353-T357 PolarHBondContact O-N 3.5Å; V353-T357 PolarHBondContact O-OG1 3.2Å; V353-T357 VanDerWaalsContact O-OG1 3.06Å; C354-T357 PolarHBondContact O-N 2.82Å; T357-S359 VanDerWaalsContact C-N 3.33Å; T357-S359 PolarHBondContact O-N 3.33Å; T357-V360 PolarHBondContact O-N 2.94Å; T357-C361 WeakPolarHBondContact O-CB 3.12Å; T357-C361 PolarHBondContact O-N 3.2Å; T357-C361 PolarHBondContact O-SG 3.13Å; T357-C361 VanDerWaalsContact O-SG 3.36Å; T357-L376 HydrophobicContact CG2-CD2 3.61Å; T357-L382 HydrophobicContact CG2-CD1 4.28Å; T357-L382 HydrophobicContact CG2-CD2 4.06Å; T357-F387 HydrophobicContact CG2-CE2 3.89Å; T357-F387 HydrophobicContact CG2-CZ 4.19Å; T357-F387 WeakPolarHBondContact OG1-CZ 3.22Å
358	Y	94.8	Very high	92.7	Very high	4 Å²	4	21.5 Å²	21.5	2%	0.016	12%	0.118	C	C	.	.	H	α-helix	trans	-63.8	-38.3	176.6	-87.5	-116	0	0	0	111.9	P66 A69 S70 G286 F290 C354 V356 G362 F372 L376	P66-Y358 HydrophobicContact CB-CE2 4.46Å; A69-Y358 HydrophobicContact CB-CE2 4.3Å; S70-Y358 WeakPolarHBondContact CA-OH 3.33Å; S70-Y358 PolarHBondContact N-OH 3.35Å; G286-Y358 VanDerWaalsContact CA-O 3.3Å; G286-Y358 WeakPolarHBondContact CA-O 3.3Å; F290-Y358 HydrophobicContact CB-CD1 3.45Å; F290-Y358 VanDerWaalsContact CB-CD1 3.45Å; F290-Y358 HydrophobicContact CB-CE1 3.9Å; F290-Y358 HydrophobicContact CB-CG 3.91Å; F290-Y358 AromaticContact CD2-CD1 3.97Å; F290-Y358 HydrophobicContact CD2-CD1 3.97Å; F290-Y358 HydrophobicContact CD2-CD2 4.03Å; F290-Y358 AromaticContact CD2-CE1 3.87Å; F290-Y358 HydrophobicContact CD2-CE1 3.87Å; F290-Y358 AromaticContact CD2-CE2 3.93Å; F290-Y358 HydrophobicContact CD2-CE2 3.93Å; F290-Y358 HydrophobicContact CD2-CG 4.04Å; F290-Y358 AromaticContact CD2-CZ 3.83Å; F290-Y358 HydrophobicContact CG-CD1 4.19Å; F290-Y358 HydrophobicContact CG-CE1 4.4Å; F290-Y358 HydrophobicContact CG-CG 4.37Å; C354-Y358 WeakPolarHBondContact O-CB 3.48Å; C354-Y358 WeakPolarHBondContact O-CD2 3.15Å; C354-Y358 PolarHBondContact O-N 3.02Å; V356-Y358 PolarHBondContact O-N 3.01Å; Y358-G362 PolarHBondContact O-N 3.27Å; Y358-F372 AromaticContact CD1-CE1 3.79Å; Y358-F372 HydrophobicContact CD1-CE1 3.79Å; Y358-F372 AromaticContact CD1-CZ 3.36Å; Y358-F372 HydrophobicContact CD1-CZ 3.36Å; Y358-F372 AromaticContact CE1-CE1 3.74Å; Y358-F372 HydrophobicContact CE1-CE1 3.74Å; Y358-F372 AromaticContact CE1-CZ 3.81Å; Y358-F372 HydrophobicContact CE1-CZ 3.81Å; Y358-F372 AromaticContact CG-CZ 3.9Å; Y358-F372 HydrophobicContact CG-CZ 3.9Å; Y358-L376 HydrophobicContact CD2-CD1 4.37Å; Y358-L376 HydrophobicContact CD2-CD2 4.35Å; Y358-L376 HydrophobicContact CE1-CD1 4.12Å; Y358-L376 HydrophobicContact CE2-CD1 3.9Å; Y358-L376 HydrophobicContact CE2-CD2 4.27Å
359	S	95.5	Very high	92.2	Very high	0 Å²	0	20.4 Å²	20.4	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-65.1	-39.8	175.3	75.4	0	0	0	0	112.5	C277 G283 L355 V356 T357 G362 F363	C277-S359 WeakPolarHBondContact CB-OG 3.5Å; G283-S359 WeakPolarHBondContact CA-O 3.28Å; L355-S359 WeakPolarHBondContact O-CB 3.3Å; L355-S359 PolarHBondContact O-N 3.48Å; L355-S359 PolarHBondContact O-OG 3.43Å; V356-S359 PolarHBondContact O-N 3.12Å; V356-S359 VanDerWaalsContact O-N 3.11Å; V356-S359 PolarHBondContact O-OG 2.84Å; T357-S359 VanDerWaalsContact C-N 3.33Å; T357-S359 PolarHBondContact O-N 3.33Å; S359-G362 PolarHBondContact O-N 3.16Å; S359-F363 PolarHBondContact O-N 2.98Å
360	V	94.4	Very high	91.8	Very high	3 Å²	3	20.6 Å²	20.6	2%	0.018	14%	0.135	C	C	.	.	H	α-helix	trans	-66.7	-48.7	177.4	172.3	0	0	0	0	110.6	C277 V356 T357 G362 F363 L364 F387 A390	C277-V360 WeakPolarHBondContact SG-CG2 3.43Å; V356-V360 HydrophobicContact CG1-CG2 4.39Å; V356-V360 WeakPolarHBondContact O-CG2 3.48Å; V356-V360 PolarHBondContact O-N 3.2Å; T357-V360 PolarHBondContact O-N 2.94Å; V360-G362 VanDerWaalsContact C-N 3.3Å; V360-G362 PolarHBondContact O-N 2.96Å; V360-F363 PolarHBondContact O-N 3.42Å; V360-L364 WeakPolarHBondContact O-CB 3.49Å; V360-L364 PolarHBondContact O-N 3.12Å; V360-F387 HydrophobicContact CB-CE1 4.31Å; V360-F387 HydrophobicContact CB-CZ 4.39Å; V360-F387 HydrophobicContact CG1-CD1 4.2Å; V360-F387 HydrophobicContact CG1-CE1 4.3Å; V360-F387 HydrophobicContact CG1-CG 4.33Å; V360-F387 HydrophobicContact CG2-CD1 4.32Å; V360-F387 HydrophobicContact CG2-CE1 3.83Å; V360-F387 HydrophobicContact CG2-CZ 4.27Å; V360-A390 HydrophobicContact CG1-CB 3.49Å; V360-A390 VanDerWaalsContact CG1-CB 3.49Å
361	C	93.5	Very high	91.5	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-64.2	-35	176.9	-67.5	0	0	0	0	111.9	T357 L364 A365 F372 L375 L376	T357-C361 WeakPolarHBondContact O-CB 3.12Å; T357-C361 PolarHBondContact O-N 3.2Å; T357-C361 PolarHBondContact O-SG 3.13Å; T357-C361 VanDerWaalsContact O-SG 3.36Å; C361-L364 PolarHBondContact O-N 2.9Å; C361-A365 VanDerWaalsContact O-CB 3.27Å; C361-A365 WeakPolarHBondContact O-CB 3.44Å; C361-A365 PolarHBondContact O-N 2.81Å; C361-F372 HydrophobicContact CB-CD2 4.01Å; C361-F372 HydrophobicContact CB-CE2 3.52Å; C361-F372 HydrophobicContact CB-CZ 4.26Å; C361-L375 HydrophobicContact CB-CB 4.08Å; C361-L375 HydrophobicContact CB-CD1 4.25Å; C361-L375 WeakPolarHBondContact O-CD1 3.49Å; C361-L376 HydrophobicContact CB-CD2 4.41Å; C361-L376 HydrophobicContact CB-CG 4.5Å
362	G	93.8	Very high	91.2	Very high	5 Å²	5	22.7 Å²	22.7	5%	0.052	15%	0.152	C	C	.	.	H	α-helix	trans	-67	-43.3	177.4	0	0	0	0	0	112.4	G282 Y358 S359 V360 S366	G282-G362 VanDerWaalsContact C-C 3.49Å; G282-G362 CarbonylContact C-O 3.59Å; G282-G362 CarbonylContact O-C 3.55Å; Y358-G362 PolarHBondContact O-N 3.27Å; S359-G362 PolarHBondContact O-N 3.16Å; V360-G362 VanDerWaalsContact C-N 3.3Å; V360-G362 PolarHBondContact O-N 2.96Å; G362-S366 PolarHBondContact O-N 3.5Å; G362-S366 VanDerWaalsContact O-N 3.14Å
363	F	93.7	Very high	90.7	Very high	4 Å²	4	26.9 Å²	26.9	2%	0.018	17%	0.172	C	C	.	.	H	α-helix	trans	-57.3	-52.4	169.9	160.2	-115.3	0	0	0	110.9	V280 S359 V360 A365 S366 E367 A390 R393 F394	V280-F363 HydrophobicContact CB-CD2 3.96Å; V280-F363 HydrophobicContact CB-CE2 4.23Å; V280-F363 HydrophobicContact CG1-CD2 3.34Å; V280-F363 HydrophobicContact CG1-CE2 3.27Å; V280-F363 HydrophobicContact CG1-CG 4.41Å; V280-F363 HydrophobicContact CG1-CZ 4.3Å; S359-F363 PolarHBondContact O-N 2.98Å; V360-F363 PolarHBondContact O-N 3.42Å; F363-A365 VanDerWaalsContact C-N 3.34Å; F363-A365 PolarHBondContact O-N 3.03Å; F363-S366 PolarHBondContact O-N 3.49Å; F363-S366 VanDerWaalsContact O-N 3.15Å; F363-E367 HydrophobicContact CD2-CG 3.85Å; F363-E367 HydrophobicContact CE2-CG 3.36Å; F363-E367 HydrophobicContact CZ-CG 3.95Å; F363-E367 PolarHBondContact O-N 3.27Å; F363-E367 VanDerWaalsContact O-N 3.14Å; F363-A390 HydrophobicContact CD1-CB 4.23Å; F363-A390 HydrophobicContact CE1-CB 4.26Å; F363-R393 HydrophobicContact CE1-CB 4.14Å; F363-R393 HydrophobicContact CZ-CB 3.78Å; F363-F394 AromaticContact CD1-CE1 3.87Å; F363-F394 HydrophobicContact CD1-CE1 3.87Å; F363-F394 HydrophobicContact CD1-CZ 4.22Å; F363-F394 HydrophobicContact CE1-CD1 4.06Å; F363-F394 AromaticContact CE1-CE1 3.51Å; F363-F394 HydrophobicContact CE1-CE1 3.51Å; F363-F394 HydrophobicContact CE1-CZ 4.15Å; F363-F394 HydrophobicContact CE2-CE1 4.49Å; F363-F394 HydrophobicContact CG-CE1 4.48Å; F363-F394 HydrophobicContact CZ-CD1 4.12Å; F363-F394 AromaticContact CZ-CE1 3.86Å; F363-F394 HydrophobicContact CZ-CE1 3.86Å
364	L	91.6	Very high	90.4	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-63.6	-38.5	-177	-174.1	63.3	0	0	0	112.4	W206 V360 C361 S366 E367 T368 L375 I386 E389	W206-L364 HydrophobicContact CH2-CD2 3.95Å; W206-L364 HydrophobicContact CH2-CG 4.48Å; W206-L364 HydrophobicContact CZ3-CD2 4.04Å; V360-L364 WeakPolarHBondContact O-CB 3.49Å; V360-L364 PolarHBondContact O-N 3.12Å; C361-L364 PolarHBondContact O-N 2.9Å; L364-S366 VanDerWaalsContact C-N 3.34Å; L364-S366 PolarHBondContact O-N 3.35Å; L364-E367 PolarHBondContact O-N 3.37Å; L364-T368 HydrophobicContact CD1-CG2 3.64Å; L364-T368 HydrophobicContact CG-CG2 4.05Å; L364-T368 WeakPolarHBondContact O-CB 3.34Å; L364-T368 WeakPolarHBondContact O-CG2 3.3Å; L364-T368 PolarHBondContact O-N 3.38Å; L364-T368 PolarHBondContact O-OG1 3.38Å; L364-L375 HydrophobicContact CB-CD1 4.19Å; L364-L375 HydrophobicContact CD2-CD1 4.39Å; L364-L375 HydrophobicContact CD2-CD2 4.26Å; L364-L375 HydrophobicContact CG-CD1 4.34Å; L364-I386 HydrophobicContact CD2-CG2 3.83Å; L364-E389 HydrophobicContact CD1-CG 3.79Å; L364-E389 HydrophobicContact CD2-CB 4.48Å; L364-E389 HydrophobicContact CD2-CG 4.26Å
365	A	91.1	Very high	90.1	Very high	18 Å²	18	32.2 Å²	32.2	15%	0.149	20%	0.201	C	C	.	.	H	α-helix	trans	-61	-41.7	174.7	0	0	0	0	0	112	C361 F363 E367 G369 V370 F372 L375	C361-A365 VanDerWaalsContact O-CB 3.27Å; C361-A365 WeakPolarHBondContact O-CB 3.44Å; C361-A365 PolarHBondContact O-N 2.81Å; F363-A365 VanDerWaalsContact C-N 3.34Å; F363-A365 PolarHBondContact O-N 3.03Å; A365-E367 VanDerWaalsContact C-N 3.32Å; A365-E367 PolarHBondContact O-N 2.93Å; A365-G369 WeakPolarHBondContact O-CA 3.25Å; A365-G369 PolarHBondContact O-N 3.04Å; A365-V370 WeakPolarHBondContact CB-O 3.45Å; A365-F372 HydrophobicContact CB-CB 4.3Å; A365-F372 HydrophobicContact CB-CD2 4.43Å; A365-L375 HydrophobicContact CB-CD1 3.81Å
366	S	89.8	Confident	89.8	Confident	69 Å²	69	31 Å²	31	48%	0.483	20%	0.195	S	C	.	.	H	α-helix	trans	-66.3	-33.5	178.1	-173.8	0	0	0	0	112.9	G362 F363 L364	G362-S366 PolarHBondContact O-N 3.5Å; G362-S366 VanDerWaalsContact O-N 3.14Å; F363-S366 PolarHBondContact O-N 3.49Å; F363-S366 VanDerWaalsContact O-N 3.15Å; L364-S366 VanDerWaalsContact C-N 3.34Å; L364-S366 PolarHBondContact O-N 3.35Å
367	E	86.3	Confident	89.5	Confident	47 Å²	47	32.1 Å²	32.1	22%	0.22	20%	0.201	C	C	.	.	H	α-helix	trans	-85.9	-34.5	-178.8	-65.6	-68.9	142.8	0	0	112.6	W171 F363 L364 A365	W171-E367 WeakPolarHBondContact CH2-OE2 3.45Å; W171-E367 PolarHBondContact NE1-O 3.48Å; F363-E367 HydrophobicContact CD2-CG 3.85Å; F363-E367 HydrophobicContact CE2-CG 3.36Å; F363-E367 HydrophobicContact CZ-CG 3.95Å; F363-E367 PolarHBondContact O-N 3.27Å; F363-E367 VanDerWaalsContact O-N 3.14Å; L364-E367 PolarHBondContact O-N 3.37Å; A365-E367 VanDerWaalsContact C-N 3.32Å; A365-E367 PolarHBondContact O-N 2.93Å
368	T	84.4	Confident	89.2	Confident	31 Å²	31	36.3 Å²	36.3	19%	0.19	22%	0.219	C	C	.	.	H	α-helix	trans	-91	-22.6	-177.6	56	0	0	0	0	114.1	W206 L364 V370 R393	W206-T368 HydrophobicContact CH2-CG2 4.5Å; W206-T368 HydrophobicContact CZ2-CG2 3.78Å; L364-T368 HydrophobicContact CD1-CG2 3.64Å; L364-T368 HydrophobicContact CG-CG2 4.05Å; L364-T368 WeakPolarHBondContact O-CB 3.34Å; L364-T368 WeakPolarHBondContact O-CG2 3.3Å; L364-T368 PolarHBondContact O-N 3.38Å; L364-T368 PolarHBondContact O-OG1 3.38Å; T368-V370 PolarHBondContact O-N 2.95Å; T368-V370 WeakPolarHBondContact OG1-CB 3.31Å; T368-V370 PolarHBondContact OG1-N 3.27Å; T368-V370 VanDerWaalsContact OG1-N 3.17Å; T368-R393 VanDerWaalsContact CG2-CZ 3.42Å; T368-R393 VanDerWaalsContact CG2-NH1 3.29Å
369	G	82.5	Confident	88.8	Confident	70 Å²	70	36.2 Å²	36.2	72%	0.722	22%	0.219	S	C	*	.			trans	71.5	5.9	-167.3	0	0	0	0	0	114.1	A365	A365-G369 WeakPolarHBondContact O-CA 3.25Å; A365-G369 PolarHBondContact O-N 3.04Å
370	V	84.1	Confident	88.6	Confident	50 Å²	50	36.3 Å²	36.3	30%	0.303	22%	0.22	S	C	.	.			trans	-75.2	141.1	176	175.3	0	0	0	0	110	W206 A365 T368 F372 N374 L375	W206-V370 HydrophobicContact CZ2-CB 4.46Å; W206-V370 HydrophobicContact CZ2-CG2 3.85Å; A365-V370 WeakPolarHBondContact CB-O 3.45Å; T368-V370 PolarHBondContact O-N 2.95Å; T368-V370 WeakPolarHBondContact OG1-CB 3.31Å; T368-V370 PolarHBondContact OG1-N 3.27Å; T368-V370 VanDerWaalsContact OG1-N 3.17Å; V370-F372 PolarHBondContact O-N 2.9Å; V370-N374 HydrophobicContact CG1-CB 4.24Å; V370-L375 HydrophobicContact CB-CD2 4.24Å; V370-L375 HydrophobicContact CG1-CD2 3.76Å; V370-L375 HydrophobicContact CG1-CG 4.36Å
371	A	86.6	Confident	88.5	Confident	57 Å²	57	40.3 Å²	40.3	47%	0.471	24%	0.235	S	C	.	.			trans	-57.2	128.6	176.3	0	0	0	0	0	111	E373 N374	A371-E373 VanDerWaalsContact C-N 3.26Å; A371-E373 PolarHBondContact O-N 3.45Å; A371-N374 WeakPolarHBondContact O-CB 3.33Å; A371-N374 PolarHBondContact O-N 3.29Å
372	F	86.3	Confident	88.5	Confident	40 Å²	40	40.3 Å²	40.3	18%	0.175	24%	0.235	C	C	.	.	G	3₁₀ helix	trans	-51.8	-41.2	-176.6	176.5	-98.8	0	0	0	113.6	Y358 C361 A365 V370 N374 L375 L376	Y358-F372 AromaticContact CD1-CE1 3.79Å; Y358-F372 HydrophobicContact CD1-CE1 3.79Å; Y358-F372 AromaticContact CD1-CZ 3.36Å; Y358-F372 HydrophobicContact CD1-CZ 3.36Å; Y358-F372 AromaticContact CE1-CE1 3.74Å; Y358-F372 HydrophobicContact CE1-CE1 3.74Å; Y358-F372 AromaticContact CE1-CZ 3.81Å; Y358-F372 HydrophobicContact CE1-CZ 3.81Å; Y358-F372 AromaticContact CG-CZ 3.9Å; Y358-F372 HydrophobicContact CG-CZ 3.9Å; C361-F372 HydrophobicContact CB-CD2 4.01Å; C361-F372 HydrophobicContact CB-CE2 3.52Å; C361-F372 HydrophobicContact CB-CZ 4.26Å; A365-F372 HydrophobicContact CB-CB 4.3Å; A365-F372 HydrophobicContact CB-CD2 4.43Å; V370-F372 PolarHBondContact O-N 2.9Å; F372-N374 VanDerWaalsContact C-N 3.27Å; F372-N374 PolarHBondContact O-N 2.96Å; F372-L375 WeakPolarHBondContact O-CB 3.42Å; F372-L375 PolarHBondContact O-N 2.92Å; F372-L375 VanDerWaalsContact O-N 3.14Å; F372-L376 HydrophobicContact CD1-CD1 4.27Å; F372-L376 HydrophobicContact CE1-CD1 3.5Å; F372-L376 VanDerWaalsContact CE1-CD1 3.5Å; F372-L376 HydrophobicContact CZ-CD1 3.68Å
373	E	84.4	Confident	88.5	Confident	131 Å²	131	40.1 Å²	40.1	61%	0.612	23%	0.233	S	C	*	.	G	3₁₀ helix	trans	-63.4	-31.2	-178.7	-61.6	-176.5	169.3	0	0	112.8	A371 L375 L376	A371-E373 VanDerWaalsContact C-N 3.26Å; A371-E373 PolarHBondContact O-N 3.45Å; E373-L375 PolarHBondContact O-N 3.44Å; E373-L376 PolarHBondContact O-N 2.83Å
374	N	86.6	Confident	88.5	Confident	113 Å²	113	39.9 Å²	39.9	60%	0.604	23%	0.232	S	C	*	.	G	3₁₀ helix	trans	-74.4	-13	179.7	-67	-11.3	0	0	0	112.9	V370 A371 F372 V377	V370-N374 HydrophobicContact CG1-CB 4.24Å; A371-N374 WeakPolarHBondContact O-CB 3.33Å; A371-N374 PolarHBondContact O-N 3.29Å; F372-N374 VanDerWaalsContact C-N 3.27Å; F372-N374 PolarHBondContact O-N 2.96Å; N374-V377 WeakPolarHBondContact O-CG1 3.48Å
375	L	89.6	Confident	88.6	Confident	2 Å²	2	39.9 Å²	39.9	1%	0.01	23%	0.232	C	C	.	.	G	3₁₀ helix	trans	-86.1	-23	179.3	-54.9	-179.5	0	0	0	112.5	W206 C361 L364 A365 V370 F372 E373 V377 L382 I386	W206-L375 HydrophobicContact CH2-CD2 3.49Å; W206-L375 VanDerWaalsContact CH2-CD2 3.49Å; W206-L375 HydrophobicContact CZ2-CD2 4.47Å; W206-L375 HydrophobicContact CZ3-CD2 4.23Å; C361-L375 HydrophobicContact CB-CB 4.08Å; C361-L375 HydrophobicContact CB-CD1 4.25Å; C361-L375 WeakPolarHBondContact O-CD1 3.49Å; L364-L375 HydrophobicContact CB-CD1 4.19Å; L364-L375 HydrophobicContact CD2-CD1 4.39Å; L364-L375 HydrophobicContact CD2-CD2 4.26Å; L364-L375 HydrophobicContact CG-CD1 4.34Å; A365-L375 HydrophobicContact CB-CD1 3.81Å; V370-L375 HydrophobicContact CB-CD2 4.24Å; V370-L375 HydrophobicContact CG1-CD2 3.76Å; V370-L375 HydrophobicContact CG1-CG 4.36Å; F372-L375 WeakPolarHBondContact O-CB 3.42Å; F372-L375 PolarHBondContact O-N 2.92Å; F372-L375 VanDerWaalsContact O-N 3.14Å; E373-L375 PolarHBondContact O-N 3.44Å; L375-V377 PolarHBondContact O-N 3.27Å; L375-L382 WeakPolarHBondContact O-CD1 3.33Å; L375-I386 HydrophobicContact CB-CG2 4.43Å
376	L	88.5	Confident	88.8	Confident	4 Å²	4	39.2 Å²	39.2	2%	0.021	23%	0.225	C	C	.	.	S	Bend	trans	-88.2	56.9	-177.2	-70.2	166.8	0	0	0	111.2	P66 H67 S70 T357 Y358 C361 F372 E373	P66-L376 HydrophobicContact CB-CD2 4.11Å; H67-L376 PolarHBondContact ND1-O 3.07Å; S70-L376 WeakPolarHBondContact OG-CD1 3.28Å; T357-L376 HydrophobicContact CG2-CD2 3.61Å; Y358-L376 HydrophobicContact CD2-CD1 4.37Å; Y358-L376 HydrophobicContact CD2-CD2 4.35Å; Y358-L376 HydrophobicContact CE1-CD1 4.12Å; Y358-L376 HydrophobicContact CE2-CD1 3.9Å; Y358-L376 HydrophobicContact CE2-CD2 4.27Å; C361-L376 HydrophobicContact CB-CD2 4.41Å; C361-L376 HydrophobicContact CB-CG 4.5Å; F372-L376 HydrophobicContact CD1-CD1 4.27Å; F372-L376 HydrophobicContact CE1-CD1 3.5Å; F372-L376 VanDerWaalsContact CE1-CD1 3.5Å; F372-L376 HydrophobicContact CZ-CD1 3.68Å; E373-L376 PolarHBondContact O-N 2.83Å
377	V	88.3	Confident	89	Confident	24 Å²	24	36.5 Å²	36.5	15%	0.145	21%	0.205	C	C	.	.			trans	-74.2	157.2	-177.6	-61.7	0	0	0	0	112.9	N374 L375 R381 L382 I386	N374-V377 WeakPolarHBondContact O-CG1 3.48Å; L375-V377 PolarHBondContact O-N 3.27Å; V377-R381 HydrophobicContact CG2-CB 3.89Å; V377-R381 HydrophobicContact CG2-CG 3.99Å; V377-L382 HydrophobicContact CG2-CB 4.09Å; V377-I386 HydrophobicContact CG2-CG1 4.04Å
378	K	86.8	Confident	89.4	Confident	91 Å²	91	34.2 Å²	34.2	40%	0.396	19%	0.194	S	C	.	.	S	Bend	trans	-76.2	145.1	175.4	-165.6	-168.5	171.7	-160.2	0	110.7	W63 E461 N465	W63-K378 HydrophobicContact CE3-CG 3.81Å; W63-K378 HydrophobicContact CH2-CG 4.15Å; W63-K378 HydrophobicContact CZ3-CD 4.2Å; W63-K378 HydrophobicContact CZ3-CG 3.33Å; K378-E461 IonicContact NZ-OE1 2.82Å; K378-N465 PolarHBondContact NZ-OD1 3.32Å
379	G	88	Confident	89.8	Confident	2 Å²	2	33.1 Å²	33.1	2%	0.021	19%	0.187	C	C	.	.	S	Bend	trans	81.9	-158.2	163.6	0	0	0	0	0	115.8	R381 L382	G379-R381 PolarHBondContact O-N 3.33Å; G379-R381 VanDerWaalsContact O-N 3.16Å; G379-L382 PolarHBondContact O-N 3.35Å
380	P	91.4	Very high	90.3	Very high	2 Å²	2	29.9 Å²	29.9	1%	0.013	15%	0.153	C	C	.	.	H	α-helix	trans	-62.8	-26	-171.1	21.3	-30.2	0	0	0	113.5	Y59 W141 F212 L382 V383 F384 I457 F460	Y59-P380 WeakPolarHBondContact OH-CA 3.37Å; Y59-P380 VanDerWaalsContact OH-CB 3.23Å; Y59-P380 WeakPolarHBondContact OH-CB 3.35Å; Y59-P380 WeakPolarHBondContact OH-CD 3.41Å; W141-P380 HydrophobicContact CZ3-CB 4.09Å; F212-P380 HydrophobicContact CZ-CB 4.24Å; P380-L382 VanDerWaalsContact C-N 3.25Å; P380-L382 PolarHBondContact O-N 2.96Å; P380-V383 PolarHBondContact O-N 2.86Å; P380-F384 HydrophobicContact CB-CD2 4.08Å; P380-F384 WeakPolarHBondContact O-CD2 3.24Å; P380-F384 PolarHBondContact O-N 3.45Å; P380-I457 HydrophobicContact CG-CD1 3.92Å; P380-F460 HydrophobicContact CG-CE1 4.43Å
381	R	91.8	Very high	90.7	Very high	86 Å²	86	27.6 Å²	27.6	33%	0.325	14%	0.139	S	C	.	.	H	α-helix	trans	-57	-38.1	178.7	-165.9	176.5	173.3	-156.1	-3.7	112.4	E209 V377 G379 V385 I386	E209-R381 IonicContact OE1-NE 3.11Å; E209-R381 PolarHBondContact OE1-NE 3.39Å; E209-R381 IonicContact OE2-CZ 3.51Å; E209-R381 IonicContact OE2-NE 2.75Å; E209-R381 PolarHBondContact OE2-NE 2.97Å; E209-R381 IonicContact OE2-NH2 3.45Å; E209-R381 PolarHBondContact OE2-NH2 2.98Å; V377-R381 HydrophobicContact CG2-CB 3.89Å; V377-R381 HydrophobicContact CG2-CG 3.99Å; G379-R381 PolarHBondContact O-N 3.33Å; G379-R381 VanDerWaalsContact O-N 3.16Å; R381-V385 HydrophobicContact CG-CB 4.03Å; R381-V385 HydrophobicContact CG-CG2 3.99Å; R381-V385 WeakPolarHBondContact O-CA 3.35Å; R381-V385 WeakPolarHBondContact O-CB 3.16Å; R381-V385 PolarHBondContact O-N 3.47Å; R381-I386 PolarHBondContact O-N 3.28Å; R381-I386 VanDerWaalsContact O-N 3.08Å
382	L	92.6	Very high	91	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	13%	0.125	C	C	.	.	I	π-helix	trans	-61.9	-49.2	175.2	-174.4	70.6	0	0	0	111	W63 T357 L375 V377 G379 P380 I386 F387	W63-L382 HydrophobicContact CB-CB 4.19Å; W63-L382 HydrophobicContact CB-CD2 3.74Å; T357-L382 HydrophobicContact CG2-CD1 4.28Å; T357-L382 HydrophobicContact CG2-CD2 4.06Å; L375-L382 WeakPolarHBondContact O-CD1 3.33Å; V377-L382 HydrophobicContact CG2-CB 4.09Å; G379-L382 PolarHBondContact O-N 3.35Å; P380-L382 VanDerWaalsContact C-N 3.25Å; P380-L382 PolarHBondContact O-N 2.96Å; L382-I386 HydrophobicContact CD1-CB 4.13Å; L382-I386 HydrophobicContact CD1-CG1 4.19Å; L382-I386 HydrophobicContact CD1-CG2 4.26Å; L382-I386 WeakPolarHBondContact O-CB 2.99Å; L382-I386 PolarHBondContact O-N 2.97Å; L382-F387 HydrophobicContact CG-CD2 4.38Å; L382-F387 HydrophobicContact CG-CE2 4.25Å; L382-F387 VanDerWaalsContact O-CD2 3.31Å; L382-F387 WeakPolarHBondContact O-CD2 3.45Å; L382-F387 PolarHBondContact O-N 2.83Å; L382-F387 VanDerWaalsContact O-N 3.12Å
383	V	93.3	Very high	91.2	Very high	1 Å²	1	26.1 Å²	26.1	1%	0.006	13%	0.125	C	C	.	.	I	π-helix	trans	-73.9	-40.1	-171.7	-179.8	0	0	0	0	112.5	Y59 L62 W63 P380 Y404 I408	Y59-V383 HydrophobicContact CE2-CB 4.5Å; Y59-V383 HydrophobicContact CE2-CG2 4.09Å; L62-V383 HydrophobicContact CB-CG2 3.83Å; L62-V383 HydrophobicContact CD1-CG1 4.26Å; L62-V383 HydrophobicContact CD1-CG2 4.4Å; W63-V383 HydrophobicContact CB-CG2 4.28Å; P380-V383 PolarHBondContact O-N 2.86Å; V383-Y404 WeakPolarHBondContact CG1-OH 3.5Å; V383-Y404 WeakPolarHBondContact O-CE1 3.49Å; V383-Y404 PolarHBondContact O-OH 3.45Å; V383-I408 HydrophobicContact CG1-CD1 3.53Å; V383-I408 HydrophobicContact CG1-CG1 4.4Å
384	F	95	Very high	91.5	Very high	0 Å²	0	20.3 Å²	20.3	0%	0	10%	0.098	C	C	.	.	I	π-helix	trans	-102.9	-20.3	-172.7	-68.5	-76.9	0	0	0	114.5	V138 W141 A142 Y145 F212 P380 A388 F405 I408	V138-F384 HydrophobicContact CG1-CE2 3.63Å; V138-F384 HydrophobicContact CG1-CZ 3.57Å; W141-F384 HydrophobicContact CB-CD1 4.44Å; W141-F384 HydrophobicContact CB-CE1 3.88Å; W141-F384 HydrophobicContact CB-CZ 3.94Å; W141-F384 HydrophobicContact CE3-CD2 4.32Å; W141-F384 AromaticContact CE3-CE2 3.88Å; W141-F384 HydrophobicContact CE3-CE2 3.88Å; W141-F384 HydrophobicContact CE3-CZ 4.32Å; A142-F384 HydrophobicContact CB-CE1 4.29Å; Y145-F384 AromaticContact CD2-CD1 3.7Å; Y145-F384 HydrophobicContact CD2-CD1 3.7Å; Y145-F384 HydrophobicContact CD2-CE1 4.21Å; Y145-F384 HydrophobicContact CE2-CB 4.18Å; Y145-F384 AromaticContact CE2-CD1 3.66Å; Y145-F384 HydrophobicContact CE2-CD1 3.66Å; Y145-F384 HydrophobicContact CE2-CG 4.28Å; Y145-F384 HydrophobicContact CG-CD1 4.41Å; Y145-F384 PolarHBondContact OH-O 3.3Å; F212-F384 HydrophobicContact CD2-CB 4.02Å; F212-F384 HydrophobicContact CE2-CB 3.95Å; F212-F384 HydrophobicContact CE2-CD2 4.46Å; F212-F384 HydrophobicContact CE2-CG 4.19Å; F212-F384 HydrophobicContact CZ-CB 4.41Å; P380-F384 HydrophobicContact CB-CD2 4.08Å; P380-F384 WeakPolarHBondContact O-CD2 3.24Å; P380-F384 PolarHBondContact O-N 3.45Å; F384-A388 WeakPolarHBondContact O-CB 3.46Å; F384-F405 HydrophobicContact CD1-CE1 4.02Å; F384-F405 HydrophobicContact CE1-CE1 4.2Å; F384-I408 HydrophobicContact CE1-CD1 4.47Å
385	V	94.1	Very high	91.6	Very high	0 Å²	0	19 Å²	19	0%	0	10%	0.095	C	C	.	.	I	π-helix	trans	-105.9	-62.1	178.4	-176.4	0	0	0	0	110.3	S208 E209 F212 R381 F387 A388 E389	S208-V385 VanDerWaalsContact OG-CG1 3.31Å; S208-V385 WeakPolarHBondContact OG-CG1 3.23Å; E209-V385 HydrophobicContact CB-CG1 3.89Å; F212-V385 HydrophobicContact CB-CG2 3.8Å; F212-V385 HydrophobicContact CD1-CG2 3.88Å; F212-V385 HydrophobicContact CG-CG2 4.04Å; R381-V385 HydrophobicContact CG-CB 4.03Å; R381-V385 HydrophobicContact CG-CG2 3.99Å; R381-V385 WeakPolarHBondContact O-CA 3.35Å; R381-V385 WeakPolarHBondContact O-CB 3.16Å; R381-V385 PolarHBondContact O-N 3.47Å; V385-F387 PolarHBondContact O-N 3.38Å; V385-A388 PolarHBondContact O-N 3.4Å; V385-E389 WeakPolarHBondContact O-CB 3.46Å; V385-E389 PolarHBondContact O-N 3.35Å
386	I	93.8	Very high	91.7	Very high	3 Å²	3	25.1 Å²	25.1	2%	0.015	13%	0.127	C	C	.	.	I	π-helix	trans	-64.2	-47.3	-172.2	-53	-59.7	0	0	0	111.6	W206 L364 L375 V377 R381 L382 A390	W206-I386 HydrophobicContact CE3-CD1 4.48Å; W206-I386 HydrophobicContact CZ3-CD1 3.68Å; L364-I386 HydrophobicContact CD2-CG2 3.83Å; L375-I386 HydrophobicContact CB-CG2 4.43Å; V377-I386 HydrophobicContact CG2-CG1 4.04Å; R381-I386 PolarHBondContact O-N 3.28Å; R381-I386 VanDerWaalsContact O-N 3.08Å; L382-I386 HydrophobicContact CD1-CB 4.13Å; L382-I386 HydrophobicContact CD1-CG1 4.19Å; L382-I386 HydrophobicContact CD1-CG2 4.26Å; L382-I386 WeakPolarHBondContact O-CB 2.99Å; L382-I386 PolarHBondContact O-N 2.97Å; I386-A390 PolarHBondContact O-N 3.38Å; I386-A390 VanDerWaalsContact O-N 3.08Å
387	F	94	Very high	91.9	Very high	12 Å²	12	25.4 Å²	25.4	5%	0.053	13%	0.13	C	C	.	.	H	α-helix	trans	-67.4	-37.2	176.3	-90	-106	0	0	0	112.6	T357 V360 L382 V385 A390 I391 Y404	T357-F387 HydrophobicContact CG2-CE2 3.89Å; T357-F387 HydrophobicContact CG2-CZ 4.19Å; T357-F387 WeakPolarHBondContact OG1-CZ 3.22Å; V360-F387 HydrophobicContact CB-CE1 4.31Å; V360-F387 HydrophobicContact CB-CZ 4.39Å; V360-F387 HydrophobicContact CG1-CD1 4.2Å; V360-F387 HydrophobicContact CG1-CE1 4.3Å; V360-F387 HydrophobicContact CG1-CG 4.33Å; V360-F387 HydrophobicContact CG2-CD1 4.32Å; V360-F387 HydrophobicContact CG2-CE1 3.83Å; V360-F387 HydrophobicContact CG2-CZ 4.27Å; L382-F387 HydrophobicContact CG-CD2 4.38Å; L382-F387 HydrophobicContact CG-CE2 4.25Å; L382-F387 VanDerWaalsContact O-CD2 3.31Å; L382-F387 WeakPolarHBondContact O-CD2 3.45Å; L382-F387 PolarHBondContact O-N 2.83Å; L382-F387 VanDerWaalsContact O-N 3.12Å; V385-F387 PolarHBondContact O-N 3.38Å; F387-A390 PolarHBondContact O-N 3.33Å; F387-I391 WeakPolarHBondContact O-CB 3.37Å; F387-I391 WeakPolarHBondContact O-CD1 3.23Å; F387-I391 WeakPolarHBondContact O-CG1 3.39Å; F387-I391 PolarHBondContact O-N 3.22Å; F387-Y404 HydrophobicContact CB-CE1 4.04Å; F387-Y404 HydrophobicContact CB-CE2 4.27Å; F387-Y404 VanDerWaalsContact CB-OH 3.3Å; F387-Y404 WeakPolarHBondContact CB-OH 3.48Å; F387-Y404 HydrophobicContact CD1-CD2 4.37Å; F387-Y404 AromaticContact CD1-CE2 3.53Å; F387-Y404 HydrophobicContact CD1-CE2 3.53Å; F387-Y404 AromaticContact CD1-CZ 3.76Å; F387-Y404 HydrophobicContact CE1-CE2 4.12Å; F387-Y404 HydrophobicContact CG-CE2 4.13Å; F387-Y404 AromaticContact CG-CZ 3.86Å; F387-Y404 WeakPolarHBondContact CG-OH 3.4Å
388	A	94.5	Very high	92.2	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-64.8	-42	177.9	0	0	0	0	0	111.5	Y145 W156 F384 V385 I391 A392	Y145-A388 HydrophobicContact CE1-CB 4.29Å; W156-A388 HydrophobicContact CD2-CB 4.47Å; W156-A388 HydrophobicContact CG-CB 4.45Å; W156-A388 PolarHBondContact NE1-O 3.06Å; F384-A388 WeakPolarHBondContact O-CB 3.46Å; V385-A388 PolarHBondContact O-N 3.4Å; A388-I391 PolarHBondContact O-N 2.94Å; A388-A392 PolarHBondContact O-N 3.18Å
389	E	92.7	Very high	92.5	Very high	8 Å²	8	25 Å²	25	4%	0.037	14%	0.136	C	C	.	.	H	α-helix	trans	-60.4	-46.4	174	-177.6	58.1	-154.2	0	0	111.6	W206 S208 L364 V385 I391 A392 R393	W206-E389 HydrophobicContact CD2-CG 4.25Å; W206-E389 HydrophobicContact CE3-CB 4.47Å; W206-E389 HydrophobicContact CE3-CG 4.03Å; W206-E389 HydrophobicContact CZ3-CG 4.42Å; S208-E389 PolarHBondContact OG-OE2 3.5Å; L364-E389 HydrophobicContact CD1-CG 3.79Å; L364-E389 HydrophobicContact CD2-CB 4.48Å; L364-E389 HydrophobicContact CD2-CG 4.26Å; V385-E389 WeakPolarHBondContact O-CB 3.46Å; V385-E389 PolarHBondContact O-N 3.35Å; E389-I391 VanDerWaalsContact C-N 3.33Å; E389-I391 PolarHBondContact O-N 2.86Å; E389-A392 PolarHBondContact O-N 3.2Å; E389-R393 IonicContact OE1-CZ 3.3Å; E389-R393 IonicContact OE1-NE 3.38Å; E389-R393 PolarHBondContact OE1-NE 3.35Å; E389-R393 VanDerWaalsContact OE1-NE 3.11Å; E389-R393 IonicContact OE1-NH2 3.78Å; E389-R393 PolarHBondContact OE1-NH2 3.46Å
390	A	93	Very high	92.9	Very high	1 Å²	1	26.9 Å²	26.9	1%	0.008	14%	0.142	C	C	.	.	H	α-helix	trans	-62	-41.4	176.3	0	0	0	0	0	112	V360 F363 I386 F387 A392 R393	V360-A390 HydrophobicContact CG1-CB 3.49Å; V360-A390 VanDerWaalsContact CG1-CB 3.49Å; F363-A390 HydrophobicContact CD1-CB 4.23Å; F363-A390 HydrophobicContact CE1-CB 4.26Å; I386-A390 PolarHBondContact O-N 3.38Å; I386-A390 VanDerWaalsContact O-N 3.08Å; F387-A390 PolarHBondContact O-N 3.33Å; A390-A392 VanDerWaalsContact C-N 3.35Å; A390-A392 PolarHBondContact O-N 3.35Å; A390-R393 PolarHBondContact O-N 3.21Å
391	I	94.1	Very high	93.1	Very high	2 Å²	2	26.8 Å²	26.8	1%	0.01	14%	0.141	C	C	.	.	H	α-helix	trans	-63.7	-39.2	177.7	-74.1	165	0	0	0	111.9	F273 F387 A388 E389 R393 F394 A397 W400 A401 Y404	F273-I391 HydrophobicContact CE1-CD1 4.02Å; F273-I391 HydrophobicContact CE1-CG1 3.79Å; F273-I391 HydrophobicContact CZ-CD1 4.09Å; F273-I391 HydrophobicContact CZ-CG1 4.23Å; F387-I391 WeakPolarHBondContact O-CB 3.37Å; F387-I391 WeakPolarHBondContact O-CD1 3.23Å; F387-I391 WeakPolarHBondContact O-CG1 3.39Å; F387-I391 PolarHBondContact O-N 3.22Å; A388-I391 PolarHBondContact O-N 2.94Å; E389-I391 VanDerWaalsContact C-N 3.33Å; E389-I391 PolarHBondContact O-N 2.86Å; I391-R393 PolarHBondContact O-N 3.39Å; I391-F394 PolarHBondContact O-N 3.12Å; I391-F394 VanDerWaalsContact O-N 3.09Å; I391-A397 VanDerWaalsContact O-CB 3.27Å; I391-A397 WeakPolarHBondContact O-CB 3.39Å; I391-W400 HydrophobicContact CG2-CB 3.93Å; I391-A401 HydrophobicContact CG2-CB 3.78Å; I391-Y404 HydrophobicContact CD1-CD1 3.63Å; I391-Y404 HydrophobicContact CD1-CD2 4.22Å; I391-Y404 HydrophobicContact CD1-CE1 4.3Å; I391-Y404 HydrophobicContact CD1-CG 3.57Å
392	A	92.7	Very high	93.3	Very high	21 Å²	21	24.5 Å²	24.5	17%	0.174	14%	0.137	C	C	.	.	H	α-helix	trans	-59.8	-26.9	179.8	0	0	0	0	0	112.8	V154 A157 A388 E389 A390	V154-A392 HydrophobicContact CG2-CB 3.91Å; A157-A392 HydrophobicContact CB-CB 4.38Å; A388-A392 PolarHBondContact O-N 3.18Å; E389-A392 PolarHBondContact O-N 3.2Å; A390-A392 VanDerWaalsContact C-N 3.35Å; A390-A392 PolarHBondContact O-N 3.35Å
393	R	90.1	Very high	93.4	Very high	45 Å²	45	27 Å²	27	17%	0.17	15%	0.149	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.4	-12.5	179.8	-62.5	174.7	-174.4	-131.2	-5.5	113.9	F363 T368 E389 A390 I391	F363-R393 HydrophobicContact CE1-CB 4.14Å; F363-R393 HydrophobicContact CZ-CB 3.78Å; T368-R393 VanDerWaalsContact CG2-CZ 3.42Å; T368-R393 VanDerWaalsContact CG2-NH1 3.29Å; E389-R393 IonicContact OE1-CZ 3.3Å; E389-R393 IonicContact OE1-NE 3.38Å; E389-R393 PolarHBondContact OE1-NE 3.35Å; E389-R393 VanDerWaalsContact OE1-NE 3.11Å; E389-R393 IonicContact OE1-NH2 3.78Å; E389-R393 PolarHBondContact OE1-NH2 3.46Å; A390-R393 PolarHBondContact O-N 3.21Å; I391-R393 PolarHBondContact O-N 3.39Å
394	F	90.9	Very high	93.5	Very high	9 Å²	9	27.1 Å²	27.1	4%	0.039	15%	0.15	C	C	.	.	S	Bend	trans	-73.7	146.5	176.4	-69.3	-27.4	0	0	0	111.9	F273 K276 V280 F363 I391 I396 A397 W400	F273-F394 HydrophobicContact CD1-CE2 4.34Å; F273-F394 HydrophobicContact CE1-CE2 4.21Å; K276-F394 HydrophobicContact CG-CD2 4.37Å; K276-F394 HydrophobicContact CG-CE1 4.31Å; K276-F394 HydrophobicContact CG-CE2 4.14Å; K276-F394 HydrophobicContact CG-CZ 4.12Å; V280-F394 HydrophobicContact CG2-CE1 4.25Å; F363-F394 AromaticContact CD1-CE1 3.87Å; F363-F394 HydrophobicContact CD1-CE1 3.87Å; F363-F394 HydrophobicContact CD1-CZ 4.22Å; F363-F394 HydrophobicContact CE1-CD1 4.06Å; F363-F394 AromaticContact CE1-CE1 3.51Å; F363-F394 HydrophobicContact CE1-CE1 3.51Å; F363-F394 HydrophobicContact CE1-CZ 4.15Å; F363-F394 HydrophobicContact CE2-CE1 4.49Å; F363-F394 HydrophobicContact CG-CE1 4.48Å; F363-F394 HydrophobicContact CZ-CD1 4.12Å; F363-F394 AromaticContact CZ-CE1 3.86Å; F363-F394 HydrophobicContact CZ-CE1 3.86Å; I391-F394 PolarHBondContact O-N 3.12Å; I391-F394 VanDerWaalsContact O-N 3.09Å; F394-I396 PolarHBondContact O-N 3.13Å; F394-A397 PolarHBondContact O-N 3.25Å; F394-W400 HydrophobicContact CB-CG 4.28Å; F394-W400 HydrophobicContact CD2-CB 4.37Å; F394-W400 HydrophobicContact CD2-CD2 4.16Å; F394-W400 HydrophobicContact CD2-CG 4.04Å
395	P	89	Confident	93.5	Very high	85 Å²	85	27.1 Å²	27.1	55%	0.552	15%	0.15	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.9	135.9	170	27.4	-34.1	0	0	0	109.1	A397 W400	P395-A397 VanDerWaalsContact C-N 3.33Å; P395-W400 PolarHBondContact O-NE1 3.45Å; P395-W400 VanDerWaalsContact O-NE1 3.08Å
396	I	91	Very high	93.4	Very high	131 Å²	131	29.8 Å²	29.8	67%	0.672	16%	0.163	S	C	*	.	T	Hydrogen-bonded Turn	trans	61.2	42.8	-177	-37.4	171.5	0	0	0	111.1	F394 P398 V399	F394-I396 PolarHBondContact O-N 3.13Å; I396-P398 VanDerWaalsContact C-N 3.29Å; I396-P398 VanDerWaalsContact O-N 3.1Å; I396-V399 HydrophobicContact CG2-CB 4.22Å; I396-V399 HydrophobicContact CG2-CG2 3.65Å; I396-V399 PolarHBondContact O-N 3.48Å
397	A	92.7	Very high	93.4	Very high	11 Å²	11	29.6 Å²	29.6	9%	0.091	16%	0.162	C	C	.	.	H	α-helix	trans	-43.1	-40.5	-179.1	0	0	0	0	0	115.7	V154 I391 F394 P395 V399 W400 A401	V154-A397 HydrophobicContact CG1-CB 4.33Å; V154-A397 HydrophobicContact CG2-CB 4.41Å; I391-A397 VanDerWaalsContact O-CB 3.27Å; I391-A397 WeakPolarHBondContact O-CB 3.39Å; F394-A397 PolarHBondContact O-N 3.25Å; P395-A397 VanDerWaalsContact C-N 3.33Å; A397-V399 VanDerWaalsContact C-N 3.28Å; A397-V399 PolarHBondContact O-N 3.4Å; A397-W400 PolarHBondContact O-N 3.42Å; A397-A401 WeakPolarHBondContact O-CB 3.3Å; A397-A401 PolarHBondContact O-N 3.19Å
398	P	94.4	Very high	93.3	Very high	27 Å²	27	29 Å²	29	18%	0.175	16%	0.16	C	C	.	.	H	α-helix	trans	-53.9	-39.3	177.2	-30.6	38.2	0	0	0	114.4	S149 R151 T152 V154 I396 A401 V402	S149-P398 WeakPolarHBondContact O-CB 3.08Å; R151-P398 WeakPolarHBondContact O-CG 3.17Å; T152-P398 WeakPolarHBondContact O-CG 3.39Å; V154-P398 HydrophobicContact CG1-CG 4.29Å; I396-P398 VanDerWaalsContact C-N 3.29Å; I396-P398 VanDerWaalsContact O-N 3.1Å; P398-A401 PolarHBondContact O-N 2.84Å; P398-V402 VanDerWaalsContact O-CG2 3.27Å; P398-V402 WeakPolarHBondContact O-CG2 3.3Å; P398-V402 PolarHBondContact O-N 2.96Å
399	V	94.4	Very high	93.1	Very high	80 Å²	80	29.9 Å²	29.9	49%	0.485	16%	0.164	S	C	.	.	H	α-helix	trans	-67.8	-43	-178.9	174.1	0	0	0	0	111	I396 A397 M403	I396-V399 HydrophobicContact CG2-CB 4.22Å; I396-V399 HydrophobicContact CG2-CG2 3.65Å; I396-V399 PolarHBondContact O-N 3.48Å; A397-V399 VanDerWaalsContact C-N 3.28Å; A397-V399 PolarHBondContact O-N 3.4Å; V399-M403 HydrophobicContact CG1-CE 4.27Å; V399-M403 WeakPolarHBondContact O-CG 3.3Å; V399-M403 PolarHBondContact O-N 2.98Å; V399-M403 VanDerWaalsContact O-N 3.16Å
400	W	94.9	Very high	92.9	Very high	40 Å²	40	31.6 Å²	31.6	15%	0.152	17%	0.172	C	C	.	.	H	α-helix	trans	-63.5	-46.2	175.6	-61.7	99.9	0	0	0	111	V272 F273 K276 I391 F394 P395 A397 V402 M403 Y404	V272-W400 HydrophobicContact CG1-CH2 4.22Å; V272-W400 HydrophobicContact CG1-CZ3 3.89Å; F273-W400 HydrophobicContact CD1-CE3 4.31Å; F273-W400 HydrophobicContact CE1-CB 4.31Å; F273-W400 AromaticContact CE1-CE3 3.98Å; F273-W400 HydrophobicContact CE1-CE3 3.98Å; F273-W400 HydrophobicContact CE2-CE3 4.25Å; F273-W400 HydrophobicContact CZ-CB 3.98Å; F273-W400 AromaticContact CZ-CE3 3.95Å; F273-W400 HydrophobicContact CZ-CE3 3.95Å; F273-W400 VanDerWaalsContact CZ-O 3.29Å; F273-W400 WeakPolarHBondContact CZ-O 3.45Å; K276-W400 HydrophobicContact CB-CH2 3.52Å; K276-W400 HydrophobicContact CB-CZ2 4.31Å; K276-W400 HydrophobicContact CB-CZ3 3.67Å; K276-W400 HydrophobicContact CD-CH2 3.86Å; K276-W400 HydrophobicContact CD-CZ2 3.8Å; K276-W400 HydrophobicContact CG-CE3 4.41Å; K276-W400 HydrophobicContact CG-CH2 3.51Å; K276-W400 HydrophobicContact CG-CZ2 3.8Å; K276-W400 HydrophobicContact CG-CZ3 3.82Å; I391-W400 HydrophobicContact CG2-CB 3.93Å; F394-W400 HydrophobicContact CB-CG 4.28Å; F394-W400 HydrophobicContact CD2-CB 4.37Å; F394-W400 HydrophobicContact CD2-CD2 4.16Å; F394-W400 HydrophobicContact CD2-CG 4.04Å; P395-W400 PolarHBondContact O-NE1 3.45Å; P395-W400 VanDerWaalsContact O-NE1 3.08Å; A397-W400 PolarHBondContact O-N 3.42Å; W400-V402 PolarHBondContact O-N 2.88Å; W400-M403 HydrophobicContact CD2-CE 4.06Å; W400-M403 HydrophobicContact CE3-CE 3.61Å; W400-M403 HydrophobicContact CZ3-CE 4.02Å; W400-M403 PolarHBondContact O-N 3.24Å; W400-Y404 WeakPolarHBondContact O-CB 3.46Å; W400-Y404 PolarHBondContact O-N 2.98Å
401	A	95.7	Very high	92.4	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-58.3	-47.8	177.5	0	0	0	0	0	112	V154 W156 I391 A397 P398 M403 Y404 F405	V154-A401 HydrophobicContact CG1-CB 3.97Å; W156-A401 HydrophobicContact CH2-CB 4.22Å; W156-A401 HydrophobicContact CZ2-CB 3.91Å; I391-A401 HydrophobicContact CG2-CB 3.78Å; A397-A401 WeakPolarHBondContact O-CB 3.3Å; A397-A401 PolarHBondContact O-N 3.19Å; P398-A401 PolarHBondContact O-N 2.84Å; A401-M403 PolarHBondContact O-N 3.36Å; A401-Y404 PolarHBondContact O-N 3.27Å; A401-F405 HydrophobicContact CB-CD2 4.33Å; A401-F405 HydrophobicContact CB-CE2 4.24Å; A401-F405 WeakPolarHBondContact O-CD2 3.42Å; A401-F405 PolarHBondContact O-N 3.09Å
402	V	96	Very high	91.6	Very high	38 Å²	38	31.7 Å²	31.7	23%	0.23	17%	0.173	C	C	.	.	H	α-helix	trans	-56.9	-48	177.1	168.8	0	0	0	0	111.1	L146 S149 L150 P398 W400 Y404 I406	L146-V402 HydrophobicContact CD1-CB 4.33Å; L146-V402 HydrophobicContact CD1-CG1 4.07Å; L146-V402 HydrophobicContact CD1-CG2 4.34Å; S149-V402 WeakPolarHBondContact OG-CG2 3.2Å; L150-V402 HydrophobicContact CD2-CG2 4.09Å; P398-V402 VanDerWaalsContact O-CG2 3.27Å; P398-V402 WeakPolarHBondContact O-CG2 3.3Å; P398-V402 PolarHBondContact O-N 2.96Å; W400-V402 PolarHBondContact O-N 2.88Å; V402-Y404 PolarHBondContact O-N 2.9Å; V402-I406 HydrophobicContact CG1-CD1 3.64Å; V402-I406 HydrophobicContact CG1-CG1 4.45Å; V402-I406 WeakPolarHBondContact O-CB 3.21Å; V402-I406 WeakPolarHBondContact O-CG1 3.43Å; V402-I406 PolarHBondContact O-N 3.16Å
403	M	94.9	Very high	90.6	Very high	53 Å²	53	31.3 Å²	31.3	26%	0.261	17%	0.168	S	C	.	.	H	α-helix	trans	-60.7	-45.7	177.9	-69.2	-173.3	-62	0	0	111.8	I269 F273 V399 W400 A401 I406 M407	I269-M403 HydrophobicContact CG2-CB 4.12Å; F273-M403 HydrophobicContact CE2-CB 4.22Å; V399-M403 HydrophobicContact CG1-CE 4.27Å; V399-M403 WeakPolarHBondContact O-CG 3.3Å; V399-M403 PolarHBondContact O-N 2.98Å; V399-M403 VanDerWaalsContact O-N 3.16Å; W400-M403 HydrophobicContact CD2-CE 4.06Å; W400-M403 HydrophobicContact CE3-CE 3.61Å; W400-M403 HydrophobicContact CZ3-CE 4.02Å; W400-M403 PolarHBondContact O-N 3.24Å; A401-M403 PolarHBondContact O-N 3.36Å; M403-I406 PolarHBondContact O-N 3.26Å; M403-M407 WeakPolarHBondContact O-CB 3.39Å; M403-M407 PolarHBondContact O-N 3.14Å
404	Y	94.7	Very high	89.1	Confident	4 Å²	4	30.5 Å²	30.5	2%	0.016	17%	0.168	C	C	.	.	H	α-helix	trans	-64.4	-45.9	-178.2	179.9	-107.6	0	0	0	113	V383 F387 I391 W400 A401 V402 M407 I408	V383-Y404 WeakPolarHBondContact CG1-OH 3.5Å; V383-Y404 WeakPolarHBondContact O-CE1 3.49Å; V383-Y404 PolarHBondContact O-OH 3.45Å; F387-Y404 HydrophobicContact CB-CE1 4.04Å; F387-Y404 HydrophobicContact CB-CE2 4.27Å; F387-Y404 VanDerWaalsContact CB-OH 3.3Å; F387-Y404 WeakPolarHBondContact CB-OH 3.48Å; F387-Y404 HydrophobicContact CD1-CD2 4.37Å; F387-Y404 AromaticContact CD1-CE2 3.53Å; F387-Y404 HydrophobicContact CD1-CE2 3.53Å; F387-Y404 AromaticContact CD1-CZ 3.76Å; F387-Y404 HydrophobicContact CE1-CE2 4.12Å; F387-Y404 HydrophobicContact CG-CE2 4.13Å; F387-Y404 AromaticContact CG-CZ 3.86Å; F387-Y404 WeakPolarHBondContact CG-OH 3.4Å; I391-Y404 HydrophobicContact CD1-CD1 3.63Å; I391-Y404 HydrophobicContact CD1-CD2 4.22Å; I391-Y404 HydrophobicContact CD1-CE1 4.3Å; I391-Y404 HydrophobicContact CD1-CG 3.57Å; W400-Y404 WeakPolarHBondContact O-CB 3.46Å; W400-Y404 PolarHBondContact O-N 2.98Å; A401-Y404 PolarHBondContact O-N 3.27Å; V402-Y404 PolarHBondContact O-N 2.9Å; Y404-M407 HydrophobicContact CD2-CE 3.6Å; Y404-M407 HydrophobicContact CE2-CE 3.54Å; Y404-M407 VanDerWaalsContact O-CB 3.3Å; Y404-M407 WeakPolarHBondContact O-CB 3.44Å; Y404-M407 PolarHBondContact O-N 2.91Å; Y404-I408 HydrophobicContact CD1-CD1 3.97Å; Y404-I408 HydrophobicContact CE1-CD1 3.42Å; Y404-I408 VanDerWaalsContact CE1-CD1 3.42Å; Y404-I408 HydrophobicContact CE1-CG1 4.43Å; Y404-I408 HydrophobicContact CE2-CD1 4.37Å; Y404-I408 PolarHBondContact O-N 3.15Å
405	F	95	Very high	87.5	Confident	0 Å²	0	30.5 Å²	30.5	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-74.6	-28.8	-179.9	-66	-64.5	0	0	0	112.5	Y145 L146 W156 F384 A401 I408 I409	Y145-F405 VanDerWaalsContact CB-CE1 3.42Å; Y145-F405 AromaticContact CD1-CE1 3.79Å; Y145-F405 HydrophobicContact CD1-CE1 3.79Å; Y145-F405 AromaticContact CD1-CE2 3.78Å; Y145-F405 HydrophobicContact CD1-CE2 3.78Å; Y145-F405 AromaticContact CD1-CZ 3.26Å; Y145-F405 HydrophobicContact CD1-CZ 3.26Å; Y145-F405 HydrophobicContact CD2-CE1 4.28Å; Y145-F405 HydrophobicContact CE1-CZ 4.1Å; Y145-F405 HydrophobicContact CG-CD1 4.18Å; Y145-F405 AromaticContact CG-CE1 3.59Å; Y145-F405 HydrophobicContact CG-CE1 3.59Å; Y145-F405 HydrophobicContact CG-CE2 4.09Å; Y145-F405 AromaticContact CG-CZ 3.55Å; Y145-F405 HydrophobicContact CG-CZ 3.55Å; L146-F405 HydrophobicContact CB-CB 4.04Å; L146-F405 HydrophobicContact CD1-CB 4.46Å; W156-F405 HydrophobicContact CH2-CD2 4.36Å; W156-F405 AromaticContact CH2-CE2 3.56Å; W156-F405 HydrophobicContact CH2-CE2 3.56Å; W156-F405 HydrophobicContact CH2-CZ 4.26Å; W156-F405 AromaticContact CZ2-CE2 3.7Å; W156-F405 HydrophobicContact CZ2-CE2 3.7Å; W156-F405 HydrophobicContact CZ2-CZ 4.3Å; F384-F405 HydrophobicContact CD1-CE1 4.02Å; F384-F405 HydrophobicContact CE1-CE1 4.2Å; A401-F405 HydrophobicContact CB-CD2 4.33Å; A401-F405 HydrophobicContact CB-CE2 4.24Å; A401-F405 WeakPolarHBondContact O-CD2 3.42Å; A401-F405 PolarHBondContact O-N 3.09Å; F405-I408 HydrophobicContact CD1-CD1 3.98Å; F405-I408 HydrophobicContact CE1-CD1 4.24Å; F405-I408 PolarHBondContact O-N 3.15Å; F405-I409 WeakPolarHBondContact O-CD1 3.45Å; F405-I409 VanDerWaalsContact O-CG1 3.27Å; F405-I409 WeakPolarHBondContact O-CG1 3.48Å; F405-I409 PolarHBondContact O-N 2.94Å
406	I	93.7	Very high	85.9	Confident	55 Å²	55	26.8 Å²	26.8	28%	0.282	15%	0.146	S	C	.	.	H	α-helix	trans	-62.6	-43.7	167.2	-73.1	172.4	0	0	0	110.8	L146 V402 M403 I408 I409 M410	L146-I406 HydrophobicContact CD1-CD1 4.38Å; L146-I406 HydrophobicContact CD1-CG1 3.88Å; L146-I406 HydrophobicContact CD2-CG1 4.18Å; V402-I406 HydrophobicContact CG1-CD1 3.64Å; V402-I406 HydrophobicContact CG1-CG1 4.45Å; V402-I406 WeakPolarHBondContact O-CB 3.21Å; V402-I406 WeakPolarHBondContact O-CG1 3.43Å; V402-I406 PolarHBondContact O-N 3.16Å; M403-I406 PolarHBondContact O-N 3.26Å; I406-I408 PolarHBondContact O-N 3.16Å; I406-I409 PolarHBondContact O-N 3.28Å; I406-M410 HydrophobicContact CG2-CE 3.54Å; I406-M410 HydrophobicContact CG2-CG 4.24Å; I406-M410 HydrophobicContact CG2-SD 3.87Å; I406-M410 WeakPolarHBondContact O-CB 3.3Å; I406-M410 VanDerWaalsContact O-CG 3.3Å; I406-M410 WeakPolarHBondContact O-CG 3.35Å; I406-M410 PolarHBondContact O-N 3.44Å
407	M	92.7	Very high	84.4	Confident	0 Å²	0	20.8 Å²	20.8	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-56.5	-49	175.4	172.4	-163	84.5	0	0	111.1	P266 I269 L270 M403 Y404 I409 M410 I411	P266-M407 HydrophobicContact CB-CG 3.65Å; P266-M407 HydrophobicContact CG-CG 4.24Å; I269-M407 HydrophobicContact CB-CB 4.29Å; I269-M407 HydrophobicContact CB-SD 4.45Å; I269-M407 HydrophobicContact CD1-CB 3.94Å; I269-M407 HydrophobicContact CG2-CB 3.99Å; I269-M407 HydrophobicContact CG2-CG 4.41Å; I269-M407 HydrophobicContact CG2-SD 4.07Å; L270-M407 HydrophobicContact CD1-SD 4.45Å; L270-M407 HydrophobicContact CD2-CE 4.1Å; L270-M407 HydrophobicContact CD2-SD 3.54Å; L270-M407 VanDerWaalsContact CD2-SD 3.54Å; L270-M407 HydrophobicContact CG-SD 3.59Å; L270-M407 VanDerWaalsContact CG-SD 3.59Å; M403-M407 WeakPolarHBondContact O-CB 3.39Å; M403-M407 PolarHBondContact O-N 3.14Å; Y404-M407 HydrophobicContact CD2-CE 3.6Å; Y404-M407 HydrophobicContact CE2-CE 3.54Å; Y404-M407 VanDerWaalsContact O-CB 3.3Å; Y404-M407 WeakPolarHBondContact O-CB 3.44Å; Y404-M407 PolarHBondContact O-N 2.91Å; M407-I409 PolarHBondContact O-N 2.9Å; M407-M410 PolarHBondContact O-N 3.47Å; M407-I411 HydrophobicContact CG-CD1 4.07Å; M407-I411 WeakPolarHBondContact O-CG1 3.15Å; M407-I411 PolarHBondContact O-N 2.91Å
408	I	91.7	Very high	82.9	Confident	0 Å²	0	20.2 Å²	20.2	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-58.6	-50.7	177.8	-66.5	173.3	0	0	0	110.2	L62 A142 V383 F384 Y404 F405 I406 M410 I411 F412	L62-I408 HydrophobicContact CD1-CG1 4.47Å; A142-I408 HydrophobicContact CB-CB 4.14Å; A142-I408 HydrophobicContact CB-CG2 3.68Å; V383-I408 HydrophobicContact CG1-CD1 3.53Å; V383-I408 HydrophobicContact CG1-CG1 4.4Å; F384-I408 HydrophobicContact CE1-CD1 4.47Å; Y404-I408 HydrophobicContact CD1-CD1 3.97Å; Y404-I408 HydrophobicContact CE1-CD1 3.42Å; Y404-I408 VanDerWaalsContact CE1-CD1 3.42Å; Y404-I408 HydrophobicContact CE1-CG1 4.43Å; Y404-I408 HydrophobicContact CE2-CD1 4.37Å; Y404-I408 PolarHBondContact O-N 3.15Å; F405-I408 HydrophobicContact CD1-CD1 3.98Å; F405-I408 HydrophobicContact CE1-CD1 4.24Å; F405-I408 PolarHBondContact O-N 3.15Å; I406-I408 PolarHBondContact O-N 3.16Å; I408-M410 VanDerWaalsContact C-N 3.31Å; I408-M410 PolarHBondContact O-N 3.34Å; I408-I411 WeakPolarHBondContact O-CB 3.48Å; I408-I411 PolarHBondContact O-N 2.61Å; I408-F412 HydrophobicContact CG2-CD2 4.07Å; I408-F412 HydrophobicContact CG2-CE2 3.73Å; I408-F412 WeakPolarHBondContact O-CD2 3.36Å; I408-F412 PolarHBondContact O-N 3.4Å
409	I	91.6	Very high	81.3	Confident	18 Å²	18	20 Å²	20	9%	0.092	11%	0.109	C	C	.	.	H	α-helix	trans	-56.9	-46.4	179.4	-67.2	163.4	0	0	0	110.7	V139 A142 I143 L146 L243 F405 I406 M407 I411 F412 V413	V139-I409 HydrophobicContact CG1-CG2 4.43Å; A142-I409 HydrophobicContact CB-CD1 4.4Å; A142-I409 HydrophobicContact CB-CG1 3.72Å; I143-I409 HydrophobicContact CG1-CD1 3.75Å; I143-I409 HydrophobicContact CG1-CG1 4.2Å; L146-I409 HydrophobicContact CB-CD1 4.39Å; L146-I409 HydrophobicContact CD2-CD1 3.71Å; L243-I409 HydrophobicContact CD2-CG2 3.53Å; F405-I409 WeakPolarHBondContact O-CD1 3.45Å; F405-I409 VanDerWaalsContact O-CG1 3.27Å; F405-I409 WeakPolarHBondContact O-CG1 3.48Å; F405-I409 PolarHBondContact O-N 2.94Å; I406-I409 PolarHBondContact O-N 3.28Å; M407-I409 PolarHBondContact O-N 2.9Å; I409-I411 PolarHBondContact O-N 2.79Å; I409-F412 PolarHBondContact O-N 2.9Å; I409-V413 HydrophobicContact CG2-CG2 4.31Å; I409-V413 WeakPolarHBondContact O-CG2 3.37Å; I409-V413 PolarHBondContact O-N 3.44Å
410	M	88.2	Confident	79.8	Confident	43 Å²	43	16.5 Å²	16.5	21%	0.212	9%	0.087	C	C	.	.	H	α-helix	trans	-59.4	-42.3	-179.5	-77.7	-179.4	175.4	0	0	113.1	I261 S262 V265 P266 I406 M407 I408 F412 V413	I261-M410 HydrophobicContact CG2-CE 4.01Å; I261-M410 HydrophobicContact CG2-SD 4.49Å; S262-M410 WeakPolarHBondContact CB-O 3.38Å; V265-M410 HydrophobicContact CB-SD 3.78Å; V265-M410 HydrophobicContact CG1-CE 4.13Å; V265-M410 HydrophobicContact CG1-SD 3.61Å; P266-M410 HydrophobicContact CG-CB 3.83Å; I406-M410 HydrophobicContact CG2-CE 3.54Å; I406-M410 HydrophobicContact CG2-CG 4.24Å; I406-M410 HydrophobicContact CG2-SD 3.87Å; I406-M410 WeakPolarHBondContact O-CB 3.3Å; I406-M410 VanDerWaalsContact O-CG 3.3Å; I406-M410 WeakPolarHBondContact O-CG 3.35Å; I406-M410 PolarHBondContact O-N 3.44Å; M407-M410 PolarHBondContact O-N 3.47Å; I408-M410 VanDerWaalsContact C-N 3.31Å; I408-M410 PolarHBondContact O-N 3.34Å; M410-F412 PolarHBondContact O-N 3.11Å; M410-V413 PolarHBondContact O-N 3.01Å
411	I	83.1	Confident	78.3	Confident	5 Å²	5	15 Å²	15	3%	0.026	8%	0.082	C	C	.	.	H	α-helix	trans	-54	-43	177.1	-73.9	164.6	0	0	0	111	F57 L62 P266 M407 I408 I409 A415	F57-I411 HydrophobicContact CD1-CD1 4.03Å; F57-I411 HydrophobicContact CD1-CG1 3.79Å; F57-I411 HydrophobicContact CE1-CD1 3.28Å; F57-I411 HydrophobicContact CE1-CG1 3.51Å; F57-I411 HydrophobicContact CZ-CD1 3.76Å; F57-I411 HydrophobicContact CZ-CG1 4.44Å; F57-I411 WeakPolarHBondContact O-CG2 3.27Å; L62-I411 HydrophobicContact CD1-CD1 4.33Å; L62-I411 HydrophobicContact CD2-CD1 4.49Å; P266-I411 HydrophobicContact CB-CD1 4.39Å; P266-I411 HydrophobicContact CB-CG1 4.04Å; P266-I411 HydrophobicContact CG-CG1 4.06Å; M407-I411 HydrophobicContact CG-CD1 4.07Å; M407-I411 WeakPolarHBondContact O-CG1 3.15Å; M407-I411 PolarHBondContact O-N 2.91Å; I408-I411 WeakPolarHBondContact O-CB 3.48Å; I408-I411 PolarHBondContact O-N 2.61Å; I409-I411 PolarHBondContact O-N 2.79Å; I411-A415 WeakPolarHBondContact O-CB 3.49Å
412	F	76.7	Confident	76.7	Confident	1 Å²	1	15.1 Å²	15.1	0%	0.004	8%	0.083	C	C	.	.	H	α-helix	trans	-79.8	-22.1	-178.1	-72.8	-78.4	0	0	0	114.8	Y59 Y135 V138 V139 Q244 I408 I409 M410 V414 A415	Y59-F412 HydrophobicContact CD2-CE2 4.48Å; Y59-F412 AromaticContact CD2-CZ 3.87Å; Y59-F412 HydrophobicContact CD2-CZ 3.87Å; Y59-F412 HydrophobicContact CG-CE1 4.35Å; Y59-F412 AromaticContact CG-CZ 3.73Å; Y59-F412 HydrophobicContact CG-CZ 3.73Å; Y135-F412 HydrophobicContact CD2-CE1 4.3Å; Y135-F412 HydrophobicContact CG-CE1 4.24Å; V138-F412 HydrophobicContact CB-CE1 4.16Å; V138-F412 HydrophobicContact CB-CE2 3.9Å; V138-F412 HydrophobicContact CB-CZ 3.47Å; V138-F412 VanDerWaalsContact CB-CZ 3.47Å; V138-F412 HydrophobicContact CG1-CE1 4.49Å; V138-F412 HydrophobicContact CG1-CE2 3.51Å; V138-F412 HydrophobicContact CG1-CZ 3.38Å; V138-F412 HydrophobicContact CG2-CZ 4.1Å; V139-F412 HydrophobicContact CG2-CB 3.27Å; V139-F412 HydrophobicContact CG2-CD1 4.18Å; V139-F412 HydrophobicContact CG2-CD2 3.79Å; V139-F412 HydrophobicContact CG2-CG 3.52Å; Q244-F412 PolarHBondContact NE2-O 2.86Å; I408-F412 HydrophobicContact CG2-CD2 4.07Å; I408-F412 HydrophobicContact CG2-CE2 3.73Å; I408-F412 WeakPolarHBondContact O-CD2 3.36Å; I408-F412 PolarHBondContact O-N 3.4Å; I409-F412 PolarHBondContact O-N 2.9Å; M410-F412 PolarHBondContact O-N 3.11Å; F412-V414 VanDerWaalsContact C-N 3.26Å; F412-V414 PolarHBondContact O-N 2.96Å; F412-A415 PolarHBondContact O-N 2.86Å
413	V	70.5	Confident	75.2	Confident	13 Å²	13	14.1 Å²	14.1	8%	0.079	8%	0.077	C	C	.	.	H	α-helix	trans	-60.3	-37.2	-177.4	166.7	0	0	0	0	112.2	L243 Q244 C247 V258 I409 M410	L243-V413 HydrophobicContact CD1-CG2 4.48Å; L243-V413 HydrophobicContact CD2-CG2 3.32Å; L243-V413 HydrophobicContact CG-CG2 3.72Å; Q244-V413 PolarHBondContact OE1-O 3.37Å; C247-V413 HydrophobicContact CB-CG1 3.9Å; C247-V413 WeakPolarHBondContact SG-CG1 2.99Å; V258-V413 HydrophobicContact CG1-CG1 3.7Å; I409-V413 HydrophobicContact CG2-CG2 4.31Å; I409-V413 WeakPolarHBondContact O-CG2 3.37Å; I409-V413 PolarHBondContact O-N 3.44Å; M410-V413 PolarHBondContact O-N 3.01Å
414	V	59	Low	73.7	Confident	27 Å²	27	14.8 Å²	14.8	16%	0.164	8%	0.079	C	C	.	.	H	α-helix	trans	-94.2	-23.9	179.6	168.3	0	0	0	0	112.9	V258 A259 S262 F412 N416	V258-V414 HydrophobicContact CG1-CG2 4.05Å; A259-V414 HydrophobicContact CB-CG1 4.47Å; A259-V414 HydrophobicContact CB-CG2 4.38Å; S262-V414 WeakPolarHBondContact OG-CG2 3.03Å; F412-V414 VanDerWaalsContact C-N 3.26Å; F412-V414 PolarHBondContact O-N 2.96Å; V414-N416 VanDerWaalsContact C-N 3.3Å; V414-N416 PolarHBondContact O-N 2.98Å
415	A	56.9	Low	72.1	Confident	9 Å²	9	20 Å²	20	7%	0.074	10%	0.102	C	C	.	.	H	α-helix	trans	-75	-10.1	-172.7	0	0	0	0	0	115.2	F55 I411 F412 V417	F55-A415 HydrophobicContact CD2-CB 4.42Å; F55-A415 VanDerWaalsContact CD2-O 3.31Å; F55-A415 WeakPolarHBondContact CD2-O 3.08Å; F55-A415 WeakPolarHBondContact CE2-O 3.48Å; I411-A415 WeakPolarHBondContact O-CB 3.49Å; F412-A415 PolarHBondContact O-N 2.86Å; A415-V417 PolarHBondContact O-N 3.36Å
416	N	57.1	Low	70.2	Confident	8 Å²	8	20.1 Å²	20.1	4%	0.043	10%	0.103	C	C	.	.			trans	-82.8	126.8	-171.5	-80.5	-10.9	0	0	0	113.1	Q244 V414 V418	Q244-N416 PolarHBondContact NE2-ND2 3.16Å; V414-N416 VanDerWaalsContact C-N 3.3Å; V414-N416 PolarHBondContact O-N 2.98Å; N416-V418 HydrophobicContact CB-CG2 4.32Å; N416-V418 PolarHBondContact O-N 3.13Å
417	V	57.9	Low	68.4	Low	4 Å²	4	23.4 Å²	23.4	2%	0.024	11%	0.112	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.6	6.4	-169.3	-170.7	0	0	0	0	113.4	F55 S128 S132 W319 T321 A415 T419 S420 L421	F55-V417 HydrophobicContact CE2-CG2 3.95Å; F55-V417 HydrophobicContact CZ-CG2 4.4Å; S128-V417 WeakPolarHBondContact OG-CG1 3.3Å; S132-V417 WeakPolarHBondContact OG-CB 3.41Å; S132-V417 PolarHBondContact OG-N 3.49Å; W319-V417 HydrophobicContact CE3-CG2 4.38Å; T321-V417 WeakPolarHBondContact OG1-CG1 3.38Å; A415-V417 PolarHBondContact O-N 3.36Å; V417-T419 PolarHBondContact O-N 3.28Å; V417-S420 WeakPolarHBondContact CG1-OG 3.42Å; V417-S420 PolarHBondContact O-N 3.27Å; V417-S420 PolarHBondContact O-OG 3.14Å; V417-L421 WeakPolarHBondContact O-CD1 3.21Å; V417-L421 PolarHBondContact O-N 3.43Å
418	V	61.2	Low	66.9	Low	0 Å²	0	34.4 Å²	34.4	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-55.2	-29	-178.2	-177	0	0	0	0	112.3	W241 L248 N416 S420 L421 C422 L437 L441 F444	W241-V418 HydrophobicContact CZ3-CG2 4.13Å; L248-V418 HydrophobicContact CD1-CB 3.66Å; L248-V418 HydrophobicContact CD1-CG1 3.81Å; N416-V418 HydrophobicContact CB-CG2 4.32Å; N416-V418 PolarHBondContact O-N 3.13Å; V418-S420 PolarHBondContact O-N 3.4Å; V418-L421 WeakPolarHBondContact O-CB 3.48Å; V418-L421 PolarHBondContact O-N 3.16Å; V418-C422 PolarHBondContact O-N 3.45Å; V418-C422 PolarHBondContact O-SG 3.43Å; V418-L437 HydrophobicContact CG1-CD1 3.51Å; V418-L441 HydrophobicContact CG1-CD2 3.98Å; V418-L441 HydrophobicContact CG2-CD2 4.18Å; V418-F444 HydrophobicContact CG2-CD2 4.44Å; V418-F444 HydrophobicContact CG2-CE2 4.21Å
419	T	62.7	Low	65.4	Low	23 Å²	23	38.4 Å²	38.4	14%	0.141	17%	0.174	C	C	.	.	H	α-helix	trans	-60.2	-44.3	175	-49.8	0	0	0	0	112.4	L248 V252 V417 L421 C422 D423	L248-T419 WeakPolarHBondContact CD2-OG1 3.39Å; V252-T419 HydrophobicContact CG2-CG2 4.19Å; V417-T419 PolarHBondContact O-N 3.28Å; T419-L421 VanDerWaalsContact C-N 3.31Å; T419-L421 PolarHBondContact O-N 3.32Å; T419-C422 PolarHBondContact O-N 3.34Å; T419-D423 PolarHBondContact O-N 2.88Å
420	S	62.6	Low	63.8	Low	5 Å²	5	44.2 Å²	44.2	4%	0.035	20%	0.195	C	C	.	.	H	α-helix	trans	-69.1	-34.4	177.7	76.3	0	0	0	0	111.4	T324 V417 V418 D423	T324-S420 WeakPolarHBondContact OG1-CB 3.36Å; V417-S420 WeakPolarHBondContact CG1-OG 3.42Å; V417-S420 PolarHBondContact O-N 3.27Å; V417-S420 PolarHBondContact O-OG 3.14Å; V418-S420 PolarHBondContact O-N 3.4Å; S420-D423 PolarHBondContact O-N 3.46Å
421	L	62.8	Low	62.7	Low	8 Å²	8	51.9 Å²	51.9	4%	0.042	23%	0.227	C	C	.	.	H	α-helix	trans	-65.2	-42.3	178.8	-75.1	139.5	0	0	0	111.9	F125 A129 V417 V418 T419 F444	F125-L421 HydrophobicContact CD1-CD2 3.99Å; F125-L421 HydrophobicContact CD2-CD2 3.71Å; F125-L421 HydrophobicContact CD2-CG 4.12Å; F125-L421 HydrophobicContact CE1-CD2 3.51Å; F125-L421 VanDerWaalsContact CE2-CA 3.49Å; F125-L421 HydrophobicContact CE2-CB 3.98Å; F125-L421 HydrophobicContact CE2-CD2 3.27Å; F125-L421 HydrophobicContact CE2-CG 3.83Å; F125-L421 HydrophobicContact CG-CD2 4.07Å; F125-L421 HydrophobicContact CZ-CB 4.43Å; F125-L421 HydrophobicContact CZ-CD2 3.13Å; F125-L421 HydrophobicContact CZ-CG 4.17Å; A129-L421 HydrophobicContact CB-CD1 4.34Å; A129-L421 HydrophobicContact CB-CD2 3.65Å; V417-L421 WeakPolarHBondContact O-CD1 3.21Å; V417-L421 PolarHBondContact O-N 3.43Å; V418-L421 WeakPolarHBondContact O-CB 3.48Å; V418-L421 PolarHBondContact O-N 3.16Å; T419-L421 VanDerWaalsContact C-N 3.31Å; T419-L421 PolarHBondContact O-N 3.32Å; L421-F444 HydrophobicContact CB-CZ 4.5Å; L421-F444 HydrophobicContact CD1-CE2 3.74Å; L421-F444 HydrophobicContact CD1-CZ 3.65Å; L421-F444 HydrophobicContact CD2-CZ 3.73Å; L421-F444 HydrophobicContact CG-CZ 4.15Å
422	C	62.5	Low	62.2	Low	4 Å²	4	55.6 Å²	55.6	3%	0.027	25%	0.247	C	C	.	.	H	α-helix	trans	-69.6	-34.2	180	-68.2	0	0	0	0	112.1	V418 T419 H424 F425 A426 L437	V418-C422 PolarHBondContact O-N 3.45Å; V418-C422 PolarHBondContact O-SG 3.43Å; T419-C422 PolarHBondContact O-N 3.34Å; C422-H424 PolarHBondContact O-N 3.06Å; C422-F425 PolarHBondContact O-N 2.89Å; C422-A426 WeakPolarHBondContact O-CA 3.44Å; C422-A426 WeakPolarHBondContact O-CB 3.34Å; C422-A426 PolarHBondContact O-N 3Å; C422-L437 WeakPolarHBondContact SG-CD1 3.39Å
423	D	62.8	Low	61.9	Low	16 Å²	16	58.8 Å²	58.8	9%	0.086	26%	0.262	C	S	.	.	H	α-helix	trans	-62.5	-38.7	-173.7	-89.2	-6.1	0	0	0	114.3	R39 Y328 T419 S420 R427	R39-D423 IonicContact CZ-OD2 2.62Å; R39-D423 IonicContact NH1-OD1 2.66Å; R39-D423 IonicContact NH1-OD2 3.28Å; R39-D423 PolarHBondContact NH1-OD2 3.28Å; R39-D423 IonicContact NH2-OD2 2.71Å; R39-D423 PolarHBondContact NH2-OD2 3.08Å; Y328-D423 PolarHBondContact OH-OD1 2.96Å; Y328-D423 PolarHBondContact OH-OD2 3.49Å; T419-D423 PolarHBondContact O-N 2.88Å; S420-D423 PolarHBondContact O-N 3.46Å; D423-R427 PolarHBondContact O-N 2.64Å; D423-R427 VanDerWaalsContact O-N 3.15Å
424	H	63.5	Low	62.3	Low	68 Å²	68	64.6 Å²	64.6	32%	0.315	28%	0.282	S	S	.	.	H	α-helix	trans	-66.9	-47	-179.5	-170.8	74.5	0	0	0	111.8	I108 C422	I108-H424 HydrophobicContact CD1-CB 4.12Å; C422-H424 PolarHBondContact O-N 3.06Å
425	F	61.3	Low	63.4	Low	112 Å²	112	69.2 Å²	69.2	49%	0.491	30%	0.302	S	S	.	.	H	α-helix	trans	-75.4	-33.5	179.3	-74.7	-75	0	0	0	112.4	F125 C422 R427 R428 L429 V436	F125-F425 AromaticContact CZ-CE2 3.99Å; F125-F425 HydrophobicContact CZ-CE2 3.99Å; C422-F425 PolarHBondContact O-N 2.89Å; F425-R427 VanDerWaalsContact C-N 3.29Å; F425-R427 PolarHBondContact O-N 3.48Å; F425-R428 PolarHBondContact O-N 3.39Å; F425-R428 VanDerWaalsContact O-N 3.12Å; F425-L429 PolarHBondContact O-N 3.47Å; F425-V436 HydrophobicContact CB-CG1 3.63Å
426	A	54.7	Low	64.5	Low	3 Å²	3	69.6 Å²	69.6	3%	0.025	30%	0.303	C	S	.	.	H	α-helix	trans	-64.9	-31.1	177.2	0	0	0	0	0	112.3	C422 R428 L429 R430 Q433	C422-A426 WeakPolarHBondContact O-CA 3.44Å; C422-A426 WeakPolarHBondContact O-CB 3.34Å; C422-A426 PolarHBondContact O-N 3Å; A426-R428 PolarHBondContact O-N 2.86Å; A426-L429 CarbonylContact O-C 3.19Å; A426-L429 PolarHBondContact O-N 3.15Å; A426-R430 WeakPolarHBondContact O-CA 3.47Å; A426-R430 PolarHBondContact O-N 3.12Å; A426-Q433 HydrophobicContact CB-CG 3.98Å
427	R	57.1	Low	65.7	Low	125 Å²	125	69.3 Å²	69.3	47%	0.472	30%	0.302	S	S	.	.	H	α-helix	trans	-61.4	-36.4	173.7	-167.2	175.6	64.2	128.9	2.7	111.7	D423 F425	D423-R427 PolarHBondContact O-N 2.64Å; D423-R427 VanDerWaalsContact O-N 3.15Å; F425-R427 VanDerWaalsContact C-N 3.29Å; F425-R427 PolarHBondContact O-N 3.48Å
428	R	60.5	Low	67	Low	231 Å²	231	71.1 Å²	71.1	87%	0.872	32%	0.315	S	S	*	.	H	α-helix	trans	-82.6	-27.1	177	-157.4	168.8	-171.7	162.7	1.9	112.8	F425 A426	F425-R428 PolarHBondContact O-N 3.39Å; F425-R428 VanDerWaalsContact O-N 3.12Å; A426-R428 PolarHBondContact O-N 2.86Å
429	L	59.9	Low	68.3	Low	84 Å²	84	76.2 Å²	76.2	44%	0.44	34%	0.342	S	S	.	.	S	Bend	trans	-118.5	46.6	180	-83.7	88.3	0	0	0	112.8	F425 A426 K431 N432 V436	F425-L429 PolarHBondContact O-N 3.47Å; A426-L429 CarbonylContact O-C 3.19Å; A426-L429 PolarHBondContact O-N 3.15Å; L429-K431 PolarHBondContact O-N 2.95Å; L429-K431 VanDerWaalsContact O-N 3.08Å; L429-N432 CarbonylContact O-C 3.59Å; L429-N432 PolarHBondContact O-N 2.78Å; L429-V436 HydrophobicContact CB-CG2 3.71Å; L429-V436 HydrophobicContact CD2-CG2 3.93Å; L429-V436 HydrophobicContact CG-CG2 4.37Å
430	R	59.7	Low	69.3	Low	139 Å²	139	76 Å²	76	53%	0.525	34%	0.342	S	S	.	.	G	3₁₀ helix	trans	-58.6	-28.8	-172.2	-165.2	175.7	178	-159.5	-4.9	113.9	I38 A426 N432 Q433	I38-R430 PolarHBondContact O-NH2 3.41Å; A426-R430 WeakPolarHBondContact O-CA 3.47Å; A426-R430 PolarHBondContact O-N 3.12Å; R430-N432 VanDerWaalsContact C-N 3.32Å; R430-N432 PolarHBondContact O-N 3.09Å; R430-Q433 WeakPolarHBondContact O-CG 3.42Å
431	K	65.3	Low	70.5	Confident	205 Å²	205	76.3 Å²	76.3	89%	0.891	34%	0.343	S	S	*	.	G	3₁₀ helix	trans	-71.2	-24.2	176.9	-73.7	-175.9	177.4	177.9	0	113.6	L429	L429-K431 PolarHBondContact O-N 2.95Å; L429-K431 VanDerWaalsContact O-N 3.08Å
432	N	72.3	Confident	71.9	Confident	82 Å²	82	80.1 Å²	80.1	44%	0.439	37%	0.367	S	S	.	.	G	3₁₀ helix	trans	-127.5	34.8	-168	-73.5	5.1	0	0	0	113	L429 R430 R434 H435 V436	L429-N432 CarbonylContact O-C 3.59Å; L429-N432 PolarHBondContact O-N 2.78Å; R430-N432 VanDerWaalsContact C-N 3.32Å; R430-N432 PolarHBondContact O-N 3.09Å; N432-R434 PolarHBondContact O-N 3.02Å; N432-R434 VanDerWaalsContact O-N 3.07Å; N432-H435 HydrophobicContact CB-CB 4.3Å; N432-H435 WeakPolarHBondContact O-CB 3.43Å; N432-H435 PolarHBondContact O-N 3.44Å; N432-V436 PolarHBondContact O-N 2.96Å
433	Q	70.6	Confident	73.3	Confident	68 Å²	68	84.5 Å²	84.5	32%	0.318	39%	0.389	S	S	.	.	H	α-helix	trans	-53.8	-34.4	-174.4	-57.8	-179.3	-60.1	0	0	113.5	H251 A426 R430 V436 L437	H251-Q433 WeakPolarHBondContact NE2-CB 3.27Å; A426-Q433 HydrophobicContact CB-CG 3.98Å; R430-Q433 WeakPolarHBondContact O-CG 3.42Å; Q433-V436 PolarHBondContact O-N 3.26Å; Q433-L437 PolarHBondContact O-N 2.77Å
434	R	77.5	Confident	74.6	Confident	135 Å²	135	84.6 Å²	84.6	51%	0.509	39%	0.388	S	S	.	.	H	α-helix	trans	-64.6	-38.7	175.8	-63.8	179.4	-179.9	163.5	0.6	113.1	N432 L437 S438	N432-R434 PolarHBondContact O-N 3.02Å; N432-R434 VanDerWaalsContact O-N 3.07Å; R434-L437 PolarHBondContact O-N 3.28Å; R434-S438 PolarHBondContact O-N 3.14Å; R434-S438 PolarHBondContact O-OG 3.15Å
435	H	82	Confident	76	Confident	124 Å²	124	83.8 Å²	83.8	57%	0.574	38%	0.383	S	S	*	.	H	α-helix	trans	-70.3	-37	177.6	-66.2	-64.5	0	0	0	111.4	N432 S438 L439	N432-H435 HydrophobicContact CB-CB 4.3Å; N432-H435 WeakPolarHBondContact O-CB 3.43Å; N432-H435 PolarHBondContact O-N 3.44Å; H435-S438 WeakPolarHBondContact CA-OG 3.21Å; H435-S438 PolarHBondContact O-N 3.31Å; H435-S438 PolarHBondContact O-OG 3.49Å; H435-L439 VanDerWaalsContact O-CB 3.31Å; H435-L439 WeakPolarHBondContact O-CB 3.5Å; H435-L439 PolarHBondContact O-N 3.4Å
436	V	80.8	Confident	77.7	Confident	17 Å²	17	82.8 Å²	82.8	10%	0.103	39%	0.386	C	S	.	.	H	α-helix	trans	-62.2	-47.3	174.2	178.2	0	0	0	0	110.5	F425 L429 N432 Q433 L439 A440	F425-V436 HydrophobicContact CB-CG1 3.63Å; L429-V436 HydrophobicContact CB-CG2 3.71Å; L429-V436 HydrophobicContact CD2-CG2 3.93Å; L429-V436 HydrophobicContact CG-CG2 4.37Å; N432-V436 PolarHBondContact O-N 2.96Å; Q433-V436 PolarHBondContact O-N 3.26Å; V436-L439 PolarHBondContact O-N 3Å; V436-A440 WeakPolarHBondContact O-CB 3.24Å; V436-A440 PolarHBondContact O-N 2.71Å
437	L	82.1	Confident	79.5	Confident	2 Å²	2	85 Å²	85	1%	0.01	41%	0.405	C	S	.	.	H	α-helix	trans	-57.7	-50.7	174.9	176.6	65.8	0	0	0	110.9	F245 L248 V418 C422 Q433 R434 L439 A440 L441	F245-L437 HydrophobicContact CD2-CD2 3.85Å; F245-L437 HydrophobicContact CD2-CG 4.02Å; F245-L437 HydrophobicContact CE2-CD2 4.13Å; F245-L437 HydrophobicContact CE2-CG 4.38Å; L248-L437 HydrophobicContact CB-CD1 4.35Å; L248-L437 HydrophobicContact CB-CD2 3.92Å; L248-L437 HydrophobicContact CD1-CD1 4.26Å; V418-L437 HydrophobicContact CG1-CD1 3.51Å; C422-L437 WeakPolarHBondContact SG-CD1 3.39Å; Q433-L437 PolarHBondContact O-N 2.77Å; R434-L437 PolarHBondContact O-N 3.28Å; L437-L439 VanDerWaalsContact C-N 3.3Å; L437-L439 PolarHBondContact O-N 3.39Å; L437-A440 PolarHBondContact O-N 3.09Å; L437-L441 HydrophobicContact CD1-CD1 4.03Å; L437-L441 HydrophobicContact CD1-CG 4.13Å; L437-L441 HydrophobicContact CG-CD1 4.06Å; L437-L441 HydrophobicContact CG-CG 4.48Å; L437-L441 VanDerWaalsContact O-CG 3.25Å; L437-L441 WeakPolarHBondContact O-CG 2.99Å; L437-L441 PolarHBondContact O-N 2.94Å
438	S	85.6	Confident	81.2	Confident	43 Å²	43	79.1 Å²	79.1	30%	0.301	38%	0.382	S	S	.	.	H	α-helix	trans	-60	-40.1	179	61.9	0	0	0	0	112.7	R434 H435 L441 V442	R434-S438 PolarHBondContact O-N 3.14Å; R434-S438 PolarHBondContact O-OG 3.15Å; H435-S438 WeakPolarHBondContact CA-OG 3.21Å; H435-S438 PolarHBondContact O-N 3.31Å; H435-S438 PolarHBondContact O-OG 3.49Å; S438-L441 PolarHBondContact O-N 3.19Å; S438-V442 VanDerWaalsContact O-CG2 3.25Å; S438-V442 WeakPolarHBondContact O-CG2 3.5Å; S438-V442 PolarHBondContact O-N 2.83Å
439	L	87.3	Confident	82.9	Confident	107 Å²	107	70 Å²	70	56%	0.56	35%	0.351	S	S	*	.	H	α-helix	trans	-67.2	-44.5	179	179.1	63.1	0	0	0	111.2	H435 V436 L437 L441 V442 I443	H435-L439 VanDerWaalsContact O-CB 3.31Å; H435-L439 WeakPolarHBondContact O-CB 3.5Å; H435-L439 PolarHBondContact O-N 3.4Å; V436-L439 PolarHBondContact O-N 3Å; L437-L439 VanDerWaalsContact C-N 3.3Å; L437-L439 PolarHBondContact O-N 3.39Å; L439-L441 VanDerWaalsContact C-N 3.34Å; L439-L441 PolarHBondContact O-N 2.98Å; L439-V442 PolarHBondContact O-N 3.36Å; L439-I443 HydrophobicContact CD1-CD1 4.33Å; L439-I443 HydrophobicContact CG-CD1 4.07Å; L439-I443 VanDerWaalsContact O-CG1 3.3Å; L439-I443 WeakPolarHBondContact O-CG1 3.3Å; L439-I443 PolarHBondContact O-N 3.48Å
440	A	84.6	Confident	84.5	Confident	19 Å²	19	69.1 Å²	69.1	16%	0.157	35%	0.346	C	S	.	.	H	α-helix	trans	-60.6	-44.1	177.4	0	0	0	0	0	111.5	V436 L437 V442 I443 F444	V436-A440 WeakPolarHBondContact O-CB 3.24Å; V436-A440 PolarHBondContact O-N 2.71Å; L437-A440 PolarHBondContact O-N 3.09Å; A440-V442 PolarHBondContact O-N 3.14Å; A440-I443 PolarHBondContact O-N 2.97Å; A440-F444 WeakPolarHBondContact O-CG 3.19Å; A440-F444 PolarHBondContact O-N 2.97Å
441	L	87.8	Confident	86.1	Confident	11 Å²	11	63.3 Å²	63.3	6%	0.058	32%	0.324	C	S	.	.	H	α-helix	trans	-65.4	-37.6	177.2	-66.4	179.3	0	0	0	112.5	W241 F245 V418 L437 S438 L439 F444 Y445	W241-L441 HydrophobicContact CD2-CD2 4.39Å; W241-L441 HydrophobicContact CE3-CD2 3.45Å; W241-L441 VanDerWaalsContact CE3-CD2 3.45Å; W241-L441 HydrophobicContact CZ3-CD2 3.82Å; F245-L441 HydrophobicContact CB-CD1 3.49Å; F245-L441 VanDerWaalsContact CB-CD1 3.49Å; F245-L441 HydrophobicContact CD2-CD1 3.76Å; F245-L441 HydrophobicContact CG-CD1 4.11Å; V418-L441 HydrophobicContact CG1-CD2 3.98Å; V418-L441 HydrophobicContact CG2-CD2 4.18Å; L437-L441 HydrophobicContact CD1-CD1 4.03Å; L437-L441 HydrophobicContact CD1-CG 4.13Å; L437-L441 HydrophobicContact CG-CD1 4.06Å; L437-L441 HydrophobicContact CG-CG 4.48Å; L437-L441 VanDerWaalsContact O-CG 3.25Å; L437-L441 WeakPolarHBondContact O-CG 2.99Å; L437-L441 PolarHBondContact O-N 2.94Å; S438-L441 PolarHBondContact O-N 3.19Å; L439-L441 VanDerWaalsContact C-N 3.34Å; L439-L441 PolarHBondContact O-N 2.98Å; L441-F444 PolarHBondContact O-N 3.34Å; L441-Y445 WeakPolarHBondContact O-CB 3.49Å; L441-Y445 PolarHBondContact O-N 3.45Å
442	V	91.7	Very high	87.5	Confident	87 Å²	87	53.5 Å²	53.5	53%	0.527	28%	0.282	S	S	.	.	H	α-helix	trans	-64.1	-42.5	173.3	169.6	0	0	0	0	110.9	S438 L439 A440 Y445 V446	S438-V442 VanDerWaalsContact O-CG2 3.25Å; S438-V442 WeakPolarHBondContact O-CG2 3.5Å; S438-V442 PolarHBondContact O-N 2.83Å; L439-V442 PolarHBondContact O-N 3.36Å; A440-V442 PolarHBondContact O-N 3.14Å; V442-Y445 PolarHBondContact O-N 2.82Å; V442-V446 WeakPolarHBondContact O-CG2 3.39Å; V442-V446 PolarHBondContact O-N 2.88Å
443	I	91.2	Very high	88.6	Confident	96 Å²	96	50.6 Å²	50.6	49%	0.492	27%	0.267	S	S	.	.	H	α-helix	trans	-61.3	-45.3	175.8	-68.1	165.4	0	0	0	110.5	L439 A440 V446 A447	L439-I443 HydrophobicContact CD1-CD1 4.33Å; L439-I443 HydrophobicContact CG-CD1 4.07Å; L439-I443 VanDerWaalsContact O-CG1 3.3Å; L439-I443 WeakPolarHBondContact O-CG1 3.3Å; L439-I443 PolarHBondContact O-N 3.48Å; A440-I443 PolarHBondContact O-N 2.97Å; I443-V446 PolarHBondContact O-N 3.46Å; I443-A447 VanDerWaalsContact O-CB 3.29Å; I443-A447 WeakPolarHBondContact O-CB 3Å; I443-A447 PolarHBondContact O-N 2.97Å
444	F	91	Very high	89.7	Confident	18 Å²	18	50.1 Å²	50.1	8%	0.079	26%	0.264	C	S	.	.	H	α-helix	trans	-68.6	-35.9	178.6	-65.3	-15.5	0	0	0	113.4	A129 I133 W241 V418 L421 A440 L441 G448	A129-F444 HydrophobicContact CB-CE1 4.24Å; A129-F444 HydrophobicContact CB-CZ 4.24Å; I133-F444 HydrophobicContact CD1-CD1 3.96Å; I133-F444 HydrophobicContact CD1-CG 4.49Å; I133-F444 HydrophobicContact CG1-CB 3.94Å; I133-F444 HydrophobicContact CG1-CD1 3.94Å; I133-F444 HydrophobicContact CG1-CG 3.97Å; W241-F444 HydrophobicContact CH2-CB 3.45Å; W241-F444 VanDerWaalsContact CH2-CB 3.45Å; W241-F444 AromaticContact CH2-CD2 3.64Å; W241-F444 HydrophobicContact CH2-CD2 3.64Å; W241-F444 AromaticContact CH2-CG 3.96Å; W241-F444 HydrophobicContact CH2-CG 3.96Å; W241-F444 HydrophobicContact CZ2-CB 3.41Å; W241-F444 VanDerWaalsContact CZ2-CB 3.41Å; W241-F444 HydrophobicContact CZ2-CD2 4.47Å; W241-F444 HydrophobicContact CZ2-CG 4.37Å; W241-F444 HydrophobicContact CZ3-CB 4.09Å; W241-F444 AromaticContact CZ3-CD2 3.82Å; W241-F444 HydrophobicContact CZ3-CD2 3.82Å; W241-F444 HydrophobicContact CZ3-CG 4.47Å; V418-F444 HydrophobicContact CG2-CD2 4.44Å; V418-F444 HydrophobicContact CG2-CE2 4.21Å; L421-F444 HydrophobicContact CB-CZ 4.5Å; L421-F444 HydrophobicContact CD1-CE2 3.74Å; L421-F444 HydrophobicContact CD1-CZ 3.65Å; L421-F444 HydrophobicContact CD2-CZ 3.73Å; L421-F444 HydrophobicContact CG-CZ 4.15Å; A440-F444 WeakPolarHBondContact O-CG 3.19Å; A440-F444 PolarHBondContact O-N 2.97Å; L441-F444 PolarHBondContact O-N 3.34Å; F444-G448 PolarHBondContact O-N 3.07Å
445	Y	93.7	Very high	90.5	Very high	52 Å²	52	43.7 Å²	43.7	20%	0.204	24%	0.239	C	C	.	.	H	α-helix	trans	-59	-51.9	171.7	173.6	-107	0	0	0	110.6	F237 L238 W241 L441 V442 A447 G448 L449	F237-Y445 AromaticContact CD1-CD2 3.57Å; F237-Y445 HydrophobicContact CD1-CD2 3.57Å; F237-Y445 AromaticContact CD1-CE2 3.84Å; F237-Y445 HydrophobicContact CD1-CE2 3.84Å; F237-Y445 AromaticContact CE1-CD2 3.97Å; F237-Y445 HydrophobicContact CE1-CD2 3.97Å; F237-Y445 WeakPolarHBondContact CE1-O 3.34Å; L238-Y445 HydrophobicContact CB-CD2 4.21Å; L238-Y445 HydrophobicContact CB-CE2 3.63Å; L238-Y445 HydrophobicContact CD1-CD2 4.11Å; L238-Y445 HydrophobicContact CD1-CE2 4.08Å; L238-Y445 HydrophobicContact CD1-CG 4.34Å; L238-Y445 HydrophobicContact CG-CE2 4.41Å; W241-Y445 AromaticContact CD1-CD2 3.79Å; L441-Y445 WeakPolarHBondContact O-CB 3.49Å; L441-Y445 PolarHBondContact O-N 3.45Å; V442-Y445 PolarHBondContact O-N 2.82Å; Y445-A447 PolarHBondContact O-N 3.17Å; Y445-G448 PolarHBondContact O-N 3.5Å; Y445-L449 HydrophobicContact CE1-CD2 4.21Å; Y445-L449 HydrophobicContact CE2-CD2 3.96Å; Y445-L449 WeakPolarHBondContact O-CG 3.36Å; Y445-L449 PolarHBondContact O-N 3Å
446	V	95.5	Very high	91.1	Very high	90 Å²	90	37.9 Å²	37.9	55%	0.545	21%	0.213	S	C	.	.	H	α-helix	trans	-63	-44.5	179.8	174.8	0	0	0	0	111.5	V442 I443 G448 L449	V442-V446 WeakPolarHBondContact O-CG2 3.39Å; V442-V446 PolarHBondContact O-N 2.88Å; I443-V446 PolarHBondContact O-N 3.46Å; V446-G448 VanDerWaalsContact C-N 3.27Å; V446-G448 PolarHBondContact O-N 3.44Å; V446-L449 PolarHBondContact O-N 3Å
447	A	93.4	Very high	91.7	Very high	51 Å²	51	37.1 Å²	37.1	42%	0.421	21%	0.208	S	C	.	.	H	α-helix	trans	-63.9	-32.2	178.4	0	0	0	0	0	112.7	I133 I443 Y445	I133-A447 HydrophobicContact CD1-CB 3.99Å; I443-A447 VanDerWaalsContact O-CB 3.29Å; I443-A447 WeakPolarHBondContact O-CB 3Å; I443-A447 PolarHBondContact O-N 2.97Å; Y445-A447 PolarHBondContact O-N 3.17Å
448	G	93.6	Very high	92.2	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-85.4	-6.9	-179.3	0	0	0	0	0	115.7	F444 Y445 V446 I450 F451	F444-G448 PolarHBondContact O-N 3.07Å; Y445-G448 PolarHBondContact O-N 3.5Å; V446-G448 VanDerWaalsContact C-N 3.27Å; V446-G448 PolarHBondContact O-N 3.44Å; G448-I450 PolarHBondContact O-N 3.39Å; G448-I450 VanDerWaalsContact O-N 3.09Å; G448-F451 WeakPolarHBondContact O-CD2 3.01Å; G448-F451 PolarHBondContact O-N 3.37Å
449	L	94.9	Very high	92.6	Very high	40 Å²	40	36.5 Å²	36.5	21%	0.209	20%	0.199	C	C	.	.	G	3₁₀ helix	trans	-58.5	-25	178.4	-72.9	178.1	0	0	0	113	M229 A234 Y445 V446 F451 C452	M229-L449 HydrophobicContact SD-CB 4.35Å; M229-L449 HydrophobicContact SD-CD1 4.43Å; M229-L449 HydrophobicContact SD-CD2 4.03Å; M229-L449 HydrophobicContact SD-CG 4.5Å; A234-L449 HydrophobicContact CB-CD2 4.19Å; Y445-L449 HydrophobicContact CE1-CD2 4.21Å; Y445-L449 HydrophobicContact CE2-CD2 3.96Å; Y445-L449 WeakPolarHBondContact O-CG 3.36Å; Y445-L449 PolarHBondContact O-N 3Å; V446-L449 PolarHBondContact O-N 3Å; L449-F451 PolarHBondContact O-N 2.87Å; L449-C452 WeakPolarHBondContact O-CB 3.38Å; L449-C452 PolarHBondContact O-N 3.26Å
450	I	93.4	Very high	92.9	Very high	66 Å²	66	31.4 Å²	31.4	34%	0.338	17%	0.173	S	C	.	.	G	3₁₀ helix	trans	-57	-34.6	174.4	-169.1	168.8	0	0	0	112.4	G448 C452 T453 Y459	G448-I450 PolarHBondContact O-N 3.39Å; G448-I450 VanDerWaalsContact O-N 3.09Å; I450-C452 PolarHBondContact O-N 3.39Å; I450-T453 WeakPolarHBondContact O-CB 3.2Å; I450-T453 WeakPolarHBondContact O-CG2 3.34Å; I450-T453 PolarHBondContact O-N 2.8Å; I450-T453 PolarHBondContact O-OG1 3.39Å; I450-Y459 HydrophobicContact CD1-CD1 4.2Å; I450-Y459 HydrophobicContact CD1-CD2 4.24Å; I450-Y459 HydrophobicContact CD1-CE1 4.12Å; I450-Y459 HydrophobicContact CD1-CE2 4.15Å; I450-Y459 HydrophobicContact CD1-CG 4.27Å; I450-Y459 HydrophobicContact CG1-CD2 3.88Å; I450-Y459 HydrophobicContact CG1-CE2 3.96Å; I450-Y459 HydrophobicContact CG1-CG 4.25Å
451	F	94.1	Very high	93.3	Very high	16 Å²	16	31.2 Å²	31.2	7%	0.07	17%	0.169	C	C	.	.	G	3₁₀ helix	trans	-77.6	-10.5	178.1	-57	-74.7	0	0	0	113.2	I133 Y134 V137 G448 L449 T453 G456 F460	I133-F451 HydrophobicContact CG2-CD2 4.24Å; I133-F451 HydrophobicContact CG2-CE2 3.81Å; Y134-F451 VanDerWaalsContact CB-CZ 3.43Å; V137-F451 HydrophobicContact CB-CB 4.29Å; V137-F451 HydrophobicContact CG1-CB 4.07Å; V137-F451 HydrophobicContact CG2-CB 3.31Å; V137-F451 HydrophobicContact CG2-CD2 3.94Å; V137-F451 HydrophobicContact CG2-CG 3.74Å; G448-F451 WeakPolarHBondContact O-CD2 3.01Å; G448-F451 PolarHBondContact O-N 3.37Å; L449-F451 PolarHBondContact O-N 2.87Å; F451-T453 VanDerWaalsContact C-N 3.3Å; F451-G456 WeakPolarHBondContact O-CA 3.36Å; F451-F460 HydrophobicContact CD1-CB 4.35Å
452	C	95.4	Very high	93.5	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	17%	0.169	C	C	.	.	G	3₁₀ helix	trans	-92.3	12.2	174.5	-58.9	0	0	0	0	112.6	M229 L230 L233 A234 L449 I450	M229-C452 HydrophobicContact CG-CB 4.41Å; L230-C452 PolarHBondContact N-O 3.42Å; L233-C452 HydrophobicContact CD2-CB 4.47Å; L233-C452 HydrophobicContact CG-CB 4.36Å; A234-C452 HydrophobicContact CB-CB 4.31Å; L449-C452 WeakPolarHBondContact O-CB 3.38Å; L449-C452 PolarHBondContact O-N 3.26Å; I450-C452 PolarHBondContact O-N 3.39Å
453	T	94.9	Very high	93.5	Very high	20 Å²	20	28 Å²	28	12%	0.123	15%	0.149	C	C	.	.	B	Isolated β-bridge	trans	-91.3	167.4	173.9	65.9	0	0	0	0	110.8	F226 I450 F451 A455 G456	F226-T453 WeakPolarHBondContact O-CB 3.18Å; I450-T453 WeakPolarHBondContact O-CB 3.2Å; I450-T453 WeakPolarHBondContact O-CG2 3.34Å; I450-T453 PolarHBondContact O-N 2.8Å; I450-T453 PolarHBondContact O-OG1 3.39Å; F451-T453 VanDerWaalsContact C-N 3.3Å; T453-A455 PolarHBondContact O-N 3.04Å; T453-G456 WeakPolarHBondContact O-CA 3.26Å; T453-G456 PolarHBondContact O-N 3.28Å; T453-G456 PolarHBondContact OG1-N 3.02Å
454	K	94.2	Very high	93.3	Very high	58 Å²	58	24.1 Å²	24.1	25%	0.252	13%	0.129	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61	-27	175.4	-64.4	-167.8	172.7	-141.8	0	113.3	E218 S220 F226 L230 G456	E218-K454 HydrophobicContact CB-CD 4.25Å; E218-K454 HydrophobicContact CB-CG 4.2Å; E218-K454 VanDerWaalsContact O-CB 3.29Å; E218-K454 WeakPolarHBondContact O-CB 3.43Å; E218-K454 VanDerWaalsContact O-CD 3.3Å; E218-K454 WeakPolarHBondContact O-CD 3.28Å; E218-K454 VanDerWaalsContact O-CG 3.26Å; E218-K454 WeakPolarHBondContact O-CG 3.41Å; E218-K454 WeakPolarHBondContact OE2-CE 3.48Å; E218-K454 IonicContact OE2-NZ 3.56Å; E218-K454 PolarHBondContact OE2-NZ 2.96Å; S220-K454 PolarHBondContact N-O 3.19Å; F226-K454 PolarHBondContact O-N 3.4Å; L230-K454 HydrophobicContact CD2-CG 4.34Å; K454-G456 VanDerWaalsContact C-N 3.29Å
455	A	93.6	Very high	93.2	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	14%	0.139	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85	2.9	172.2	0	0	0	0	0	113.7	S220 F226 T453 I457 Y458 Y459	S220-A455 WeakPolarHBondContact OG-CA 3.38Å; F226-A455 PolarHBondContact O-N 3.42Å; T453-A455 PolarHBondContact O-N 3.04Å; A455-I457 VanDerWaalsContact C-N 3.28Å; A455-I457 PolarHBondContact O-N 3.03Å; A455-Y458 HydrophobicContact CB-CD2 4.27Å; A455-Y458 WeakPolarHBondContact O-CB 3.36Å; A455-Y458 PolarHBondContact O-N 3.17Å; A455-Y459 HydrophobicContact CB-CD2 4.23Å; A455-Y459 HydrophobicContact CB-CE2 3.79Å; A455-Y459 WeakPolarHBondContact O-CD2 3.1Å; A455-Y459 PolarHBondContact O-N 3.07Å
456	G	94	Very high	93	Very high	2 Å²	2	24 Å²	24	2%	0.021	13%	0.132	C	C	.	.	H	α-helix	trans	-57.4	-36	-170.1	0	0	0	0	0	114.3	F451 T453 K454 Y458 Y459 F460	F451-G456 WeakPolarHBondContact O-CA 3.36Å; T453-G456 WeakPolarHBondContact O-CA 3.26Å; T453-G456 PolarHBondContact O-N 3.28Å; T453-G456 PolarHBondContact OG1-N 3.02Å; K454-G456 VanDerWaalsContact C-N 3.29Å; G456-Y458 VanDerWaalsContact C-N 3.33Å; G456-Y458 PolarHBondContact O-N 2.62Å; G456-Y459 PolarHBondContact O-N 2.81Å; G456-F460 WeakPolarHBondContact O-CB 3.32Å; G456-F460 PolarHBondContact O-N 2.94Å
457	I	93.2	Very high	92.6	Very high	1 Å²	1	19.7 Å²	19.7	1%	0.005	11%	0.106	C	C	.	.	H	α-helix	trans	-64.6	-36.1	176.8	-171	60.8	0	0	0	112.3	W141 L217 M219 P380 A455 F460 E461 Y538	W141-I457 HydrophobicContact CH2-CD1 3.75Å; W141-I457 HydrophobicContact CZ2-CD1 4.24Å; L217-I457 HydrophobicContact CD1-CB 4Å; L217-I457 HydrophobicContact CD1-CD1 4.33Å; L217-I457 HydrophobicContact CD1-CG1 4.1Å; L217-I457 HydrophobicContact CD1-CG2 4.39Å; M219-I457 HydrophobicContact CG-CG2 3.88Å; M219-I457 HydrophobicContact SD-CG2 3.84Å; P380-I457 HydrophobicContact CG-CD1 3.92Å; A455-I457 VanDerWaalsContact C-N 3.28Å; A455-I457 PolarHBondContact O-N 3.03Å; I457-F460 HydrophobicContact CD1-CD1 4.41Å; I457-F460 WeakPolarHBondContact O-CB 3.38Å; I457-F460 PolarHBondContact O-N 3.29Å; I457-E461 PolarHBondContact O-N 2.84Å; I457-Y538 HydrophobicContact CD1-CE2 4.5Å; I457-Y538 HydrophobicContact CG1-CE1 4.41Å; I457-Y538 HydrophobicContact CG1-CE2 3.99Å
458	Y	93.9	Very high	92.1	Very high	8 Å²	8	17.3 Å²	17.3	3%	0.031	9%	0.086	C	C	.	.	H	α-helix	trans	-68.9	-40.2	176.9	-59.7	-65.5	0	0	0	111.5	M219 S220 V223 A455 G456 F460 F462 Y538 Y541 Y543	M219-Y458 HydrophobicContact CG-CE2 4.23Å; S220-Y458 WeakPolarHBondContact O-CE2 3.16Å; S220-Y458 PolarHBondContact O-OH 2.71Å; V223-Y458 HydrophobicContact CG2-CD1 4.49Å; V223-Y458 HydrophobicContact CG2-CD2 4.43Å; V223-Y458 HydrophobicContact CG2-CG 3.99Å; A455-Y458 HydrophobicContact CB-CD2 4.27Å; A455-Y458 WeakPolarHBondContact O-CB 3.36Å; A455-Y458 PolarHBondContact O-N 3.17Å; G456-Y458 VanDerWaalsContact C-N 3.33Å; G456-Y458 PolarHBondContact O-N 2.62Å; Y458-F460 VanDerWaalsContact C-N 3.33Å; Y458-F462 VanDerWaalsContact O-CB 3.22Å; Y458-F462 WeakPolarHBondContact O-CB 3.35Å; Y458-F462 PolarHBondContact O-N 3.4Å; Y458-Y538 HydrophobicContact CD1-CD1 4.26Å; Y458-Y538 HydrophobicContact CD1-CG 4.43Å; Y458-Y538 AromaticContact CE1-CD1 3.86Å; Y458-Y538 HydrophobicContact CE1-CD1 3.86Å; Y458-Y538 HydrophobicContact CE1-CG 4.41Å; Y458-Y541 AromaticContact CD1-CD1 3.96Å; Y458-Y541 HydrophobicContact CD1-CD1 3.96Å; Y458-Y541 HydrophobicContact CD1-CE1 4.28Å; Y458-Y541 AromaticContact CE1-CD1 3.71Å; Y458-Y541 HydrophobicContact CE1-CD1 3.71Å; Y458-Y541 HydrophobicContact CE1-CE1 4.31Å; Y458-Y541 AromaticContact CE1-CG 3.97Å; Y458-Y541 HydrophobicContact CE1-CG 3.97Å; Y458-Y543 WeakPolarHBondContact CA-OH 3.39Å; Y458-Y543 WeakPolarHBondContact CB-OH 2.95Å; Y458-Y543 HydrophobicContact CD1-CE2 4.47Å; Y458-Y543 PolarHBondContact O-OH 3.2Å
459	Y	93.9	Very high	91.5	Very high	24 Å²	24	18.3 Å²	18.3	9%	0.094	10%	0.096	C	C	.	.	H	α-helix	trans	-65.9	-37.7	173.4	-67.3	-64.3	0	0	0	112.1	V223 F226 I450 A455 G456 F462 C463	V223-Y459 HydrophobicContact CG1-CD1 4.06Å; V223-Y459 HydrophobicContact CG1-CD2 4.48Å; V223-Y459 HydrophobicContact CG1-CE1 3.5Å; V223-Y459 HydrophobicContact CG1-CE2 4Å; V223-Y459 VanDerWaalsContact CG1-CZ 3.46Å; V223-Y459 PolarHBondContact O-OH 2.98Å; F226-Y459 HydrophobicContact CD1-CE2 4.09Å; F226-Y459 AromaticContact CE1-CE2 3.98Å; F226-Y459 HydrophobicContact CE1-CE2 3.98Å; F226-Y459 AromaticContact CE1-CZ 3.69Å; F226-Y459 WeakPolarHBondContact CE1-OH 3.32Å; F226-Y459 WeakPolarHBondContact CZ-OH 3.46Å; I450-Y459 HydrophobicContact CD1-CD1 4.2Å; I450-Y459 HydrophobicContact CD1-CD2 4.24Å; I450-Y459 HydrophobicContact CD1-CE1 4.12Å; I450-Y459 HydrophobicContact CD1-CE2 4.15Å; I450-Y459 HydrophobicContact CD1-CG 4.27Å; I450-Y459 HydrophobicContact CG1-CD2 3.88Å; I450-Y459 HydrophobicContact CG1-CE2 3.96Å; I450-Y459 HydrophobicContact CG1-CG 4.25Å; A455-Y459 HydrophobicContact CB-CD2 4.23Å; A455-Y459 HydrophobicContact CB-CE2 3.79Å; A455-Y459 WeakPolarHBondContact O-CD2 3.1Å; A455-Y459 PolarHBondContact O-N 3.07Å; G456-Y459 PolarHBondContact O-N 2.81Å; Y459-F462 PolarHBondContact O-N 2.9Å; Y459-C463 PolarHBondContact O-N 3.47Å; Y459-C463 PolarHBondContact O-SG 2.89Å
460	F	93.5	Very high	91.1	Very high	1 Å²	1	17.3 Å²	17.3	0%	0.004	9%	0.092	C	C	.	.	H	α-helix	trans	-60.3	-52.1	175.3	177.4	-85.8	0	0	0	111.2	Y59 Y134 V138 W141 P380 F451 G456 I457 Y458 F462 C463 E464	Y59-F460 HydrophobicContact CE1-CE1 4.34Å; Y59-F460 AromaticContact CE1-CZ 3.8Å; Y59-F460 HydrophobicContact CE1-CZ 3.8Å; Y134-F460 AromaticContact CD2-CD2 3.68Å; Y134-F460 HydrophobicContact CD2-CD2 3.68Å; Y134-F460 AromaticContact CD2-CE2 3.57Å; Y134-F460 HydrophobicContact CD2-CE2 3.57Å; Y134-F460 HydrophobicContact CD2-CG 4.49Å; Y134-F460 HydrophobicContact CD2-CZ 4.32Å; Y134-F460 HydrophobicContact CE2-CD2 4.47Å; Y134-F460 HydrophobicContact CE2-CE2 4.07Å; Y134-F460 HydrophobicContact CE2-CZ 4.39Å; V138-F460 HydrophobicContact CG2-CE2 3.5Å; V138-F460 HydrophobicContact CG2-CZ 3.75Å; W141-F460 HydrophobicContact CH2-CB 4.37Å; W141-F460 HydrophobicContact CH2-CD1 4.19Å; W141-F460 AromaticContact CH2-CD2 3.95Å; W141-F460 HydrophobicContact CH2-CD2 3.95Å; W141-F460 HydrophobicContact CH2-CE2 4.3Å; W141-F460 AromaticContact CH2-CG 3.9Å; W141-F460 HydrophobicContact CH2-CG 3.9Å; W141-F460 HydrophobicContact CZ3-CD2 4.42Å; W141-F460 HydrophobicContact CZ3-CE2 4.32Å; W141-F460 HydrophobicContact CZ3-CZ 4.39Å; P380-F460 HydrophobicContact CG-CE1 4.43Å; F451-F460 HydrophobicContact CD1-CB 4.35Å; G456-F460 WeakPolarHBondContact O-CB 3.32Å; G456-F460 PolarHBondContact O-N 2.94Å; I457-F460 HydrophobicContact CD1-CD1 4.41Å; I457-F460 WeakPolarHBondContact O-CB 3.38Å; I457-F460 PolarHBondContact O-N 3.29Å; Y458-F460 VanDerWaalsContact C-N 3.33Å; F460-F462 VanDerWaalsContact C-N 3.31Å; F460-F462 PolarHBondContact O-N 3.39Å; F460-C463 PolarHBondContact O-N 2.72Å; F460-E464 PolarHBondContact O-N 2.96Å
461	E	91.5	Very high	90.9	Very high	14 Å²	14	14.2 Å²	14.2	7%	0.065	8%	0.076	C	C	.	.	H	α-helix	trans	-65.1	-36.6	179.6	-172	66.1	-157	0	0	111.4	K378 I457 E464 N465 L536 Y538	K378-E461 IonicContact NZ-OE1 2.82Å; I457-E461 PolarHBondContact O-N 2.84Å; E461-E464 PolarHBondContact O-N 2.87Å; E461-N465 PolarHBondContact O-N 2.82Å; E461-N465 VanDerWaalsContact O-N 3.16Å; E461-N465 PolarHBondContact O-ND2 3.29Å; E461-N465 PolarHBondContact OE1-ND2 3.12Å; E461-L536 HydrophobicContact CG-CD1 4.26Å; E461-Y538 HydrophobicContact CB-CD2 4.24Å; E461-Y538 HydrophobicContact CG-CD2 4.04Å
462	F	92.8	Very high	90.8	Very high	14 Å²	14	13.4 Å²	13.4	6%	0.061	7%	0.073	C	C	.	.	H	α-helix	trans	-57.9	-49.1	171.8	172.5	-95.3	0	0	0	112.1	Y458 Y459 F460 Y466 L536 Y543 M547 L550 G551 L554	Y458-F462 VanDerWaalsContact O-CB 3.22Å; Y458-F462 WeakPolarHBondContact O-CB 3.35Å; Y458-F462 PolarHBondContact O-N 3.4Å; Y459-F462 PolarHBondContact O-N 2.9Å; F460-F462 VanDerWaalsContact C-N 3.31Å; F460-F462 PolarHBondContact O-N 3.39Å; F462-Y466 AromaticContact CD2-CD2 3.57Å; F462-Y466 HydrophobicContact CD2-CD2 3.57Å; F462-Y466 AromaticContact CD2-CE2 3.85Å; F462-Y466 HydrophobicContact CD2-CE2 3.85Å; F462-Y466 AromaticContact CE2-CD2 3.53Å; F462-Y466 HydrophobicContact CE2-CD2 3.53Å; F462-Y466 AromaticContact CE2-CE2 3.85Å; F462-Y466 HydrophobicContact CE2-CE2 3.85Å; F462-Y466 HydrophobicContact CE2-CG 4.37Å; F462-Y466 HydrophobicContact CG-CD2 4.32Å; F462-Y466 HydrophobicContact CZ-CD2 4.29Å; F462-Y466 WeakPolarHBondContact O-CD2 3.47Å; F462-Y466 PolarHBondContact O-N 3.31Å; F462-Y466 VanDerWaalsContact O-N 3.12Å; F462-L536 HydrophobicContact CB-CD2 4.15Å; F462-L536 HydrophobicContact CD2-CD2 4.33Å; F462-Y543 HydrophobicContact CB-CE1 4.32Å; F462-M547 HydrophobicContact CB-CE 4.22Å; F462-M547 HydrophobicContact CD2-CE 3.83Å; F462-M547 HydrophobicContact CE2-CE 4.43Å; F462-M547 VanDerWaalsContact CE2-O 3.27Å; F462-M547 WeakPolarHBondContact CE2-O 3.4Å; F462-M547 HydrophobicContact CG-CE 4.03Å; F462-L550 HydrophobicContact CZ-CB 4.32Å; F462-L550 HydrophobicContact CZ-CD2 4.29Å; F462-L550 HydrophobicContact CZ-CG 4.08Å; F462-G551 VanDerWaalsContact CE2-CA 3.47Å; F462-G551 VanDerWaalsContact CZ-CA 3.42Å; F462-L554 HydrophobicContact CE1-CD2 4.16Å
463	C	91.5	Very high	90.6	Very high	18 Å²	18	13.4 Å²	13.4	12%	0.122	7%	0.073	C	C	.	.	H	α-helix	trans	-64.4	-44.3	177.7	-75	0	0	0	0	112	Y134 Y459 F460 N465 Y466 V467	Y134-C463 HydrophobicContact CD1-CB 3.81Å; Y134-C463 HydrophobicContact CD2-CB 4.34Å; Y134-C463 HydrophobicContact CE1-CB 4.03Å; Y134-C463 HydrophobicContact CG-CB 4.02Å; Y459-C463 PolarHBondContact O-N 3.47Å; Y459-C463 PolarHBondContact O-SG 2.89Å; F460-C463 PolarHBondContact O-N 2.72Å; C463-N465 VanDerWaalsContact C-N 3.31Å; C463-N465 PolarHBondContact O-N 3.49Å; C463-Y466 PolarHBondContact O-N 2.96Å; C463-V467 HydrophobicContact CB-CG2 4.05Å; C463-V467 WeakPolarHBondContact O-CA 3.43Å; C463-V467 WeakPolarHBondContact O-CB 3.27Å; C463-V467 WeakPolarHBondContact O-CG2 3.47Å; C463-V467 PolarHBondContact O-N 3.07Å
464	E	88	Confident	90.5	Very high	13 Å²	13	13.5 Å²	13.5	6%	0.061	7%	0.073	C	C	.	.	H	α-helix	trans	-59.4	-40.2	-178.3	-175.4	66.4	-179.4	0	0	112.3	W63 Y134 Y135 F460 E461	W63-E464 HydrophobicContact CZ2-CG 4.42Å; Y134-E464 HydrophobicContact CE2-CB 4.31Å; Y134-E464 VanDerWaalsContact CE2-OE2 3.22Å; Y134-E464 WeakPolarHBondContact CE2-OE2 3.4Å; Y134-E464 PolarHBondContact OH-OE2 3.31Å; Y135-E464 VanDerWaalsContact CE1-OE2 3.28Å; Y135-E464 WeakPolarHBondContact CE1-OE2 3.5Å; Y135-E464 PolarHBondContact OH-OE2 3.36Å; F460-E464 PolarHBondContact O-N 2.96Å; E461-E464 PolarHBondContact O-N 2.87Å
465	N	88.4	Confident	90.5	Very high	54 Å²	54	10.7 Å²	10.7	29%	0.289	6%	0.061	S	C	.	.	H	α-helix	trans	-81.2	-39.7	-178.7	-68.4	-83.2	0	0	0	113.1	K378 E461 C463 L536	K378-N465 PolarHBondContact NZ-OD1 3.32Å; E461-N465 PolarHBondContact O-N 2.82Å; E461-N465 VanDerWaalsContact O-N 3.16Å; E461-N465 PolarHBondContact O-ND2 3.29Å; E461-N465 PolarHBondContact OE1-ND2 3.12Å; C463-N465 VanDerWaalsContact C-N 3.31Å; C463-N465 PolarHBondContact O-N 3.49Å; N465-L536 HydrophobicContact CB-CD1 4Å; N465-L536 WeakPolarHBondContact ND2-CD1 3.47Å
466	Y	89.6	Confident	90.6	Very high	13 Å²	13	10.7 Å²	10.7	5%	0.051	6%	0.061	C	C	.	.	H	α-helix	trans	-95	-31	-174.3	-71.5	-72.2	0	0	0	115	F462 C463 S471 Y533 L536 N548 G551 S555	F462-Y466 AromaticContact CD2-CD2 3.57Å; F462-Y466 HydrophobicContact CD2-CD2 3.57Å; F462-Y466 AromaticContact CD2-CE2 3.85Å; F462-Y466 HydrophobicContact CD2-CE2 3.85Å; F462-Y466 AromaticContact CE2-CD2 3.53Å; F462-Y466 HydrophobicContact CE2-CD2 3.53Å; F462-Y466 AromaticContact CE2-CE2 3.85Å; F462-Y466 HydrophobicContact CE2-CE2 3.85Å; F462-Y466 HydrophobicContact CE2-CG 4.37Å; F462-Y466 HydrophobicContact CG-CD2 4.32Å; F462-Y466 HydrophobicContact CZ-CD2 4.29Å; F462-Y466 WeakPolarHBondContact O-CD2 3.47Å; F462-Y466 PolarHBondContact O-N 3.31Å; F462-Y466 VanDerWaalsContact O-N 3.12Å; C463-Y466 PolarHBondContact O-N 2.96Å; Y466-S471 PolarHBondContact O-OG 3.02Å; Y466-Y533 HydrophobicContact CE1-CE2 4.11Å; Y466-Y533 PolarHBondContact OH-OH 2.98Å; Y466-L536 HydrophobicContact CE2-CB 4.22Å; Y466-L536 HydrophobicContact CE2-CD2 4.09Å; Y466-N548 WeakPolarHBondContact OH-CA 3.15Å; Y466-N548 PolarHBondContact OH-OD1 2.94Å; Y466-G551 VanDerWaalsContact CD1-CA 3.49Å; Y466-G551 WeakPolarHBondContact CD1-O 3.34Å; Y466-S555 PolarHBondContact O-OG 2.84Å
467	V	86.8	Confident	90.6	Very high	0 Å²	0	12.6 Å²	12.6	0%	0	7%	0.069	C	C	.	.	H	α-helix	trans	-75.1	-43.3	-177.9	176.9	0	0	0	0	111.2	I127 L130 V131 C463 S471 L554	I127-V467 HydrophobicContact CD1-CG1 4Å; I127-V467 HydrophobicContact CG2-CG1 4.18Å; L130-V467 HydrophobicContact CB-CG1 4.03Å; L130-V467 HydrophobicContact CD1-CG1 4.25Å; V131-V467 HydrophobicContact CG2-CG1 4.16Å; C463-V467 HydrophobicContact CB-CG2 4.05Å; C463-V467 WeakPolarHBondContact O-CA 3.43Å; C463-V467 WeakPolarHBondContact O-CB 3.27Å; C463-V467 WeakPolarHBondContact O-CG2 3.47Å; C463-V467 PolarHBondContact O-N 3.07Å; V467-S471 WeakPolarHBondContact O-CB 3.48Å; V467-S471 PolarHBondContact O-OG 3.16Å; V467-L554 HydrophobicContact CG2-CD2 3.47Å; V467-L554 VanDerWaalsContact CG2-CD2 3.47Å; V467-L554 HydrophobicContact CG2-CG 4.15Å
468	I	83.1	Confident	90.7	Very high	2 Å²	2	15 Å²	15	1%	0.01	8%	0.08	C	C	.	.	H	α-helix	trans	-83.8	-43.2	-175.2	-66.2	178.5	0	0	0	111.8	V131 Y134 Y135 F313 W319 V472	V131-I468 HydrophobicContact CG2-CD1 4.32Å; V131-I468 HydrophobicContact CG2-CG1 4.02Å; Y134-I468 WeakPolarHBondContact OH-CD1 3.24Å; Y135-I468 WeakPolarHBondContact OH-CD1 3.05Å; F313-I468 HydrophobicContact CD1-CG2 3.59Å; F313-I468 HydrophobicContact CE1-CG2 3.56Å; F313-I468 HydrophobicContact CG-CG2 4.33Å; F313-I468 HydrophobicContact CZ-CG2 4.23Å; W319-I468 HydrophobicContact CH2-CD1 3.82Å; W319-I468 HydrophobicContact CH2-CG1 4.3Å; W319-I468 HydrophobicContact CZ2-CD1 3.82Å; W319-I468 HydrophobicContact CZ2-CG1 4Å; W319-I468 HydrophobicContact CZ2-CG2 4.25Å; I468-V472 HydrophobicContact CG2-CG2 4.44Å; I468-V472 WeakPolarHBondContact O-CB 3.17Å; I468-V472 WeakPolarHBondContact O-CG2 3.35Å; I468-V472 PolarHBondContact O-N 2.92Å
469	G	81.3	Confident	90.7	Very high	20 Å²	20	14.7 Å²	14.7	21%	0.206	8%	0.078	C	C	.	.	H	α-helix	trans	-51.4	-94.8	-166.9	0	0	0	0	0	115.6	S471 L473	G469-S471 VanDerWaalsContact C-N 3.32Å; G469-S471 PolarHBondContact O-N 3.21Å; G469-L473 WeakPolarHBondContact O-CG 3.44Å
470	C	85.4	Confident	90.8	Very high	20 Å²	20	13.5 Å²	13.5	14%	0.135	7%	0.074	C	C	.	.	H	α-helix	trans	-71.6	-27.3	-176.3	-68.6	0	0	0	0	113.1	T474	C470-T474 WeakPolarHBondContact O-CB 3.37Å; C470-T474 PolarHBondContact O-N 3.07Å; C470-T474 PolarHBondContact O-OG1 2.63Å
471	S	90.5	Very high	90.8	Very high	0 Å²	0	16.1 Å²	16.1	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-56.9	-55.5	179.9	-60.1	0	0	0	0	112.6	Y466 V467 G469 T474 I475 S555	Y466-S471 PolarHBondContact O-OG 3.02Å; V467-S471 WeakPolarHBondContact O-CB 3.48Å; V467-S471 PolarHBondContact O-OG 3.16Å; G469-S471 VanDerWaalsContact C-N 3.32Å; G469-S471 PolarHBondContact O-N 3.21Å; S471-T474 PolarHBondContact O-N 3.34Å; S471-I475 WeakPolarHBondContact O-CG1 3.41Å; S471-I475 PolarHBondContact O-N 3.16Å; S471-S555 WeakPolarHBondContact OG-CA 3.43Å; S471-S555 PolarHBondContact OG-O 3.25Å
472	V	90.5	Very high	91	Very high	0 Å²	0	15.4 Å²	15.4	0%	0	8%	0.083	C	C	.	.	H	α-helix	trans	-70.9	-38.6	-174.1	-175.5	0	0	0	0	110.1	I127 F312 F313 C317 I468 T474 I475 A476	I127-V472 HydrophobicContact CG2-CG2 3.94Å; F312-V472 HydrophobicContact CE1-CG1 3.77Å; F312-V472 HydrophobicContact CZ-CG1 4.46Å; F313-V472 HydrophobicContact CE1-CB 4.41Å; C317-V472 WeakPolarHBondContact O-CG1 3.43Å; I468-V472 HydrophobicContact CG2-CG2 4.44Å; I468-V472 WeakPolarHBondContact O-CB 3.17Å; I468-V472 WeakPolarHBondContact O-CG2 3.35Å; I468-V472 PolarHBondContact O-N 2.92Å; V472-T474 VanDerWaalsContact C-N 3.29Å; V472-T474 PolarHBondContact O-N 3.08Å; V472-I475 PolarHBondContact O-N 3.17Å; V472-A476 WeakPolarHBondContact O-CB 3.48Å; V472-A476 PolarHBondContact O-N 2.75Å
473	L	92.4	Very high	91.1	Very high	0 Å²	0	14.8 Å²	14.8	0%	0	8%	0.081	C	C	.	.	H	α-helix	trans	-60.9	-39	174.3	-64.7	172.9	0	0	0	112.2	L309 F312 F313 G469 A476 F477 L525 I526 A529	L309-L473 HydrophobicContact CD2-CD1 3.61Å; L309-L473 HydrophobicContact CD2-CD2 4.31Å; F312-L473 HydrophobicContact CD1-CD2 3.67Å; F312-L473 HydrophobicContact CE1-CD2 3.97Å; F312-L473 HydrophobicContact CG-CD2 4.15Å; F313-L473 HydrophobicContact CZ-CD1 4.41Å; F313-L473 HydrophobicContact CZ-CG 4.29Å; G469-L473 WeakPolarHBondContact O-CG 3.44Å; L473-A476 WeakPolarHBondContact O-CB 3.25Å; L473-A476 PolarHBondContact O-N 3.45Å; L473-F477 PolarHBondContact O-N 3.27Å; L473-L525 HydrophobicContact CD1-CB 4.38Å; L473-L525 HydrophobicContact CD2-CB 4.31Å; L473-L525 HydrophobicContact CD2-CD1 4.37Å; L473-I526 HydrophobicContact CB-CD1 4.46Å; L473-I526 HydrophobicContact CB-CG1 3.74Å; L473-A529 HydrophobicContact CD1-CB 4.37Å
474	T	92.7	Very high	91.1	Very high	21 Å²	21	14.1 Å²	14.1	13%	0.129	8%	0.076	C	C	.	.	H	α-helix	trans	-65.3	-46.7	176.2	-58	0	0	0	0	110.8	C470 S471 V472 A476 F477 F478 L559	C470-T474 WeakPolarHBondContact O-CB 3.37Å; C470-T474 PolarHBondContact O-N 3.07Å; C470-T474 PolarHBondContact O-OG1 2.63Å; S471-T474 PolarHBondContact O-N 3.34Å; V472-T474 VanDerWaalsContact C-N 3.29Å; V472-T474 PolarHBondContact O-N 3.08Å; T474-A476 VanDerWaalsContact C-N 3.28Å; T474-A476 PolarHBondContact O-N 2.67Å; T474-F477 PolarHBondContact O-N 2.83Å; T474-F478 HydrophobicContact CG2-CD2 3.89Å; T474-F478 HydrophobicContact CG2-CE2 3.76Å; T474-F478 VanDerWaalsContact O-CD2 3.24Å; T474-F478 WeakPolarHBondContact O-CD2 3.46Å; T474-F478 PolarHBondContact O-N 2.75Å; T474-F478 VanDerWaalsContact O-N 3.16Å; T474-L559 HydrophobicContact CG2-CB 4.2Å; T474-L559 HydrophobicContact CG2-CD1 4.39Å
475	I	94.6	Very high	91.4	Very high	0 Å²	0	19.4 Å²	19.4	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-55.8	-47.2	174.4	-66.3	169.1	0	0	0	109.9	I120 M124 I127 S471 V472 F477 F478 E479 P558	I120-I475 HydrophobicContact CG2-CG2 3.85Å; M124-I475 HydrophobicContact CE-CG2 3.89Å; M124-I475 HydrophobicContact CG-CG2 3.66Å; I127-I475 HydrophobicContact CG1-CD1 3.88Å; S471-I475 WeakPolarHBondContact O-CG1 3.41Å; S471-I475 PolarHBondContact O-N 3.16Å; V472-I475 PolarHBondContact O-N 3.17Å; I475-F477 PolarHBondContact O-N 3.04Å; I475-F478 PolarHBondContact O-N 2.91Å; I475-E479 VanDerWaalsContact O-CB 3.3Å; I475-E479 WeakPolarHBondContact O-CB 3.42Å; I475-E479 PolarHBondContact O-N 3.32Å; I475-P558 HydrophobicContact CD1-CB 3.97Å; I475-P558 HydrophobicContact CD1-CG 4.2Å; I475-P558 HydrophobicContact CG1-CB 3.76Å; I475-P558 HydrophobicContact CG1-CG 4.44Å
476	A	94.1	Very high	91.6	Very high	0 Å²	0	18.9 Å²	18.9	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-61.4	-42.3	-179.5	0	0	0	0	0	113.2	F92 F312 S318 V472 L473 T474 E479 C480 L522	F92-A476 HydrophobicContact CE1-CB 4.45Å; F92-A476 HydrophobicContact CE2-CB 3.9Å; F92-A476 WeakPolarHBondContact CE2-O 3.24Å; F92-A476 HydrophobicContact CZ-CB 3.7Å; F312-A476 HydrophobicContact CE1-CB 4.24Å; F312-A476 HydrophobicContact CE2-CB 3.92Å; F312-A476 HydrophobicContact CZ-CB 3.36Å; S318-A476 WeakPolarHBondContact OG-CA 3.47Å; S318-A476 WeakPolarHBondContact OG-CB 3.45Å; V472-A476 WeakPolarHBondContact O-CB 3.48Å; V472-A476 PolarHBondContact O-N 2.75Å; L473-A476 WeakPolarHBondContact O-CB 3.25Å; L473-A476 PolarHBondContact O-N 3.45Å; T474-A476 VanDerWaalsContact C-N 3.28Å; T474-A476 PolarHBondContact O-N 2.67Å; A476-E479 PolarHBondContact O-N 3.27Å; A476-C480 WeakPolarHBondContact O-CB 3.39Å; A476-C480 PolarHBondContact O-N 2.99Å; A476-L522 HydrophobicContact CB-CD1 4.2Å; A476-L522 HydrophobicContact CB-CD2 3.96Å
477	F	94.5	Very high	91.8	Very high	42 Å²	42	19.5 Å²	19.5	18%	0.184	10%	0.097	C	C	.	.	H	α-helix	trans	-61.1	-48.2	177.2	174.2	-98.3	0	0	0	111.5	L473 T474 I475 C480 M481 P519 L522 L523 I526	L473-F477 PolarHBondContact O-N 3.27Å; T474-F477 PolarHBondContact O-N 2.83Å; I475-F477 PolarHBondContact O-N 3.04Å; F477-C480 PolarHBondContact O-N 3.49Å; F477-M481 HydrophobicContact CE2-CE 4.34Å; F477-M481 HydrophobicContact CZ-CE 4.11Å; F477-M481 WeakPolarHBondContact O-CB 3.33Å; F477-M481 PolarHBondContact O-N 3.21Å; F477-P519 HydrophobicContact CE2-CB 4.47Å; F477-L522 HydrophobicContact CB-CB 4.34Å; F477-L522 HydrophobicContact CD2-CB 4.34Å; F477-L523 HydrophobicContact CD2-CB 4.35Å; F477-L523 HydrophobicContact CE2-CB 4.11Å; F477-I526 HydrophobicContact CB-CD1 3.85Å; F477-I526 HydrophobicContact CG-CD1 4.3Å
478	F	95.1	Very high	92	Very high	52 Å²	52	20.4 Å²	20.4	23%	0.228	11%	0.106	C	C	.	.	H	α-helix	trans	-68.5	-35.7	177.9	-76.8	-73.6	0	0	0	112.4	F117 I120 T474 I475 M481 A482 L559 I562	F117-F478 HydrophobicContact CE1-CD1 4.18Å; I120-F478 HydrophobicContact CD1-CB 3.77Å; I120-F478 HydrophobicContact CG1-CB 4.19Å; T474-F478 HydrophobicContact CG2-CD2 3.89Å; T474-F478 HydrophobicContact CG2-CE2 3.76Å; T474-F478 VanDerWaalsContact O-CD2 3.24Å; T474-F478 WeakPolarHBondContact O-CD2 3.46Å; T474-F478 PolarHBondContact O-N 2.75Å; T474-F478 VanDerWaalsContact O-N 3.16Å; I475-F478 PolarHBondContact O-N 2.91Å; F478-M481 PolarHBondContact O-N 3.47Å; F478-A482 VanDerWaalsContact O-CB 3.25Å; F478-A482 WeakPolarHBondContact O-CB 3.26Å; F478-A482 PolarHBondContact O-N 3.49Å; F478-L559 HydrophobicContact CD2-CD1 4.31Å; F478-L559 HydrophobicContact CE2-CD1 3.38Å; F478-L559 HydrophobicContact CZ-CD1 3.6Å; F478-I562 HydrophobicContact CB-CD1 4.25Å; F478-I562 HydrophobicContact CD2-CD1 4.05Å; F478-I562 HydrophobicContact CG-CD1 4.29Å
479	E	95.4	Very high	92.5	Very high	0 Å²	0	20.5 Å²	20.5	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-60.9	-50.1	174.7	174.8	175.8	-167.3	0	0	110.8	F92 W111 I120 M124 S318 I475 A476 M481 A482 I483	F92-E479 HydrophobicContact CZ-CB 4.26Å; F92-E479 HydrophobicContact CZ-CG 4.07Å; F92-E479 VanDerWaalsContact CZ-OE2 3.24Å; F92-E479 WeakPolarHBondContact CZ-OE2 3.43Å; W111-E479 HydrophobicContact CH2-CB 4.13Å; W111-E479 HydrophobicContact CH2-CG 3.97Å; W111-E479 HydrophobicContact CZ2-CB 4.29Å; W111-E479 HydrophobicContact CZ2-CG 4.06Å; I120-E479 HydrophobicContact CG2-CB 4.23Å; M124-E479 HydrophobicContact CE-CG 4.29Å; M124-E479 WeakPolarHBondContact CE-OE2 3.24Å; S318-E479 PolarHBondContact OG-OE2 3.28Å; I475-E479 VanDerWaalsContact O-CB 3.3Å; I475-E479 WeakPolarHBondContact O-CB 3.42Å; I475-E479 PolarHBondContact O-N 3.32Å; A476-E479 PolarHBondContact O-N 3.27Å; E479-M481 VanDerWaalsContact C-N 3.33Å; E479-M481 PolarHBondContact O-N 2.82Å; E479-A482 PolarHBondContact O-N 3.21Å; E479-I483 WeakPolarHBondContact O-CG1 3.33Å; E479-I483 PolarHBondContact O-N 3.34Å
480	C	94.6	Very high	93	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-61.5	-42	177.9	-166.6	0	0	0	0	111.9	F92 A476 F477 S484 L522	F92-C480 HydrophobicContact CE2-CB 4.07Å; A476-C480 WeakPolarHBondContact O-CB 3.39Å; A476-C480 PolarHBondContact O-N 2.99Å; F477-C480 PolarHBondContact O-N 3.49Å; C480-S484 WeakPolarHBondContact O-CB 3.48Å; C480-S484 PolarHBondContact O-N 2.98Å; C480-S484 PolarHBondContact O-OG 3.04Å; C480-L522 HydrophobicContact CB-CD1 3.95Å
481	M	94.5	Very high	93.3	Very high	55 Å²	55	23.9 Å²	23.9	27%	0.271	12%	0.119	S	C	.	.	H	α-helix	trans	-65.5	-46.7	178.2	-171.4	59.5	58.7	0	0	111.9	F477 F478 E479 I483 W485 V486 P519	F477-M481 HydrophobicContact CE2-CE 4.34Å; F477-M481 HydrophobicContact CZ-CE 4.11Å; F477-M481 WeakPolarHBondContact O-CB 3.33Å; F477-M481 PolarHBondContact O-N 3.21Å; F478-M481 PolarHBondContact O-N 3.47Å; E479-M481 VanDerWaalsContact C-N 3.33Å; E479-M481 PolarHBondContact O-N 2.82Å; M481-I483 PolarHBondContact O-N 2.83Å; M481-W485 WeakPolarHBondContact O-CB 3.44Å; M481-W485 PolarHBondContact O-N 3.46Å; M481-W485 HydrophobicContact SD-CB 3.86Å; M481-W485 HydrophobicContact SD-CG 3.64Å; M481-V486 PolarHBondContact O-N 2.97Å; M481-P519 HydrophobicContact CE-CB 4.12Å
482	A	94.7	Very high	93.3	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	12%	0.123	C	C	.	.	I	π-helix	trans	-61.5	-44.8	-179.5	0	0	0	0	0	111.4	W111 F117 I120 F478 E479 V486 Y487	W111-A482 HydrophobicContact CH2-CB 4.27Å; W111-A482 HydrophobicContact CZ3-CB 3.71Å; F117-A482 HydrophobicContact CB-CB 4.18Å; F117-A482 HydrophobicContact CD2-CB 3.72Å; F117-A482 HydrophobicContact CE2-CB 4.29Å; F117-A482 HydrophobicContact CG-CB 3.91Å; I120-A482 HydrophobicContact CD1-CB 4.25Å; F478-A482 VanDerWaalsContact O-CB 3.25Å; F478-A482 WeakPolarHBondContact O-CB 3.26Å; F478-A482 PolarHBondContact O-N 3.49Å; E479-A482 PolarHBondContact O-N 3.21Å; A482-V486 WeakPolarHBondContact O-CA 3.35Å; A482-V486 VanDerWaalsContact O-CB 3.27Å; A482-V486 WeakPolarHBondContact O-CB 3.35Å; A482-V486 PolarHBondContact O-N 3.47Å; A482-Y487 PolarHBondContact O-N 3.28Å
483	I	94.3	Very high	93.4	Very high	1 Å²	1	24.7 Å²	24.7	1%	0.005	13%	0.125	C	C	.	.	I	π-helix	trans	-79.1	-42.6	-177.6	-54.2	-63.2	0	0	0	111.9	L95 L99 W111 V113 E479 M481 Y487 G488 A492	L95-I483 HydrophobicContact CD1-CB 4.31Å; L95-I483 HydrophobicContact CD1-CG2 3.59Å; L95-I483 HydrophobicContact CD2-CB 4.16Å; L95-I483 HydrophobicContact CD2-CG2 4.36Å; L95-I483 HydrophobicContact CG-CG2 4.24Å; L99-I483 HydrophobicContact CD1-CD1 3.99Å; L99-I483 HydrophobicContact CD1-CG1 3.87Å; L99-I483 HydrophobicContact CD2-CD1 3.86Å; L99-I483 HydrophobicContact CD2-CG1 4.46Å; L99-I483 HydrophobicContact CD2-CG2 4.47Å; W111-I483 HydrophobicContact CH2-CD1 4.34Å; W111-I483 HydrophobicContact CH2-CG1 4.38Å; W111-I483 HydrophobicContact CZ3-CD1 4.15Å; V113-I483 HydrophobicContact CG1-CD1 3.75Å; V113-I483 HydrophobicContact CG2-CD1 4.32Å; E479-I483 WeakPolarHBondContact O-CG1 3.33Å; E479-I483 PolarHBondContact O-N 3.34Å; M481-I483 PolarHBondContact O-N 2.83Å; I483-Y487 HydrophobicContact CG2-CD1 4.36Å; I483-G488 CarbonylContact O-C 3.2Å; I483-G488 PolarHBondContact O-N 3.39Å; I483-A492 HydrophobicContact CG2-CB 4.03Å
484	S	93	Very high	93.4	Very high	4 Å²	4	27.7 Å²	27.7	3%	0.028	14%	0.141	C	C	.	.	I	π-helix	trans	-78.4	-32.7	-173.2	-50.5	0	0	0	0	113.5	C480 V489 L514	C480-S484 WeakPolarHBondContact O-CB 3.48Å; C480-S484 PolarHBondContact O-N 2.98Å; C480-S484 PolarHBondContact O-OG 3.04Å; S484-V489 PolarHBondContact O-N 2.79Å; S484-L514 WeakPolarHBondContact CB-O 3.3Å; S484-L514 PolarHBondContact OG-O 3.16Å; S484-L514 VanDerWaalsContact OG-O 3.07Å
485	W	93.5	Very high	93.4	Very high	123 Å²	123	27.7 Å²	27.7	47%	0.466	14%	0.14	S	C	.	.	I	π-helix	trans	-108.8	-38.3	-176.2	-74.6	86.9	0	0	0	114.5	M481 K515 F516	M481-W485 WeakPolarHBondContact O-CB 3.44Å; M481-W485 PolarHBondContact O-N 3.46Å; M481-W485 HydrophobicContact SD-CB 3.86Å; M481-W485 HydrophobicContact SD-CG 3.64Å; W485-K515 HydrophobicContact CZ2-CG 3.94Å; W485-K515 PolarHBondContact NE1-O 3.31Å; W485-F516 AromaticContact CH2-CE1 3.77Å; W485-F516 HydrophobicContact CH2-CE1 3.77Å; W485-F516 HydrophobicContact CH2-CZ 4.43Å; W485-F516 AromaticContact CZ2-CD1 3.91Å; W485-F516 HydrophobicContact CZ2-CD1 3.91Å; W485-F516 AromaticContact CZ2-CE1 3.55Å; W485-F516 HydrophobicContact CZ2-CE1 3.55Å; W485-F516 HydrophobicContact CZ2-CZ 4.41Å
486	V	92.9	Very high	93.3	Very high	44 Å²	44	28 Å²	28	27%	0.267	14%	0.142	S	C	.	.	I	π-helix	trans	-88.2	-54	-176	-175.2	0	0	0	0	110.9	F117 M481 A482 G488 M585	F117-V486 HydrophobicContact CE2-CG2 3.99Å; M481-V486 PolarHBondContact O-N 2.97Å; A482-V486 WeakPolarHBondContact O-CA 3.35Å; A482-V486 VanDerWaalsContact O-CB 3.27Å; A482-V486 WeakPolarHBondContact O-CB 3.35Å; A482-V486 PolarHBondContact O-N 3.47Å; V486-G488 VanDerWaalsContact C-N 3.33Å; V486-M585 HydrophobicContact CG1-CB 3.89Å; V486-M585 HydrophobicContact CG1-CE 4.4Å; V486-M585 HydrophobicContact CG1-CG 3.86Å; V486-M585 HydrophobicContact CG1-SD 4.33Å
487	Y	93.1	Very high	93.2	Very high	25 Å²	25	31.7 Å²	31.7	10%	0.098	16%	0.158	C	C	.	.	I	π-helix	trans	-70.6	-33.6	172.6	-177.8	-118.1	0	0	0	112.1	V113 A482 I483 N491 A492 N495 P587 W591	V113-Y487 HydrophobicContact CG2-CD1 3.93Å; V113-Y487 HydrophobicContact CG2-CD2 3.26Å; V113-Y487 HydrophobicContact CG2-CE1 4.26Å; V113-Y487 HydrophobicContact CG2-CE2 3.68Å; V113-Y487 HydrophobicContact CG2-CG 3.4Å; A482-Y487 PolarHBondContact O-N 3.28Å; I483-Y487 HydrophobicContact CG2-CD1 4.36Å; Y487-N491 HydrophobicContact CD1-CB 4.07Å; Y487-N491 HydrophobicContact CE1-CB 3.61Å; Y487-N491 HydrophobicContact CE2-CB 4.33Å; Y487-N491 PolarHBondContact O-ND2 3.49Å; Y487-A492 HydrophobicContact CD1-CB 4.46Å; Y487-N495 WeakPolarHBondContact CE1-ND2 3.42Å; Y487-N495 PolarHBondContact OH-ND2 3.38Å; Y487-P587 HydrophobicContact CD2-CG 3.77Å; Y487-P587 HydrophobicContact CE2-CG 3.69Å; Y487-W591 AromaticContact CE2-NE1 3.5Å; Y487-W591 AromaticContact CZ-NE1 3.46Å; Y487-W591 PolarHBondContact OH-NE1 3.13Å; Y487-W591 VanDerWaalsContact OH-NE1 3.16Å
488	G	92.3	Very high	93.1	Very high	20 Å²	20	31.6 Å²	31.6	21%	0.206	16%	0.156	C	C	.	.	I	π-helix	trans	98.7	125.7	178.2	0	0	0	0	0	112.3	I483 V486 D490 N491 A492	I483-G488 CarbonylContact O-C 3.2Å; I483-G488 PolarHBondContact O-N 3.39Å; V486-G488 VanDerWaalsContact C-N 3.33Å; G488-D490 PolarHBondContact O-N 3.31Å; G488-N491 PolarHBondContact O-N 2.86Å; G488-A492 PolarHBondContact O-N 3.25Å; G488-A492 VanDerWaalsContact O-N 3.11Å
489	V	92.3	Very high	92.9	Very high	3 Å²	3	29.2 Å²	29.2	2%	0.018	15%	0.146	C	C	.	.	H	α-helix	trans	-59.2	-32.8	178.6	66.4	0	0	0	0	113.2	S484 A492 L493 K511 L514 K515	S484-V489 PolarHBondContact O-N 2.79Å; V489-A492 PolarHBondContact O-N 3.23Å; V489-L493 HydrophobicContact CG2-CD1 4.04Å; V489-L493 HydrophobicContact CG2-CG 4.34Å; V489-L493 WeakPolarHBondContact O-CB 3.44Å; V489-L493 VanDerWaalsContact O-CG 3.3Å; V489-L493 WeakPolarHBondContact O-CG 3.35Å; V489-L493 PolarHBondContact O-N 3.41Å; V489-K511 HydrophobicContact CG1-CG 3.87Å; V489-K511 HydrophobicContact CG2-CG 4.42Å; V489-L514 HydrophobicContact CG2-CB 3.85Å; V489-L514 HydrophobicContact CG2-CD1 4.25Å; V489-K515 HydrophobicContact CG1-CB 4.32Å; V489-K515 HydrophobicContact CG1-CD 4.21Å
490	D	92.2	Very high	92.7	Very high	57 Å²	57	30.2 Å²	30.2	31%	0.305	15%	0.152	S	C	.	.	H	α-helix	trans	-65.9	-46.2	178.2	-71.1	-59.2	0	0	0	110.6	G488 A492 L493 D494 Y507 K511	G488-D490 PolarHBondContact O-N 3.31Å; D490-A492 VanDerWaalsContact C-N 3.31Å; D490-A492 PolarHBondContact O-N 2.68Å; D490-L493 PolarHBondContact O-N 3.49Å; D490-L493 VanDerWaalsContact O-N 3.17Å; D490-D494 WeakPolarHBondContact O-CB 3.26Å; D490-D494 PolarHBondContact O-N 2.9Å; D490-Y507 PolarHBondContact OD1-OH 2.98Å; D490-K511 WeakPolarHBondContact OD1-CE 3.12Å; D490-K511 IonicContact OD1-NZ 3.09Å; D490-K511 PolarHBondContact OD1-NZ 3.37Å; D490-K511 VanDerWaalsContact OD2-CE 3.26Å; D490-K511 WeakPolarHBondContact OD2-CE 2.88Å; D490-K511 IonicContact OD2-NZ 2.65Å; D490-K511 PolarHBondContact OD2-NZ 3.41Å
491	N	91.6	Very high	92.5	Very high	54 Å²	54	33.3 Å²	33.3	29%	0.289	18%	0.184	S	C	.	.	H	α-helix	trans	-59.2	-41.9	174.5	-63.8	-23.2	0	0	0	111.7	Y487 G488 D494 N495	Y487-N491 HydrophobicContact CD1-CB 4.07Å; Y487-N491 HydrophobicContact CE1-CB 3.61Å; Y487-N491 HydrophobicContact CE2-CB 4.33Å; Y487-N491 PolarHBondContact O-ND2 3.49Å; G488-N491 PolarHBondContact O-N 2.86Å; N491-D494 PolarHBondContact O-N 3.23Å; N491-N495 WeakPolarHBondContact O-CB 3.33Å; N491-N495 PolarHBondContact O-N 2.88Å; N491-N495 PolarHBondContact O-ND2 3.48Å; N491-N495 PolarHBondContact O-OD1 2.94Å
492	A	92	Very high	92.3	Very high	11 Å²	11	34.4 Å²	34.4	9%	0.091	19%	0.185	C	C	.	.	H	α-helix	trans	-64.4	-40.8	176.8	0	0	0	0	0	112.8	I483 Y487 G488 V489 D490 L496	I483-A492 HydrophobicContact CG2-CB 4.03Å; Y487-A492 HydrophobicContact CD1-CB 4.46Å; G488-A492 PolarHBondContact O-N 3.25Å; G488-A492 VanDerWaalsContact O-N 3.11Å; V489-A492 PolarHBondContact O-N 3.23Å; D490-A492 VanDerWaalsContact C-N 3.31Å; D490-A492 PolarHBondContact O-N 2.68Å; A492-L496 PolarHBondContact O-N 2.99Å; A492-L496 VanDerWaalsContact O-N 3.14Å
493	L	92.7	Very high	92	Very high	7 Å²	7	39.4 Å²	39.4	4%	0.037	21%	0.205	C	C	.	.	H	α-helix	trans	-73.7	-32.3	177.9	-68.5	172	0	0	0	112.5	V489 D490 L496 K497 L504 Y507 W510 K511 L514	V489-L493 HydrophobicContact CG2-CD1 4.04Å; V489-L493 HydrophobicContact CG2-CG 4.34Å; V489-L493 WeakPolarHBondContact O-CB 3.44Å; V489-L493 VanDerWaalsContact O-CG 3.3Å; V489-L493 WeakPolarHBondContact O-CG 3.35Å; V489-L493 PolarHBondContact O-N 3.41Å; D490-L493 PolarHBondContact O-N 3.49Å; D490-L493 VanDerWaalsContact O-N 3.17Å; L493-L496 WeakPolarHBondContact O-CB 3.29Å; L493-L496 PolarHBondContact O-N 3.28Å; L493-K497 PolarHBondContact O-N 3.24Å; L493-L504 HydrophobicContact CD2-CD1 3.91Å; L493-Y507 HydrophobicContact CB-CE2 3.72Å; L493-Y507 HydrophobicContact CD1-CD2 4.19Å; L493-Y507 HydrophobicContact CD1-CE2 3.6Å; L493-Y507 HydrophobicContact CG-CE2 4.22Å; L493-W510 HydrophobicContact CD2-CB 4.26Å; L493-K511 HydrophobicContact CD1-CB 4.01Å; L493-L514 HydrophobicContact CD2-CD1 4.34Å
494	D	91.6	Very high	91.8	Very high	63 Å²	63	39.8 Å²	39.8	34%	0.337	21%	0.207	S	C	.	.	H	α-helix	trans	-70.2	-39.5	173.5	-75.9	-33.7	0	0	0	111.3	D490 N491 L496 K497 W498 Y503	D490-D494 WeakPolarHBondContact O-CB 3.26Å; D490-D494 PolarHBondContact O-N 2.9Å; N491-D494 PolarHBondContact O-N 3.23Å; D494-L496 PolarHBondContact O-N 3.47Å; D494-K497 WeakPolarHBondContact O-CB 3.41Å; D494-K497 PolarHBondContact O-N 3.22Å; D494-W498 PolarHBondContact O-N 3.38Å; D494-Y503 WeakPolarHBondContact OD1-CE1 2.96Å; D494-Y503 PolarHBondContact OD1-OH 3.33Å
495	N	92.2	Very high	91.4	Very high	21 Å²	21	43 Å²	43	11%	0.112	23%	0.227	C	C	.	.	H	α-helix	trans	-58.3	-40	170.1	-67.9	-15.7	0	0	0	111.8	F102 Y487 N491 W498 M499	F102-N495 HydrophobicContact CD1-CB 4.44Å; F102-N495 HydrophobicContact CD2-CB 3.88Å; F102-N495 HydrophobicContact CE1-CB 4.34Å; F102-N495 HydrophobicContact CE2-CB 3.78Å; F102-N495 HydrophobicContact CG-CB 4.21Å; F102-N495 HydrophobicContact CZ-CB 4.01Å; F102-N495 VanDerWaalsContact CZ-CG 3.43Å; F102-N495 VanDerWaalsContact CZ-OD1 3.26Å; F102-N495 WeakPolarHBondContact CZ-OD1 3.42Å; Y487-N495 WeakPolarHBondContact CE1-ND2 3.42Å; Y487-N495 PolarHBondContact OH-ND2 3.38Å; N491-N495 WeakPolarHBondContact O-CB 3.33Å; N491-N495 PolarHBondContact O-N 2.88Å; N491-N495 PolarHBondContact O-ND2 3.48Å; N491-N495 PolarHBondContact O-OD1 2.94Å; N495-W498 WeakPolarHBondContact O-CB 3.45Å; N495-W498 PolarHBondContact O-N 2.89Å; N495-M499 PolarHBondContact O-N 3.37Å; N495-M499 VanDerWaalsContact O-N 3.14Å
496	L	92.4	Very high	91	Very high	6 Å²	6	43 Å²	43	3%	0.031	24%	0.236	C	C	.	.	H	α-helix	trans	-65.2	-44	177.3	-173.7	65.8	0	0	0	111.5	L94 C335 A492 L493 D494 W498 M499 T500 L504	L94-L496 HydrophobicContact CD1-CD1 4.34Å; L94-L496 HydrophobicContact CD1-CD2 4.48Å; L94-L496 HydrophobicContact CD2-CD2 4.1Å; L94-L496 HydrophobicContact CG-CD2 4.38Å; C335-L496 WeakPolarHBondContact SG-CD1 3.38Å; A492-L496 PolarHBondContact O-N 2.99Å; A492-L496 VanDerWaalsContact O-N 3.14Å; L493-L496 WeakPolarHBondContact O-CB 3.29Å; L493-L496 PolarHBondContact O-N 3.28Å; D494-L496 PolarHBondContact O-N 3.47Å; L496-W498 VanDerWaalsContact C-N 3.28Å; L496-W498 PolarHBondContact O-N 3.37Å; L496-M499 HydrophobicContact CD1-CE 4.08Å; L496-M499 PolarHBondContact O-N 2.83Å; L496-T500 HydrophobicContact CD1-CG2 4.2Å; L496-T500 HydrophobicContact CG-CG2 4.46Å; L496-T500 PolarHBondContact O-N 3.23Å; L496-T500 PolarHBondContact O-OG1 3.36Å; L496-L504 HydrophobicContact CD2-CD1 3.39Å; L496-L504 HydrophobicContact CD2-CD2 3.83Å; L496-L504 HydrophobicContact CD2-CG 3.52Å
497	K	92.6	Very high	90.7	Very high	77 Å²	77	43.9 Å²	43.9	34%	0.335	24%	0.235	S	C	.	.	H	α-helix	trans	-59.6	-38.7	172.8	165.8	-179.2	161.3	-160.1	0	111.7	L493 D494 M499 G501 Y503	L493-K497 PolarHBondContact O-N 3.24Å; D494-K497 WeakPolarHBondContact O-CB 3.41Å; D494-K497 PolarHBondContact O-N 3.22Å; K497-M499 VanDerWaalsContact C-N 3.33Å; K497-M499 PolarHBondContact O-N 3.37Å; K497-G501 WeakPolarHBondContact O-CA 3.4Å; K497-G501 PolarHBondContact O-N 2.99Å; K497-Y503 HydrophobicContact CB-CD1 4.18Å; K497-Y503 HydrophobicContact CB-CE1 4.18Å; K497-Y503 HydrophobicContact CD-CD1 3.87Å; K497-Y503 HydrophobicContact CD-CD2 3.78Å; K497-Y503 HydrophobicContact CD-CE1 3.46Å; K497-Y503 VanDerWaalsContact CD-CE1 3.46Å; K497-Y503 HydrophobicContact CD-CE2 3.36Å; K497-Y503 HydrophobicContact CD-CG 4.01Å; K497-Y503 WeakPolarHBondContact CD-OH 3.32Å; K497-Y503 HydrophobicContact CG-CE1 4.42Å; K497-Y503 PolarHBondContact NZ-OH 2.86Å
498	W	91.3	Very high	90.6	Very high	41 Å²	41	47.6 Å²	47.6	16%	0.155	26%	0.256	C	S	.	.	H	α-helix	trans	-60.6	-44.2	177.7	-166.6	-5.1	0	0	0	111.2	F102 F331 D494 N495 L496 P593 H598 E601 E602 F603	F102-W498 HydrophobicContact CE2-CD2 4.37Å; F102-W498 AromaticContact CE2-CE3 3.66Å; F102-W498 HydrophobicContact CE2-CE3 3.66Å; F102-W498 HydrophobicContact CE2-CZ3 4.15Å; F102-W498 HydrophobicContact CZ-CE3 4.05Å; F102-W498 HydrophobicContact CZ-CZ3 4.15Å; F331-W498 AromaticContact CE1-CD1 3.81Å; F331-W498 HydrophobicContact CE1-CG 4.19Å; F331-W498 AromaticContact CE1-NE1 3.96Å; F331-W498 HydrophobicContact CZ-CD2 4.2Å; F331-W498 HydrophobicContact CZ-CG 4.11Å; D494-W498 PolarHBondContact O-N 3.38Å; N495-W498 WeakPolarHBondContact O-CB 3.45Å; N495-W498 PolarHBondContact O-N 2.89Å; L496-W498 VanDerWaalsContact C-N 3.28Å; L496-W498 PolarHBondContact O-N 3.37Å; W498-P593 HydrophobicContact CE3-CG 4.23Å; W498-P593 HydrophobicContact CH2-CG 3.81Å; W498-P593 HydrophobicContact CZ2-CG 4.13Å; W498-P593 HydrophobicContact CZ3-CG 3.84Å; W498-H598 WeakPolarHBondContact CZ2-O 3.34Å; W498-E601 PolarHBondContact NE1-OE2 3.47Å; W498-E602 HydrophobicContact CH2-CB 4.03Å; W498-E602 HydrophobicContact CZ2-CB 3.68Å; W498-F603 HydrophobicContact CH2-CD2 4.12Å; W498-F603 HydrophobicContact CH2-CE2 4.16Å; W498-F603 HydrophobicContact CZ3-CE2 4.41Å
499	M	92	Very high	90.4	Very high	2 Å²	2	51.3 Å²	51.3	1%	0.01	27%	0.27	C	S	.	.	H	α-helix	trans	-70.5	-49.2	177.1	-67.9	-177.2	-69.3	0	0	112.8	Q101 F102 F331 H332 N495 L496 K497	Q101-M499 HydrophobicContact CB-SD 4.01Å; Q101-M499 HydrophobicContact CG-SD 3.83Å; F102-M499 WeakPolarHBondContact CA-SD 3.47Å; F102-M499 HydrophobicContact CB-CE 3.9Å; F102-M499 HydrophobicContact CB-SD 3.63Å; F102-M499 HydrophobicContact CD2-CE 4.46Å; F102-M499 HydrophobicContact CD2-CG 4.17Å; F102-M499 HydrophobicContact CD2-SD 4.2Å; F102-M499 HydrophobicContact CG-SD 4.44Å; F102-M499 PolarHBondContact N-SD 2.89Å; F102-M499 VanDerWaalsContact N-SD 3.4Å; F331-M499 HydrophobicContact CD2-CG 4.2Å; F331-M499 HydrophobicContact CE1-CG 4.26Å; F331-M499 HydrophobicContact CE2-CG 3.82Å; F331-M499 HydrophobicContact CZ-CG 3.85Å; H332-M499 VanDerWaalsContact CA-O 3.3Å; H332-M499 WeakPolarHBondContact CA-O 3.44Å; N495-M499 PolarHBondContact O-N 3.37Å; N495-M499 VanDerWaalsContact O-N 3.14Å; L496-M499 HydrophobicContact CD1-CE 4.08Å; L496-M499 PolarHBondContact O-N 2.83Å; K497-M499 VanDerWaalsContact C-N 3.33Å; K497-M499 PolarHBondContact O-N 3.37Å
500	T	91.2	Very high	90.3	Very high	21 Å²	21	52.9 Å²	52.9	13%	0.129	28%	0.276	C	S	.	.	H	α-helix	trans	-84.2	-19.3	-172.1	62.5	0	0	0	0	113.7	L496 Y502	L496-T500 HydrophobicContact CD1-CG2 4.2Å; L496-T500 HydrophobicContact CG-CG2 4.46Å; L496-T500 PolarHBondContact O-N 3.23Å; L496-T500 PolarHBondContact O-OG1 3.36Å; T500-Y502 VanDerWaalsContact C-N 3.3Å; T500-Y502 WeakPolarHBondContact O-CD1 3.44Å; T500-Y502 PolarHBondContact OG1-N 3.17Å; T500-Y502 PolarHBondContact OG1-O 2.93Å
501	G	89.2	Confident	90.3	Very high	65 Å²	65	52.7 Å²	52.7	67%	0.67	27%	0.272	S	S	*	.	S	Bend	trans	80.7	-0.2	-173.7	0	0	0	0	0	114.8	K497	K497-G501 WeakPolarHBondContact O-CA 3.4Å; K497-G501 PolarHBondContact O-N 2.99Å
502	Y	91.4	Very high	90.3	Very high	78 Å²	78	54.2 Å²	54.2	31%	0.306	28%	0.28	S	S	.	.	S	Bend	trans	-146.2	151.2	-178.1	63	-89.5	0	0	0	112.6	D334 T500	D334-Y502 VanDerWaalsContact CG-OH 3.31Å; D334-Y502 PolarHBondContact OD1-OH 3.3Å; D334-Y502 VanDerWaalsContact OD1-OH 3.05Å; D334-Y502 PolarHBondContact OD2-OH 3.46Å; T500-Y502 VanDerWaalsContact C-N 3.3Å; T500-Y502 WeakPolarHBondContact O-CD1 3.44Å; T500-Y502 PolarHBondContact OG1-N 3.17Å; T500-Y502 PolarHBondContact OG1-O 2.93Å
503	Y	89.2	Confident	90.2	Very high	105 Å²	105	54.7 Å²	54.7	41%	0.412	28%	0.28	S	S	.	.	P	Polyproline II helix	trans	-70.1	138	169.6	-76.5	-67	0	0	0	110.8	D494 K497 Y507	D494-Y503 WeakPolarHBondContact OD1-CE1 2.96Å; D494-Y503 PolarHBondContact OD1-OH 3.33Å; K497-Y503 HydrophobicContact CB-CD1 4.18Å; K497-Y503 HydrophobicContact CB-CE1 4.18Å; K497-Y503 HydrophobicContact CD-CD1 3.87Å; K497-Y503 HydrophobicContact CD-CD2 3.78Å; K497-Y503 HydrophobicContact CD-CE1 3.46Å; K497-Y503 VanDerWaalsContact CD-CE1 3.46Å; K497-Y503 HydrophobicContact CD-CE2 3.36Å; K497-Y503 HydrophobicContact CD-CG 4.01Å; K497-Y503 WeakPolarHBondContact CD-OH 3.32Å; K497-Y503 HydrophobicContact CG-CE1 4.42Å; K497-Y503 PolarHBondContact NZ-OH 2.86Å; Y503-Y507 AromaticContact CD1-CD2 3.59Å; Y503-Y507 HydrophobicContact CD1-CD2 3.59Å; Y503-Y507 AromaticContact CD1-CE2 3.6Å; Y503-Y507 HydrophobicContact CD1-CE2 3.6Å; Y503-Y507 HydrophobicContact CE1-CD2 4.23Å; Y503-Y507 AromaticContact CE1-CE2 3.79Å; Y503-Y507 HydrophobicContact CE1-CE2 3.79Å; Y503-Y507 HydrophobicContact CG-CD2 4.27Å
504	L	89.3	Confident	90.2	Very high	8 Å²	8	54.8 Å²	54.8	4%	0.042	28%	0.28	C	S	.	.	P	Polyproline II helix	trans	-50.3	142.8	175	-73.4	174.4	0	0	0	112.1	L94 F336 L493 L496 L506 Y507 W510	L94-L504 HydrophobicContact CD2-CD1 3.8Å; L94-L504 HydrophobicContact CD2-CD2 4.24Å; F336-L504 HydrophobicContact CB-CD2 3.99Å; F336-L504 HydrophobicContact CD1-CD2 4.15Å; F336-L504 HydrophobicContact CD2-CD2 3.31Å; F336-L504 HydrophobicContact CE2-CD2 3.75Å; F336-L504 HydrophobicContact CG-CD2 3.54Å; F336-L504 HydrophobicContact CZ-CD2 4.33Å; L493-L504 HydrophobicContact CD2-CD1 3.91Å; L496-L504 HydrophobicContact CD2-CD1 3.39Å; L496-L504 HydrophobicContact CD2-CD2 3.83Å; L496-L504 HydrophobicContact CD2-CG 3.52Å; L504-L506 PolarHBondContact O-N 3.43Å; L504-Y507 PolarHBondContact O-N 3.28Å; L504-W510 HydrophobicContact CB-CG 4.29Å; L504-W510 HydrophobicContact CD1-CB 4.2Å; L504-W510 HydrophobicContact CD1-CD2 3.69Å; L504-W510 HydrophobicContact CD1-CE3 4.16Å; L504-W510 HydrophobicContact CD1-CG 3.68Å
505	P	84.1	Confident	90.2	Very high	71 Å²	71	54.7 Å²	54.7	46%	0.461	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.1	134.3	173.1	26.6	-33.3	0	0	0	109.2	F336 W510	F336-P505 HydrophobicContact CE1-CG 4.12Å; F336-P505 HydrophobicContact CZ-CG 4.17Å; P505-W510 PolarHBondContact O-NE1 3.23Å
506	L	85.9	Confident	90.2	Very high	123 Å²	123	59 Å²	59	64%	0.644	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	62	45.3	-175.6	-49.3	168.4	0	0	0	113.2	L504 I508 L509 W510	L504-L506 PolarHBondContact O-N 3.43Å; L506-I508 PolarHBondContact O-N 2.87Å; L506-L509 HydrophobicContact CB-CB 4.2Å; L506-L509 HydrophobicContact CB-CD1 3.78Å; L506-L509 HydrophobicContact CB-CG 4.04Å; L506-L509 HydrophobicContact CD1-CD1 3.71Å; L506-L509 HydrophobicContact CG-CD1 4.21Å; L506-L509 WeakPolarHBondContact O-CB 3.45Å; L506-L509 PolarHBondContact O-N 3.3Å; L506-W510 PolarHBondContact O-N 3.41Å
507	Y	86.6	Confident	90.2	Very high	64 Å²	64	61.9 Å²	61.9	25%	0.251	31%	0.31	S	S	.	.	H	α-helix	trans	-36	-47.4	179.5	179.5	-96.8	0	0	0	115	D490 L493 Y503 L504 L509 W510 K511	D490-Y507 PolarHBondContact OD1-OH 2.98Å; L493-Y507 HydrophobicContact CB-CE2 3.72Å; L493-Y507 HydrophobicContact CD1-CD2 4.19Å; L493-Y507 HydrophobicContact CD1-CE2 3.6Å; L493-Y507 HydrophobicContact CG-CE2 4.22Å; Y503-Y507 AromaticContact CD1-CD2 3.59Å; Y503-Y507 HydrophobicContact CD1-CD2 3.59Å; Y503-Y507 AromaticContact CD1-CE2 3.6Å; Y503-Y507 HydrophobicContact CD1-CE2 3.6Å; Y503-Y507 HydrophobicContact CE1-CD2 4.23Å; Y503-Y507 AromaticContact CE1-CE2 3.79Å; Y503-Y507 HydrophobicContact CE1-CE2 3.79Å; Y503-Y507 HydrophobicContact CG-CD2 4.27Å; L504-Y507 PolarHBondContact O-N 3.28Å; Y507-L509 VanDerWaalsContact C-N 3.31Å; Y507-L509 PolarHBondContact O-N 3.21Å; Y507-W510 PolarHBondContact O-N 3.01Å; Y507-K511 HydrophobicContact CE1-CD 4.26Å; Y507-K511 PolarHBondContact O-N 3.03Å
508	I	89.7	Confident	90.2	Very high	103 Å²	103	58.2 Å²	58.2	53%	0.528	29%	0.294	S	S	.	.	H	α-helix	trans	-63.6	-34.6	-178.6	-168.5	58.8	0	0	0	113.2	L506 K511 I512	L506-I508 PolarHBondContact O-N 2.87Å; I508-K511 PolarHBondContact O-N 3.23Å; I508-I512 HydrophobicContact CG1-CD1 4.08Å; I508-I512 VanDerWaalsContact O-CG1 3.3Å; I508-I512 WeakPolarHBondContact O-CG1 3.28Å; I508-I512 PolarHBondContact O-N 2.9Å
509	L	89.9	Confident	90.2	Very high	97 Å²	97	56.8 Å²	56.8	51%	0.508	29%	0.29	S	S	.	.	H	α-helix	trans	-68.1	-44.2	177.8	-64.2	-176	0	0	0	110.4	L506 Y507 K511 I512 H513	L506-L509 HydrophobicContact CB-CB 4.2Å; L506-L509 HydrophobicContact CB-CD1 3.78Å; L506-L509 HydrophobicContact CB-CG 4.04Å; L506-L509 HydrophobicContact CD1-CD1 3.71Å; L506-L509 HydrophobicContact CG-CD1 4.21Å; L506-L509 WeakPolarHBondContact O-CB 3.45Å; L506-L509 PolarHBondContact O-N 3.3Å; Y507-L509 VanDerWaalsContact C-N 3.31Å; Y507-L509 PolarHBondContact O-N 3.21Å; L509-K511 VanDerWaalsContact C-N 3.3Å; L509-K511 PolarHBondContact O-N 3.36Å; L509-I512 PolarHBondContact O-N 3.26Å; L509-H513 WeakPolarHBondContact O-CB 3.38Å; L509-H513 PolarHBondContact O-N 3.11Å
510	W	89.6	Confident	90.3	Very high	36 Å²	36	62 Å²	62	14%	0.136	32%	0.317	C	S	.	.	H	α-helix	trans	-60	-42.3	174.9	-66.2	98	0	0	0	111.8	V90 P91 L94 F336 L493 L504 P505 L506 Y507 H513 L514	V90-W510 HydrophobicContact CG1-CH2 3.97Å; V90-W510 HydrophobicContact CG1-CZ3 4.44Å; P91-W510 HydrophobicContact CB-CE3 4.27Å; P91-W510 HydrophobicContact CB-CZ3 3.94Å; P91-W510 HydrophobicContact CG-CE3 4.37Å; P91-W510 HydrophobicContact CG-CZ3 3.82Å; L94-W510 HydrophobicContact CD2-CE3 4.15Å; L94-W510 HydrophobicContact CD2-CH2 4.12Å; L94-W510 HydrophobicContact CD2-CZ3 3.75Å; F336-W510 AromaticContact CE2-CH2 3.84Å; F336-W510 HydrophobicContact CE2-CH2 3.84Å; F336-W510 AromaticContact CE2-CZ2 3.62Å; F336-W510 HydrophobicContact CE2-CZ2 3.62Å; F336-W510 HydrophobicContact CZ-CZ2 4.12Å; L493-W510 HydrophobicContact CD2-CB 4.26Å; L504-W510 HydrophobicContact CB-CG 4.29Å; L504-W510 HydrophobicContact CD1-CB 4.2Å; L504-W510 HydrophobicContact CD1-CD2 3.69Å; L504-W510 HydrophobicContact CD1-CE3 4.16Å; L504-W510 HydrophobicContact CD1-CG 3.68Å; P505-W510 PolarHBondContact O-NE1 3.23Å; L506-W510 PolarHBondContact O-N 3.41Å; Y507-W510 PolarHBondContact O-N 3.01Å; W510-H513 PolarHBondContact O-N 2.85Å; W510-L514 WeakPolarHBondContact O-CB 3.41Å; W510-L514 WeakPolarHBondContact O-CG 3.4Å; W510-L514 PolarHBondContact O-N 3.46Å
511	K	91.4	Very high	90.3	Very high	54 Å²	54	62.5 Å²	62.5	24%	0.235	32%	0.319	C	S	.	.	H	α-helix	trans	-60.6	-48.2	176.3	-174.4	171.5	-178.7	165.5	0	112.2	V489 D490 L493 Y507 I508 L509 H513 K515	V489-K511 HydrophobicContact CG1-CG 3.87Å; V489-K511 HydrophobicContact CG2-CG 4.42Å; D490-K511 WeakPolarHBondContact OD1-CE 3.12Å; D490-K511 IonicContact OD1-NZ 3.09Å; D490-K511 PolarHBondContact OD1-NZ 3.37Å; D490-K511 VanDerWaalsContact OD2-CE 3.26Å; D490-K511 WeakPolarHBondContact OD2-CE 2.88Å; D490-K511 IonicContact OD2-NZ 2.65Å; D490-K511 PolarHBondContact OD2-NZ 3.41Å; L493-K511 HydrophobicContact CD1-CB 4.01Å; Y507-K511 HydrophobicContact CE1-CD 4.26Å; Y507-K511 PolarHBondContact O-N 3.03Å; I508-K511 PolarHBondContact O-N 3.23Å; L509-K511 VanDerWaalsContact C-N 3.3Å; L509-K511 PolarHBondContact O-N 3.36Å; K511-H513 VanDerWaalsContact C-N 3.3Å; K511-H513 PolarHBondContact O-N 3.04Å; K511-K515 WeakPolarHBondContact O-CB 3.4Å; K511-K515 PolarHBondContact O-N 3.07Å; K511-K515 VanDerWaalsContact O-N 3.12Å
512	I	92	Very high	90.5	Very high	86 Å²	86	59.4 Å²	59.4	44%	0.441	29%	0.287	S	S	.	.	H	α-helix	trans	-63.4	-41.2	176.5	-68.1	166.5	0	0	0	110.4	I508 L509 F516 L517	I508-I512 HydrophobicContact CG1-CD1 4.08Å; I508-I512 VanDerWaalsContact O-CG1 3.3Å; I508-I512 WeakPolarHBondContact O-CG1 3.28Å; I508-I512 PolarHBondContact O-N 2.9Å; L509-I512 PolarHBondContact O-N 3.26Å; I512-F516 PolarHBondContact O-N 3.31Å; I512-L517 PolarHBondContact O-N 3.44Å
513	H	90.6	Very high	90.6	Very high	20 Å²	20	59.2 Å²	59.2	9%	0.093	29%	0.291	C	S	.	.	I	π-helix	trans	-64.2	-55.5	-176.2	-165.2	-55.2	0	0	0	111.8	F87 L509 W510 K511 K515 L517 S518	F87-H513 VanDerWaalsContact C-NE2 3.34Å; F87-H513 PolarHBondContact O-CE1 2.88Å; F87-H513 PolarHBondContact O-NE2 3.4Å; L509-H513 WeakPolarHBondContact O-CB 3.38Å; L509-H513 PolarHBondContact O-N 3.11Å; W510-H513 PolarHBondContact O-N 2.85Å; K511-H513 VanDerWaalsContact C-N 3.3Å; K511-H513 PolarHBondContact O-N 3.04Å; H513-K515 PolarHBondContact O-N 3.19Å; H513-L517 PolarHBondContact O-N 3.45Å; H513-S518 PolarHBondContact CE1-OG 2.86Å; H513-S518 PolarHBondContact ND1-OG 3Å; H513-S518 PolarHBondContact O-N 3.3Å; H513-S518 PolarHBondContact O-OG 3.46Å
514	L	91.4	Very high	90.8	Very high	10 Å²	10	56.7 Å²	56.7	5%	0.052	29%	0.292	C	S	.	.	I	π-helix	trans	-67.1	-38.1	-178.7	-68.3	171.7	0	0	0	111.5	P91 S484 V489 L493 W510 P519	P91-L514 HydrophobicContact CB-CD2 3.99Å; S484-L514 WeakPolarHBondContact CB-O 3.3Å; S484-L514 PolarHBondContact OG-O 3.16Å; S484-L514 VanDerWaalsContact OG-O 3.07Å; V489-L514 HydrophobicContact CG2-CB 3.85Å; V489-L514 HydrophobicContact CG2-CD1 4.25Å; L493-L514 HydrophobicContact CD2-CD1 4.34Å; W510-L514 WeakPolarHBondContact O-CB 3.41Å; W510-L514 WeakPolarHBondContact O-CG 3.4Å; W510-L514 PolarHBondContact O-N 3.46Å; L514-P519 WeakPolarHBondContact O-CD 3.34Å
515	K	92.7	Very high	90.9	Very high	60 Å²	60	56.7 Å²	56.7	26%	0.261	29%	0.292	S	S	.	.	I	π-helix	trans	-73.7	-40.3	-177.9	-170.4	169.3	-178.3	168.7	0	113.9	W485 V489 K511 H513	W485-K515 HydrophobicContact CZ2-CG 3.94Å; W485-K515 PolarHBondContact NE1-O 3.31Å; V489-K515 HydrophobicContact CG1-CB 4.32Å; V489-K515 HydrophobicContact CG1-CD 4.21Å; K511-K515 WeakPolarHBondContact O-CB 3.4Å; K511-K515 PolarHBondContact O-N 3.07Å; K511-K515 VanDerWaalsContact O-N 3.12Å; H513-K515 PolarHBondContact O-N 3.19Å
516	F	92.7	Very high	91.3	Very high	112 Å²	112	54.7 Å²	54.7	49%	0.491	28%	0.277	S	S	.	.	I	π-helix	trans	-122	-47.9	-170.9	-59.5	-68.7	0	0	0	113.7	W485 I512 L520	W485-F516 AromaticContact CH2-CE1 3.77Å; W485-F516 HydrophobicContact CH2-CE1 3.77Å; W485-F516 HydrophobicContact CH2-CZ 4.43Å; W485-F516 AromaticContact CZ2-CD1 3.91Å; W485-F516 HydrophobicContact CZ2-CD1 3.91Å; W485-F516 AromaticContact CZ2-CE1 3.55Å; W485-F516 HydrophobicContact CZ2-CE1 3.55Å; W485-F516 HydrophobicContact CZ2-CZ 4.41Å; I512-F516 PolarHBondContact O-N 3.31Å; F516-L520 VanDerWaalsContact O-CB 3.25Å; F516-L520 WeakPolarHBondContact O-CB 3.39Å; F516-L520 PolarHBondContact O-N 2.93Å
517	L	92.1	Very high	91.6	Very high	66 Å²	66	53.8 Å²	53.8	35%	0.346	27%	0.272	S	S	.	.	I	π-helix	trans	-72.5	-48.1	-170.6	-170	57.6	0	0	0	112.3	I512 H513 L520 I521	I512-L517 PolarHBondContact O-N 3.44Å; H513-L517 PolarHBondContact O-N 3.45Å; L517-L520 PolarHBondContact O-N 3.2Å; L517-I521 HydrophobicContact CD1-CD1 3.74Å; L517-I521 HydrophobicContact CD1-CG1 4.07Å; L517-I521 HydrophobicContact CD2-CD1 4.38Å; L517-I521 HydrophobicContact CG-CD1 3.65Å; L517-I521 HydrophobicContact CG-CG1 4.34Å; L517-I521 VanDerWaalsContact O-CG1 3.3Å; L517-I521 WeakPolarHBondContact O-CG1 3.24Å; L517-I521 PolarHBondContact O-N 3.02Å
518	S	91.4	Very high	91.9	Very high	1 Å²	1	52.2 Å²	52.2	1%	0.007	27%	0.266	C	S	.	.	H	α-helix	trans	-60.2	-50.3	-179.8	-63.9	0	0	0	0	112.5	H513 L520 I521 L522	H513-S518 PolarHBondContact CE1-OG 2.86Å; H513-S518 PolarHBondContact ND1-OG 3Å; H513-S518 PolarHBondContact O-N 3.3Å; H513-S518 PolarHBondContact O-OG 3.46Å; S518-L520 VanDerWaalsContact C-N 3.31Å; S518-L520 PolarHBondContact O-N 3.09Å; S518-I521 PolarHBondContact O-N 3.13Å; S518-L522 WeakPolarHBondContact O-CB 3.32Å; S518-L522 VanDerWaalsContact O-CG 3.3Å; S518-L522 WeakPolarHBondContact O-CG 3.27Å; S518-L522 PolarHBondContact O-N 3.43Å
519	P	92.5	Very high	91.9	Very high	10 Å²	10	48.4 Å²	48.4	7%	0.065	25%	0.249	C	C	.	.	H	α-helix	trans	-60.6	-39.3	176.5	-22.8	32.8	0	0	0	113.1	F477 M481 L514 L523	F477-P519 HydrophobicContact CE2-CB 4.47Å; M481-P519 HydrophobicContact CE-CB 4.12Å; L514-P519 WeakPolarHBondContact O-CD 3.34Å; P519-L523 WeakPolarHBondContact O-CB 3.27Å; P519-L523 PolarHBondContact O-N 3Å
520	L	93.4	Very high	91.8	Very high	112 Å²	112	46.7 Å²	46.7	59%	0.586	25%	0.245	S	C	*	.	H	α-helix	trans	-65.9	-43.9	179.4	-179.7	65.4	0	0	0	111.6	F516 L517 S518 L523 A524	F516-L520 VanDerWaalsContact O-CB 3.25Å; F516-L520 WeakPolarHBondContact O-CB 3.39Å; F516-L520 PolarHBondContact O-N 2.93Å; L517-L520 PolarHBondContact O-N 3.2Å; S518-L520 VanDerWaalsContact C-N 3.31Å; S518-L520 PolarHBondContact O-N 3.09Å; L520-L523 PolarHBondContact O-N 3.43Å; L520-A524 WeakPolarHBondContact O-CB 3.46Å; L520-A524 PolarHBondContact O-N 2.93Å
521	I	92.2	Very high	91.7	Very high	32 Å²	32	50.2 Å²	50.2	16%	0.164	27%	0.27	C	S	.	.	H	α-helix	trans	-67.6	-44.1	178.2	-66	171.1	0	0	0	110.7	I88 L517 S518 L523 A524 L525	I88-I521 HydrophobicContact CD1-CG2 3.36Å; I88-I521 HydrophobicContact CG1-CD1 3.93Å; I88-I521 HydrophobicContact CG1-CG2 3.73Å; I88-I521 HydrophobicContact CG2-CG2 4.38Å; L517-I521 HydrophobicContact CD1-CD1 3.74Å; L517-I521 HydrophobicContact CD1-CG1 4.07Å; L517-I521 HydrophobicContact CD2-CD1 4.38Å; L517-I521 HydrophobicContact CG-CD1 3.65Å; L517-I521 HydrophobicContact CG-CG1 4.34Å; L517-I521 VanDerWaalsContact O-CG1 3.3Å; L517-I521 WeakPolarHBondContact O-CG1 3.24Å; L517-I521 PolarHBondContact O-N 3.02Å; S518-I521 PolarHBondContact O-N 3.13Å; I521-L523 VanDerWaalsContact C-N 3.3Å; I521-L523 PolarHBondContact O-N 2.97Å; I521-A524 CarbonylContact O-C 3.44Å; I521-A524 WeakPolarHBondContact O-CA 3.36Å; I521-A524 WeakPolarHBondContact O-CB 3.25Å; I521-A524 PolarHBondContact O-N 2.66Å; I521-A524 VanDerWaalsContact O-N 3.07Å; I521-L525 HydrophobicContact CG2-CD1 4.21Å; I521-L525 HydrophobicContact CG2-CG 4.27Å; I521-L525 WeakPolarHBondContact O-CG 3.46Å; I521-L525 PolarHBondContact O-N 3.45Å
522	L	92.7	Very high	91.6	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-59.5	-41.9	176.1	-71.8	169.1	0	0	0	111.5	F92 F312 A476 F477 C480 S518 L525 I526	F92-L522 HydrophobicContact CD2-CD1 4.04Å; F92-L522 HydrophobicContact CE2-CD1 3.88Å; F312-L522 HydrophobicContact CD2-CD2 4.18Å; F312-L522 HydrophobicContact CE2-CD2 3.89Å; F312-L522 HydrophobicContact CZ-CD2 4.48Å; A476-L522 HydrophobicContact CB-CD1 4.2Å; A476-L522 HydrophobicContact CB-CD2 3.96Å; F477-L522 HydrophobicContact CB-CB 4.34Å; F477-L522 HydrophobicContact CD2-CB 4.34Å; C480-L522 HydrophobicContact CB-CD1 3.95Å; S518-L522 WeakPolarHBondContact O-CB 3.32Å; S518-L522 VanDerWaalsContact O-CG 3.3Å; S518-L522 WeakPolarHBondContact O-CG 3.27Å; S518-L522 PolarHBondContact O-N 3.43Å; L522-L525 PolarHBondContact O-N 3.36Å; L522-I526 WeakPolarHBondContact O-CG1 3.42Å; L522-I526 PolarHBondContact O-N 3.25Å
523	L	93.3	Very high	91.3	Very high	73 Å²	73	50.1 Å²	50.1	38%	0.382	27%	0.266	S	S	.	.	H	α-helix	trans	-61.5	-43.6	172.8	-178.3	63.6	0	0	0	111.7	F477 P519 L520 I521 L525 I526 L527	F477-L523 HydrophobicContact CD2-CB 4.35Å; F477-L523 HydrophobicContact CE2-CB 4.11Å; P519-L523 WeakPolarHBondContact O-CB 3.27Å; P519-L523 PolarHBondContact O-N 3Å; L520-L523 PolarHBondContact O-N 3.43Å; I521-L523 VanDerWaalsContact C-N 3.3Å; I521-L523 PolarHBondContact O-N 2.97Å; L523-L525 VanDerWaalsContact C-N 3.31Å; L523-L525 PolarHBondContact O-N 3.19Å; L523-I526 PolarHBondContact O-N 2.83Å; L523-L527 HydrophobicContact CG-CD1 4.3Å; L523-L527 VanDerWaalsContact O-CG 3.31Å; L523-L527 WeakPolarHBondContact O-CG 3.31Å; L523-L527 PolarHBondContact O-N 3.2Å
524	A	93.2	Very high	91.2	Very high	52 Å²	52	55.9 Å²	55.9	43%	0.43	29%	0.293	S	S	.	.	H	α-helix	trans	-62.5	-36.8	176.2	0	0	0	0	0	112.4	L520 I521 L527 Y528	L520-A524 WeakPolarHBondContact O-CB 3.46Å; L520-A524 PolarHBondContact O-N 2.93Å; I521-A524 CarbonylContact O-C 3.44Å; I521-A524 WeakPolarHBondContact O-CA 3.36Å; I521-A524 WeakPolarHBondContact O-CB 3.25Å; I521-A524 PolarHBondContact O-N 2.66Å; I521-A524 VanDerWaalsContact O-N 3.07Å; A524-L527 PolarHBondContact O-N 3.48Å; A524-Y528 VanDerWaalsContact O-CB 3.27Å; A524-Y528 WeakPolarHBondContact O-CB 3.42Å; A524-Y528 PolarHBondContact O-N 3.12Å
525	L	92.4	Very high	91.1	Very high	8 Å²	8	58.9 Å²	58.9	4%	0.042	31%	0.313	C	S	.	.	H	α-helix	trans	-69.2	-39.9	175.7	-67.7	176.7	0	0	0	112.5	I88 A308 L309 L473 I521 L522 L523 Y528 A529	I88-L525 HydrophobicContact CD1-CD1 4.48Å; A308-L525 HydrophobicContact CB-CD1 4.31Å; A308-L525 HydrophobicContact CB-CD2 3.45Å; A308-L525 VanDerWaalsContact CB-CD2 3.45Å; A308-L525 HydrophobicContact CB-CG 4.46Å; L309-L525 HydrophobicContact CD2-CB 4.3Å; L309-L525 HydrophobicContact CD2-CD2 4.31Å; L309-L525 HydrophobicContact CG-CD2 4.4Å; L473-L525 HydrophobicContact CD1-CB 4.38Å; L473-L525 HydrophobicContact CD2-CB 4.31Å; L473-L525 HydrophobicContact CD2-CD1 4.37Å; I521-L525 HydrophobicContact CG2-CD1 4.21Å; I521-L525 HydrophobicContact CG2-CG 4.27Å; I521-L525 WeakPolarHBondContact O-CG 3.46Å; I521-L525 PolarHBondContact O-N 3.45Å; L522-L525 PolarHBondContact O-N 3.36Å; L523-L525 VanDerWaalsContact C-N 3.31Å; L523-L525 PolarHBondContact O-N 3.19Å; L525-Y528 PolarHBondContact O-N 2.88Å; L525-A529 WeakPolarHBondContact O-CB 3.49Å; L525-A529 PolarHBondContact O-N 3.02Å
526	I	92.2	Very high	90.9	Very high	29 Å²	29	56.7 Å²	56.7	15%	0.149	30%	0.304	C	S	.	.	H	α-helix	trans	-61.1	-47.6	172.9	-67.3	166.2	0	0	0	109.8	L473 F477 L522 L523 Y528 A529 C530	L473-I526 HydrophobicContact CB-CD1 4.46Å; L473-I526 HydrophobicContact CB-CG1 3.74Å; F477-I526 HydrophobicContact CB-CD1 3.85Å; F477-I526 HydrophobicContact CG-CD1 4.3Å; L522-I526 WeakPolarHBondContact O-CG1 3.42Å; L522-I526 PolarHBondContact O-N 3.25Å; L523-I526 PolarHBondContact O-N 2.83Å; I526-Y528 PolarHBondContact O-N 2.8Å; I526-A529 PolarHBondContact O-N 3.37Å; I526-C530 PolarHBondContact O-N 3.38Å; I526-C530 PolarHBondContact O-SG 2.91Å
527	L	92.6	Very high	90.7	Very high	104 Å²	104	55.4 Å²	55.4	55%	0.545	31%	0.306	S	S	.	.	H	α-helix	trans	-62.4	-42.5	177.6	-68.9	173.7	0	0	0	111.9	L523 A524 C530 V531	L523-L527 HydrophobicContact CG-CD1 4.3Å; L523-L527 VanDerWaalsContact O-CG 3.31Å; L523-L527 WeakPolarHBondContact O-CG 3.31Å; L523-L527 PolarHBondContact O-N 3.2Å; A524-L527 PolarHBondContact O-N 3.48Å; L527-C530 PolarHBondContact O-N 3.35Å; L527-V531 VanDerWaalsContact O-CG2 3.28Å; L527-V531 WeakPolarHBondContact O-CG2 3.33Å; L527-V531 PolarHBondContact O-N 3.35Å
528	Y	92.5	Very high	90.5	Very high	32 Å²	32	53.2 Å²	53.2	13%	0.125	29%	0.293	C	S	.	.	H	α-helix	trans	-61	-47.3	176	176	-99.4	0	0	0	111.6	Y301 R302 D306 L309 A524 L525 I526 C530 V531 Q532	Y301-Y528 HydrophobicContact CD2-CE2 4.33Å; Y301-Y528 HydrophobicContact CE2-CE2 4.14Å; R302-Y528 PolarHBondContact O-OH 2.82Å; D306-Y528 WeakPolarHBondContact OD1-CE1 3.35Å; D306-Y528 PolarHBondContact OD1-OH 3.07Å; L309-Y528 HydrophobicContact CD1-CD1 3.91Å; L309-Y528 HydrophobicContact CD1-CE1 3.84Å; L309-Y528 HydrophobicContact CG-CD1 4.45Å; A524-Y528 VanDerWaalsContact O-CB 3.27Å; A524-Y528 WeakPolarHBondContact O-CB 3.42Å; A524-Y528 PolarHBondContact O-N 3.12Å; L525-Y528 PolarHBondContact O-N 2.88Å; I526-Y528 PolarHBondContact O-N 2.8Å; Y528-C530 VanDerWaalsContact C-N 3.3Å; Y528-C530 PolarHBondContact O-N 3.31Å; Y528-V531 PolarHBondContact O-N 2.98Å; Y528-V531 VanDerWaalsContact O-N 3.16Å; Y528-Q532 HydrophobicContact CD1-CG 4.42Å; Y528-Q532 HydrophobicContact CD2-CG 4.01Å; Y528-Q532 HydrophobicContact CE1-CG 4.03Å; Y528-Q532 HydrophobicContact CE2-CG 3.57Å; Y528-Q532 HydrophobicContact CG-CG 4.42Å; Y528-Q532 PolarHBondContact O-N 2.95Å
529	A	88.2	Confident	90	Very high	22 Å²	22	58.1 Å²	58.1	18%	0.182	32%	0.316	C	S	.	.	H	α-helix	trans	-60.7	-38.4	177.2	0	0	0	0	0	112.1	L473 L525 I526 Y533	L473-A529 HydrophobicContact CD1-CB 4.37Å; L525-A529 WeakPolarHBondContact O-CB 3.49Å; L525-A529 PolarHBondContact O-N 3.02Å; I526-A529 PolarHBondContact O-N 3.37Å; A529-Y533 PolarHBondContact O-N 3.14Å
530	C	87.8	Confident	89.6	Confident	61 Å²	61	67.1 Å²	67.1	41%	0.412	36%	0.357	S	S	.	.	H	α-helix	trans	-67.3	-39.8	174.1	-70.3	0	0	0	0	112.9	I526 L527 Y528 Y533	I526-C530 PolarHBondContact O-N 3.38Å; I526-C530 PolarHBondContact O-SG 2.91Å; L527-C530 PolarHBondContact O-N 3.35Å; Y528-C530 VanDerWaalsContact C-N 3.3Å; Y528-C530 PolarHBondContact O-N 3.31Å; C530-Y533 WeakPolarHBondContact O-CB 3.46Å
531	V	89.4	Confident	89.4	Confident	111 Å²	111	64.3 Å²	64.3	67%	0.673	34%	0.339	S	S	*	.	H	α-helix	trans	-73.1	-37.8	-179.1	170.2	0	0	0	0	112	L527 Y528 Y533	L527-V531 VanDerWaalsContact O-CG2 3.28Å; L527-V531 WeakPolarHBondContact O-CG2 3.33Å; L527-V531 PolarHBondContact O-N 3.35Å; Y528-V531 PolarHBondContact O-N 2.98Å; Y528-V531 VanDerWaalsContact O-N 3.16Å; V531-Y533 PolarHBondContact O-N 3.23Å
532	Q	87.6	Confident	89.4	Confident	63 Å²	63	66 Å²	66	29%	0.294	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.9	8.4	178.3	-65.1	-61.3	-24.4	0	0	113.5	Y301 Y528 Q534	Y301-Q532 PolarHBondContact OH-NE2 3.47Å; Y528-Q532 HydrophobicContact CD1-CG 4.42Å; Y528-Q532 HydrophobicContact CD2-CG 4.01Å; Y528-Q532 HydrophobicContact CE1-CG 4.03Å; Y528-Q532 HydrophobicContact CE2-CG 3.57Å; Y528-Q532 HydrophobicContact CG-CG 4.42Å; Y528-Q532 PolarHBondContact O-N 2.95Å; Q532-Q534 PolarHBondContact O-N 3.39Å
533	Y	86.7	Confident	89.4	Confident	74 Å²	74	66.5 Å²	66.5	29%	0.29	36%	0.36	S	S	.	.			trans	-57.6	127.6	178.2	174.8	-103.3	0	0	0	111.2	Y466 A529 C530 V531 N548 W552	Y466-Y533 HydrophobicContact CE1-CE2 4.11Å; Y466-Y533 PolarHBondContact OH-OH 2.98Å; A529-Y533 PolarHBondContact O-N 3.14Å; C530-Y533 WeakPolarHBondContact O-CB 3.46Å; V531-Y533 PolarHBondContact O-N 3.23Å; Y533-N548 PolarHBondContact OH-OD1 3.1Å; Y533-W552 HydrophobicContact CD1-CZ2 4.26Å; Y533-W552 AromaticContact CD2-CE2 3.86Å; Y533-W552 HydrophobicContact CD2-CH2 4.42Å; Y533-W552 AromaticContact CD2-CZ2 3.39Å; Y533-W552 HydrophobicContact CD2-CZ2 3.39Å; Y533-W552 AromaticContact CD2-NE1 3.84Å; Y533-W552 AromaticContact CE1-NE1 3.81Å; Y533-W552 AromaticContact CE2-CE2 3.69Å; Y533-W552 AromaticContact CE2-CZ2 3.75Å; Y533-W552 HydrophobicContact CE2-CZ2 3.75Å; Y533-W552 AromaticContact CE2-NE1 3.22Å; Y533-W552 AromaticContact CG-CZ2 3.66Å; Y533-W552 HydrophobicContact CG-CZ2 3.66Å; Y533-W552 AromaticContact CZ-NE1 3.2Å; Y533-W552 PolarHBondContact OH-NE1 2.75Å
534	Q	87.7	Confident	89.5	Confident	142 Å²	142	64.7 Å²	64.7	66%	0.664	35%	0.353	S	S	*	.			trans	-125.4	143	169.6	-65.3	-61.2	-38.6	0	0	108.5	Q532 L536	Q532-Q534 PolarHBondContact O-N 3.39Å; Q534-L536 PolarHBondContact O-N 3.35Å
535	P	88.9	Confident	89.4	Confident	73 Å²	73	68.9 Å²	68.9	47%	0.474	37%	0.368	S	S	.	.			trans	-53.4	138.5	172.7	-24.3	34	0	0	0	111	T537	P535-T537 PolarHBondContact O-N 3.29Å
536	L	89.5	Confident	89.5	Confident	13 Å²	13	74.9 Å²	74.9	7%	0.068	39%	0.39	C	S	.	.			trans	-64.2	131.7	-176.7	-174	64	0	0	0	110.2	E461 F462 N465 Y466 Q534 Y543 N548	E461-L536 HydrophobicContact CG-CD1 4.26Å; F462-L536 HydrophobicContact CB-CD2 4.15Å; F462-L536 HydrophobicContact CD2-CD2 4.33Å; N465-L536 HydrophobicContact CB-CD1 4Å; N465-L536 WeakPolarHBondContact ND2-CD1 3.47Å; Y466-L536 HydrophobicContact CE2-CB 4.22Å; Y466-L536 HydrophobicContact CE2-CD2 4.09Å; Q534-L536 PolarHBondContact O-N 3.35Å; L536-Y543 HydrophobicContact CB-CD2 4.01Å; L536-Y543 HydrophobicContact CB-CG 4.12Å; L536-Y543 HydrophobicContact CD2-CD1 3.88Å; L536-Y543 HydrophobicContact CD2-CD2 3.97Å; L536-Y543 HydrophobicContact CD2-CE1 3.72Å; L536-Y543 HydrophobicContact CD2-CE2 3.8Å; L536-Y543 HydrophobicContact CD2-CG 3.99Å; L536-Y543 HydrophobicContact CG-CD1 4.47Å; L536-Y543 HydrophobicContact CG-CD2 3.69Å; L536-Y543 HydrophobicContact CG-CE1 4.48Å; L536-Y543 HydrophobicContact CG-CE2 3.7Å; L536-Y543 HydrophobicContact CG-CG 4.08Å; L536-Y543 WeakPolarHBondContact O-CB 3.42Å; L536-Y543 VanDerWaalsContact O-CD2 3.23Å; L536-Y543 WeakPolarHBondContact O-CD2 3.31Å; L536-Y543 PolarHBondContact O-N 2.9Å; L536-Y543 VanDerWaalsContact O-N 3.15Å; L536-N548 PolarHBondContact N-OD1 3.16Å
537	T	89.2	Confident	89.6	Confident	86 Å²	86	73.6 Å²	73.6	53%	0.528	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	142.4	174.5	51.5	0	0	0	0	108.5	P535 Y541 A542	P535-T537 PolarHBondContact O-N 3.29Å; T537-Y541 WeakPolarHBondContact CA-O 3.42Å; T537-A542 HydrophobicContact CG2-CB 4.39Å
538	Y	86.5	Confident	89.6	Confident	20 Å²	20	69.2 Å²	69.2	8%	0.078	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	113.3	170.4	-179.3	-93.2	0	0	0	107	M219 I457 Y458 E461 Q540 Y541	M219-Y538 HydrophobicContact SD-CE1 3.98Å; I457-Y538 HydrophobicContact CD1-CE2 4.5Å; I457-Y538 HydrophobicContact CG1-CE1 4.41Å; I457-Y538 HydrophobicContact CG1-CE2 3.99Å; Y458-Y538 HydrophobicContact CD1-CD1 4.26Å; Y458-Y538 HydrophobicContact CD1-CG 4.43Å; Y458-Y538 AromaticContact CE1-CD1 3.86Å; Y458-Y538 HydrophobicContact CE1-CD1 3.86Å; Y458-Y538 HydrophobicContact CE1-CG 4.41Å; E461-Y538 HydrophobicContact CB-CD2 4.24Å; E461-Y538 HydrophobicContact CG-CD2 4.04Å; Y538-Q540 PolarHBondContact O-N 3.49Å; Y538-Q540 VanDerWaalsContact O-N 3.17Å; Y538-Y541 PolarHBondContact N-O 3.38Å; Y538-Y541 WeakPolarHBondContact O-CA 3.33Å; Y538-Y541 WeakPolarHBondContact O-CB 3.48Å; Y538-Y541 PolarHBondContact O-N 2.95Å
539	E	82	Confident	89.6	Confident	104 Å²	104	70.6 Å²	70.6	49%	0.486	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	53	-117.3	-171.5	-58.5	176.1	-176.8	0	0	111.9
540	Q	82.9	Confident	89.8	Confident	199 Å²	199	73.7 Å²	73.7	93%	0.93	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.6	-6.9	176.7	-60.3	-178.9	-1.7	0	0	112.6	Y538	Y538-Q540 PolarHBondContact O-N 3.49Å; Y538-Q540 VanDerWaalsContact O-N 3.17Å
541	Y	89.5	Confident	90.1	Very high	53 Å²	53	70.8 Å²	70.8	21%	0.208	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	120.5	-179.2	-179	-97.9	0	0	0	111.3	V223 Y458 T537 Y538 Y543	V223-Y541 HydrophobicContact CG2-CE1 3.59Å; V223-Y541 PolarHBondContact N-OH 2.96Å; Y458-Y541 AromaticContact CD1-CD1 3.96Å; Y458-Y541 HydrophobicContact CD1-CD1 3.96Å; Y458-Y541 HydrophobicContact CD1-CE1 4.28Å; Y458-Y541 AromaticContact CE1-CD1 3.71Å; Y458-Y541 HydrophobicContact CE1-CD1 3.71Å; Y458-Y541 HydrophobicContact CE1-CE1 4.31Å; Y458-Y541 AromaticContact CE1-CG 3.97Å; Y458-Y541 HydrophobicContact CE1-CG 3.97Å; T537-Y541 WeakPolarHBondContact CA-O 3.42Å; Y538-Y541 PolarHBondContact N-O 3.38Å; Y538-Y541 WeakPolarHBondContact O-CA 3.33Å; Y538-Y541 WeakPolarHBondContact O-CB 3.48Å; Y538-Y541 PolarHBondContact O-N 2.95Å; Y541-Y543 AromaticContact CD1-CD2 3.98Å; Y541-Y543 HydrophobicContact CD1-CD2 3.98Å; Y541-Y543 HydrophobicContact CD1-CE2 4.05Å; Y541-Y543 HydrophobicContact CE1-CD1 4.46Å; Y541-Y543 HydrophobicContact CE1-CD2 4.07Å; Y541-Y543 HydrophobicContact CE1-CE2 4.33Å; Y541-Y543 HydrophobicContact CE1-CG 4.15Å
542	A	92.5	Very high	90.1	Very high	67 Å²	67	68.9 Å²	68.9	55%	0.554	35%	0.353	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.7	129.5	171.5	0	0	0	0	0	110.5	T537	T537-A542 HydrophobicContact CG2-CB 4.39Å
543	Y	93.2	Very high	90.4	Very high	10 Å²	10	68.7 Å²	68.7	4%	0.039	36%	0.362	C	S	.	.	P	Polyproline II helix	trans	-71.6	141.3	-179.8	-76.9	-113.8	0	0	0	110.6	V223 Y458 F462 L536 Y541 M547 N548	V223-Y543 HydrophobicContact CG2-CD1 3.82Å; V223-Y543 HydrophobicContact CG2-CE1 3.72Å; Y458-Y543 WeakPolarHBondContact CA-OH 3.39Å; Y458-Y543 WeakPolarHBondContact CB-OH 2.95Å; Y458-Y543 HydrophobicContact CD1-CE2 4.47Å; Y458-Y543 PolarHBondContact O-OH 3.2Å; F462-Y543 HydrophobicContact CB-CE1 4.32Å; L536-Y543 HydrophobicContact CB-CD2 4.01Å; L536-Y543 HydrophobicContact CB-CG 4.12Å; L536-Y543 HydrophobicContact CD2-CD1 3.88Å; L536-Y543 HydrophobicContact CD2-CD2 3.97Å; L536-Y543 HydrophobicContact CD2-CE1 3.72Å; L536-Y543 HydrophobicContact CD2-CE2 3.8Å; L536-Y543 HydrophobicContact CD2-CG 3.99Å; L536-Y543 HydrophobicContact CG-CD1 4.47Å; L536-Y543 HydrophobicContact CG-CD2 3.69Å; L536-Y543 HydrophobicContact CG-CE1 4.48Å; L536-Y543 HydrophobicContact CG-CE2 3.7Å; L536-Y543 HydrophobicContact CG-CG 4.08Å; L536-Y543 WeakPolarHBondContact O-CB 3.42Å; L536-Y543 VanDerWaalsContact O-CD2 3.23Å; L536-Y543 WeakPolarHBondContact O-CD2 3.31Å; L536-Y543 PolarHBondContact O-N 2.9Å; L536-Y543 VanDerWaalsContact O-N 3.15Å; Y541-Y543 AromaticContact CD1-CD2 3.98Å; Y541-Y543 HydrophobicContact CD1-CD2 3.98Å; Y541-Y543 HydrophobicContact CD1-CE2 4.05Å; Y541-Y543 HydrophobicContact CE1-CD1 4.46Å; Y541-Y543 HydrophobicContact CE1-CD2 4.07Å; Y541-Y543 HydrophobicContact CE1-CE2 4.33Å; Y541-Y543 HydrophobicContact CE1-CG 4.15Å; Y543-M547 HydrophobicContact CD1-CB 4.4Å; Y543-M547 HydrophobicContact CD1-CE 3.58Å; Y543-M547 HydrophobicContact CD1-SD 3.66Å; Y543-M547 HydrophobicContact CE1-CE 3.74Å; Y543-M547 HydrophobicContact CE1-SD 4.26Å; Y543-N548 PolarHBondContact O-ND2 3.28Å
544	P	94	Very high	90.6	Very high	36 Å²	36	66.8 Å²	66.8	23%	0.234	36%	0.357	C	S	.	.	P	Polyproline II helix	trans	-65.8	152.5	178.1	28.8	-35.7	0	0	0	111.6	W546 M547 N548	P544-W546 VanDerWaalsContact C-N 3.26Å; P544-W546 HydrophobicContact CG-CZ2 4.3Å; P544-W546 VanDerWaalsContact CG-NE1 3.25Å; P544-W546 PolarHBondContact O-N 3.27Å; P544-W546 VanDerWaalsContact O-N 3.16Å; P544-M547 HydrophobicContact CG-CB 4.26Å; P544-M547 HydrophobicContact CG-CG 3.91Å; P544-M547 HydrophobicContact CG-SD 4.06Å; P544-M547 WeakPolarHBondContact O-CB 3.43Å; P544-M547 PolarHBondContact O-N 3.13Å; P544-N548 PolarHBondContact O-N 2.76Å; P544-N548 PolarHBondContact O-ND2 3.24Å
545	D	92.9	Very high	90.7	Very high	140 Å²	140	60.3 Å²	60.3	75%	0.749	33%	0.327	S	S	*	.	H	α-helix	trans	-57.5	-35.4	-174.4	-65	-32.7	0	0	0	113.8	M547 N548 A549	D545-M547 PolarHBondContact O-N 3.28Å; D545-N548 PolarHBondContact O-N 2.95Å; D545-A549 PolarHBondContact O-N 3.23Å
546	W	94.3	Very high	90.8	Very high	134 Å²	134	60.7 Å²	60.7	51%	0.508	32%	0.324	S	S	.	.	H	α-helix	trans	-63.1	-31.3	178.2	71.7	-97.9	0	0	0	112.3	P544 L550	P544-W546 VanDerWaalsContact C-N 3.26Å; P544-W546 HydrophobicContact CG-CZ2 4.3Å; P544-W546 VanDerWaalsContact CG-NE1 3.25Å; P544-W546 PolarHBondContact O-N 3.27Å; P544-W546 VanDerWaalsContact O-N 3.16Å; W546-L550 HydrophobicContact CZ3-CD2 4.19Å; W546-L550 WeakPolarHBondContact O-CB 3.25Å; W546-L550 PolarHBondContact O-N 3.14Å
547	M	93.2	Very high	91	Very high	2 Å²	2	63 Å²	63	1%	0.01	34%	0.336	C	S	.	.	H	α-helix	trans	-72.8	-44.5	174.7	-77.5	-167.5	72.6	0	0	111.2	V223 F462 Y543 P544 D545 A549 L550 G551	V223-M547 HydrophobicContact CB-CE 4.11Å; V223-M547 HydrophobicContact CB-SD 3.38Å; V223-M547 WeakPolarHBondContact CB-SD 3.47Å; V223-M547 HydrophobicContact CG1-CE 3.61Å; V223-M547 HydrophobicContact CG1-SD 3.53Å; V223-M547 VanDerWaalsContact CG1-SD 3.53Å; V223-M547 HydrophobicContact CG2-CE 3.99Å; V223-M547 HydrophobicContact CG2-SD 3.33Å; V223-M547 WeakPolarHBondContact CG2-SD 3.49Å; F462-M547 HydrophobicContact CB-CE 4.22Å; F462-M547 HydrophobicContact CD2-CE 3.83Å; F462-M547 HydrophobicContact CE2-CE 4.43Å; F462-M547 VanDerWaalsContact CE2-O 3.27Å; F462-M547 WeakPolarHBondContact CE2-O 3.4Å; F462-M547 HydrophobicContact CG-CE 4.03Å; Y543-M547 HydrophobicContact CD1-CB 4.4Å; Y543-M547 HydrophobicContact CD1-CE 3.58Å; Y543-M547 HydrophobicContact CD1-SD 3.66Å; Y543-M547 HydrophobicContact CE1-CE 3.74Å; Y543-M547 HydrophobicContact CE1-SD 4.26Å; P544-M547 HydrophobicContact CG-CB 4.26Å; P544-M547 HydrophobicContact CG-CG 3.91Å; P544-M547 HydrophobicContact CG-SD 4.06Å; P544-M547 WeakPolarHBondContact O-CB 3.43Å; P544-M547 PolarHBondContact O-N 3.13Å; D545-M547 PolarHBondContact O-N 3.28Å; M547-A549 PolarHBondContact O-N 3.47Å; M547-L550 WeakPolarHBondContact O-CB 3.3Å; M547-L550 PolarHBondContact O-N 3.12Å; M547-L550 VanDerWaalsContact O-N 3.12Å; M547-G551 PolarHBondContact O-N 2.96Å
548	N	92.4	Very high	91.1	Very high	12 Å²	12	59 Å²	59	6%	0.064	31%	0.311	C	S	.	.	H	α-helix	trans	-57.4	-41.3	174.3	-69.5	-80.7	0	0	0	110.9	Y466 Y533 L536 Y543 P544 D545 G551 W552	Y466-N548 WeakPolarHBondContact OH-CA 3.15Å; Y466-N548 PolarHBondContact OH-OD1 2.94Å; Y533-N548 PolarHBondContact OH-OD1 3.1Å; L536-N548 PolarHBondContact N-OD1 3.16Å; Y543-N548 PolarHBondContact O-ND2 3.28Å; P544-N548 PolarHBondContact O-N 2.76Å; P544-N548 PolarHBondContact O-ND2 3.24Å; D545-N548 PolarHBondContact O-N 2.95Å; N548-G551 PolarHBondContact O-N 3.03Å; N548-W552 VanDerWaalsContact O-CD1 3.28Å; N548-W552 PolarHBondContact O-N 2.83Å; N548-W552 VanDerWaalsContact O-N 3.07Å
549	A	93.4	Very high	91.4	Very high	61 Å²	61	60.5 Å²	60.5	50%	0.504	32%	0.321	S	S	.	.	H	α-helix	trans	-63.7	-42.2	174.7	0	0	0	0	0	112.9	D545 M547 G551 W552 A553	D545-A549 PolarHBondContact O-N 3.23Å; M547-A549 PolarHBondContact O-N 3.47Å; A549-G551 VanDerWaalsContact C-N 3.31Å; A549-G551 PolarHBondContact O-N 3.28Å; A549-W552 PolarHBondContact O-N 3.24Å; A549-A553 PolarHBondContact O-N 2.79Å
550	L	93.3	Very high	92	Very high	87 Å²	87	58.9 Å²	58.9	46%	0.455	32%	0.318	S	S	.	.	H	α-helix	trans	-62.8	-38.6	174.2	-177.9	63.8	0	0	0	111.8	F462 W546 M547 A553 L554	F462-L550 HydrophobicContact CZ-CB 4.32Å; F462-L550 HydrophobicContact CZ-CD2 4.29Å; F462-L550 HydrophobicContact CZ-CG 4.08Å; W546-L550 HydrophobicContact CZ3-CD2 4.19Å; W546-L550 WeakPolarHBondContact O-CB 3.25Å; W546-L550 PolarHBondContact O-N 3.14Å; M547-L550 WeakPolarHBondContact O-CB 3.3Å; M547-L550 PolarHBondContact O-N 3.12Å; M547-L550 VanDerWaalsContact O-N 3.12Å; L550-A553 WeakPolarHBondContact O-CB 3.24Å; L550-A553 PolarHBondContact O-N 2.93Å; L550-L554 PolarHBondContact O-N 3.04Å
551	G	92	Very high	92.6	Very high	0 Å²	0	50.8 Å²	50.8	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-62.4	-43.1	176.7	0	0	0	0	0	112.5	F462 Y466 M547 N548 A549 L554 S555	F462-G551 VanDerWaalsContact CE2-CA 3.47Å; F462-G551 VanDerWaalsContact CZ-CA 3.42Å; Y466-G551 VanDerWaalsContact CD1-CA 3.49Å; Y466-G551 WeakPolarHBondContact CD1-O 3.34Å; M547-G551 PolarHBondContact O-N 2.96Å; N548-G551 PolarHBondContact O-N 3.03Å; A549-G551 VanDerWaalsContact C-N 3.31Å; A549-G551 PolarHBondContact O-N 3.28Å; G551-L554 PolarHBondContact O-N 3.46Å; G551-S555 WeakPolarHBondContact O-CB 2.95Å; G551-S555 PolarHBondContact O-N 3.22Å; G551-S555 PolarHBondContact O-OG 3.08Å
552	W	91.2	Very high	92.8	Very high	71 Å²	71	48.7 Å²	48.7	27%	0.269	27%	0.273	S	S	.	.	H	α-helix	trans	-65	-39.7	172.5	-82.6	109.3	0	0	0	112.9	Y533 N548 A549 L554 S555 I556	Y533-W552 HydrophobicContact CD1-CZ2 4.26Å; Y533-W552 AromaticContact CD2-CE2 3.86Å; Y533-W552 HydrophobicContact CD2-CH2 4.42Å; Y533-W552 AromaticContact CD2-CZ2 3.39Å; Y533-W552 HydrophobicContact CD2-CZ2 3.39Å; Y533-W552 AromaticContact CD2-NE1 3.84Å; Y533-W552 AromaticContact CE1-NE1 3.81Å; Y533-W552 AromaticContact CE2-CE2 3.69Å; Y533-W552 AromaticContact CE2-CZ2 3.75Å; Y533-W552 HydrophobicContact CE2-CZ2 3.75Å; Y533-W552 AromaticContact CE2-NE1 3.22Å; Y533-W552 AromaticContact CG-CZ2 3.66Å; Y533-W552 HydrophobicContact CG-CZ2 3.66Å; Y533-W552 AromaticContact CZ-NE1 3.2Å; Y533-W552 PolarHBondContact OH-NE1 2.75Å; N548-W552 VanDerWaalsContact O-CD1 3.28Å; N548-W552 PolarHBondContact O-N 2.83Å; N548-W552 VanDerWaalsContact O-N 3.07Å; A549-W552 PolarHBondContact O-N 3.24Å; W552-L554 VanDerWaalsContact C-N 3.29Å; W552-L554 PolarHBondContact O-N 3.19Å; W552-S555 PolarHBondContact O-N 3.4Å; W552-I556 WeakPolarHBondContact O-CG1 3.49Å; W552-I556 PolarHBondContact O-N 2.92Å
553	A	92.4	Very high	93	Very high	59 Å²	59	49.8 Å²	49.8	49%	0.488	27%	0.268	S	S	.	.	H	α-helix	trans	-60.7	-40.7	174.4	0	0	0	0	0	111.6	A549 L550 I556 L557	A549-A553 PolarHBondContact O-N 2.79Å; L550-A553 WeakPolarHBondContact O-CB 3.24Å; L550-A553 PolarHBondContact O-N 2.93Å; A553-I556 PolarHBondContact O-N 2.96Å; A553-L557 PolarHBondContact O-N 3.01Å; A553-L557 VanDerWaalsContact O-N 3.09Å
554	L	90.9	Very high	93.1	Very high	34 Å²	34	54.8 Å²	54.8	18%	0.178	29%	0.293	C	S	.	.	H	α-helix	trans	-68.1	-37.4	175.1	-171.6	57.2	0	0	0	112.2	L130 F462 V467 L550 G551 W552 I556 L557	L130-L554 HydrophobicContact CD1-CD1 4.05Å; F462-L554 HydrophobicContact CE1-CD2 4.16Å; V467-L554 HydrophobicContact CG2-CD2 3.47Å; V467-L554 VanDerWaalsContact CG2-CD2 3.47Å; V467-L554 HydrophobicContact CG2-CG 4.15Å; L550-L554 PolarHBondContact O-N 3.04Å; G551-L554 PolarHBondContact O-N 3.46Å; W552-L554 VanDerWaalsContact C-N 3.29Å; W552-L554 PolarHBondContact O-N 3.19Å; L554-I556 VanDerWaalsContact C-N 3.3Å; L554-I556 PolarHBondContact O-N 3.34Å; L554-L557 HydrophobicContact CD1-CD2 3.95Å; L554-L557 VanDerWaalsContact O-CB 3.27Å; L554-L557 WeakPolarHBondContact O-CB 3.35Å; L554-L557 PolarHBondContact O-N 3.49Å
555	S	90.2	Very high	93.1	Very high	5 Å²	5	54.2 Å²	54.2	4%	0.035	29%	0.289	C	S	.	.	H	α-helix	trans	-65.5	-32.8	177.3	-59.1	0	0	0	0	113	Y466 S471 G551 W552	Y466-S555 PolarHBondContact O-OG 2.84Å; S471-S555 WeakPolarHBondContact OG-CA 3.43Å; S471-S555 PolarHBondContact OG-O 3.25Å; G551-S555 WeakPolarHBondContact O-CB 2.95Å; G551-S555 PolarHBondContact O-N 3.22Å; G551-S555 PolarHBondContact O-OG 3.08Å; W552-S555 PolarHBondContact O-N 3.4Å
556	I	91.7	Very high	93.1	Very high	82 Å²	82	47.9 Å²	47.9	42%	0.421	26%	0.258	S	S	.	.	H	α-helix	trans	-87.8	-16	180	-65.8	167	0	0	0	111.5	W552 A553 L554 P558 L559 V560	W552-I556 WeakPolarHBondContact O-CG1 3.49Å; W552-I556 PolarHBondContact O-N 2.92Å; A553-I556 PolarHBondContact O-N 2.96Å; L554-I556 VanDerWaalsContact C-N 3.3Å; L554-I556 PolarHBondContact O-N 3.34Å; I556-P558 VanDerWaalsContact C-CD 3.49Å; I556-P558 VanDerWaalsContact C-N 3.35Å; I556-L559 HydrophobicContact CG2-CB 4.49Å; I556-L559 WeakPolarHBondContact O-CA 3.42Å; I556-L559 VanDerWaalsContact O-CB 3.31Å; I556-L559 WeakPolarHBondContact O-CB 3.4Å; I556-L559 PolarHBondContact O-N 3.39Å; I556-V560 HydrophobicContact CG2-CG2 4.04Å; I556-V560 PolarHBondContact O-N 3.3Å; I556-V560 VanDerWaalsContact O-N 3.13Å
557	L	92.6	Very high	93	Very high	61 Å²	61	45.9 Å²	45.9	32%	0.319	26%	0.256	S	S	.	.	H	α-helix	trans	-49.9	-44.9	-178.6	178.7	65.7	0	0	0	113.7	V126 A553 L554 L559 V560 I561	V126-L557 HydrophobicContact CG1-CD2 4.38Å; A553-L557 PolarHBondContact O-N 3.01Å; A553-L557 VanDerWaalsContact O-N 3.09Å; L554-L557 HydrophobicContact CD1-CD2 3.95Å; L554-L557 VanDerWaalsContact O-CB 3.27Å; L554-L557 WeakPolarHBondContact O-CB 3.35Å; L554-L557 PolarHBondContact O-N 3.49Å; L557-L559 VanDerWaalsContact C-N 3.29Å; L557-L559 PolarHBondContact O-N 2.94Å; L557-V560 PolarHBondContact O-N 3.29Å; L557-V560 VanDerWaalsContact O-N 3.15Å; L557-I561 HydrophobicContact CD1-CD1 4.26Å; L557-I561 HydrophobicContact CD1-CG1 4.31Å; L557-I561 HydrophobicContact CG-CD1 3.99Å; L557-I561 HydrophobicContact CG-CG1 4.48Å; L557-I561 WeakPolarHBondContact O-CG1 3.38Å; L557-I561 PolarHBondContact O-N 3.21Å
558	P	91.3	Very high	93	Very high	2 Å²	2	51.9 Å²	51.9	1%	0.013	28%	0.282	C	S	.	.	H	α-helix	trans	-56	-39.9	174.9	-30.4	39.1	0	0	0	114.3	S123 I127 I475 I556 I561 I562	S123-P558 WeakPolarHBondContact OG-CA 3.27Å; S123-P558 PolarHBondContact OG-O 3.33Å; I127-P558 HydrophobicContact CD1-CG 3.9Å; I127-P558 HydrophobicContact CG1-CG 4.04Å; I475-P558 HydrophobicContact CD1-CB 3.97Å; I475-P558 HydrophobicContact CD1-CG 4.2Å; I475-P558 HydrophobicContact CG1-CB 3.76Å; I475-P558 HydrophobicContact CG1-CG 4.44Å; I556-P558 VanDerWaalsContact C-CD 3.49Å; I556-P558 VanDerWaalsContact C-N 3.35Å; P558-I561 PolarHBondContact O-N 3.49Å; P558-I562 WeakPolarHBondContact O-CD1 3.46Å; P558-I562 WeakPolarHBondContact O-CG1 3.22Å; P558-I562 PolarHBondContact O-N 2.93Å
559	L	92.8	Very high	92.9	Very high	52 Å²	52	52.7 Å²	52.7	27%	0.272	29%	0.287	S	S	.	.	H	α-helix	trans	-66.6	-42	178.2	-178.9	58.1	0	0	0	110.9	T474 F478 I556 L557 I561 I562 I563	T474-L559 HydrophobicContact CG2-CB 4.2Å; T474-L559 HydrophobicContact CG2-CD1 4.39Å; F478-L559 HydrophobicContact CD2-CD1 4.31Å; F478-L559 HydrophobicContact CE2-CD1 3.38Å; F478-L559 HydrophobicContact CZ-CD1 3.6Å; I556-L559 HydrophobicContact CG2-CB 4.49Å; I556-L559 WeakPolarHBondContact O-CA 3.42Å; I556-L559 VanDerWaalsContact O-CB 3.31Å; I556-L559 WeakPolarHBondContact O-CB 3.4Å; I556-L559 PolarHBondContact O-N 3.39Å; L557-L559 VanDerWaalsContact C-N 3.29Å; L557-L559 PolarHBondContact O-N 2.94Å; L559-I561 VanDerWaalsContact C-N 3.34Å; L559-I561 PolarHBondContact O-N 3.15Å; L559-I562 PolarHBondContact O-N 3.08Å; L559-I563 HydrophobicContact CD1-CD1 3.98Å; L559-I563 HydrophobicContact CD1-CG1 4.32Å; L559-I563 HydrophobicContact CG-CD1 3.9Å; L559-I563 VanDerWaalsContact O-CG1 3.31Å; L559-I563 WeakPolarHBondContact O-CG1 3.12Å; L559-I563 PolarHBondContact O-N 3.12Å
560	V	95	Very high	92.8	Very high	70 Å²	70	52.1 Å²	52.1	42%	0.424	27%	0.273	S	S	.	.	H	α-helix	trans	-61.7	-43.9	176	177.5	0	0	0	0	110.4	I556 L557 I562 I563 M564	I556-V560 HydrophobicContact CG2-CG2 4.04Å; I556-V560 PolarHBondContact O-N 3.3Å; I556-V560 VanDerWaalsContact O-N 3.13Å; L557-V560 PolarHBondContact O-N 3.29Å; L557-V560 VanDerWaalsContact O-N 3.15Å; V560-I562 PolarHBondContact O-N 3.36Å; V560-I563 PolarHBondContact O-N 3.15Å; V560-M564 HydrophobicContact CG1-CG 3.92Å; V560-M564 VanDerWaalsContact O-CB 3.25Å; V560-M564 WeakPolarHBondContact O-CB 3.31Å; V560-M564 WeakPolarHBondContact O-CG 3.49Å; V560-M564 PolarHBondContact O-N 3.25Å
561	I	95.4	Very high	92.7	Very high	29 Å²	29	54 Å²	54	15%	0.149	28%	0.283	C	S	.	.	H	α-helix	trans	-60.8	-45.6	176.8	-67.7	167.8	0	0	0	110.8	I122 S123 V126 L557 P558 L559 I563 M564 T565	I122-I561 HydrophobicContact CB-CG2 3.87Å; I122-I561 HydrophobicContact CG2-CG2 3.72Å; S123-I561 WeakPolarHBondContact OG-CB 3.34Å; S123-I561 WeakPolarHBondContact OG-CG2 3.03Å; V126-I561 HydrophobicContact CB-CD1 4.45Å; V126-I561 HydrophobicContact CG2-CD1 4.18Å; L557-I561 HydrophobicContact CD1-CD1 4.26Å; L557-I561 HydrophobicContact CD1-CG1 4.31Å; L557-I561 HydrophobicContact CG-CD1 3.99Å; L557-I561 HydrophobicContact CG-CG1 4.48Å; L557-I561 WeakPolarHBondContact O-CG1 3.38Å; L557-I561 PolarHBondContact O-N 3.21Å; P558-I561 PolarHBondContact O-N 3.49Å; L559-I561 VanDerWaalsContact C-N 3.34Å; L559-I561 PolarHBondContact O-N 3.15Å; I561-I563 PolarHBondContact O-N 3.47Å; I561-M564 PolarHBondContact O-N 2.86Å; I561-T565 HydrophobicContact CG2-CG2 4.23Å; I561-T565 WeakPolarHBondContact O-CB 3.27Å; I561-T565 WeakPolarHBondContact O-CG2 3.27Å; I561-T565 PolarHBondContact O-N 2.94Å; I561-T565 PolarHBondContact O-OG1 3.02Å
562	I	95	Very high	92.6	Very high	8 Å²	8	59.1 Å²	59.1	4%	0.041	31%	0.309	C	S	.	.	H	α-helix	trans	-58.6	-48.2	177.5	-67.7	162.3	0	0	0	110.8	F117 I120 F478 P558 L559 V560 T565 G566	F117-I562 HydrophobicContact CD1-CG2 4.25Å; I120-I562 HydrophobicContact CG1-CD1 3.91Å; I120-I562 HydrophobicContact CG1-CG1 3.9Å; I120-I562 HydrophobicContact CG1-CG2 4.44Å; F478-I562 HydrophobicContact CB-CD1 4.25Å; F478-I562 HydrophobicContact CD2-CD1 4.05Å; F478-I562 HydrophobicContact CG-CD1 4.29Å; P558-I562 WeakPolarHBondContact O-CD1 3.46Å; P558-I562 WeakPolarHBondContact O-CG1 3.22Å; P558-I562 PolarHBondContact O-N 2.93Å; L559-I562 PolarHBondContact O-N 3.08Å; V560-I562 PolarHBondContact O-N 3.36Å; I562-T565 PolarHBondContact O-OG1 3.41Å; I562-T565 VanDerWaalsContact O-OG1 3.04Å; I562-G566 PolarHBondContact O-N 3.27Å; I562-G566 VanDerWaalsContact O-N 3.12Å
563	I	95.5	Very high	92.4	Very high	90 Å²	90	61.4 Å²	61.4	46%	0.462	32%	0.318	S	S	.	.	H	α-helix	trans	-67.2	-47.5	-179.2	-66	168.2	0	0	0	111.2	L559 V560 I561 T565 G566 L567	L559-I563 HydrophobicContact CD1-CD1 3.98Å; L559-I563 HydrophobicContact CD1-CG1 4.32Å; L559-I563 HydrophobicContact CG-CD1 3.9Å; L559-I563 VanDerWaalsContact O-CG1 3.31Å; L559-I563 WeakPolarHBondContact O-CG1 3.12Å; L559-I563 PolarHBondContact O-N 3.12Å; V560-I563 PolarHBondContact O-N 3.15Å; I561-I563 PolarHBondContact O-N 3.47Å; I563-T565 PolarHBondContact O-N 3.05Å; I563-G566 PolarHBondContact O-N 3.46Å; I563-L567 HydrophobicContact CG2-CD1 3.84Å; I563-L567 HydrophobicContact CG2-CG 4.31Å; I563-L567 WeakPolarHBondContact O-CB 3.42Å; I563-L567 VanDerWaalsContact O-CG 3.29Å; I563-L567 WeakPolarHBondContact O-CG 3.39Å; I563-L567 PolarHBondContact O-N 3.39Å
564	M	95.3	Very high	91.9	Very high	115 Å²	115	63.5 Å²	63.5	57%	0.567	33%	0.329	S	S	*	.	H	α-helix	trans	-64.6	-40.5	-176.2	-73.5	-61.6	-64.8	0	0	112.4	V560 I561 L567 F568	V560-M564 HydrophobicContact CG1-CG 3.92Å; V560-M564 VanDerWaalsContact O-CB 3.25Å; V560-M564 WeakPolarHBondContact O-CB 3.31Å; V560-M564 WeakPolarHBondContact O-CG 3.49Å; V560-M564 PolarHBondContact O-N 3.25Å; I561-M564 PolarHBondContact O-N 2.86Å; M564-L567 PolarHBondContact O-N 2.79Å; M564-F568 VanDerWaalsContact O-CB 3.29Å; M564-F568 WeakPolarHBondContact O-CB 3.12Å; M564-F568 PolarHBondContact O-N 3.04Å
565	T	93.6	Very high	91.6	Very high	24 Å²	24	64 Å²	64	15%	0.147	34%	0.342	C	S	.	.	H	α-helix	trans	-69.6	-41.1	177.1	54.2	0	0	0	0	111.7	G119 I122 I561 I562 I563 L567 F568 N569	G119-T565 WeakPolarHBondContact CA-OG1 3.32Å; G119-T565 PolarHBondContact N-OG1 3.32Å; I122-T565 HydrophobicContact CD1-CG2 3.89Å; I561-T565 HydrophobicContact CG2-CG2 4.23Å; I561-T565 WeakPolarHBondContact O-CB 3.27Å; I561-T565 WeakPolarHBondContact O-CG2 3.27Å; I561-T565 PolarHBondContact O-N 2.94Å; I561-T565 PolarHBondContact O-OG1 3.02Å; I562-T565 PolarHBondContact O-OG1 3.41Å; I562-T565 VanDerWaalsContact O-OG1 3.04Å; I563-T565 PolarHBondContact O-N 3.05Å; T565-L567 PolarHBondContact O-N 3.21Å; T565-F568 PolarHBondContact O-N 3.24Å; T565-N569 WeakPolarHBondContact O-CB 3.3Å; T565-N569 PolarHBondContact O-N 3.02Å
566	G	93	Very high	91.5	Very high	8 Å²	8	68.9 Å²	68.9	8%	0.082	37%	0.371	C	S	.	.	H	α-helix	trans	-60.1	-43.9	172.8	0	0	0	0	0	112.3	L116 I562 I563 F570	L116-G566 WeakPolarHBondContact O-CA 3.39Å; I562-G566 PolarHBondContact O-N 3.27Å; I562-G566 VanDerWaalsContact O-N 3.12Å; I563-G566 PolarHBondContact O-N 3.46Å; G566-F570 VanDerWaalsContact O-CB 3.29Å; G566-F570 WeakPolarHBondContact O-CB 3.49Å; G566-F570 PolarHBondContact O-N 2.93Å
567	L	93.3	Very high	91.3	Very high	91 Å²	91	68.8 Å²	68.8	48%	0.476	38%	0.377	S	S	.	.	H	α-helix	trans	-63.9	-44.7	174.7	-73	173.7	0	0	0	112	I563 M564 T565 F570 L571	I563-L567 HydrophobicContact CG2-CD1 3.84Å; I563-L567 HydrophobicContact CG2-CG 4.31Å; I563-L567 WeakPolarHBondContact O-CB 3.42Å; I563-L567 VanDerWaalsContact O-CG 3.29Å; I563-L567 WeakPolarHBondContact O-CG 3.39Å; I563-L567 PolarHBondContact O-N 3.39Å; M564-L567 PolarHBondContact O-N 2.79Å; T565-L567 PolarHBondContact O-N 3.21Å; L567-F570 WeakPolarHBondContact O-CB 3.48Å; L567-F570 PolarHBondContact O-N 3.38Å; L567-L571 WeakPolarHBondContact O-CB 3.2Å; L567-L571 VanDerWaalsContact O-CG 3.24Å; L567-L571 WeakPolarHBondContact O-CG 3.11Å; L567-L571 PolarHBondContact O-N 2.94Å
568	F	93.6	Very high	91.1	Very high	128 Å²	128	71.3 Å²	71.3	56%	0.561	40%	0.395	S	S	*	.	H	α-helix	trans	-60.6	-47.6	177.8	179.3	-104.3	0	0	0	111.9	M564 T565 F570 L571 I572	M564-F568 VanDerWaalsContact O-CB 3.29Å; M564-F568 WeakPolarHBondContact O-CB 3.12Å; M564-F568 PolarHBondContact O-N 3.04Å; T565-F568 PolarHBondContact O-N 3.24Å; F568-F570 VanDerWaalsContact C-N 3.29Å; F568-F570 PolarHBondContact O-N 3.1Å; F568-L571 PolarHBondContact O-N 3.25Å; F568-I572 HydrophobicContact CD1-CD1 3.68Å; F568-I572 HydrophobicContact CD2-CD1 4.15Å; F568-I572 HydrophobicContact CE1-CD1 3.21Å; F568-I572 HydrophobicContact CE2-CD1 3.73Å; F568-I572 HydrophobicContact CG-CD1 4.15Å; F568-I572 HydrophobicContact CZ-CD1 3.26Å; F568-I572 HydrophobicContact CZ-CG1 4.43Å; F568-I572 PolarHBondContact O-N 3.11Å; F568-I572 VanDerWaalsContact O-N 3.08Å
569	N	90.1	Very high	91	Very high	29 Å²	29	77.1 Å²	77.1	16%	0.155	42%	0.42	C	S	.	.	H	α-helix	trans	-62.1	-37.4	176.1	-76.3	-13.4	0	0	0	111.5	P115 Q118 T565 R573 L584	P115-N569 PolarHBondContact O-ND2 3.4Å; Q118-N569 PolarHBondContact OE1-ND2 3.08Å; Q118-N569 VanDerWaalsContact OE1-ND2 3.11Å; T565-N569 WeakPolarHBondContact O-CB 3.3Å; T565-N569 PolarHBondContact O-N 3.02Å; N569-R573 WeakPolarHBondContact O-CG 2.95Å; N569-R573 PolarHBondContact O-N 3.27Å; N569-L584 HydrophobicContact CB-CD1 4.4Å; N569-L584 HydrophobicContact CB-CD2 4.01Å
570	F	90.9	Very high	90.8	Very high	49 Å²	49	77.5 Å²	77.5	22%	0.215	42%	0.418	C	S	.	.	H	α-helix	trans	-66.5	-37.6	174.5	-176.8	-92.7	0	0	0	113.6	G566 L567 F568 C577 R580 F581 L584	G566-F570 VanDerWaalsContact O-CB 3.29Å; G566-F570 WeakPolarHBondContact O-CB 3.49Å; G566-F570 PolarHBondContact O-N 2.93Å; L567-F570 WeakPolarHBondContact O-CB 3.48Å; L567-F570 PolarHBondContact O-N 3.38Å; F568-F570 VanDerWaalsContact C-N 3.29Å; F568-F570 PolarHBondContact O-N 3.1Å; F570-C577 HydrophobicContact CZ-CB 4.42Å; F570-R580 HydrophobicContact CD2-CB 4.04Å; F570-R580 HydrophobicContact CE2-CB 3.75Å; F570-R580 HydrophobicContact CZ-CB 4.46Å; F570-R580 PolarHBondContact O-NH1 3.04Å; F570-F581 HydrophobicContact CE2-CB 4.41Å; F570-L584 HydrophobicContact CB-CD1 4.02Å; F570-L584 HydrophobicContact CD2-CD1 4.27Å
571	L	91.3	Very high	90.4	Very high	127 Å²	127	78.7 Å²	78.7	67%	0.665	42%	0.417	S	S	*	.	H	α-helix	trans	-72.7	-35.3	180	-71	172.6	0	0	0	112.7	L567 F568	L567-L571 WeakPolarHBondContact O-CB 3.2Å; L567-L571 VanDerWaalsContact O-CG 3.24Å; L567-L571 WeakPolarHBondContact O-CG 3.11Å; L567-L571 PolarHBondContact O-N 2.94Å; F568-L571 PolarHBondContact O-N 3.25Å
572	I	89.6	Confident	90.1	Very high	107 Å²	107	83.9 Å²	83.9	55%	0.549	44%	0.435	S	S	.	.	H	α-helix	trans	-72.7	-36.6	179.4	-71.9	165.4	0	0	0	112.4	F568 S574	F568-I572 HydrophobicContact CD1-CD1 3.68Å; F568-I572 HydrophobicContact CD2-CD1 4.15Å; F568-I572 HydrophobicContact CE1-CD1 3.21Å; F568-I572 HydrophobicContact CE2-CD1 3.73Å; F568-I572 HydrophobicContact CG-CD1 4.15Å; F568-I572 HydrophobicContact CZ-CD1 3.26Å; F568-I572 HydrophobicContact CZ-CG1 4.43Å; F568-I572 PolarHBondContact O-N 3.11Å; F568-I572 VanDerWaalsContact O-N 3.08Å; I572-S574 PolarHBondContact O-N 2.93Å
573	R	87.1	Confident	89.8	Confident	119 Å²	119	86.7 Å²	86.7	45%	0.449	45%	0.45	S	S	.	.	S	Bend	trans	-67.3	129.8	179.9	-67.6	-68.4	-175	-171.3	1.3	110	N569 R580 L584	N569-R573 WeakPolarHBondContact O-CG 2.95Å; N569-R573 PolarHBondContact O-N 3.27Å; R573-R580 HydrophobicContact CB-CB 4.48Å; R573-R580 HydrophobicContact CB-CG 4.23Å; R573-R580 WeakPolarHBondContact O-CD 3.17Å; R573-R580 PolarHBondContact O-NE 2.92Å; R573-R580 PolarHBondContact O-NH1 3Å; R573-L584 HydrophobicContact CG-CD2 4Å; R573-L584 HydrophobicContact CG-CG 4.29Å
574	S	82.9	Confident	89.6	Confident	104 Å²	104	82.5 Å²	82.5	73%	0.727	43%	0.429	S	S	*	.			trans	-84.1	158.4	175.9	60.3	0	0	0	0	111.3	I572	I572-S574 PolarHBondContact O-N 2.93Å
575	G	82.9	Confident	89.3	Confident	44 Å²	44	79.6 Å²	79.6	45%	0.454	41%	0.414	S	S	.	.	S	Bend	trans	116.1	-170.5	175.7	0	0	0	0	0	115	R580	G575-R580 PolarHBondContact O-NE 2.72Å; G575-R580 PolarHBondContact O-NH2 3.46Å
576	V	88.5	Confident	89.1	Confident	107 Å²	107	80.6 Å²	80.6	65%	0.648	42%	0.418	S	S	*	.			trans	-71.3	142.9	178.9	-179.4	0	0	0	0	110.1	V578 K579 R580	V576-V578 VanDerWaalsContact C-N 3.31Å; V576-V578 PolarHBondContact O-N 3.12Å; V576-K579 HydrophobicContact CB-CB 4.46Å; V576-K579 WeakPolarHBondContact O-CA 3.41Å; V576-K579 WeakPolarHBondContact O-CB 3.47Å; V576-K579 PolarHBondContact O-N 2.99Å; V576-R580 PolarHBondContact O-N 2.93Å
577	C	87.9	Confident	88.9	Confident	81 Å²	81	81.6 Å²	81.6	55%	0.547	42%	0.423	S	S	.	.	H	α-helix	trans	-45.8	-50.2	-178.3	-179.7	0	0	0	0	113.5	F570 K579 R580 F581	F570-C577 HydrophobicContact CZ-CB 4.42Å; C577-K579 VanDerWaalsContact C-N 3.35Å; C577-K579 PolarHBondContact O-N 3.39Å; C577-R580 PolarHBondContact O-N 3.09Å; C577-F581 PolarHBondContact O-N 3.48Å
578	V	88.1	Confident	88.6	Confident	113 Å²	113	80.4 Å²	80.4	69%	0.685	42%	0.415	S	S	*	.	H	α-helix	trans	-62.4	-41	179.7	-178.4	0	0	0	0	112	V576 R582	V576-V578 VanDerWaalsContact C-N 3.31Å; V576-V578 PolarHBondContact O-N 3.12Å; V578-R582 WeakPolarHBondContact O-CB 3.42Å; V578-R582 PolarHBondContact O-N 3.07Å
579	K	88.9	Confident	88	Confident	125 Å²	125	81.8 Å²	81.8	54%	0.543	43%	0.429	S	S	.	.	H	α-helix	trans	-66.8	-44.6	178.5	-174.3	178.9	176.4	-175.5	0	110.8	V576 C577 F581 R582 D583	V576-K579 HydrophobicContact CB-CB 4.46Å; V576-K579 WeakPolarHBondContact O-CA 3.41Å; V576-K579 WeakPolarHBondContact O-CB 3.47Å; V576-K579 PolarHBondContact O-N 2.99Å; C577-K579 VanDerWaalsContact C-N 3.35Å; C577-K579 PolarHBondContact O-N 3.39Å; K579-F581 VanDerWaalsContact C-N 3.32Å; K579-F581 PolarHBondContact O-N 3.47Å; K579-R582 PolarHBondContact O-N 3.11Å; K579-D583 WeakPolarHBondContact CE-OD2 3.41Å; K579-D583 WeakPolarHBondContact CG-OD2 3.43Å; K579-D583 WeakPolarHBondContact O-CB 3.33Å; K579-D583 PolarHBondContact O-N 3.12Å
580	R	88.4	Confident	87.5	Confident	59 Å²	59	82.4 Å²	82.4	22%	0.223	44%	0.438	C	S	.	.	H	α-helix	trans	-57.6	-45.8	177	-65.3	-178.4	-164.9	-156.2	-0.3	112	F570 R573 G575 V576 C577 D583 L584	F570-R580 HydrophobicContact CD2-CB 4.04Å; F570-R580 HydrophobicContact CE2-CB 3.75Å; F570-R580 HydrophobicContact CZ-CB 4.46Å; F570-R580 PolarHBondContact O-NH1 3.04Å; R573-R580 HydrophobicContact CB-CB 4.48Å; R573-R580 HydrophobicContact CB-CG 4.23Å; R573-R580 WeakPolarHBondContact O-CD 3.17Å; R573-R580 PolarHBondContact O-NE 2.92Å; R573-R580 PolarHBondContact O-NH1 3Å; G575-R580 PolarHBondContact O-NE 2.72Å; G575-R580 PolarHBondContact O-NH2 3.46Å; V576-R580 PolarHBondContact O-N 2.93Å; C577-R580 PolarHBondContact O-N 3.09Å; R580-D583 PolarHBondContact O-N 3.35Å; R580-L584 VanDerWaalsContact O-CG 3.3Å; R580-L584 WeakPolarHBondContact O-CG 3.3Å; R580-L584 PolarHBondContact O-N 2.83Å; R580-L584 VanDerWaalsContact O-N 3.1Å
581	F	88	Confident	87.3	Confident	96 Å²	96	81.1 Å²	81.1	42%	0.421	43%	0.431	S	S	.	.	H	α-helix	trans	-65.4	-43.9	-179.8	-167.8	-106.6	0	0	0	111.5	L116 F570 C577 K579 L584 M585	L116-F581 HydrophobicContact CD1-CE2 4.5Å; L116-F581 HydrophobicContact CD2-CD2 4.25Å; L116-F581 HydrophobicContact CD2-CE2 3.62Å; L116-F581 HydrophobicContact CD2-CZ 4.07Å; F570-F581 HydrophobicContact CE2-CB 4.41Å; C577-F581 PolarHBondContact O-N 3.48Å; K579-F581 VanDerWaalsContact C-N 3.32Å; K579-F581 PolarHBondContact O-N 3.47Å; F581-L584 PolarHBondContact O-N 2.89Å; F581-M585 HydrophobicContact CD1-CE 3.94Å; F581-M585 HydrophobicContact CD1-SD 3.7Å; F581-M585 HydrophobicContact CE1-CE 3.04Å; F581-M585 HydrophobicContact CE1-CG 4.44Å; F581-M585 HydrophobicContact CE1-SD 3.36Å; F581-M585 WeakPolarHBondContact CE1-SD 3.36Å; F581-M585 HydrophobicContact CE2-CE 4.01Å; F581-M585 HydrophobicContact CZ-CE 3.09Å; F581-M585 HydrophobicContact CZ-SD 4.01Å; F581-M585 WeakPolarHBondContact O-CG 3.49Å; F581-M585 PolarHBondContact O-N 2.79Å; F581-M585 VanDerWaalsContact O-N 3.11Å
582	R	89.2	Confident	87	Confident	138 Å²	138	75.5 Å²	75.5	52%	0.521	40%	0.404	S	S	.	.	H	α-helix	trans	-60.4	-48.4	174.5	-176.6	-179	178.6	-176.9	0	112	V578 K579 L584 M585 I586	V578-R582 WeakPolarHBondContact O-CB 3.42Å; V578-R582 PolarHBondContact O-N 3.07Å; K579-R582 PolarHBondContact O-N 3.11Å; R582-L584 PolarHBondContact O-N 2.79Å; R582-M585 PolarHBondContact O-N 2.81Å; R582-I586 HydrophobicContact CG-CD1 3.84Å; R582-I586 WeakPolarHBondContact O-CG1 3.36Å; R582-I586 PolarHBondContact O-N 3.19Å; R582-I586 VanDerWaalsContact O-N 3.12Å
583	D	88	Confident	86.9	Confident	67 Å²	67	70.6 Å²	70.6	36%	0.358	38%	0.379	S	S	.	.	H	α-helix	trans	-63.3	-27.2	-178.9	-65.3	-7.7	0	0	0	112	K579 R580	K579-D583 WeakPolarHBondContact CE-OD2 3.41Å; K579-D583 WeakPolarHBondContact CG-OD2 3.43Å; K579-D583 WeakPolarHBondContact O-CB 3.33Å; K579-D583 PolarHBondContact O-N 3.12Å; R580-D583 PolarHBondContact O-N 3.35Å
584	L	90.1	Very high	86.7	Confident	1 Å²	1	67.2 Å²	67.2	1%	0.005	38%	0.377	C	S	.	.	H	α-helix	trans	-85.5	-17.8	175.3	-71.1	172.6	0	0	0	114.2	P115 L116 N569 F570 R573 R580 F581 R582	P115-L584 HydrophobicContact CB-CD2 3.89Å; P115-L584 VanDerWaalsContact CD-O 3.3Å; P115-L584 WeakPolarHBondContact CD-O 3.34Å; L116-L584 HydrophobicContact CB-CB 4Å; L116-L584 WeakPolarHBondContact CB-O 3.43Å; L116-L584 HydrophobicContact CD1-CB 4.48Å; L116-L584 HydrophobicContact CD1-CD1 4.27Å; L116-L584 PolarHBondContact N-O 2.9Å; N569-L584 HydrophobicContact CB-CD1 4.4Å; N569-L584 HydrophobicContact CB-CD2 4.01Å; F570-L584 HydrophobicContact CB-CD1 4.02Å; F570-L584 HydrophobicContact CD2-CD1 4.27Å; R573-L584 HydrophobicContact CG-CD2 4Å; R573-L584 HydrophobicContact CG-CG 4.29Å; R580-L584 VanDerWaalsContact O-CG 3.3Å; R580-L584 WeakPolarHBondContact O-CG 3.3Å; R580-L584 PolarHBondContact O-N 2.83Å; R580-L584 VanDerWaalsContact O-N 3.1Å; F581-L584 PolarHBondContact O-N 2.89Å; R582-L584 PolarHBondContact O-N 2.79Å
585	M	89.6	Confident	86.6	Confident	55 Å²	55	63.3 Å²	63.3	27%	0.271	35%	0.348	S	S	.	.	H	α-helix	trans	-86.1	-23.3	174.4	-76.7	-175.8	155.8	0	0	112.5	L116 V486 F581 R582	L116-M585 HydrophobicContact CD2-CE 3.89Å; L116-M585 HydrophobicContact CD2-CG 4.17Å; V486-M585 HydrophobicContact CG1-CB 3.89Å; V486-M585 HydrophobicContact CG1-CE 4.4Å; V486-M585 HydrophobicContact CG1-CG 3.86Å; V486-M585 HydrophobicContact CG1-SD 4.33Å; F581-M585 HydrophobicContact CD1-CE 3.94Å; F581-M585 HydrophobicContact CD1-SD 3.7Å; F581-M585 HydrophobicContact CE1-CE 3.04Å; F581-M585 HydrophobicContact CE1-CG 4.44Å; F581-M585 HydrophobicContact CE1-SD 3.36Å; F581-M585 WeakPolarHBondContact CE1-SD 3.36Å; F581-M585 HydrophobicContact CE2-CE 4.01Å; F581-M585 HydrophobicContact CZ-CE 3.09Å; F581-M585 HydrophobicContact CZ-SD 4.01Å; F581-M585 WeakPolarHBondContact O-CG 3.49Å; F581-M585 PolarHBondContact O-N 2.79Å; F581-M585 VanDerWaalsContact O-N 3.11Å; R582-M585 PolarHBondContact O-N 2.81Å
586	I	89	Confident	86.3	Confident	44 Å²	44	62.4 Å²	62.4	23%	0.226	34%	0.336	C	S	.	.	S	Bend	trans	-77.9	138.3	176.2	-68.8	166.3	0	0	0	109.3	P115 R582 A651	P115-I586 WeakPolarHBondContact CD-O 3.18Å; R582-I586 HydrophobicContact CG-CD1 3.84Å; R582-I586 WeakPolarHBondContact O-CG1 3.36Å; R582-I586 PolarHBondContact O-N 3.19Å; R582-I586 VanDerWaalsContact O-N 3.12Å; I586-A651 HydrophobicContact CG2-CB 3.78Å
587	P	89.4	Confident	85.8	Confident	29 Å²	29	61.1 Å²	61.1	19%	0.188	33%	0.328	C	S	.	.	P	Polyproline II helix	trans	-56.2	143.5	171.7	-22.9	30.8	0	0	0	112.6	K112 V113 Y487 W591	K112-P587 WeakPolarHBondContact O-CA 3.36Å; V113-P587 WeakPolarHBondContact O-CA 3.39Å; V113-P587 WeakPolarHBondContact O-CG 3.09Å; Y487-P587 HydrophobicContact CD2-CG 3.77Å; Y487-P587 HydrophobicContact CE2-CG 3.69Å; P587-W591 HydrophobicContact CB-CB 3.81Å; P587-W591 HydrophobicContact CB-CG 3.83Å
588	E	86.5	Confident	85.6	Confident	66 Å²	66	57.9 Å²	57.9	31%	0.308	31%	0.305	S	S	.	.	P	Polyproline II helix	trans	-65.3	153.4	171.3	-59.8	-173.1	167.1	0	0	111	K112 P115 A590 W591	K112-E588 HydrophobicContact CB-CB 4.44Å; K112-E588 WeakPolarHBondContact CG-OE2 3.29Å; K112-E588 PolarHBondContact O-N 3.31Å; P115-E588 HydrophobicContact CG-CG 3.55Å; E588-A590 PolarHBondContact O-N 3.19Å; E588-W591 WeakPolarHBondContact O-CB 3.25Å; E588-W591 PolarHBondContact O-N 3.19Å
589	D	80.7	Confident	85.4	Confident	158 Å²	158	55.1 Å²	55.1	85%	0.845	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55	-23.7	177.1	-51.5	-25.2	0	0	0	113.5	W591 R599	D589-W591 VanDerWaalsContact C-N 3.34Å; D589-R599 PolarHBondContact O-NH1 3.32Å
590	A	80.3	Confident	84.8	Confident	41 Å²	41	49.9 Å²	49.9	34%	0.339	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.3	-8.7	176.6	0	0	0	0	0	114	K112 E588 R599	K112-A590 HydrophobicContact CD-CB 4.13Å; E588-A590 PolarHBondContact O-N 3.19Å; A590-R599 PolarHBondContact O-NH2 3.1Å
591	W	86.8	Confident	84.3	Confident	22 Å²	22	51.7 Å²	51.7	8%	0.083	27%	0.273	C	S	.	.			trans	-68.7	152.9	171.8	178.7	-110.2	0	0	0	110.9	L99 F102 V110 K112 V113 Y487 P587 E588 D589 R599	L99-W591 HydrophobicContact CD2-CH2 3.94Å; L99-W591 HydrophobicContact CD2-CZ2 4.3Å; F102-W591 HydrophobicContact CD1-CH2 4.28Å; F102-W591 AromaticContact CD1-CZ2 3.91Å; F102-W591 HydrophobicContact CD1-CZ2 3.91Å; F102-W591 HydrophobicContact CE1-CZ2 4.06Å; V110-W591 HydrophobicContact CG2-CH2 4.05Å; V110-W591 HydrophobicContact CG2-CZ3 3.82Å; V110-W591 WeakPolarHBondContact O-CZ3 3.44Å; K112-W591 HydrophobicContact CB-CB 4.5Å; K112-W591 HydrophobicContact CB-CE3 4.37Å; V113-W591 HydrophobicContact CB-CD2 3.71Å; V113-W591 HydrophobicContact CB-CE3 3.79Å; V113-W591 HydrophobicContact CB-CG 4.44Å; V113-W591 HydrophobicContact CB-CH2 3.8Å; V113-W591 HydrophobicContact CB-CZ2 3.71Å; V113-W591 HydrophobicContact CB-CZ3 3.84Å; V113-W591 HydrophobicContact CG1-CH2 4.49Å; V113-W591 HydrophobicContact CG2-CD2 4.11Å; V113-W591 HydrophobicContact CG2-CH2 4.17Å; V113-W591 HydrophobicContact CG2-CZ2 3.61Å; Y487-W591 AromaticContact CE2-NE1 3.5Å; Y487-W591 AromaticContact CZ-NE1 3.46Å; Y487-W591 PolarHBondContact OH-NE1 3.13Å; Y487-W591 VanDerWaalsContact OH-NE1 3.16Å; P587-W591 HydrophobicContact CB-CB 3.81Å; P587-W591 HydrophobicContact CB-CG 3.83Å; E588-W591 WeakPolarHBondContact O-CB 3.25Å; E588-W591 PolarHBondContact O-N 3.19Å; D589-W591 VanDerWaalsContact C-N 3.34Å; W591-R599 PolarHBondContact O-NH2 3.34Å
592	G	86.1	Confident	83.6	Confident	10 Å²	10	53.1 Å²	53.1	10%	0.103	28%	0.281	C	S	.	.	S	Bend	trans	114.1	-175.3	-175	0	0	0	0	0	112.8	A594	G592-A594 PolarHBondContact O-N 2.94Å
593	P	87.5	Confident	82.8	Confident	3 Å²	3	50.2 Å²	50.2	2%	0.019	27%	0.272	C	S	.	.			trans	-53.8	137.7	177	-24.8	33.7	0	0	0	111.7	F102 F331 W498 L595 H598 R599	F102-P593 HydrophobicContact CD2-CG 4.5Å; F102-P593 HydrophobicContact CE2-CG 3.82Å; F102-P593 HydrophobicContact CZ-CG 4.03Å; F102-P593 WeakPolarHBondContact O-CA 3.43Å; F331-P593 HydrophobicContact CD2-CB 4.44Å; F331-P593 HydrophobicContact CE2-CB 3.77Å; F331-P593 HydrophobicContact CE2-CG 3.83Å; F331-P593 HydrophobicContact CZ-CB 4.05Å; F331-P593 HydrophobicContact CZ-CG 3.74Å; W498-P593 HydrophobicContact CE3-CG 4.23Å; W498-P593 HydrophobicContact CH2-CG 3.81Å; W498-P593 HydrophobicContact CZ2-CG 4.13Å; W498-P593 HydrophobicContact CZ3-CG 3.84Å; P593-L595 VanDerWaalsContact C-N 3.34Å; P593-L595 PolarHBondContact O-N 3.08Å; P593-H598 HydrophobicContact CB-CB 3.62Å; P593-H598 HydrophobicContact CG-CB 4.3Å; P593-R599 HydrophobicContact CB-CG 4.08Å; P593-R599 HydrophobicContact CG-CG 4.29Å; P593-R599 PolarHBondContact O-NE 3.29Å; P593-R599 PolarHBondContact O-NH2 3.34Å; P593-R599 VanDerWaalsContact O-NH2 3.12Å
594	A	81.7	Confident	81.6	Confident	48 Å²	48	50.2 Å²	50.2	40%	0.397	28%	0.276	S	S	.	.	S	Bend	trans	-67.9	-34	-177.2	0	0	0	0	0	113.3	G592	G592-A594 PolarHBondContact O-N 2.94Å
595	L	81.4	Confident	79.9	Confident	23 Å²	23	55.9 Å²	55.9	12%	0.12	31%	0.306	C	S	.	.	S	Bend	trans	-93.8	135.2	-178.7	-64.1	169.5	0	0	0	110.3	P25 E35 N36 P593 V597 H598 R599	P25-L595 HydrophobicContact CG-CD2 4.24Å; E35-L595 HydrophobicContact CG-CD1 3.76Å; E35-L595 WeakPolarHBondContact O-CD1 3.27Å; N36-L595 HydrophobicContact CB-CD1 4.27Å; N36-L595 HydrophobicContact CB-CD2 4.47Å; P593-L595 VanDerWaalsContact C-N 3.34Å; P593-L595 PolarHBondContact O-N 3.08Å; L595-V597 PolarHBondContact O-N 2.98Å; L595-H598 PolarHBondContact O-N 2.96Å; L595-H598 VanDerWaalsContact O-N 3.14Å; L595-R599 PolarHBondContact O-N 3.31Å
596	A	75.6	Confident	78.3	Confident	25 Å²	25	56.9 Å²	56.9	21%	0.207	31%	0.31	C	S	.	.	H	α-helix	trans	-61	-32.9	178.4	0	0	0	0	0	112.5	Y24 H598 R599 A600	Y24-A596 HydrophobicContact CD1-CB 4.25Å; A596-H598 VanDerWaalsContact C-N 3.28Å; A596-H598 PolarHBondContact O-N 3.06Å; A596-R599 PolarHBondContact O-N 3.19Å; A596-A600 WeakPolarHBondContact O-CB 3.19Å; A596-A600 PolarHBondContact O-N 3.19Å
597	V	79.5	Confident	76.5	Confident	79 Å²	79	56.6 Å²	56.6	48%	0.479	31%	0.308	S	S	.	.	H	α-helix	trans	-55.9	-44.3	175	178.4	0	0	0	0	111	L595 A600	L595-V597 PolarHBondContact O-N 2.98Å; V597-A600 WeakPolarHBondContact O-CB 3.22Å; V597-A600 PolarHBondContact O-N 3.14Å
598	H	83.5	Confident	74.3	Confident	14 Å²	14	57.5 Å²	57.5	7%	0.065	31%	0.314	C	S	.	.	H	α-helix	trans	-70	-42.1	179.3	-62.4	-33.8	0	0	0	111.5	E35 F331 H332 W498 P593 L595 A596 A600 E601	E35-H598 IonicContact OE1-CD2 3.7Å; E35-H598 IonicContact OE1-CE1 3.39Å; E35-H598 PolarHBondContact OE1-CE1 3.16Å; E35-H598 IonicContact OE1-NE2 3.16Å; E35-H598 PolarHBondContact OE1-NE2 2.96Å; F331-H598 VanDerWaalsContact CB-CD2 3.41Å; F331-H598 WeakPolarHBondContact CB-CD2 3.42Å; F331-H598 WeakPolarHBondContact CB-NE2 3.37Å; F331-H598 HydrophobicContact CD1-CB 3.99Å; F331-H598 AromaticContact CD1-CD2 3.79Å; F331-H598 AromaticContact CD1-CG 3.59Å; F331-H598 AromaticContact CD1-ND1 3.82Å; F331-H598 HydrophobicContact CE1-CB 3.97Å; F331-H598 HydrophobicContact CG-CB 4.33Å; F331-H598 AromaticContact CG-CD2 3.48Å; F331-H598 VanDerWaalsContact CG-CD2 3.48Å; F331-H598 WeakPolarHBondContact CG-CD2 3.44Å; F331-H598 AromaticContact CG-CG 3.78Å; F331-H598 AromaticContact CG-NE2 3.8Å; F331-H598 HydrophobicContact CZ-CB 4.28Å; H332-H598 AromaticContact NE2-CE1 3.82Å; H332-H598 AromaticContact NE2-ND1 3.76Å; W498-H598 WeakPolarHBondContact CZ2-O 3.34Å; P593-H598 HydrophobicContact CB-CB 3.62Å; P593-H598 HydrophobicContact CG-CB 4.3Å; L595-H598 PolarHBondContact O-N 2.96Å; L595-H598 VanDerWaalsContact O-N 3.14Å; A596-H598 VanDerWaalsContact C-N 3.28Å; A596-H598 PolarHBondContact O-N 3.06Å; H598-A600 PolarHBondContact O-N 2.9Å; H598-E601 WeakPolarHBondContact O-CB 3.35Å; H598-E601 PolarHBondContact O-N 3.49Å
599	R	82.1	Confident	72.3	Confident	55 Å²	55	58.9 Å²	58.9	21%	0.208	32%	0.321	C	S	.	.	H	α-helix	trans	-57.2	-37.7	174.8	-63.3	-174.1	-177.2	-144.5	-9	112.3	D589 A590 W591 P593 L595 A596 E601 F603	D589-R599 PolarHBondContact O-NH1 3.32Å; A590-R599 PolarHBondContact O-NH2 3.1Å; W591-R599 PolarHBondContact O-NH2 3.34Å; P593-R599 HydrophobicContact CB-CG 4.08Å; P593-R599 HydrophobicContact CG-CG 4.29Å; P593-R599 PolarHBondContact O-NE 3.29Å; P593-R599 PolarHBondContact O-NH2 3.34Å; P593-R599 VanDerWaalsContact O-NH2 3.12Å; L595-R599 PolarHBondContact O-N 3.31Å; A596-R599 PolarHBondContact O-N 3.19Å; R599-E601 VanDerWaalsContact C-N 3.28Å; R599-E601 PolarHBondContact O-N 3.31Å; R599-F603 PolarHBondContact O-N 3.25Å; R599-F603 VanDerWaalsContact O-N 3.13Å
600	A	77.1	Confident	70.4	Confident	15 Å²	15	53.8 Å²	53.8	12%	0.124	30%	0.301	C	S	.	.	H	α-helix	trans	-69.2	-19.7	-178.1	0	0	0	0	0	114.8	A596 V597 H598 E602 F603 P604 I607	A596-A600 WeakPolarHBondContact O-CB 3.19Å; A596-A600 PolarHBondContact O-N 3.19Å; V597-A600 WeakPolarHBondContact O-CB 3.22Å; V597-A600 PolarHBondContact O-N 3.14Å; H598-A600 PolarHBondContact O-N 2.9Å; A600-E602 VanDerWaalsContact C-N 3.35Å; A600-E602 PolarHBondContact O-N 2.83Å; A600-F603 CarbonylContact O-C 3.59Å; A600-P604 VanDerWaalsContact O-CA 3.24Å; A600-P604 WeakPolarHBondContact O-CA 3.46Å; A600-P604 WeakPolarHBondContact O-CD 3.25Å; A600-P604 VanDerWaalsContact O-N 3.17Å; A600-I607 HydrophobicContact CB-CD1 3.23Å; A600-I607 HydrophobicContact CB-CG1 3.46Å; A600-I607 VanDerWaalsContact CB-CG1 3.46Å
601	E	79.1	Confident	68.6	Low	96 Å²	96	58.4 Å²	58.4	45%	0.449	31%	0.309	S	S	.	.	H	α-helix	trans	-62.8	-42.6	-179.1	-63	-177.8	152.2	0	0	112	H332 W498 H598 R599	H332-E601 IonicContact CE1-OE1 2.68Å; H332-E601 IonicContact CE1-OE2 2.71Å; H332-E601 PolarHBondContact CE1-OE2 2.93Å; H332-E601 VanDerWaalsContact CE1-OE2 3.28Å; H332-E601 IonicContact NE2-OE1 3.76Å; H332-E601 PolarHBondContact NE2-OE1 2.82Å; H332-E601 VanDerWaalsContact NE2-OE1 3.16Å; H332-E601 IonicContact NE2-OE2 2.73Å; W498-E601 PolarHBondContact NE1-OE2 3.47Å; H598-E601 WeakPolarHBondContact O-CB 3.35Å; H598-E601 PolarHBondContact O-N 3.49Å; R599-E601 VanDerWaalsContact C-N 3.28Å; R599-E601 PolarHBondContact O-N 3.31Å
602	E	72	Confident	66.3	Low	126 Å²	126	64.6 Å²	64.6	59%	0.589	34%	0.339	S	S	*	.	H	α-helix	trans	-96.1	-32.4	178.5	-162.1	68.4	-164.3	0	0	111.4	W498 A600 P604	W498-E602 HydrophobicContact CH2-CB 4.03Å; W498-E602 HydrophobicContact CZ2-CB 3.68Å; A600-E602 VanDerWaalsContact C-N 3.35Å; A600-E602 PolarHBondContact O-N 2.83Å; E602-P604 VanDerWaalsContact C-CD 3.47Å; E602-P604 WeakPolarHBondContact O-CD 3.49Å
603	F	72.1	Confident	64	Low	77 Å²	77	69.7 Å²	69.7	34%	0.338	37%	0.37	S	S	.	.			trans	-123.5	68.5	-176.8	-54.8	-73.6	0	0	0	112	W498 R599 A600 L605 Q606 T650	W498-F603 HydrophobicContact CH2-CD2 4.12Å; W498-F603 HydrophobicContact CH2-CE2 4.16Å; W498-F603 HydrophobicContact CZ3-CE2 4.41Å; R599-F603 PolarHBondContact O-N 3.25Å; R599-F603 VanDerWaalsContact O-N 3.13Å; A600-F603 CarbonylContact O-C 3.59Å; F603-L605 PolarHBondContact O-N 3.28Å; F603-Q606 HydrophobicContact CB-CG 3.9Å; F603-Q606 WeakPolarHBondContact O-CB 3.38Å; F603-Q606 PolarHBondContact O-N 3.02Å; F603-T650 HydrophobicContact CE1-CG2 4.29Å; F603-T650 HydrophobicContact CZ-CG2 4.47Å
604	P	63.2	Low	61.5	Low	68 Å²	68	76.8 Å²	76.8	44%	0.442	41%	0.407	S	S	.	.	G	3₁₀ helix	trans	-60.6	-25.8	-174	22.8	-34	0	0	0	113.4	A600 E602 Q606 I607 A610	A600-P604 VanDerWaalsContact O-CA 3.24Å; A600-P604 WeakPolarHBondContact O-CA 3.46Å; A600-P604 WeakPolarHBondContact O-CD 3.25Å; A600-P604 VanDerWaalsContact O-N 3.17Å; E602-P604 VanDerWaalsContact C-CD 3.47Å; E602-P604 WeakPolarHBondContact O-CD 3.49Å; P604-Q606 PolarHBondContact O-N 3.38Å; P604-I607 WeakPolarHBondContact O-CB 3.3Å; P604-I607 WeakPolarHBondContact O-CG1 3.32Å; P604-I607 PolarHBondContact O-N 3.06Å; P604-A610 VanDerWaalsContact O-CB 3.3Å; P604-A610 WeakPolarHBondContact O-CB 3.4Å
605	L	54.9	Low	59.1	Low	120 Å²	120	79.6 Å²	79.6	63%	0.628	42%	0.423	S	S	*	.	G	3₁₀ helix	trans	-71.8	-8.2	178.9	-64.3	172.6	0	0	0	114.3	F603 I607 R611	F603-L605 PolarHBondContact O-N 3.28Å; L605-I607 VanDerWaalsContact C-N 3.27Å; L605-R611 PolarHBondContact O-NE 2.88Å; L605-R611 PolarHBondContact O-NH2 3.07Å
606	Q	56.2	Low	56.7	Low	76 Å²	76	82.6 Å²	82.6	36%	0.355	45%	0.445	S	S	.	.	G	3₁₀ helix	trans	-77.4	-14.8	172.4	-67.8	-177.6	-10.7	0	0	112.4	F603 P604	F603-Q606 HydrophobicContact CB-CG 3.9Å; F603-Q606 WeakPolarHBondContact O-CB 3.38Å; F603-Q606 PolarHBondContact O-N 3.02Å; P604-Q606 PolarHBondContact O-N 3.38Å
607	I	50.5	Low	54.5	Low	37 Å²	37	90.7 Å²	90.7	19%	0.19	48%	0.479	C	S	.	.	S	Bend	trans	-78	126	175.5	-55.5	166	0	0	0	109.9	F26 A600 P604 L605 E609 A610	F26-I607 HydrophobicContact CZ-CG2 3.8Å; A600-I607 HydrophobicContact CB-CD1 3.23Å; A600-I607 HydrophobicContact CB-CG1 3.46Å; A600-I607 VanDerWaalsContact CB-CG1 3.46Å; P604-I607 WeakPolarHBondContact O-CB 3.3Å; P604-I607 WeakPolarHBondContact O-CG1 3.32Å; P604-I607 PolarHBondContact O-N 3.06Å; L605-I607 VanDerWaalsContact C-N 3.27Å; I607-E609 VanDerWaalsContact C-N 3.26Å; I607-E609 HydrophobicContact CG2-CB 4Å; I607-E609 WeakPolarHBondContact CG2-OE2 3.4Å; I607-E609 PolarHBondContact O-N 3.24Å; I607-A610 HydrophobicContact CB-CB 3.88Å; I607-A610 HydrophobicContact CD1-CB 4.4Å; I607-A610 HydrophobicContact CG2-CB 4.43Å; I607-A610 PolarHBondContact O-N 2.96Å
608	P	44.2	Very low	52.3	Low	48 Å²	48	93.8 Å²	93.8	31%	0.312	49%	0.49	S	S	.	.	S	Bend	trans	-54.6	-40.6	172.8	-24.5	33.4	0	0	0	113	Y24 R611	Y24-P608 HydrophobicContact CD1-CG 4.5Å; Y24-P608 VanDerWaalsContact CE1-CD 3.43Å; Y24-P608 HydrophobicContact CE1-CG 3.67Å; Y24-P608 HydrophobicContact CE2-CG 4.18Å; Y24-P608 VanDerWaalsContact CZ-CG 3.47Å; Y24-P608 WeakPolarHBondContact OH-CG 3.29Å; P608-R611 VanDerWaalsContact O-CB 3.22Å; P608-R611 WeakPolarHBondContact O-CB 3.48Å; P608-R611 PolarHBondContact O-N 2.89Å; P608-R611 VanDerWaalsContact O-N 3.13Å
609	E	42.9	Very low	49.6	Very low	96 Å²	96	102.6 Å²	102.6	45%	0.449	53%	0.531	S	S	.	.	G	3₁₀ helix	trans	-72.5	-27.8	-178.3	-60.5	80.2	-174.6	0	0	113.4	F26 I607 R611 E612	F26-E609 VanDerWaalsContact CE2-CD 3.42Å; F26-E609 VanDerWaalsContact CE2-OE1 3.27Å; F26-E609 WeakPolarHBondContact CE2-OE1 2.95Å; F26-E609 WeakPolarHBondContact CE2-OE2 3.22Å; F26-E609 VanDerWaalsContact CZ-OE2 3.27Å; F26-E609 WeakPolarHBondContact CZ-OE2 3.04Å; I607-E609 VanDerWaalsContact C-N 3.26Å; I607-E609 HydrophobicContact CG2-CB 4Å; I607-E609 WeakPolarHBondContact CG2-OE2 3.4Å; I607-E609 PolarHBondContact O-N 3.24Å; E609-R611 PolarHBondContact O-N 3.48Å; E609-E612 PolarHBondContact O-N 3Å
610	A	41.8	Very low	47.2	Very low	51 Å²	51	105.5 Å²	105.5	42%	0.421	56%	0.557	S	S	.	*	G	3₁₀ helix	trans	-70.7	-7.2	171.6	0	0	0	0	0	112.6	P604 I607	P604-A610 VanDerWaalsContact O-CB 3.3Å; P604-A610 WeakPolarHBondContact O-CB 3.4Å; I607-A610 HydrophobicContact CB-CB 3.88Å; I607-A610 HydrophobicContact CD1-CB 4.4Å; I607-A610 HydrophobicContact CG2-CB 4.43Å; I607-A610 PolarHBondContact O-N 2.96Å
611	R	42.9	Very low	44.9	Very low	138 Å²	138	111.7 Å²	111.7	52%	0.521	59%	0.587	S	S	.	*	G	3₁₀ helix	trans	-89.8	-8.4	174.5	-55.8	174	-179.2	-170.7	-0.7	112.7	L605 P608 E609 P613	L605-R611 PolarHBondContact O-NE 2.88Å; L605-R611 PolarHBondContact O-NH2 3.07Å; P608-R611 VanDerWaalsContact O-CB 3.22Å; P608-R611 WeakPolarHBondContact O-CB 3.48Å; P608-R611 PolarHBondContact O-N 2.89Å; P608-R611 VanDerWaalsContact O-N 3.13Å; E609-R611 PolarHBondContact O-N 3.48Å; R611-P613 WeakPolarHBondContact O-CD 3.29Å
612	E	37.6	Very low	42.7	Very low	151 Å²	151	115.8 Å²	115.8	71%	0.706	60%	0.604	S	S	*	*	S	Bend	trans	-84.7	117.1	172.8	-64.2	-167.8	169.8	0	0	109.5	E609 I614	E609-E612 PolarHBondContact O-N 3Å; E612-I614 PolarHBondContact O-N 3.38Å
613	P	37.3	Very low	40.9	Very low	117 Å²	117	115.3 Å²	115.3	76%	0.76	61%	0.612	S	S	*	*			trans	-62.6	124.5	169.2	26.2	-29.6	0	0	0	107	R611 S615	R611-P613 WeakPolarHBondContact O-CD 3.29Å; P613-S615 PolarHBondContact O-N 2.99Å
614	I	35.6	Very low	39.3	Very low	153 Å²	153	120.4 Å²	120.4	79%	0.785	64%	0.636	S	S	*	*			trans	-45.9	107.6	168.2	-62.1	166.4	0	0	0	106.2	E612 C616	E612-I614 PolarHBondContact O-N 3.38Å; I614-C616 PolarHBondContact O-N 3.01Å
615	S	31.9	Very low	37.8	Very low	106 Å²	106	125.9 Å²	125.9	74%	0.741	66%	0.655	S	S	*	*			trans	-67.5	90.6	168.6	53.5	0	0	0	0	104.9	P613 E617	P613-S615 PolarHBondContact O-N 2.99Å; S615-E617 VanDerWaalsContact C-N 3.31Å; S615-E617 PolarHBondContact O-N 3.35Å
616	C	31.2	Very low	37	Very low	87 Å²	87	126.1 Å²	126.1	59%	0.588	66%	0.662	S	S	*	*			trans	-57.9	104.5	164.3	-83.7	0	0	0	0	106.1	I614 M618	I614-C616 PolarHBondContact O-N 3.01Å; C616-M618 HydrophobicContact CB-CE 3.88Å; C616-M618 PolarHBondContact O-N 3.35Å
617	E	29.5	Very low	36	Very low	194 Å²	194	129.5 Å²	129.5	91%	0.907	68%	0.682	S	S	*	*			trans	-56.4	86.4	156.1	-72.1	-179.3	154.7	0	0	107.4	S615	S615-E617 VanDerWaalsContact C-N 3.31Å; S615-E617 PolarHBondContact O-N 3.35Å
618	M	32.4	Very low	35.1	Very low	144 Å²	144	137.8 Å²	137.8	71%	0.709	71%	0.711	S	S	*	*			trans	-127.8	100.4	160.1	-81.9	-172.2	-89.4	0	0	105.2	C616 P620	C616-M618 HydrophobicContact CB-CE 3.88Å; C616-M618 PolarHBondContact O-N 3.35Å; M618-P620 VanDerWaalsContact O-CD 3.24Å; M618-P620 WeakPolarHBondContact O-CD 3.49Å
619	E	27.4	Very low	35	Very low	199 Å²	199	141 Å²	141	93%	0.93	73%	0.73	S	S	*	*			trans	-48.9	132.3	158.4	-76.8	177.5	130.4	0	0	108.5
620	P	30.6	Very low	34.7	Very low	116 Å²	116	144.6 Å²	144.6	75%	0.753	75%	0.747	S	S	*	*				-142.3	150.2	124	28.9	-10.2	0	0	0	114.1	M618	M618-P620 VanDerWaalsContact O-CD 3.24Å; M618-P620 WeakPolarHBondContact O-CD 3.49Å
621	L	29.8	Very low	34.7	Very low	145 Å²	145	148 Å²	148	76%	0.759	76%	0.758	S	S	*	*			trans	-34.5	145.7	171.8	-84.1	70.2	0	0	0	115.6
622	F	33.7	Very low	34.3	Very low	183 Å²	183	148 Å²	148	80%	0.803	77%	0.766	S	S	*	*			trans	101.8	114.6	160.9	-58.2	-70	0	0	0	116.5
623	P	33.4	Very low	34.5	Very low	116 Å²	116	148.8 Å²	148.8	75%	0.753	77%	0.769	S	S	*	*			trans	-90.1	119.7	176.9	34.5	-26.8	0	0	0	109.7
624	H	37.6	Very low	34.7	Very low	184 Å²	184	147.9 Å²	147.9	85%	0.852	76%	0.762	S	S	*	*			trans	-130.6	115.8	153.8	-93.3	-67.5	0	0	0	109.8	V626	H624-V626 PolarHBondContact O-N 3.08Å
625	H	32.4	Very low	34.8	Very low	182 Å²	182	146 Å²	146	84%	0.843	75%	0.753	S	S	*	*			trans	-47.4	122.9	168.7	-90.4	-87.5	0	0	0	111.4
626	V	38.7	Very low	35	Very low	126 Å²	126	146.1 Å²	146.1	76%	0.764	75%	0.745	S	S	*	*			trans	-133.6	117.1	154.4	-179.4	0	0	0	0	107.1	H624 R628	H624-V626 PolarHBondContact O-N 3.08Å; V626-R628 PolarHBondContact O-N 3.4Å
627	D	34.5	Very low	35.3	Very low	147 Å²	147	144 Å²	144	79%	0.786	74%	0.737	S	S	*	*			trans	-54.2	116.6	174.5	-71.9	-46.4	0	0	0	110.6
628	R	32.7	Very low	35.8	Very low	210 Å²	210	137 Å²	137	79%	0.792	71%	0.71	S	S	*	*			trans	-121.7	81.2	169.7	-85.6	-171.4	-178.1	171.1	2.5	108.8	V626	V626-R628 PolarHBondContact O-N 3.4Å
629	T	40.4	Very low	35.9	Very low	115 Å²	115	136.5 Å²	136.5	71%	0.706	70%	0.701	S	S	*	*	S	Bend	trans	-126.5	-4.9	170.9	37.4	0	0	0	0	114.1
630	E	38.6	Very low	36.7	Very low	173 Å²	173	132.6 Å²	132.6	81%	0.808	69%	0.685	S	S	*	*	S	Bend	trans	-110.5	-11.1	-178.9	-71	-173.7	156.7	0	0	115.5
631	D	40.1	Very low	37	Very low	122 Å²	122	135 Å²	135	65%	0.652	68%	0.684	S	S	*	*	H	α-helix	trans	-96	-6.8	-178.5	-70.8	-31.7	0	0	0	114.9
632	M	36.1	Very low	37.4	Very low	139 Å²	139	135.4 Å²	135.4	69%	0.685	68%	0.675	S	S	*	*	H	α-helix	trans	-84.4	-31.9	-180	-92.5	-162.6	-68.6	0	0	113.9	N636	M632-N636 PolarHBondContact O-N 3.4Å; M632-N636 VanDerWaalsContact O-N 3.14Å
633	E	40	Very low	37.6	Very low	167 Å²	167	129.2 Å²	129.2	78%	0.78	65%	0.65	S	S	*	*	H	α-helix	trans	-75.2	-34.3	-178.1	-73.5	-170.4	155	0	0	112.7	G637	E633-G637 PolarHBondContact O-N 3.31Å; E633-G637 VanDerWaalsContact O-N 3.17Å
634	T	42	Very low	37.8	Very low	98 Å²	98	128 Å²	128	60%	0.601	64%	0.638	S	S	*	*	H	α-helix	trans	-72.4	-32.8	175.4	43.9	0	0	0	0	112.2	S638	T634-S638 PolarHBondContact O-N 3.08Å
635	L	37.7	Very low	37.6	Very low	113 Å²	113	127 Å²	127	59%	0.592	63%	0.626	S	S	*	*	H	α-helix	trans	-68.2	-43.9	173.9	-135.6	86.4	0	0	0	111.3	G637 S638 Y639	L635-G637 PolarHBondContact O-N 2.94Å; L635-S638 PolarHBondContact O-N 3.19Å; L635-Y639 WeakPolarHBondContact O-CB 3.24Å; L635-Y639 PolarHBondContact O-N 2.94Å
636	N	36.9	Very low	37.9	Very low	109 Å²	109	122.1 Å²	122.1	58%	0.583	61%	0.609	S	S	*	*	H	α-helix	trans	-62.4	-41.2	178.1	-94.1	-12.6	0	0	0	112.5	M632 S638 Y639 I640	M632-N636 PolarHBondContact O-N 3.4Å; M632-N636 VanDerWaalsContact O-N 3.14Å; N636-S638 PolarHBondContact O-N 3.39Å; N636-Y639 PolarHBondContact O-N 3.39Å; N636-I640 WeakPolarHBondContact O-CG1 3.24Å; N636-I640 PolarHBondContact O-N 2.96Å
637	G	37.6	Very low	37.9	Very low	41 Å²	41	120 Å²	120	42%	0.423	59%	0.593	S	S	.	*	H	α-helix	trans	-66.5	-33.6	176.1	0	0	0	0	0	113.9	E633 L635	E633-G637 PolarHBondContact O-N 3.31Å; E633-G637 VanDerWaalsContact O-N 3.17Å; L635-G637 PolarHBondContact O-N 2.94Å
638	S	38.8	Very low	38	Very low	47 Å²	47	120.8 Å²	120.8	33%	0.329	59%	0.585	S	S	.	*	H	α-helix	trans	-73.3	-30.1	173	170.4	0	0	0	0	112.7	T634 L635 N636 R642	T634-S638 PolarHBondContact O-N 3.08Å; L635-S638 PolarHBondContact O-N 3.19Å; N636-S638 PolarHBondContact O-N 3.39Å; S638-R642 PolarHBondContact O-N 3.2Å; S638-R642 PolarHBondContact OG-NH2 3.07Å
639	Y	35.3	Very low	38.1	Very low	134 Å²	134	116.3 Å²	116.3	53%	0.525	57%	0.573	S	S	.	*	H	α-helix	trans	-78	-43.8	-176.3	-125.3	-96.8	0	0	0	111.8	L635 N636 K641 R642 L643	L635-Y639 WeakPolarHBondContact O-CB 3.24Å; L635-Y639 PolarHBondContact O-N 2.94Å; N636-Y639 PolarHBondContact O-N 3.39Å; Y639-K641 VanDerWaalsContact C-N 3.29Å; Y639-K641 PolarHBondContact O-N 3.02Å; Y639-R642 WeakPolarHBondContact O-CB 3.45Å; Y639-R642 PolarHBondContact O-N 2.78Å; Y639-L643 HydrophobicContact CD1-CD1 4.46Å; Y639-L643 PolarHBondContact O-N 3.42Å
640	I	43.1	Very low	38	Very low	117 Å²	117	114.5 Å²	114.5	60%	0.6	56%	0.562	S	S	*	*	H	α-helix	trans	-60.7	-40.8	176.4	-66.1	170.7	0	0	0	110.5	N636 R642 L643 D644	N636-I640 WeakPolarHBondContact O-CG1 3.24Å; N636-I640 PolarHBondContact O-N 2.96Å; I640-R642 VanDerWaalsContact C-N 3.27Å; I640-R642 PolarHBondContact O-N 3.27Å; I640-L643 PolarHBondContact O-N 3.24Å; I640-D644 WeakPolarHBondContact O-CB 3.41Å; I640-D644 PolarHBondContact O-N 3.46Å; I640-D644 VanDerWaalsContact O-N 3.08Å
641	K	38.9	Very low	38	Very low	167 Å²	167	107.8 Å²	107.8	73%	0.726	54%	0.537	S	S	*	.	H	α-helix	trans	-67.7	-23	174.5	-77.8	-177.1	178.1	176.6	0	114.3	Y639	Y639-K641 VanDerWaalsContact C-N 3.29Å; Y639-K641 PolarHBondContact O-N 3.02Å
642	R	37	Very low	37.5	Very low	153 Å²	153	109.4 Å²	109.4	58%	0.577	54%	0.543	S	S	*	.	H	α-helix	trans	-81.8	-38.1	175.9	-105	-176	-90	-167.8	-5.7	111.4	S638 Y639 I640 R645 V646	S638-R642 PolarHBondContact O-N 3.2Å; S638-R642 PolarHBondContact OG-NH2 3.07Å; Y639-R642 WeakPolarHBondContact O-CB 3.45Å; Y639-R642 PolarHBondContact O-N 2.78Å; I640-R642 VanDerWaalsContact C-N 3.27Å; I640-R642 PolarHBondContact O-N 3.27Å; R642-R645 WeakPolarHBondContact O-CB 3.49Å; R642-R645 PolarHBondContact O-N 3.2Å; R642-R645 VanDerWaalsContact O-N 3.16Å; R642-V646 WeakPolarHBondContact O-CG2 3.41Å; R642-V646 PolarHBondContact O-N 3.47Å
643	L	37.3	Very low	37.6	Very low	54 Å²	54	107.9 Å²	107.9	28%	0.283	54%	0.536	S	S	.	.	H	α-helix	trans	-62.1	-46.1	172.6	-79.3	156.7	0	0	0	111.5	Y639 I640 R645 V646 D647	Y639-L643 HydrophobicContact CD1-CD1 4.46Å; Y639-L643 PolarHBondContact O-N 3.42Å; I640-L643 PolarHBondContact O-N 3.24Å; L643-R645 PolarHBondContact O-N 2.94Å; L643-V646 PolarHBondContact O-N 3.24Å; L643-V646 VanDerWaalsContact O-N 3.14Å; L643-D647 PolarHBondContact O-N 3.36Å
644	D	37.6	Very low	37.5	Very low	90 Å²	90	104.8 Å²	104.8	48%	0.481	52%	0.524	S	S	.	.	H	α-helix	trans	-62.6	-17.9	175.8	-140.1	26.8	0	0	0	113.1	I640 R648	I640-D644 WeakPolarHBondContact O-CB 3.41Å; I640-D644 PolarHBondContact O-N 3.46Å; I640-D644 VanDerWaalsContact O-N 3.08Å; D644-R648 WeakPolarHBondContact O-CB 3.41Å; D644-R648 WeakPolarHBondContact O-CD 3.46Å; D644-R648 VanDerWaalsContact O-CG 3.25Å; D644-R648 WeakPolarHBondContact O-CG 3.49Å
645	R	34.4	Very low	37.2	Very low	163 Å²	163	105.2 Å²	105.2	62%	0.615	52%	0.519	S	S	*	.	H	α-helix	trans	-91.1	-39.7	176	-169.4	179.1	-173	166.5	9.5	112.2	R642 L643 R648 E649	R642-R645 WeakPolarHBondContact O-CB 3.49Å; R642-R645 PolarHBondContact O-N 3.2Å; R642-R645 VanDerWaalsContact O-N 3.16Å; L643-R645 PolarHBondContact O-N 2.94Å; R645-R648 PolarHBondContact O-N 3.17Å; R645-E649 HydrophobicContact CG-CG 4.46Å; R645-E649 WeakPolarHBondContact CG-OE1 3.38Å; R645-E649 IonicContact CZ-OE1 3.81Å; R645-E649 IonicContact NE-OE1 2.96Å; R645-E649 PolarHBondContact NE-OE1 3.36Å; R645-E649 IonicContact NH2-OE1 3.89Å; R645-E649 WeakPolarHBondContact O-CB 3.49Å; R645-E649 WeakPolarHBondContact O-CG 3.17Å; R645-E649 PolarHBondContact O-N 3.38Å
646	V	39.1	Very low	37.2	Very low	79 Å²	79	104.7 Å²	104.7	48%	0.479	52%	0.515	S	S	.	.	H	α-helix	trans	-66.5	-44	176.2	174.6	0	0	0	0	110.2	R642 L643 R648 E649 T650	R642-V646 WeakPolarHBondContact O-CG2 3.41Å; R642-V646 PolarHBondContact O-N 3.47Å; L643-V646 PolarHBondContact O-N 3.24Å; L643-V646 VanDerWaalsContact O-N 3.14Å; V646-R648 PolarHBondContact O-N 3.05Å; V646-E649 PolarHBondContact O-N 3.41Å; V646-E649 VanDerWaalsContact O-N 3.1Å; V646-T650 PolarHBondContact O-N 3.24Å; V646-T650 PolarHBondContact O-OG1 3.14Å
647	D	38.8	Very low	37.2	Very low	81 Å²	81	104.4 Å²	104.4	43%	0.433	51%	0.511	S	S	.	.	H	α-helix	trans	-63.5	-28.1	176	-70.3	-26.1	0	0	0	112.4	L643 T650 A651	L643-D647 PolarHBondContact O-N 3.36Å; D647-T650 PolarHBondContact O-OG1 3.33Å; D647-A651 WeakPolarHBondContact O-CB 3.47Å
648	R	35.6	Very low	37.2	Very low	165 Å²	165	108.7 Å²	108.7	62%	0.623	52%	0.517	S	S	*	.	H	α-helix	trans	-83.1	-25	174.4	-79.8	-176.5	-172.8	177.6	11.3	114.4	D644 R645 V646	D644-R648 WeakPolarHBondContact O-CB 3.41Å; D644-R648 WeakPolarHBondContact O-CD 3.46Å; D644-R648 VanDerWaalsContact O-CG 3.25Å; D644-R648 WeakPolarHBondContact O-CG 3.49Å; R645-R648 PolarHBondContact O-N 3.17Å; V646-R648 PolarHBondContact O-N 3.05Å
649	E	34.7	Very low	37.1	Very low	115 Å²	115	113.1 Å²	113.1	54%	0.537	53%	0.53	S	S	.	.	H	α-helix	trans	-85.5	-19.8	178.2	-75.8	175.6	-172.6	0	0	111.5	R645 V646	R645-E649 HydrophobicContact CG-CG 4.46Å; R645-E649 WeakPolarHBondContact CG-OE1 3.38Å; R645-E649 IonicContact CZ-OE1 3.81Å; R645-E649 IonicContact NE-OE1 2.96Å; R645-E649 PolarHBondContact NE-OE1 3.36Å; R645-E649 IonicContact NH2-OE1 3.89Å; R645-E649 WeakPolarHBondContact O-CB 3.49Å; R645-E649 WeakPolarHBondContact O-CG 3.17Å; R645-E649 PolarHBondContact O-N 3.38Å; V646-E649 PolarHBondContact O-N 3.41Å; V646-E649 VanDerWaalsContact O-N 3.1Å
650	T	39.7	Very low	37.2	Very low	77 Å²	77	111.5 Å²	111.5	47%	0.472	53%	0.53	S	S	.	.	S	Bend	trans	-88.3	-7.6	169.4	48.7	0	0	0	0	114.4	F603 V646 D647	F603-T650 HydrophobicContact CE1-CG2 4.29Å; F603-T650 HydrophobicContact CZ-CG2 4.47Å; V646-T650 PolarHBondContact O-N 3.24Å; V646-T650 PolarHBondContact O-OG1 3.14Å; D647-T650 PolarHBondContact O-OG1 3.33Å
651	A	36.6	Very low	36.8	Very low	33 Å²	33	111 Å²	111	27%	0.273	53%	0.525	S	S	.	.			trans	-100	10.4	178.5	0	0	0	0	0	113.7	I586 D647	I586-A651 HydrophobicContact CG2-CB 3.78Å; D647-A651 WeakPolarHBondContact O-CB 3.47Å
652	I	31.6	Very low	36.6	Very low	155 Å²	155	105.9 Å²	105.9	80%	0.795	51%	0.506	S	S	*	.			trans	-116.3	0	170.8	-58.8	173.4	0	0	0	106.7

Retrieved 652 of 652 residues in 1611.5 ms (Link to these results)

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