G4VIY8_SCHMA Loading...

Putative biogenic amine (Dopamine) receptor

AlphaFold DB , UniProt , Accession G4VIY8, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 551 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	40.6	Very low	38.1	Very low	217 Å²	217	137.8 Å²	137.8	100%	1.069	69%	0.694	S	S	*	*				0	-38.8	0	-78.6	-179.6	-158.6	0	0	115.3
2	K	36.1	Very low	38	Very low	201 Å²	201	137.7 Å²	137.7	87%	0.874	68%	0.679	S	S	*	*			trans	-83.2	-11	179.1	-78.9	-175.8	176.2	180	0	116.8
3	Q	37.1	Very low	38.1	Very low	177 Å²	177	137.5 Å²	137.5	83%	0.827	68%	0.675	S	S	*	*	S	Bend	trans	-99	-1.6	-178.4	-87.8	-171.2	-19.7	0	0	115.6
4	V	39.9	Very low	37.9	Very low	101 Å²	101	135.3 Å²	135.3	61%	0.612	67%	0.668	S	S	*	*	G	3₁₀ helix	trans	-84.5	-14.3	179.9	179.1	0	0	0	0	112.4	L6	V4-L6 PolarHBondContact O-N 3.31Å
5	F	37	Very low	38.1	Very low	145 Å²	145	133.7 Å²	133.7	64%	0.636	66%	0.658	S	S	*	*	G	3₁₀ helix	trans	-84	2.2	-177.2	-86.3	-78.9	0	0	0	116
6	L	40.2	Very low	38	Very low	134 Å²	134	135.1 Å²	135.1	70%	0.702	66%	0.655	S	S	*	*	G	3₁₀ helix	trans	-102	3.3	-171.2	-75.4	169.7	0	0	0	115.4	V4	V4-L6 PolarHBondContact O-N 3.31Å
7	N	36.2	Very low	38	Very low	132 Å²	132	137.9 Å²	137.9	71%	0.706	66%	0.657	S	S	*	*	S	Bend	trans	-127.3	24.1	-176.7	-123.1	-1.1	0	0	0	114.3
8	D	40.6	Very low	38	Very low	74 Å²	74	137.3 Å²	137.3	40%	0.396	66%	0.656	S	S	.	*			trans	-104.6	24.9	-175.6	-136	1.2	0	0	0	112.7	S10 F11 R12	D8-S10 VanDerWaalsContact C-N 3.27Å; D8-S10 PolarHBondContact O-N 2.88Å; D8-F11 PolarHBondContact O-N 3.48Å; D8-F11 VanDerWaalsContact OD1-CB 3.29Å; D8-F11 WeakPolarHBondContact OD1-CB 3.45Å; D8-R12 WeakPolarHBondContact O-CB 3.38Å; D8-R12 PolarHBondContact O-N 3.38Å
9	N	36.8	Very low	38.2	Very low	117 Å²	117	136.8 Å²	136.8	63%	0.626	65%	0.653	S	S	*	*	H	α-helix	trans	-66.4	-24.8	-173.2	-76.9	-11.4	0	0	0	113.4	E13	N9-E13 VanDerWaalsContact O-CB 3.29Å; N9-E13 WeakPolarHBondContact O-CB 3.43Å; N9-E13 WeakPolarHBondContact O-CG 3.48Å; N9-E13 PolarHBondContact O-N 2.94Å
10	S	37.9	Very low	38.4	Very low	88 Å²	88	132.6 Å²	132.6	62%	0.615	64%	0.636	S	S	*	*	H	α-helix	trans	-86.3	-25.3	177.5	65.6	0	0	0	0	113.9	D8	D8-S10 VanDerWaalsContact C-N 3.27Å; D8-S10 PolarHBondContact O-N 2.88Å
11	F	36.9	Very low	38.5	Very low	130 Å²	130	130.1 Å²	130.1	57%	0.57	63%	0.631	S	S	*	*	H	α-helix	trans	-81.4	-40.5	172.7	-157.3	-96.9	0	0	0	110.3	D8 E13 N14 E15	D8-F11 PolarHBondContact O-N 3.48Å; D8-F11 VanDerWaalsContact OD1-CB 3.29Å; D8-F11 WeakPolarHBondContact OD1-CB 3.45Å; F11-E13 VanDerWaalsContact C-N 3.31Å; F11-E13 PolarHBondContact O-N 2.94Å; F11-N14 PolarHBondContact O-N 3.3Å; F11-N14 VanDerWaalsContact O-N 3.15Å; F11-E15 PolarHBondContact O-N 3.4Å
12	R	36.8	Very low	38.8	Very low	136 Å²	136	125.3 Å²	125.3	51%	0.513	61%	0.606	S	S	.	*	H	α-helix	trans	-66.1	-29.8	173.3	-155.5	-177.7	-80.6	-155.4	-2.9	112.2	D8 Y16	D8-R12 WeakPolarHBondContact O-CB 3.38Å; D8-R12 PolarHBondContact O-N 3.38Å; R12-Y16 WeakPolarHBondContact O-CB 3.49Å; R12-Y16 PolarHBondContact O-N 3.27Å
13	E	38.7	Very low	39.4	Very low	136 Å²	136	118.1 Å²	118.1	64%	0.636	58%	0.584	S	S	*	*	H	α-helix	trans	-67.1	-36	170.6	-98	-176.3	152.1	0	0	113.1	N9 F11 R17	N9-E13 VanDerWaalsContact O-CB 3.29Å; N9-E13 WeakPolarHBondContact O-CB 3.43Å; N9-E13 WeakPolarHBondContact O-CG 3.48Å; N9-E13 PolarHBondContact O-N 2.94Å; F11-E13 VanDerWaalsContact C-N 3.31Å; F11-E13 PolarHBondContact O-N 2.94Å; E13-R17 WeakPolarHBondContact O-CB 3.23Å; E13-R17 PolarHBondContact O-N 3.05Å
14	N	36.3	Very low	39.8	Very low	106 Å²	106	115 Å²	115	57%	0.567	57%	0.573	S	S	*	*	H	α-helix	trans	-76.9	-36	177.1	-79.6	-32.3	0	0	0	112	F11 R17 M18	F11-N14 PolarHBondContact O-N 3.3Å; F11-N14 VanDerWaalsContact O-N 3.15Å; N14-R17 PolarHBondContact O-N 2.93Å; N14-M18 WeakPolarHBondContact O-CB 3.42Å; N14-M18 PolarHBondContact O-N 3.41Å
15	E	40	Very low	40.3	Very low	112 Å²	112	113.6 Å²	113.6	52%	0.523	56%	0.564	S	S	.	*	H	α-helix	trans	-67.9	-42.4	173.3	-157.5	166.3	-156.8	0	0	110.9	F11 R17 M18 E19	F11-E15 PolarHBondContact O-N 3.4Å; E15-R17 PolarHBondContact O-N 3.33Å; E15-M18 PolarHBondContact O-N 3.4Å; E15-E19 WeakPolarHBondContact O-CG 3.4Å; E15-E19 PolarHBondContact O-N 2.66Å
16	Y	36.4	Very low	40.8	Very low	156 Å²	156	110.4 Å²	110.4	61%	0.612	56%	0.561	S	S	*	*	H	α-helix	trans	-67.6	-34.7	173.5	-165	-97.8	0	0	0	112.6	R12 M18 T20	R12-Y16 WeakPolarHBondContact O-CB 3.49Å; R12-Y16 PolarHBondContact O-N 3.27Å; Y16-M18 VanDerWaalsContact C-N 3.31Å; Y16-T20 HydrophobicContact CD1-CG2 4.03Å; Y16-T20 HydrophobicContact CE1-CG2 3.79Å; Y16-T20 WeakPolarHBondContact O-CB 3.32Å; Y16-T20 WeakPolarHBondContact O-CG2 3.23Å; Y16-T20 PolarHBondContact O-N 3.03Å; Y16-T20 PolarHBondContact O-OG1 3.42Å
17	R	37.9	Very low	41.2	Very low	182 Å²	182	108.7 Å²	108.7	69%	0.687	56%	0.559	S	S	*	*	H	α-helix	trans	-70.3	-28.9	174.1	-164.4	-179.3	-84.3	-157.9	-1.7	111.7	E13 N14 E15 T20 C21	E13-R17 WeakPolarHBondContact O-CB 3.23Å; E13-R17 PolarHBondContact O-N 3.05Å; N14-R17 PolarHBondContact O-N 2.93Å; E15-R17 PolarHBondContact O-N 3.33Å; R17-T20 VanDerWaalsContact CA-OG1 3.26Å; R17-T20 WeakPolarHBondContact CA-OG1 3.48Å; R17-T20 PolarHBondContact O-OG1 3.36Å; R17-C21 WeakPolarHBondContact O-CB 3.29Å; R17-C21 PolarHBondContact O-N 3.38Å
18	M	38.1	Very low	41.9	Very low	128 Å²	128	107.8 Å²	107.8	63%	0.631	56%	0.558	S	S	*	*	H	α-helix	trans	-76.7	-44.1	173.9	-155.1	164.3	170.9	0	0	111	N14 E15 Y16 T20 C21 H22	N14-M18 WeakPolarHBondContact O-CB 3.42Å; N14-M18 PolarHBondContact O-N 3.41Å; E15-M18 PolarHBondContact O-N 3.4Å; Y16-M18 VanDerWaalsContact C-N 3.31Å; M18-T20 PolarHBondContact O-N 3.34Å; M18-C21 WeakPolarHBondContact O-CB 3.37Å; M18-C21 PolarHBondContact O-N 3.39Å; M18-C21 VanDerWaalsContact O-N 3.15Å; M18-H22 PolarHBondContact O-CD2 2.71Å; M18-H22 VanDerWaalsContact O-CD2 3.29Å; M18-H22 PolarHBondContact O-N 3.01Å
19	E	42.5	Very low	42.2	Very low	128 Å²	128	106.1 Å²	106.1	60%	0.598	55%	0.549	S	S	*	.	H	α-helix	trans	-62.4	-38.9	173.4	-75.2	-175.9	156.8	0	0	112.7	E15 C21 H22 A23	E15-E19 WeakPolarHBondContact O-CG 3.4Å; E15-E19 PolarHBondContact O-N 2.66Å; E19-C21 VanDerWaalsContact C-N 3.33Å; E19-C21 PolarHBondContact O-N 3.43Å; E19-H22 PolarHBondContact O-N 3.07Å; E19-A23 PolarHBondContact O-N 3.38Å
20	T	42.6	Very low	42.9	Very low	52 Å²	52	105.6 Å²	105.6	32%	0.319	55%	0.554	S	S	.	*	H	α-helix	trans	-71.2	-25.6	174.4	46.8	0	0	0	0	113.2	Y16 R17 M18 N24	Y16-T20 HydrophobicContact CD1-CG2 4.03Å; Y16-T20 HydrophobicContact CE1-CG2 3.79Å; Y16-T20 WeakPolarHBondContact O-CB 3.32Å; Y16-T20 WeakPolarHBondContact O-CG2 3.23Å; Y16-T20 PolarHBondContact O-N 3.03Å; Y16-T20 PolarHBondContact O-OG1 3.42Å; R17-T20 VanDerWaalsContact CA-OG1 3.26Å; R17-T20 WeakPolarHBondContact CA-OG1 3.48Å; R17-T20 PolarHBondContact O-OG1 3.36Å; M18-T20 PolarHBondContact O-N 3.34Å; T20-N24 WeakPolarHBondContact O-CB 3.43Å; T20-N24 PolarHBondContact O-N 2.9Å
21	C	40.6	Very low	43.7	Very low	80 Å²	80	107 Å²	107	54%	0.541	56%	0.564	S	S	.	*	H	α-helix	trans	-70.1	-42.4	170.6	-132.5	0	0	0	0	111.2	R17 M18 E19 A23 N24 V25	R17-C21 WeakPolarHBondContact O-CB 3.29Å; R17-C21 PolarHBondContact O-N 3.38Å; M18-C21 WeakPolarHBondContact O-CB 3.37Å; M18-C21 PolarHBondContact O-N 3.39Å; M18-C21 VanDerWaalsContact O-N 3.15Å; E19-C21 VanDerWaalsContact C-N 3.33Å; E19-C21 PolarHBondContact O-N 3.43Å; C21-A23 VanDerWaalsContact C-N 3.32Å; C21-A23 PolarHBondContact O-N 3.5Å; C21-N24 PolarHBondContact O-N 2.84Å; C21-V25 WeakPolarHBondContact O-CG2 3.4Å; C21-V25 PolarHBondContact O-N 3.33Å
22	H	46.7	Very low	44.7	Very low	117 Å²	117	103.7 Å²	103.7	54%	0.542	55%	0.554	S	S	.	*	H	α-helix	trans	-61.9	-38.2	173.3	-82.2	-84.1	0	0	0	112.2	M18 E19 S26	M18-H22 PolarHBondContact O-CD2 2.71Å; M18-H22 VanDerWaalsContact O-CD2 3.29Å; M18-H22 PolarHBondContact O-N 3.01Å; E19-H22 PolarHBondContact O-N 3.07Å; H22-S26 WeakPolarHBondContact O-CB 3.31Å; H22-S26 PolarHBondContact O-N 2.87Å; H22-S26 PolarHBondContact O-OG 2.96Å
23	A	48.9	Very low	45.8	Very low	50 Å²	50	102.7 Å²	102.7	41%	0.413	56%	0.559	S	S	.	*	H	α-helix	trans	-67.7	-38.7	175.8	0	0	0	0	0	113.2	E19 C21 S26 C27	E19-A23 PolarHBondContact O-N 3.38Å; C21-A23 VanDerWaalsContact C-N 3.32Å; C21-A23 PolarHBondContact O-N 3.5Å; A23-S26 WeakPolarHBondContact O-CB 3.35Å; A23-S26 PolarHBondContact O-N 3.44Å; A23-C27 PolarHBondContact O-N 3.33Å; A23-C27 PolarHBondContact O-SG 3.44Å; A23-C27 VanDerWaalsContact O-SG 3.4Å
24	N	45.5	Very low	47.3	Very low	112 Å²	112	99.9 Å²	99.9	60%	0.599	56%	0.555	S	S	*	*	H	α-helix	trans	-77.2	-30.5	-179.1	-77.8	-15.6	0	0	0	113.9	T20 C21 S26 C27 T28	T20-N24 WeakPolarHBondContact O-CB 3.43Å; T20-N24 PolarHBondContact O-N 2.9Å; C21-N24 PolarHBondContact O-N 2.84Å; N24-S26 VanDerWaalsContact C-N 3.29Å; N24-C27 PolarHBondContact O-N 2.96Å; N24-T28 PolarHBondContact O-N 3.15Å; N24-T28 PolarHBondContact O-OG1 2.85Å
25	V	49.4	Very low	49.1	Very low	70 Å²	70	99.5 Å²	99.5	42%	0.424	55%	0.553	S	S	.	*	H	α-helix	trans	-66.5	-36.5	169.7	174.2	0	0	0	0	110.2	C21 C27 L29	C21-V25 WeakPolarHBondContact O-CG2 3.4Å; C21-V25 PolarHBondContact O-N 3.33Å; V25-C27 VanDerWaalsContact C-N 3.32Å; V25-C27 PolarHBondContact O-N 3.35Å; V25-L29 HydrophobicContact CG1-CD1 3.86Å; V25-L29 WeakPolarHBondContact O-CD1 3.41Å; V25-L29 PolarHBondContact O-N 3.31Å
26	S	48.9	Very low	50.9	Low	79 Å²	79	99.3 Å²	99.3	55%	0.552	55%	0.551	S	S	*	*	H	α-helix	trans	-66.6	-31.6	176.2	-54.3	0	0	0	0	113	H22 A23 N24	H22-S26 WeakPolarHBondContact O-CB 3.31Å; H22-S26 PolarHBondContact O-N 2.87Å; H22-S26 PolarHBondContact O-OG 2.96Å; A23-S26 WeakPolarHBondContact O-CB 3.35Å; A23-S26 PolarHBondContact O-N 3.44Å; N24-S26 VanDerWaalsContact C-N 3.29Å
27	C	47	Very low	52.8	Low	98 Å²	98	94.8 Å²	94.8	66%	0.662	54%	0.536	S	S	*	.	H	α-helix	trans	-84.6	-22	-178.4	-71.8	0	0	0	0	114.6	A23 N24 V25	A23-C27 PolarHBondContact O-N 3.33Å; A23-C27 PolarHBondContact O-SG 3.44Å; A23-C27 VanDerWaalsContact O-SG 3.4Å; N24-C27 PolarHBondContact O-N 2.96Å; V25-C27 VanDerWaalsContact C-N 3.32Å; V25-C27 PolarHBondContact O-N 3.35Å
28	T	50.8	Low	54.8	Low	112 Å²	112	90.6 Å²	90.6	69%	0.687	53%	0.528	S	S	*	.	H	α-helix	trans	-93	-10.2	178.5	42.3	0	0	0	0	113.8	N24	N24-T28 PolarHBondContact O-N 3.15Å; N24-T28 PolarHBondContact O-OG1 2.85Å
29	L	48.6	Very low	56.8	Low	39 Å²	39	89.4 Å²	89.4	20%	0.204	52%	0.524	C	S	.	.			trans	-102.2	13.1	174.1	-85	101.9	0	0	0	114.2	V25 S31 T32 F36 I37	V25-L29 HydrophobicContact CG1-CD1 3.86Å; V25-L29 WeakPolarHBondContact O-CD1 3.41Å; V25-L29 PolarHBondContact O-N 3.31Å; L29-S31 PolarHBondContact O-N 3.39Å; L29-T32 WeakPolarHBondContact CA-OG1 3.46Å; L29-T32 VanDerWaalsContact CB-OG1 3.32Å; L29-T32 WeakPolarHBondContact CB-OG1 3.37Å; L29-T32 WeakPolarHBondContact CD2-OG1 3.23Å; L29-T32 PolarHBondContact O-N 3.44Å; L29-T32 PolarHBondContact O-OG1 2.99Å; L29-F36 HydrophobicContact CD2-CD1 4.02Å; L29-F36 HydrophobicContact CD2-CE1 3.72Å; L29-I37 HydrophobicContact CB-CD1 4.44Å
30	S	50.5	Low	58.6	Low	106 Å²	106	86.6 Å²	86.6	74%	0.741	51%	0.512	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.7	-6.4	-179	-164.2	0	0	0	0	114.5
31	S	54.2	Low	60.4	Low	118 Å²	118	87.9 Å²	87.9	83%	0.825	52%	0.52	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.3	4.6	171.4	58.6	0	0	0	0	114.3	L29	L29-S31 PolarHBondContact O-N 3.39Å
32	T	58.3	Low	62.2	Low	60 Å²	60	88.7 Å²	88.7	37%	0.368	52%	0.519	S	S	.	.	S	Bend	trans	-104.1	142.1	-178.4	19.4	0	0	0	0	112.6	L29 S34	L29-T32 WeakPolarHBondContact CA-OG1 3.46Å; L29-T32 VanDerWaalsContact CB-OG1 3.32Å; L29-T32 WeakPolarHBondContact CB-OG1 3.37Å; L29-T32 WeakPolarHBondContact CD2-OG1 3.23Å; L29-T32 PolarHBondContact O-N 3.44Å; L29-T32 PolarHBondContact O-OG1 2.99Å; T32-S34 PolarHBondContact O-N 3.02Å
33	N	60.3	Low	63.8	Low	115 Å²	115	88.7 Å²	88.7	62%	0.615	52%	0.522	S	S	*	.			trans	-46.2	130.8	-176.7	-156.9	-6.6	0	0	0	112	N35 F36	N33-N35 PolarHBondContact O-N 2.98Å; N33-F36 WeakPolarHBondContact O-CB 3.48Å; N33-F36 PolarHBondContact O-N 3.45Å
34	S	69.4	Low	65.2	Low	77 Å²	77	89.1 Å²	89.1	54%	0.538	52%	0.52	S	S	.	.	H	α-helix	trans	-53.9	-31.7	-176.1	53.8	0	0	0	0	113.4	T32 F36 I37 N38	T32-S34 PolarHBondContact O-N 3.02Å; S34-F36 PolarHBondContact O-N 3.46Å; S34-I37 PolarHBondContact O-N 3.48Å; S34-N38 PolarHBondContact O-N 2.98Å; S34-N38 VanDerWaalsContact O-N 3.16Å; S34-N38 PolarHBondContact O-ND2 3.41Å
35	N	74.5	Confident	66.8	Low	99 Å²	99	89.2 Å²	89.2	53%	0.529	52%	0.515	S	S	.	.	H	α-helix	trans	-61.4	-41	174.9	-65.8	-16.6	0	0	0	112.2	N33 I37 N38 D39	N33-N35 PolarHBondContact O-N 2.98Å; N35-I37 PolarHBondContact O-N 3.42Å; N35-N38 PolarHBondContact O-N 3.02Å; N35-D39 WeakPolarHBondContact O-CB 3.37Å; N35-D39 VanDerWaalsContact O-CG 3.25Å; N35-D39 PolarHBondContact O-N 3.4Å
36	F	78.5	Confident	68	Low	108 Å²	108	90 Å²	90	47%	0.474	52%	0.52	S	S	.	.	H	α-helix	trans	-66.9	-38.4	-179.5	-178	-101.1	0	0	0	112.3	L29 N33 S34 D39 L40	L29-F36 HydrophobicContact CD2-CD1 4.02Å; L29-F36 HydrophobicContact CD2-CE1 3.72Å; N33-F36 WeakPolarHBondContact O-CB 3.48Å; N33-F36 PolarHBondContact O-N 3.45Å; S34-F36 PolarHBondContact O-N 3.46Å; F36-D39 PolarHBondContact O-N 3.15Å; F36-L40 WeakPolarHBondContact O-CB 3.35Å; F36-L40 PolarHBondContact O-N 3.16Å
37	I	76	Confident	69.1	Low	60 Å²	60	92.1 Å²	92.1	31%	0.308	52%	0.521	S	S	.	.	H	α-helix	trans	-65.9	-45.4	176	-63.1	-174.2	0	0	0	110.4	L29 S34 N35 D39 L40 V41	L29-I37 HydrophobicContact CB-CD1 4.44Å; S34-I37 PolarHBondContact O-N 3.48Å; N35-I37 PolarHBondContact O-N 3.42Å; I37-D39 VanDerWaalsContact C-N 3.32Å; I37-D39 PolarHBondContact O-N 3.01Å; I37-L40 PolarHBondContact O-N 3.48Å; I37-V41 HydrophobicContact CG2-CG2 4.33Å; I37-V41 WeakPolarHBondContact O-CB 3.42Å; I37-V41 VanDerWaalsContact O-CG2 3.31Å; I37-V41 WeakPolarHBondContact O-CG2 3.47Å; I37-V41 PolarHBondContact O-N 3.49Å
38	N	78.8	Confident	70.4	Confident	95 Å²	95	90.7 Å²	90.7	51%	0.508	51%	0.512	S	S	.	.	H	α-helix	trans	-61.6	-40.9	177.4	-72.6	-26.1	0	0	0	111.9	S34 N35 V41 N42	S34-N38 PolarHBondContact O-N 2.98Å; S34-N38 VanDerWaalsContact O-N 3.16Å; S34-N38 PolarHBondContact O-ND2 3.41Å; N35-N38 PolarHBondContact O-N 3.02Å; N38-V41 PolarHBondContact O-N 2.97Å; N38-N42 WeakPolarHBondContact O-CB 3.44Å; N38-N42 VanDerWaalsContact O-CG 3.27Å; N38-N42 PolarHBondContact O-N 2.92Å; N38-N42 PolarHBondContact O-ND2 2.93Å
39	D	80.3	Confident	71.6	Confident	103 Å²	103	90 Å²	90	55%	0.551	50%	0.501	S	S	*	.	H	α-helix	trans	-65.1	-41.9	176.5	-71	-23.1	0	0	0	111.8	N35 F36 I37 N42 L43	N35-D39 WeakPolarHBondContact O-CB 3.37Å; N35-D39 VanDerWaalsContact O-CG 3.25Å; N35-D39 PolarHBondContact O-N 3.4Å; F36-D39 PolarHBondContact O-N 3.15Å; I37-D39 VanDerWaalsContact C-N 3.32Å; I37-D39 PolarHBondContact O-N 3.01Å; D39-N42 PolarHBondContact O-N 3.37Å; D39-L43 WeakPolarHBondContact O-CB 3.36Å; D39-L43 PolarHBondContact O-N 3.42Å
40	L	80.1	Confident	72.7	Confident	69 Å²	69	93.1 Å²	93.1	36%	0.361	52%	0.516	S	S	.	.	H	α-helix	trans	-67.3	-39.9	177.2	-171.1	69.1	0	0	0	112.4	F36 I37 L43 T44	F36-L40 WeakPolarHBondContact O-CB 3.35Å; F36-L40 PolarHBondContact O-N 3.16Å; I37-L40 PolarHBondContact O-N 3.48Å; L40-L43 PolarHBondContact O-N 3.37Å; L40-T44 WeakPolarHBondContact O-CG2 3.49Å; L40-T44 PolarHBondContact O-N 2.98Å; L40-T44 PolarHBondContact O-OG1 2.9Å
41	V	81.4	Confident	74	Confident	79 Å²	79	94.5 Å²	94.5	48%	0.479	51%	0.509	S	S	.	.	H	α-helix	trans	-65.1	-41.9	174.3	171.6	0	0	0	0	110.6	I37 N38 T44 K45	I37-V41 HydrophobicContact CG2-CG2 4.33Å; I37-V41 WeakPolarHBondContact O-CB 3.42Å; I37-V41 VanDerWaalsContact O-CG2 3.31Å; I37-V41 WeakPolarHBondContact O-CG2 3.47Å; I37-V41 PolarHBondContact O-N 3.49Å; N38-V41 PolarHBondContact O-N 2.97Å; V41-T44 WeakPolarHBondContact CA-OG1 3.39Å; V41-T44 PolarHBondContact O-OG1 3.17Å; V41-K45 VanDerWaalsContact O-CB 3.22Å; V41-K45 WeakPolarHBondContact O-CB 3.49Å; V41-K45 PolarHBondContact O-N 3.19Å
42	N	78.9	Confident	75.2	Confident	96 Å²	96	91.8 Å²	91.8	51%	0.513	49%	0.49	S	S	.	.	H	α-helix	trans	-64.1	-41.2	174	-76.9	-25.7	0	0	0	111.6	N38 D39 K45 V46	N38-N42 WeakPolarHBondContact O-CB 3.44Å; N38-N42 VanDerWaalsContact O-CG 3.27Å; N38-N42 PolarHBondContact O-N 2.92Å; N38-N42 PolarHBondContact O-ND2 2.93Å; D39-N42 PolarHBondContact O-N 3.37Å; N42-K45 PolarHBondContact O-N 3.07Å; N42-V46 WeakPolarHBondContact O-CB 3.48Å; N42-V46 WeakPolarHBondContact O-CG2 3.49Å; N42-V46 PolarHBondContact O-N 2.84Å
43	L	78.8	Confident	76.4	Confident	118 Å²	118	95 Å²	95	62%	0.618	50%	0.501	S	S	*	.	H	α-helix	trans	-64.3	-46.4	178.6	-148.3	87	0	0	0	111.7	D39 L40 V46 E47	D39-L43 WeakPolarHBondContact O-CB 3.36Å; D39-L43 PolarHBondContact O-N 3.42Å; L40-L43 PolarHBondContact O-N 3.37Å; L43-V46 PolarHBondContact O-N 3.31Å; L43-E47 WeakPolarHBondContact O-CB 3.35Å; L43-E47 PolarHBondContact O-N 3.09Å
44	T	78.4	Confident	77.6	Confident	59 Å²	59	98.1 Å²	98.1	36%	0.362	50%	0.504	S	S	.	.	H	α-helix	trans	-66.2	-37.2	177.4	49.4	0	0	0	0	111.9	L40 V41 E47 S48	L40-T44 WeakPolarHBondContact O-CG2 3.49Å; L40-T44 PolarHBondContact O-N 2.98Å; L40-T44 PolarHBondContact O-OG1 2.9Å; V41-T44 WeakPolarHBondContact CA-OG1 3.39Å; V41-T44 PolarHBondContact O-OG1 3.17Å; T44-E47 PolarHBondContact O-N 2.86Å; T44-S48 WeakPolarHBondContact O-CB 3.35Å; T44-S48 PolarHBondContact O-N 3.34Å; T44-S48 PolarHBondContact O-OG 3.34Å
45	K	79.8	Confident	78.3	Confident	113 Å²	113	99.7 Å²	99.7	49%	0.491	50%	0.498	S	S	.	.	H	α-helix	trans	-63.7	-49	172.7	-173	176.4	176	-177.3	0	111.3	V41 N42 E47 S48 E49	V41-K45 VanDerWaalsContact O-CB 3.22Å; V41-K45 WeakPolarHBondContact O-CB 3.49Å; V41-K45 PolarHBondContact O-N 3.19Å; N42-K45 PolarHBondContact O-N 3.07Å; K45-E47 VanDerWaalsContact C-N 3.3Å; K45-E47 PolarHBondContact O-N 3.28Å; K45-S48 PolarHBondContact O-N 2.76Å; K45-S48 PolarHBondContact O-OG 3.44Å; K45-E49 WeakPolarHBondContact CE-OE1 3.23Å; K45-E49 HydrophobicContact CG-CG 4.43Å; K45-E49 IonicContact NZ-OE1 3.34Å; K45-E49 WeakPolarHBondContact O-CB 3.49Å; K45-E49 WeakPolarHBondContact O-CG 3.37Å; K45-E49 PolarHBondContact O-N 3.45Å
46	V	74.5	Confident	78.8	Confident	88 Å²	88	101.2 Å²	101.2	53%	0.533	50%	0.5	S	S	.	.	H	α-helix	trans	-59.2	-41.8	175.5	169.7	0	0	0	0	110.8	N42 L43 E49 M50	N42-V46 WeakPolarHBondContact O-CB 3.48Å; N42-V46 WeakPolarHBondContact O-CG2 3.49Å; N42-V46 PolarHBondContact O-N 2.84Å; L43-V46 PolarHBondContact O-N 3.31Å; V46-E49 PolarHBondContact O-N 2.7Å; V46-M50 WeakPolarHBondContact O-CB 3.35Å; V46-M50 PolarHBondContact O-N 3.31Å
47	E	72.4	Confident	79.3	Confident	123 Å²	123	98 Å²	98	58%	0.575	49%	0.493	S	S	*	.	H	α-helix	trans	-64	-42.3	176.1	-171.1	175.7	-175.1	0	0	111.7	L43 T44 K45 F51	L43-E47 WeakPolarHBondContact O-CB 3.35Å; L43-E47 PolarHBondContact O-N 3.09Å; T44-E47 PolarHBondContact O-N 2.86Å; K45-E47 VanDerWaalsContact C-N 3.3Å; K45-E47 PolarHBondContact O-N 3.28Å; E47-F51 WeakPolarHBondContact O-CB 3.35Å; E47-F51 PolarHBondContact O-N 2.84Å
48	S	73.6	Confident	79.9	Confident	67 Å²	67	101 Å²	101	47%	0.469	51%	0.505	S	S	.	.	H	α-helix	trans	-67.3	-41.7	177.2	76.1	0	0	0	0	113	T44 K45 F51 S52	T44-S48 WeakPolarHBondContact O-CB 3.35Å; T44-S48 PolarHBondContact O-N 3.34Å; T44-S48 PolarHBondContact O-OG 3.34Å; K45-S48 PolarHBondContact O-N 2.76Å; K45-S48 PolarHBondContact O-OG 3.44Å; S48-F51 PolarHBondContact O-N 3.36Å; S48-S52 WeakPolarHBondContact O-CB 3.48Å; S48-S52 PolarHBondContact O-N 3.44Å
49	E	76.6	Confident	80.3	Confident	98 Å²	98	98.3 Å²	98.3	46%	0.458	49%	0.49	S	S	.	.	H	α-helix	trans	-67.1	-48.2	177.2	-75.5	-179.7	178.6	0	0	109.4	K45 V46 F51 S52 E53	K45-E49 WeakPolarHBondContact CE-OE1 3.23Å; K45-E49 HydrophobicContact CG-CG 4.43Å; K45-E49 IonicContact NZ-OE1 3.34Å; K45-E49 WeakPolarHBondContact O-CB 3.49Å; K45-E49 WeakPolarHBondContact O-CG 3.37Å; K45-E49 PolarHBondContact O-N 3.45Å; V46-E49 PolarHBondContact O-N 2.7Å; E49-F51 VanDerWaalsContact C-N 3.35Å; E49-F51 PolarHBondContact O-N 3.25Å; E49-S52 WeakPolarHBondContact O-CB 3.33Å; E49-S52 PolarHBondContact O-N 3.17Å; E49-S52 VanDerWaalsContact O-N 3.09Å; E49-S52 PolarHBondContact O-OG 3.16Å; E49-E53 WeakPolarHBondContact O-CG 3.49Å; E49-E53 PolarHBondContact O-N 3.16Å
50	M	72.6	Confident	80.8	Confident	104 Å²	104	97.2 Å²	97.2	51%	0.512	48%	0.483	S	S	.	.	H	α-helix	trans	-57.9	-46.8	175.3	-175.4	177	69.4	0	0	111.1	V46 S52 E53 W54	V46-M50 WeakPolarHBondContact O-CB 3.35Å; V46-M50 PolarHBondContact O-N 3.31Å; M50-S52 VanDerWaalsContact C-N 3.29Å; M50-S52 PolarHBondContact O-N 3.41Å; M50-E53 PolarHBondContact O-N 3.38Å; M50-W54 VanDerWaalsContact CG-CD1 3.48Å; M50-W54 VanDerWaalsContact CG-NE1 3.31Å; M50-W54 PolarHBondContact O-N 3.45Å
51	F	76.9	Confident	81.4	Confident	136 Å²	136	98.5 Å²	98.5	60%	0.596	49%	0.489	S	S	*	.	H	α-helix	trans	-61.8	-36.8	176.6	-174.3	-101.3	0	0	0	112.3	E47 S48 E49 R55	E47-F51 WeakPolarHBondContact O-CB 3.35Å; E47-F51 PolarHBondContact O-N 2.84Å; S48-F51 PolarHBondContact O-N 3.36Å; E49-F51 VanDerWaalsContact C-N 3.35Å; E49-F51 PolarHBondContact O-N 3.25Å; F51-R55 WeakPolarHBondContact O-CB 3.28Å; F51-R55 PolarHBondContact O-N 2.93Å
52	S	79.7	Confident	81.8	Confident	61 Å²	61	96.9 Å²	96.9	43%	0.427	48%	0.478	S	S	.	.	H	α-helix	trans	-67.6	-42.1	176.6	78.8	0	0	0	0	112.6	S48 E49 M50 R55 F56	S48-S52 WeakPolarHBondContact O-CB 3.48Å; S48-S52 PolarHBondContact O-N 3.44Å; E49-S52 WeakPolarHBondContact O-CB 3.33Å; E49-S52 PolarHBondContact O-N 3.17Å; E49-S52 VanDerWaalsContact O-N 3.09Å; E49-S52 PolarHBondContact O-OG 3.16Å; M50-S52 VanDerWaalsContact C-N 3.29Å; M50-S52 PolarHBondContact O-N 3.41Å; S52-R55 PolarHBondContact O-N 2.93Å; S52-F56 WeakPolarHBondContact O-CB 3.44Å; S52-F56 PolarHBondContact O-N 3.44Å
53	E	83.5	Confident	82.4	Confident	127 Å²	127	93.6 Å²	93.6	59%	0.593	46%	0.46	S	S	*	.	H	α-helix	trans	-65.5	-48	177.3	-72.1	-60.4	146.9	0	0	111.3	E49 M50 R55 F56 A57	E49-E53 WeakPolarHBondContact O-CG 3.49Å; E49-E53 PolarHBondContact O-N 3.16Å; M50-E53 PolarHBondContact O-N 3.38Å; E53-R55 VanDerWaalsContact C-N 3.29Å; E53-R55 PolarHBondContact O-N 3.33Å; E53-F56 PolarHBondContact O-N 3.37Å; E53-A57 WeakPolarHBondContact O-CB 3.41Å; E53-A57 PolarHBondContact O-N 3.32Å
54	W	85	Confident	83.1	Confident	181 Å²	181	91.1 Å²	91.1	69%	0.686	45%	0.452	S	S	*	.	H	α-helix	trans	-60.4	-40.3	175.4	-73.2	115.6	0	0	0	112	M50 F58	M50-W54 VanDerWaalsContact CG-CD1 3.48Å; M50-W54 VanDerWaalsContact CG-NE1 3.31Å; M50-W54 PolarHBondContact O-N 3.45Å; W54-F58 WeakPolarHBondContact O-CB 3.43Å; W54-F58 PolarHBondContact O-N 2.99Å
55	R	83.5	Confident	83.8	Confident	110 Å²	110	93 Å²	93	42%	0.415	46%	0.46	S	S	.	.	H	α-helix	trans	-66	-39.2	177.1	178.8	169.8	169.2	151.8	-20.6	111.8	F51 S52 E53 N59 R510	F51-R55 WeakPolarHBondContact O-CB 3.28Å; F51-R55 PolarHBondContact O-N 2.93Å; S52-R55 PolarHBondContact O-N 2.93Å; E53-R55 VanDerWaalsContact C-N 3.29Å; E53-R55 PolarHBondContact O-N 3.33Å; R55-N59 WeakPolarHBondContact O-CB 3.14Å; R55-N59 PolarHBondContact O-N 3.45Å; R55-N59 PolarHBondContact O-ND2 3.33Å; R55-R510 VanDerWaalsContact CZ-CZ 3.42Å
56	F	85.8	Confident	84.4	Confident	131 Å²	131	88 Å²	88	58%	0.575	44%	0.438	S	S	*	.	H	α-helix	trans	-66.9	-49.5	175.8	-175.6	-106.1	0	0	0	111.5	S52 E53 F58 N59 I60	S52-F56 WeakPolarHBondContact O-CB 3.44Å; S52-F56 PolarHBondContact O-N 3.44Å; E53-F56 PolarHBondContact O-N 3.37Å; F56-F58 VanDerWaalsContact C-N 3.33Å; F56-F58 PolarHBondContact O-N 3.05Å; F56-N59 PolarHBondContact O-N 2.85Å; F56-I60 HydrophobicContact CD1-CD1 3.69Å; F56-I60 HydrophobicContact CE1-CD1 3.24Å; F56-I60 HydrophobicContact CE1-CG1 4.26Å; F56-I60 HydrophobicContact CE2-CD1 4.43Å; F56-I60 HydrophobicContact CG-CD1 4.46Å; F56-I60 HydrophobicContact CZ-CD1 3.66Å; F56-I60 HydrophobicContact CZ-CG1 4.36Å; F56-I60 WeakPolarHBondContact O-CG1 3.12Å; F56-I60 PolarHBondContact O-N 3.18Å
57	A	89.5	Confident	85.4	Confident	40 Å²	40	87.4 Å²	87.4	33%	0.331	43%	0.431	S	S	.	.	H	α-helix	trans	-58.1	-44.3	175.4	0	0	0	0	0	112	E53 N59 I60 I61	E53-A57 WeakPolarHBondContact O-CB 3.41Å; E53-A57 PolarHBondContact O-N 3.32Å; A57-N59 PolarHBondContact O-N 2.95Å; A57-I60 PolarHBondContact O-N 3.38Å; A57-I61 VanDerWaalsContact O-CG1 3.31Å; A57-I61 WeakPolarHBondContact O-CG1 3.4Å; A57-I61 PolarHBondContact O-N 3.44Å
58	F	88.3	Confident	86.4	Confident	124 Å²	124	85.8 Å²	85.8	54%	0.544	43%	0.426	S	S	.	.	H	α-helix	trans	-62.3	-42.8	176.5	-175.7	-107	0	0	0	112.3	W54 F56 I60 I61 I62	W54-F58 WeakPolarHBondContact O-CB 3.43Å; W54-F58 PolarHBondContact O-N 2.99Å; F56-F58 VanDerWaalsContact C-N 3.33Å; F56-F58 PolarHBondContact O-N 3.05Å; F58-I60 PolarHBondContact O-N 3.31Å; F58-I61 PolarHBondContact O-N 3Å; F58-I62 HydrophobicContact CD1-CD1 3.58Å; F58-I62 HydrophobicContact CD1-CG1 4.46Å; F58-I62 HydrophobicContact CE1-CD1 3.16Å; F58-I62 HydrophobicContact CE1-CG1 4.23Å; F58-I62 HydrophobicContact CE2-CD1 4.33Å; F58-I62 HydrophobicContact CG-CD1 4.34Å; F58-I62 HydrophobicContact CZ-CD1 3.59Å; F58-I62 HydrophobicContact CZ-CG1 4.31Å; F58-I62 WeakPolarHBondContact O-CG1 3.35Å; F58-I62 PolarHBondContact O-N 3.08Å
59	N	87.2	Confident	87.4	Confident	38 Å²	38	83.4 Å²	83.4	20%	0.203	41%	0.409	C	S	.	.	H	α-helix	trans	-62.2	-41.4	174.4	-73.1	-24.2	0	0	0	111.8	R55 F56 A57 I62 I63	R55-N59 WeakPolarHBondContact O-CB 3.14Å; R55-N59 PolarHBondContact O-N 3.45Å; R55-N59 PolarHBondContact O-ND2 3.33Å; F56-N59 PolarHBondContact O-N 2.85Å; A57-N59 PolarHBondContact O-N 2.95Å; N59-I62 PolarHBondContact O-N 3.06Å; N59-I63 WeakPolarHBondContact O-CB 3.27Å; N59-I63 WeakPolarHBondContact O-CD1 3.33Å; N59-I63 VanDerWaalsContact O-CG1 3.25Å; N59-I63 WeakPolarHBondContact O-CG1 3.49Å; N59-I63 PolarHBondContact O-N 2.96Å
60	I	91.2	Very high	88.3	Confident	79 Å²	79	80.1 Å²	80.1	41%	0.405	40%	0.395	S	S	.	.	H	α-helix	trans	-61.1	-45.4	175.8	-72	173.6	0	0	0	111	F56 A57 F58 I62 I63 S64	F56-I60 HydrophobicContact CD1-CD1 3.69Å; F56-I60 HydrophobicContact CE1-CD1 3.24Å; F56-I60 HydrophobicContact CE1-CG1 4.26Å; F56-I60 HydrophobicContact CE2-CD1 4.43Å; F56-I60 HydrophobicContact CG-CD1 4.46Å; F56-I60 HydrophobicContact CZ-CD1 3.66Å; F56-I60 HydrophobicContact CZ-CG1 4.36Å; F56-I60 WeakPolarHBondContact O-CG1 3.12Å; F56-I60 PolarHBondContact O-N 3.18Å; A57-I60 PolarHBondContact O-N 3.38Å; F58-I60 PolarHBondContact O-N 3.31Å; I60-I62 VanDerWaalsContact C-N 3.34Å; I60-I62 PolarHBondContact O-N 3.28Å; I60-I63 PolarHBondContact O-N 3.49Å; I60-S64 WeakPolarHBondContact O-CB 3.14Å; I60-S64 PolarHBondContact O-N 2.75Å; I60-S64 PolarHBondContact O-OG 3.49Å
61	I	92	Very high	89.4	Confident	96 Å²	96	80.1 Å²	80.1	49%	0.492	40%	0.396	S	S	.	.	H	α-helix	trans	-60.1	-47.1	177.6	-68.8	165	0	0	0	109.9	A57 F58 S64 L65	A57-I61 VanDerWaalsContact O-CG1 3.31Å; A57-I61 WeakPolarHBondContact O-CG1 3.4Å; A57-I61 PolarHBondContact O-N 3.44Å; F58-I61 PolarHBondContact O-N 3Å; I61-S64 PolarHBondContact O-N 3.43Å; I61-L65 HydrophobicContact CG2-CD1 3.99Å; I61-L65 HydrophobicContact CG2-CG 4.44Å; I61-L65 VanDerWaalsContact O-CG 3.3Å; I61-L65 WeakPolarHBondContact O-CG 3.33Å; I61-L65 PolarHBondContact O-N 2.8Å
62	I	89.8	Confident	90.3	Very high	45 Å²	45	78.2 Å²	78.2	23%	0.231	39%	0.388	C	S	.	.	H	α-helix	trans	-58.2	-51.8	177.2	-75.2	174.3	0	0	0	111.1	F58 N59 I60 S64 L65 Q66	F58-I62 HydrophobicContact CD1-CD1 3.58Å; F58-I62 HydrophobicContact CD1-CG1 4.46Å; F58-I62 HydrophobicContact CE1-CD1 3.16Å; F58-I62 HydrophobicContact CE1-CG1 4.23Å; F58-I62 HydrophobicContact CE2-CD1 4.33Å; F58-I62 HydrophobicContact CG-CD1 4.34Å; F58-I62 HydrophobicContact CZ-CD1 3.59Å; F58-I62 HydrophobicContact CZ-CG1 4.31Å; F58-I62 WeakPolarHBondContact O-CG1 3.35Å; F58-I62 PolarHBondContact O-N 3.08Å; N59-I62 PolarHBondContact O-N 3.06Å; I60-I62 VanDerWaalsContact C-N 3.34Å; I60-I62 PolarHBondContact O-N 3.28Å; I62-S64 VanDerWaalsContact C-N 3.28Å; I62-S64 PolarHBondContact O-N 3.22Å; I62-L65 PolarHBondContact O-N 3.22Å; I62-Q66 HydrophobicContact CG2-CG 4.32Å; I62-Q66 VanDerWaalsContact O-CG 3.26Å; I62-Q66 WeakPolarHBondContact O-CG 3.46Å; I62-Q66 PolarHBondContact O-N 3.49Å
63	I	91.6	Very high	91.2	Very high	28 Å²	28	75.4 Å²	75.4	14%	0.144	37%	0.368	C	S	.	.	H	α-helix	trans	-59.3	-43	-179.4	-69.6	161.3	0	0	0	110.4	N59 I60 L65 Q66 I67 I117 Q120 V121	N59-I63 WeakPolarHBondContact O-CB 3.27Å; N59-I63 WeakPolarHBondContact O-CD1 3.33Å; N59-I63 VanDerWaalsContact O-CG1 3.25Å; N59-I63 WeakPolarHBondContact O-CG1 3.49Å; N59-I63 PolarHBondContact O-N 2.96Å; I60-I63 PolarHBondContact O-N 3.49Å; I63-L65 PolarHBondContact O-N 2.89Å; I63-Q66 PolarHBondContact O-N 3.19Å; I63-I67 HydrophobicContact CG2-CD1 3.81Å; I63-I67 HydrophobicContact CG2-CG1 4.45Å; I63-I67 WeakPolarHBondContact O-CG1 3.34Å; I63-I67 PolarHBondContact O-N 2.94Å; I63-I117 HydrophobicContact CG2-CG2 4.48Å; I63-Q120 HydrophobicContact CD1-CG 4.3Å; I63-Q120 HydrophobicContact CG1-CB 4.45Å; I63-Q120 HydrophobicContact CG1-CG 3.67Å; I63-V121 HydrophobicContact CD1-CG2 3.98Å; I63-V121 HydrophobicContact CG1-CG2 4.32Å; I63-V121 HydrophobicContact CG2-CG2 3.91Å
64	S	93.9	Very high	91.8	Very high	65 Å²	65	73.7 Å²	73.7	46%	0.455	36%	0.358	S	S	.	.	H	α-helix	trans	-61.7	-43	177.9	-56.8	0	0	0	0	111.8	I60 I61 I62 I67 L68	I60-S64 WeakPolarHBondContact O-CB 3.14Å; I60-S64 PolarHBondContact O-N 2.75Å; I60-S64 PolarHBondContact O-OG 3.49Å; I61-S64 PolarHBondContact O-N 3.43Å; I62-S64 VanDerWaalsContact C-N 3.28Å; I62-S64 PolarHBondContact O-N 3.22Å; S64-I67 PolarHBondContact O-N 3.02Å; S64-L68 WeakPolarHBondContact O-CB 3.39Å; S64-L68 PolarHBondContact O-N 3.44Å
65	L	92.8	Very high	92.4	Very high	100 Å²	100	66.7 Å²	66.7	52%	0.524	34%	0.343	S	S	.	.	H	α-helix	trans	-65.7	-37	175.6	-71	173.4	0	0	0	112.3	I61 I62 I63 S69	I61-L65 HydrophobicContact CG2-CD1 3.99Å; I61-L65 HydrophobicContact CG2-CG 4.44Å; I61-L65 VanDerWaalsContact O-CG 3.3Å; I61-L65 WeakPolarHBondContact O-CG 3.33Å; I61-L65 PolarHBondContact O-N 2.8Å; I62-L65 PolarHBondContact O-N 3.22Å; I63-L65 PolarHBondContact O-N 2.89Å; L65-S69 VanDerWaalsContact O-CB 3.29Å; L65-S69 WeakPolarHBondContact O-CB 3.33Å; L65-S69 PolarHBondContact O-N 3.36Å; L65-S69 PolarHBondContact O-OG 2.72Å
66	Q	92.2	Very high	93	Very high	6 Å²	6	62.1 Å²	62.1	3%	0.028	33%	0.33	C	S	.	.	H	α-helix	trans	-65.9	-46.9	176.4	-68.1	172.6	7.5	0	0	111.6	I62 I63 L68 S69 D70 I117 W517	I62-Q66 HydrophobicContact CG2-CG 4.32Å; I62-Q66 VanDerWaalsContact O-CG 3.26Å; I62-Q66 WeakPolarHBondContact O-CG 3.46Å; I62-Q66 PolarHBondContact O-N 3.49Å; I63-Q66 PolarHBondContact O-N 3.19Å; Q66-L68 VanDerWaalsContact C-N 3.34Å; Q66-L68 PolarHBondContact O-N 3.19Å; Q66-S69 PolarHBondContact O-N 2.95Å; Q66-D70 WeakPolarHBondContact O-CB 3.27Å; Q66-D70 PolarHBondContact O-N 3.42Å; Q66-I117 HydrophobicContact CB-CD1 4.37Å; Q66-I117 HydrophobicContact CB-CG1 3.98Å; Q66-W517 HydrophobicContact CB-CH2 3.78Å; Q66-W517 HydrophobicContact CB-CZ2 4.32Å; Q66-W517 HydrophobicContact CB-CZ3 3.93Å; Q66-W517 VanDerWaalsContact CD-CH2 3.44Å; Q66-W517 HydrophobicContact CG-CD2 3.89Å; Q66-W517 HydrophobicContact CG-CE3 3.76Å; Q66-W517 HydrophobicContact CG-CH2 3.46Å; Q66-W517 VanDerWaalsContact CG-CH2 3.46Å; Q66-W517 HydrophobicContact CG-CZ2 3.58Å; Q66-W517 HydrophobicContact CG-CZ3 3.56Å
67	I	94.9	Very high	93.6	Very high	77 Å²	77	56 Å²	56	40%	0.395	30%	0.303	S	S	.	.	H	α-helix	trans	-60.6	-45.9	176.8	-67.5	167.2	0	0	0	110.3	I63 S64 S69 D70 I71 I117	I63-I67 HydrophobicContact CG2-CD1 3.81Å; I63-I67 HydrophobicContact CG2-CG1 4.45Å; I63-I67 WeakPolarHBondContact O-CG1 3.34Å; I63-I67 PolarHBondContact O-N 2.94Å; S64-I67 PolarHBondContact O-N 3.02Å; I67-S69 PolarHBondContact O-N 3.06Å; I67-D70 PolarHBondContact O-N 2.87Å; I67-I71 HydrophobicContact CG2-CD1 4.13Å; I67-I71 WeakPolarHBondContact O-CG1 3.39Å; I67-I71 PolarHBondContact O-N 2.92Å; I67-I71 VanDerWaalsContact O-N 3.09Å; I67-I117 HydrophobicContact CD1-CG2 4.43Å; I67-I117 HydrophobicContact CG1-CD1 4.12Å; I67-I117 HydrophobicContact CG1-CG2 4.01Å
68	L	94.8	Very high	94	Very high	88 Å²	88	57.6 Å²	57.6	46%	0.461	31%	0.306	S	S	.	.	H	α-helix	trans	-61.1	-45.2	177.6	-173.2	63	0	0	0	111.5	S64 Q66 D70 I71 F72	S64-L68 WeakPolarHBondContact O-CB 3.39Å; S64-L68 PolarHBondContact O-N 3.44Å; Q66-L68 VanDerWaalsContact C-N 3.34Å; Q66-L68 PolarHBondContact O-N 3.19Å; L68-D70 VanDerWaalsContact C-N 3.34Å; L68-D70 PolarHBondContact O-N 2.63Å; L68-I71 PolarHBondContact O-N 3.11Å; L68-F72 HydrophobicContact CD1-CD2 4.1Å; L68-F72 HydrophobicContact CD1-CE2 3.58Å; L68-F72 HydrophobicContact CD2-CE2 4.24Å; L68-F72 HydrophobicContact CG-CD2 3.93Å; L68-F72 HydrophobicContact CG-CE2 3.67Å; L68-F72 WeakPolarHBondContact O-CD2 3.43Å; L68-F72 PolarHBondContact O-N 3.04Å; L68-F72 VanDerWaalsContact O-N 3.11Å
69	S	93.9	Very high	94.4	Very high	18 Å²	18	53.1 Å²	53.1	13%	0.126	29%	0.287	C	S	.	.	H	α-helix	trans	-61	-43.4	177.7	-59.3	0	0	0	0	111.3	L65 Q66 I67 I71 F72 I73	L65-S69 VanDerWaalsContact O-CB 3.29Å; L65-S69 WeakPolarHBondContact O-CB 3.33Å; L65-S69 PolarHBondContact O-N 3.36Å; L65-S69 PolarHBondContact O-OG 2.72Å; Q66-S69 PolarHBondContact O-N 2.95Å; I67-S69 PolarHBondContact O-N 3.06Å; S69-I71 PolarHBondContact O-N 2.96Å; S69-F72 PolarHBondContact O-N 3.48Å; S69-I73 WeakPolarHBondContact O-CD1 3.48Å; S69-I73 WeakPolarHBondContact O-CG1 3.42Å; S69-I73 PolarHBondContact O-N 2.98Å
70	D	95.1	Very high	94.9	Very high	28 Å²	28	51.3 Å²	51.3	15%	0.15	28%	0.278	C	S	.	.	H	α-helix	trans	-59.9	-44.9	178	-171.8	34.6	0	0	0	112	Q66 I67 L68 F72 I73 F74 A109 L113 I117	Q66-D70 WeakPolarHBondContact O-CB 3.27Å; Q66-D70 PolarHBondContact O-N 3.42Å; I67-D70 PolarHBondContact O-N 2.87Å; L68-D70 VanDerWaalsContact C-N 3.34Å; L68-D70 PolarHBondContact O-N 2.63Å; D70-F72 VanDerWaalsContact C-N 3.34Å; D70-F72 PolarHBondContact O-N 3.19Å; D70-I73 PolarHBondContact O-N 3.19Å; D70-F74 WeakPolarHBondContact O-CB 3.47Å; D70-F74 PolarHBondContact O-N 3.48Å; D70-A109 VanDerWaalsContact OD1-CA 3.28Å; D70-A109 WeakPolarHBondContact OD1-CA 3.45Å; D70-A109 VanDerWaalsContact OD1-CB 3.29Å; D70-A109 WeakPolarHBondContact OD1-CB 3.41Å; D70-L113 HydrophobicContact CB-CB 4.44Å; D70-L113 HydrophobicContact CB-CD1 4.14Å; D70-L113 WeakPolarHBondContact OD1-CD1 3.2Å; D70-I117 HydrophobicContact CB-CD1 4.24Å
71	I	96.4	Very high	95.2	Very high	105 Å²	105	49 Å²	49	54%	0.538	27%	0.266	S	S	.	.	H	α-helix	trans	-58.5	-44.8	174.7	-66.3	166.4	0	0	0	111.2	I67 L68 S69 G75	I67-I71 HydrophobicContact CG2-CD1 4.13Å; I67-I71 WeakPolarHBondContact O-CG1 3.39Å; I67-I71 PolarHBondContact O-N 2.92Å; I67-I71 VanDerWaalsContact O-N 3.09Å; L68-I71 PolarHBondContact O-N 3.11Å; S69-I71 PolarHBondContact O-N 2.96Å; I71-G75 PolarHBondContact O-N 3.29Å
72	F	96.1	Very high	95.4	Very high	96 Å²	96	46.4 Å²	46.4	42%	0.421	26%	0.256	S	S	.	.	H	α-helix	trans	-68.2	-39.2	178.2	-80.6	-66	0	0	0	112.8	L68 S69 D70 G76 M524 F528	L68-F72 HydrophobicContact CD1-CD2 4.1Å; L68-F72 HydrophobicContact CD1-CE2 3.58Å; L68-F72 HydrophobicContact CD2-CE2 4.24Å; L68-F72 HydrophobicContact CG-CD2 3.93Å; L68-F72 HydrophobicContact CG-CE2 3.67Å; L68-F72 WeakPolarHBondContact O-CD2 3.43Å; L68-F72 PolarHBondContact O-N 3.04Å; L68-F72 VanDerWaalsContact O-N 3.11Å; S69-F72 PolarHBondContact O-N 3.48Å; D70-F72 VanDerWaalsContact C-N 3.34Å; D70-F72 PolarHBondContact O-N 3.19Å; F72-G76 WeakPolarHBondContact O-CA 3.27Å; F72-G76 PolarHBondContact O-N 3.02Å; F72-M524 HydrophobicContact CB-CG 3.86Å; F72-M524 HydrophobicContact CB-SD 4.08Å; F72-F528 HydrophobicContact CD1-CZ 4.11Å; F72-F528 HydrophobicContact CE1-CZ 4.36Å
73	I	96.8	Very high	95.8	Very high	1 Å²	1	44.2 Å²	44.2	1%	0.005	25%	0.245	C	C	.	.	H	α-helix	trans	-63	-49.4	176.6	-65.9	162.1	0	0	0	109.4	S69 D70 N77 A109 L113 Y520 M524	S69-I73 WeakPolarHBondContact O-CD1 3.48Å; S69-I73 WeakPolarHBondContact O-CG1 3.42Å; S69-I73 PolarHBondContact O-N 2.98Å; D70-I73 PolarHBondContact O-N 3.19Å; I73-N77 VanDerWaalsContact O-CB 3.32Å; I73-N77 WeakPolarHBondContact O-CB 3.33Å; I73-N77 PolarHBondContact O-N 3.4Å; I73-N77 VanDerWaalsContact O-N 3.07Å; I73-N77 PolarHBondContact O-ND2 3.47Å; I73-A109 HydrophobicContact CB-CB 4.26Å; I73-A109 HydrophobicContact CG2-CB 3.81Å; I73-L113 HydrophobicContact CD1-CD1 3.59Å; I73-Y520 WeakPolarHBondContact CD1-O 3.48Å; I73-M524 HydrophobicContact CD1-CB 4.32Å; I73-M524 HydrophobicContact CG1-CB 3.63Å; I73-M524 HydrophobicContact CG1-CG 4.29Å
74	F	97.7	Very high	96	Very high	91 Å²	91	43.3 Å²	43.3	40%	0.399	24%	0.24	S	C	.	.	H	α-helix	trans	-60.1	-57.4	178.5	179.7	-91.9	0	0	0	111.5	D70 G76 L78 L106 A109 V110	D70-F74 WeakPolarHBondContact O-CB 3.47Å; D70-F74 PolarHBondContact O-N 3.48Å; F74-G76 PolarHBondContact O-N 3.41Å; F74-L78 HydrophobicContact CE1-CD2 4.11Å; F74-L78 HydrophobicContact CZ-CD2 4.38Å; F74-L78 WeakPolarHBondContact O-CB 3.42Å; F74-L78 PolarHBondContact O-N 3.34Å; F74-L106 HydrophobicContact CD2-CD1 3.54Å; F74-L106 HydrophobicContact CE2-CD1 3.88Å; F74-L106 HydrophobicContact CG-CD1 4.12Å; F74-L106 WeakPolarHBondContact O-CD1 3.48Å; F74-A109 HydrophobicContact CB-CB 4.1Å; F74-V110 HydrophobicContact CD2-CG2 3.88Å; F74-V110 HydrophobicContact CE2-CG2 3.82Å
75	G	96.7	Very high	96.1	Very high	35 Å²	35	44.5 Å²	44.5	36%	0.361	25%	0.245	S	C	.	.	H	α-helix	trans	-64.8	-42.8	-176	0	0	0	0	0	112.8	I71 L79	I71-G75 PolarHBondContact O-N 3.29Å; G75-L79 VanDerWaalsContact O-CB 3.32Å; G75-L79 WeakPolarHBondContact O-CB 3.31Å; G75-L79 PolarHBondContact O-N 2.94Å
76	G	96.8	Very high	96.2	Very high	14 Å²	14	43 Å²	43	14%	0.144	24%	0.24	C	C	.	.	H	α-helix	trans	-66.9	-46	-178.7	0	0	0	0	0	112.8	F72 F74 L79 V80 P527	F72-G76 WeakPolarHBondContact O-CA 3.27Å; F72-G76 PolarHBondContact O-N 3.02Å; F74-G76 PolarHBondContact O-N 3.41Å; G76-L79 WeakPolarHBondContact O-CB 3.42Å; G76-L79 PolarHBondContact O-N 2.88Å; G76-V80 WeakPolarHBondContact O-CG2 3.17Å; G76-V80 PolarHBondContact O-N 3.28Å; G76-P527 WeakPolarHBondContact O-CG 3.25Å
77	N	97.4	Very high	96.3	Very high	1 Å²	1	43.8 Å²	43.8	1%	0.005	25%	0.245	C	C	.	.	H	α-helix	trans	-72.4	-34.2	179.7	-72.8	-69.6	0	0	0	112	I73 L79 V80 I81 A102 D105 L106 S523	I73-N77 VanDerWaalsContact O-CB 3.32Å; I73-N77 WeakPolarHBondContact O-CB 3.33Å; I73-N77 PolarHBondContact O-N 3.4Å; I73-N77 VanDerWaalsContact O-N 3.07Å; I73-N77 PolarHBondContact O-ND2 3.47Å; N77-L79 VanDerWaalsContact C-N 3.29Å; N77-L79 PolarHBondContact O-N 2.99Å; N77-V80 PolarHBondContact O-N 3.28Å; N77-I81 WeakPolarHBondContact O-CG1 2.98Å; N77-I81 PolarHBondContact O-N 3.41Å; N77-I81 VanDerWaalsContact O-N 3.08Å; N77-A102 HydrophobicContact CB-CB 4.22Å; N77-D105 HydrophobicContact CB-CB 4.47Å; N77-L106 HydrophobicContact CB-CB 4.35Å; N77-S523 PolarHBondContact ND2-O 2.95Å
78	L	97.7	Very high	96.2	Very high	74 Å²	74	48 Å²	48	39%	0.387	26%	0.261	S	S	.	.	H	α-helix	trans	-61	-39.1	169.7	-176.7	62.4	0	0	0	111.7	F74 I81 S82 L106	F74-L78 HydrophobicContact CE1-CD2 4.11Å; F74-L78 HydrophobicContact CZ-CD2 4.38Å; F74-L78 WeakPolarHBondContact O-CB 3.42Å; F74-L78 PolarHBondContact O-N 3.34Å; L78-I81 PolarHBondContact O-N 3.37Å; L78-S82 VanDerWaalsContact O-CB 3.29Å; L78-S82 WeakPolarHBondContact O-CB 3.32Å; L78-S82 PolarHBondContact O-N 3.49Å; L78-S82 PolarHBondContact O-OG 3.5Å; L78-L106 HydrophobicContact CB-CD1 4.37Å
79	L	97.1	Very high	96	Very high	30 Å²	30	45.3 Å²	45.3	16%	0.157	25%	0.254	C	S	.	.	H	α-helix	trans	-66.2	-40.2	176.2	-171.9	68	0	0	0	112	G75 G76 N77 S82 A83 F541 L544 L545	G75-L79 VanDerWaalsContact O-CB 3.32Å; G75-L79 WeakPolarHBondContact O-CB 3.31Å; G75-L79 PolarHBondContact O-N 2.94Å; G76-L79 WeakPolarHBondContact O-CB 3.42Å; G76-L79 PolarHBondContact O-N 2.88Å; N77-L79 VanDerWaalsContact C-N 3.29Å; N77-L79 PolarHBondContact O-N 2.99Å; L79-S82 PolarHBondContact O-N 2.65Å; L79-A83 VanDerWaalsContact O-CB 3.31Å; L79-A83 WeakPolarHBondContact O-CB 3.45Å; L79-A83 PolarHBondContact O-N 3.15Å; L79-F541 HydrophobicContact CB-CE1 4.42Å; L79-F541 HydrophobicContact CD1-CD1 4.29Å; L79-F541 HydrophobicContact CD2-CB 3.99Å; L79-F541 HydrophobicContact CD2-CD1 3.73Å; L79-F541 HydrophobicContact CD2-CD2 3.75Å; L79-F541 HydrophobicContact CD2-CE1 4.07Å; L79-F541 HydrophobicContact CD2-CE2 4.1Å; L79-F541 HydrophobicContact CD2-CG 3.56Å; L79-F541 HydrophobicContact CD2-CZ 4.25Å; L79-F541 HydrophobicContact CG-CD1 3.57Å; L79-F541 HydrophobicContact CG-CD2 4.45Å; L79-F541 HydrophobicContact CG-CE1 3.71Å; L79-F541 HydrophobicContact CG-CG 3.97Å; L79-F541 HydrophobicContact CG-CZ 4.22Å; L79-L544 HydrophobicContact CD1-CB 3.86Å; L79-L544 HydrophobicContact CD1-CD1 3.84Å; L79-L545 HydrophobicContact CD1-CD2 4.23Å; L79-L545 HydrophobicContact CD1-CG 4.25Å; L79-L545 HydrophobicContact CD2-CD1 3.99Å; L79-L545 HydrophobicContact CD2-CG 4.32Å
80	V	97.3	Very high	95.9	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-57.3	-50.8	173.2	171.9	0	0	0	0	110.7	G76 N77 S82 A83 V84 I98 A102 P527 Y530 Y537 F541	G76-V80 WeakPolarHBondContact O-CG2 3.17Å; G76-V80 PolarHBondContact O-N 3.28Å; N77-V80 PolarHBondContact O-N 3.28Å; V80-S82 PolarHBondContact O-N 2.97Å; V80-A83 PolarHBondContact O-N 2.83Å; V80-V84 PolarHBondContact O-N 3.26Å; V80-I98 HydrophobicContact CG1-CG2 3.74Å; V80-A102 HydrophobicContact CB-CB 4.15Å; V80-A102 HydrophobicContact CG1-CB 3.87Å; V80-P527 HydrophobicContact CG2-CB 4.14Å; V80-P527 HydrophobicContact CG2-CG 4.09Å; V80-Y530 HydrophobicContact CG1-CD2 4.48Å; V80-Y530 HydrophobicContact CG2-CD2 3.91Å; V80-Y537 HydrophobicContact CG1-CE1 4.26Å; V80-F541 HydrophobicContact CG2-CZ 3.8Å
81	I	97.7	Very high	95.8	Very high	31 Å²	31	48.9 Å²	48.9	16%	0.159	26%	0.263	C	S	.	.	H	α-helix	trans	-60.8	-47.7	178.7	-63.6	168.8	0	0	0	110.1	N77 L78 A83 V84 V85 V99 A102 L106	N77-I81 WeakPolarHBondContact O-CG1 2.98Å; N77-I81 PolarHBondContact O-N 3.41Å; N77-I81 VanDerWaalsContact O-N 3.08Å; L78-I81 PolarHBondContact O-N 3.37Å; I81-A83 VanDerWaalsContact C-N 3.31Å; I81-A83 PolarHBondContact O-N 3.41Å; I81-V84 PolarHBondContact O-N 3.32Å; I81-V85 HydrophobicContact CG2-CG2 4.32Å; I81-V85 WeakPolarHBondContact O-CG2 3.29Å; I81-V85 PolarHBondContact O-N 2.86Å; I81-V99 HydrophobicContact CG1-CG1 4.42Å; I81-A102 HydrophobicContact CD1-CB 4.31Å; I81-A102 HydrophobicContact CG1-CB 3.9Å; I81-L106 HydrophobicContact CD1-CD2 4.08Å
82	S	97.1	Very high	95.6	Very high	41 Å²	41	45.9 Å²	45.9	29%	0.287	25%	0.245	S	C	.	.	H	α-helix	trans	-61.2	-38	179.5	-60.7	0	0	0	0	112.4	L78 L79 V80 V85 T86	L78-S82 VanDerWaalsContact O-CB 3.29Å; L78-S82 WeakPolarHBondContact O-CB 3.32Å; L78-S82 PolarHBondContact O-N 3.49Å; L78-S82 PolarHBondContact O-OG 3.5Å; L79-S82 PolarHBondContact O-N 2.65Å; V80-S82 PolarHBondContact O-N 2.97Å; S82-V85 PolarHBondContact O-N 3.4Å; S82-T86 WeakPolarHBondContact O-CB 3.33Å; S82-T86 VanDerWaalsContact O-CG2 3.27Å; S82-T86 WeakPolarHBondContact O-CG2 3.45Å; S82-T86 PolarHBondContact O-N 3.4Å; S82-T86 PolarHBondContact O-OG1 2.84Å
83	A	96.9	Very high	95.4	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-63.3	-44.4	177.7	0	0	0	0	0	112.1	L79 V80 I81 T86 T87 L90 Y537 A540 F541 L544	L79-A83 VanDerWaalsContact O-CB 3.31Å; L79-A83 WeakPolarHBondContact O-CB 3.45Å; L79-A83 PolarHBondContact O-N 3.15Å; V80-A83 PolarHBondContact O-N 2.83Å; I81-A83 VanDerWaalsContact C-N 3.31Å; I81-A83 PolarHBondContact O-N 3.41Å; A83-T86 PolarHBondContact O-OG1 2.84Å; A83-T87 WeakPolarHBondContact O-CB 3.44Å; A83-T87 PolarHBondContact O-N 2.92Å; A83-T87 PolarHBondContact O-OG1 3.06Å; A83-L90 HydrophobicContact CB-CD1 4.09Å; A83-Y537 HydrophobicContact CB-CD1 4.37Å; A83-A540 HydrophobicContact CB-CB 3.8Å; A83-F541 HydrophobicContact CB-CD1 3.83Å; A83-F541 HydrophobicContact CB-CE1 3.59Å; A83-L544 HydrophobicContact CB-CD1 4.04Å
84	V	96.6	Very high	95.2	Very high	8 Å²	8	42.9 Å²	42.9	5%	0.048	23%	0.234	C	C	.	.	H	α-helix	trans	-67.6	-43.3	176.8	174.9	0	0	0	0	110.9	V80 I81 T86 L90 R91 D95 V99 Y537	V80-V84 PolarHBondContact O-N 3.26Å; I81-V84 PolarHBondContact O-N 3.32Å; V84-T86 VanDerWaalsContact C-N 3.35Å; V84-T86 PolarHBondContact O-N 3.13Å; V84-L90 WeakPolarHBondContact CG1-O 3.04Å; V84-L90 HydrophobicContact CG2-CB 4.29Å; V84-R91 WeakPolarHBondContact O-CG 3.29Å; V84-D95 HydrophobicContact CG1-CB 4.35Å; V84-D95 HydrophobicContact CG2-CB 4.2Å; V84-V99 HydrophobicContact CB-CG2 3.68Å; V84-V99 HydrophobicContact CG1-CG2 3.64Å; V84-V99 HydrophobicContact CG2-CG2 3.76Å; V84-Y537 HydrophobicContact CG2-CE1 3.92Å; V84-Y537 WeakPolarHBondContact CG2-OH 3.33Å
85	V	95.9	Very high	95	Very high	90 Å²	90	38.7 Å²	38.7	55%	0.545	22%	0.215	S	C	.	.	H	α-helix	trans	-64.3	-38.7	178.6	172.8	0	0	0	0	111.3	I81 S82 R91	I81-V85 HydrophobicContact CG2-CG2 4.32Å; I81-V85 WeakPolarHBondContact O-CG2 3.29Å; I81-V85 PolarHBondContact O-N 2.86Å; S82-V85 PolarHBondContact O-N 3.4Å; V85-R91 PolarHBondContact O-NE 2.83Å; V85-R91 VanDerWaalsContact O-NE 3.11Å; V85-R91 PolarHBondContact O-NH2 3.36Å
86	T	95.1	Very high	94.9	Very high	70 Å²	70	38.9 Å²	38.9	43%	0.429	21%	0.208	S	C	.	.	H	α-helix	trans	-90.1	-27.9	-175	58.6	0	0	0	0	114.2	S82 A83 V84 L544	S82-T86 WeakPolarHBondContact O-CB 3.33Å; S82-T86 VanDerWaalsContact O-CG2 3.27Å; S82-T86 WeakPolarHBondContact O-CG2 3.45Å; S82-T86 PolarHBondContact O-N 3.4Å; S82-T86 PolarHBondContact O-OG1 2.84Å; A83-T86 PolarHBondContact O-OG1 2.84Å; V84-T86 VanDerWaalsContact C-N 3.35Å; V84-T86 PolarHBondContact O-N 3.13Å; T86-L544 HydrophobicContact CG2-CD2 4.08Å
87	T	94.8	Very high	94.9	Very high	22 Å²	22	38.4 Å²	38.4	14%	0.135	20%	0.202	C	C	.	.			trans	-98.8	113.5	-173.6	-44.2	0	0	0	0	111.5	A83 G89 L90 A540 R543	A83-T87 WeakPolarHBondContact O-CB 3.44Å; A83-T87 PolarHBondContact O-N 2.92Å; A83-T87 PolarHBondContact O-OG1 3.06Å; T87-G89 VanDerWaalsContact C-N 3.28Å; T87-G89 PolarHBondContact O-N 3.22Å; T87-L90 HydrophobicContact CG2-CD1 4.25Å; T87-L90 HydrophobicContact CG2-CG 4.07Å; T87-L90 PolarHBondContact O-N 3.48Å; T87-A540 WeakPolarHBondContact OG1-CB 3.26Å; T87-R543 PolarHBondContact OG1-NH2 2.84Å
88	K	92.6	Very high	94.8	Very high	165 Å²	165	39.1 Å²	39.1	72%	0.717	21%	0.205	S	C	*	.	G	3₁₀ helix	trans	-54	-42	178.6	-68.7	-178.7	-178.5	174.1	0	113	L90 R91	K88-L90 PolarHBondContact O-N 3.23Å; K88-R91 PolarHBondContact O-N 3Å
89	G	90.3	Very high	94.8	Very high	31 Å²	31	37.3 Å²	37.3	32%	0.32	20%	0.197	S	C	.	.	G	3₁₀ helix	trans	-67.7	-12.5	179.7	0	0	0	0	0	115.7	T87 R92	T87-G89 VanDerWaalsContact C-N 3.28Å; T87-G89 PolarHBondContact O-N 3.22Å; G89-R92 PolarHBondContact O-NE 3.31Å
90	L	92.1	Very high	94.8	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	19%	0.192	C	C	.	.	G	3₁₀ helix	trans	-101.6	1.9	176.1	-66.6	178.5	0	0	0	112.9	A83 V84 T87 K88 R92 D95 E536 Y537 A540	A83-L90 HydrophobicContact CB-CD1 4.09Å; V84-L90 WeakPolarHBondContact CG1-O 3.04Å; V84-L90 HydrophobicContact CG2-CB 4.29Å; T87-L90 HydrophobicContact CG2-CD1 4.25Å; T87-L90 HydrophobicContact CG2-CG 4.07Å; T87-L90 PolarHBondContact O-N 3.48Å; K88-L90 PolarHBondContact O-N 3.23Å; L90-R92 PolarHBondContact O-N 3.29Å; L90-R92 VanDerWaalsContact O-N 3.12Å; L90-D95 WeakPolarHBondContact O-CB 3.49Å; L90-E536 HydrophobicContact CD2-CB 3.64Å; L90-E536 HydrophobicContact CG-CB 4.48Å; L90-Y537 HydrophobicContact CD1-CD1 4.08Å; L90-Y537 HydrophobicContact CD1-CD2 4.48Å; L90-Y537 HydrophobicContact CD1-CE1 4.19Å; L90-Y537 HydrophobicContact CD1-CG 4.23Å; L90-Y537 HydrophobicContact CD2-CD2 3.82Å; L90-Y537 HydrophobicContact CD2-CE2 3.68Å; L90-Y537 HydrophobicContact CD2-CG 4.38Å; L90-A540 HydrophobicContact CD1-CB 3.78Å
91	R	93.1	Very high	94.8	Very high	122 Å²	122	36.3 Å²	36.3	46%	0.46	19%	0.192	S	C	.	.			trans	-86.6	35.9	180	-63.9	180	-171	171.4	3.2	112.8	V84 V85 K88	V84-R91 WeakPolarHBondContact O-CG 3.29Å; V85-R91 PolarHBondContact O-NE 2.83Å; V85-R91 VanDerWaalsContact O-NE 3.11Å; V85-R91 PolarHBondContact O-NH2 3.36Å; K88-R91 PolarHBondContact O-N 3Å
92	R	91.6	Very high	94.8	Very high	42 Å²	42	35 Å²	35	16%	0.158	19%	0.186	C	C	.	.	S	Bend	trans	-84.8	162.7	-180	-53.2	164.7	-64.7	-162.7	-2	110	G89 L90 T94 D95 L96	G89-R92 PolarHBondContact O-NE 3.31Å; L90-R92 PolarHBondContact O-N 3.29Å; L90-R92 VanDerWaalsContact O-N 3.12Å; R92-T94 PolarHBondContact O-N 3.12Å; R92-D95 VanDerWaalsContact CB-OD2 3.29Å; R92-D95 WeakPolarHBondContact CB-OD2 3.39Å; R92-D95 IonicContact CZ-OD2 2.72Å; R92-D95 PolarHBondContact N-OD2 3.44Å; R92-D95 IonicContact NE-OD2 3.83Å; R92-D95 PolarHBondContact NE-OD2 2.9Å; R92-D95 IonicContact NH2-OD1 3.68Å; R92-D95 PolarHBondContact NH2-OD1 2.75Å; R92-D95 IonicContact NH2-OD2 3.66Å; R92-D95 PolarHBondContact NH2-OD2 3.47Å; R92-D95 PolarHBondContact O-N 2.77Å; R92-D95 VanDerWaalsContact O-N 3.09Å; R92-L96 PolarHBondContact O-N 2.76Å
93	I	92.5	Very high	94.8	Very high	17 Å²	17	36.5 Å²	36.5	9%	0.087	19%	0.191	C	C	.	.	H	α-helix	trans	-60	-36.5	-178	-64.1	170.6	0	0	0	111.8	D95 L96 R172 R174 A177	I93-D95 VanDerWaalsContact C-N 3.3Å; I93-D95 PolarHBondContact O-N 3.43Å; I93-L96 WeakPolarHBondContact O-CB 3.36Å; I93-L96 PolarHBondContact O-N 3.37Å; I93-R172 HydrophobicContact CB-CG 4.15Å; I93-R172 HydrophobicContact CD1-CG 3.73Å; I93-R172 WeakPolarHBondContact CD1-O 3.33Å; I93-R172 HydrophobicContact CG2-CG 3.86Å; I93-R174 HydrophobicContact CD1-CG 4.43Å; I93-R174 HydrophobicContact CG1-CG 4.02Å; I93-A177 HydrophobicContact CG2-CB 3.7Å
94	T	91.2	Very high	94.8	Very high	17 Å²	17	36.5 Å²	36.5	10%	0.104	19%	0.191	C	C	.	.	H	α-helix	trans	-63.5	-36.5	177.4	49.8	0	0	0	0	112.8	R92 L96 Y97 Y168	R92-T94 PolarHBondContact O-N 3.12Å; T94-L96 VanDerWaalsContact C-N 3.26Å; T94-L96 PolarHBondContact O-N 3.3Å; T94-Y97 PolarHBondContact O-N 3.23Å; T94-Y168 WeakPolarHBondContact CG2-OH 3.44Å
95	D	93.9	Very high	94.8	Very high	3 Å²	3	36.1 Å²	36.1	2%	0.016	19%	0.189	C	C	.	.	H	α-helix	trans	-72.6	-21	-179.7	-59.6	-65.4	0	0	0	111.5	V84 L90 R92 I93 Y97 I98 V99 Y537	V84-D95 HydrophobicContact CG1-CB 4.35Å; V84-D95 HydrophobicContact CG2-CB 4.2Å; L90-D95 WeakPolarHBondContact O-CB 3.49Å; R92-D95 VanDerWaalsContact CB-OD2 3.29Å; R92-D95 WeakPolarHBondContact CB-OD2 3.39Å; R92-D95 IonicContact CZ-OD2 2.72Å; R92-D95 PolarHBondContact N-OD2 3.44Å; R92-D95 IonicContact NE-OD2 3.83Å; R92-D95 PolarHBondContact NE-OD2 2.9Å; R92-D95 IonicContact NH2-OD1 3.68Å; R92-D95 PolarHBondContact NH2-OD1 2.75Å; R92-D95 IonicContact NH2-OD2 3.66Å; R92-D95 PolarHBondContact NH2-OD2 3.47Å; R92-D95 PolarHBondContact O-N 2.77Å; R92-D95 VanDerWaalsContact O-N 3.09Å; I93-D95 VanDerWaalsContact C-N 3.3Å; I93-D95 PolarHBondContact O-N 3.43Å; D95-Y97 VanDerWaalsContact C-N 3.32Å; D95-Y97 PolarHBondContact O-N 3.28Å; D95-I98 WeakPolarHBondContact O-CB 3.49Å; D95-I98 PolarHBondContact O-N 3.33Å; D95-V99 WeakPolarHBondContact O-CG2 3.11Å; D95-V99 PolarHBondContact O-N 3.41Å; D95-Y537 WeakPolarHBondContact OD1-CE2 3.46Å; D95-Y537 PolarHBondContact OD1-OH 2.69Å
96	L	95.7	Very high	94.9	Very high	38 Å²	38	33 Å²	33	20%	0.199	17%	0.169	C	C	.	.	H	α-helix	trans	-63.1	-37.4	172.8	-62.4	178.1	0	0	0	112.3	R92 I93 T94 I98 V99 S100 R174 F178 I181	R92-L96 PolarHBondContact O-N 2.76Å; I93-L96 WeakPolarHBondContact O-CB 3.36Å; I93-L96 PolarHBondContact O-N 3.37Å; T94-L96 VanDerWaalsContact C-N 3.26Å; T94-L96 PolarHBondContact O-N 3.3Å; L96-I98 VanDerWaalsContact C-N 3.34Å; L96-V99 PolarHBondContact O-N 3.43Å; L96-S100 PolarHBondContact O-N 2.95Å; L96-R174 HydrophobicContact CD1-CG 4.32Å; L96-F178 HydrophobicContact CD1-CZ 4.39Å; L96-I181 HydrophobicContact CB-CD1 4.26Å
97	Y	96.2	Very high	95	Very high	5 Å²	5	32.1 Å²	32.1	2%	0.02	16%	0.161	C	C	.	.	H	α-helix	trans	-68	-36.7	175	-62.1	-78.1	0	0	0	111.7	T94 D95 S100 L101 C153 I154 D157 A177 M180 I181	T94-Y97 PolarHBondContact O-N 3.23Å; D95-Y97 VanDerWaalsContact C-N 3.32Å; D95-Y97 PolarHBondContact O-N 3.28Å; Y97-S100 PolarHBondContact O-N 2.85Å; Y97-L101 PolarHBondContact O-N 3.44Å; Y97-C153 HydrophobicContact CD1-CB 3.97Å; Y97-C153 HydrophobicContact CE1-CB 4.01Å; Y97-I154 HydrophobicContact CG-CG1 4.36Å; Y97-D157 HydrophobicContact CE2-CB 4.05Å; Y97-A177 HydrophobicContact CE1-CB 4.46Å; Y97-A177 HydrophobicContact CE2-CB 4.1Å; Y97-A177 WeakPolarHBondContact OH-CA 3.42Å; Y97-M180 HydrophobicContact CE1-CB 3.98Å; Y97-M180 HydrophobicContact CE1-CE 4.24Å; Y97-M180 HydrophobicContact CE1-SD 4.37Å; Y97-M180 PolarHBondContact OH-SD 3.41Å; Y97-I181 HydrophobicContact CD1-CD1 4.04Å; Y97-I181 HydrophobicContact CD1-CG1 3.74Å; Y97-I181 HydrophobicContact CE1-CD1 4.42Å; Y97-I181 HydrophobicContact CE1-CG1 4.01Å
98	I	95.7	Very high	95.1	Very high	15 Å²	15	31.3 Å²	31.3	8%	0.077	16%	0.156	C	C	.	.	H	α-helix	trans	-64.5	-43.1	175.1	-64.5	174	0	0	0	110.4	V80 D95 L96 S100 L101 A102 Y530 Y537	V80-I98 HydrophobicContact CG1-CG2 3.74Å; D95-I98 WeakPolarHBondContact O-CB 3.49Å; D95-I98 PolarHBondContact O-N 3.33Å; L96-I98 VanDerWaalsContact C-N 3.34Å; I98-S100 VanDerWaalsContact C-N 3.35Å; I98-S100 PolarHBondContact O-N 3.38Å; I98-L101 PolarHBondContact O-N 3.12Å; I98-A102 WeakPolarHBondContact O-CB 3.1Å; I98-A102 PolarHBondContact O-N 3.24Å; I98-Y530 HydrophobicContact CD1-CE1 3.84Å; I98-Y530 HydrophobicContact CG1-CE1 4.28Å; I98-Y530 HydrophobicContact CG2-CD2 4.4Å; I98-Y530 HydrophobicContact CG2-CE1 4.15Å; I98-Y530 HydrophobicContact CG2-CE2 3.71Å; I98-Y537 HydrophobicContact CD1-CE2 4.42Å
99	V	97.1	Very high	95.2	Very high	36 Å²	36	23.6 Å²	23.6	22%	0.218	12%	0.123	C	C	.	.	H	α-helix	trans	-61.5	-42.1	174.9	170.2	0	0	0	0	111.6	I81 V84 D95 L96 A102 L103	I81-V99 HydrophobicContact CG1-CG1 4.42Å; V84-V99 HydrophobicContact CB-CG2 3.68Å; V84-V99 HydrophobicContact CG1-CG2 3.64Å; V84-V99 HydrophobicContact CG2-CG2 3.76Å; D95-V99 WeakPolarHBondContact O-CG2 3.11Å; D95-V99 PolarHBondContact O-N 3.41Å; L96-V99 PolarHBondContact O-N 3.43Å; V99-A102 PolarHBondContact O-N 3.23Å; V99-L103 WeakPolarHBondContact O-CB 3.27Å; V99-L103 PolarHBondContact O-N 3.46Å
100	S	97.8	Very high	95.6	Very high	8 Å²	8	25.7 Å²	25.7	6%	0.056	13%	0.129	C	C	.	.	H	α-helix	trans	-62.6	-41.3	177	-177.4	0	0	0	0	112.2	L96 Y97 I98 L103 A104 N150 I181 W185	L96-S100 PolarHBondContact O-N 2.95Å; Y97-S100 PolarHBondContact O-N 2.85Å; I98-S100 VanDerWaalsContact C-N 3.35Å; I98-S100 PolarHBondContact O-N 3.38Å; S100-L103 PolarHBondContact O-N 3.01Å; S100-A104 PolarHBondContact O-N 2.92Å; S100-A104 VanDerWaalsContact O-N 3.16Å; S100-N150 VanDerWaalsContact CB-OD1 3.25Å; S100-N150 WeakPolarHBondContact CB-OD1 3.44Å; S100-N150 PolarHBondContact OG-ND2 3.29Å; S100-N150 PolarHBondContact OG-OD1 3.28Å; S100-I181 VanDerWaalsContact OG-CG2 3.31Å; S100-I181 WeakPolarHBondContact OG-CG2 3.45Å; S100-W185 PolarHBondContact OG-NE1 3.1Å
101	L	96.6	Very high	95.7	Very high	1 Å²	1	29.1 Å²	29.1	1%	0.005	15%	0.147	C	C	.	.	H	α-helix	trans	-63.9	-48.1	173.9	-178.1	62.2	0	0	0	111.6	Y97 I98 L103 A104 D105 N150 L151 I154 V482	Y97-L101 PolarHBondContact O-N 3.44Å; I98-L101 PolarHBondContact O-N 3.12Å; L101-L103 PolarHBondContact O-N 3.36Å; L101-A104 WeakPolarHBondContact O-CB 3.33Å; L101-A104 PolarHBondContact O-N 3.17Å; L101-A104 VanDerWaalsContact O-N 3.07Å; L101-D105 PolarHBondContact O-N 3.3Å; L101-N150 HydrophobicContact CB-CB 4.27Å; L101-N150 HydrophobicContact CD1-CB 4.13Å; L101-L151 HydrophobicContact CD1-CG 4.36Å; L101-L151 HydrophobicContact CD2-CD2 3.83Å; L101-L151 HydrophobicContact CD2-CG 4.41Å; L101-I154 HydrophobicContact CD2-CD1 4.06Å; L101-V482 HydrophobicContact CD2-CG1 4.5Å
102	A	97.5	Very high	95.8	Very high	3 Å²	3	23.3 Å²	23.3	3%	0.025	13%	0.126	C	C	.	.	H	α-helix	trans	-60.9	-33	177.7	0	0	0	0	0	112.5	N77 V80 I81 I98 V99 L106	N77-A102 HydrophobicContact CB-CB 4.22Å; V80-A102 HydrophobicContact CB-CB 4.15Å; V80-A102 HydrophobicContact CG1-CB 3.87Å; I81-A102 HydrophobicContact CD1-CB 4.31Å; I81-A102 HydrophobicContact CG1-CB 3.9Å; I98-A102 WeakPolarHBondContact O-CB 3.1Å; I98-A102 PolarHBondContact O-N 3.24Å; V99-A102 PolarHBondContact O-N 3.23Å; A102-L106 WeakPolarHBondContact O-CB 3.04Å; A102-L106 PolarHBondContact O-N 3.37Å
103	L	97.9	Very high	95.9	Very high	74 Å²	74	21.4 Å²	21.4	39%	0.387	12%	0.118	S	C	.	.	H	α-helix	trans	-67.1	-42.1	173.7	-179.7	63	0	0	0	111.8	V99 S100 L101 L106 L107 W185	V99-L103 WeakPolarHBondContact O-CB 3.27Å; V99-L103 PolarHBondContact O-N 3.46Å; S100-L103 PolarHBondContact O-N 3.01Å; L101-L103 PolarHBondContact O-N 3.36Å; L103-L106 PolarHBondContact O-N 3.19Å; L103-L107 HydrophobicContact CD1-CG 4.46Å; L103-L107 HydrophobicContact CG-CD1 4.41Å; L103-L107 VanDerWaalsContact O-CG 3.29Å; L103-L107 WeakPolarHBondContact O-CG 3.41Å; L103-L107 PolarHBondContact O-N 2.97Å; L103-W185 HydrophobicContact CD2-CZ2 4.27Å; L103-W185 HydrophobicContact CG-CZ2 4.37Å
104	A	97.3	Very high	96	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-61.9	-46.3	175.2	0	0	0	0	0	111.3	S100 L101 L106 L107 V108 A146 S147 W185	S100-A104 PolarHBondContact O-N 2.92Å; S100-A104 VanDerWaalsContact O-N 3.16Å; L101-A104 WeakPolarHBondContact O-CB 3.33Å; L101-A104 PolarHBondContact O-N 3.17Å; L101-A104 VanDerWaalsContact O-N 3.07Å; A104-L106 PolarHBondContact O-N 3.38Å; A104-L107 PolarHBondContact O-N 3.38Å; A104-V108 WeakPolarHBondContact O-CG2 3.38Å; A104-V108 PolarHBondContact O-N 3.34Å; A104-V108 VanDerWaalsContact O-N 3.1Å; A104-A146 HydrophobicContact CB-CB 4.3Å; A104-S147 WeakPolarHBondContact CB-OG 3.5Å; A104-W185 HydrophobicContact CB-CH2 3.88Å; A104-W185 HydrophobicContact CB-CZ2 4.08Å
105	D	96.7	Very high	96.1	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-62.9	-39.9	176.9	-71.6	-32.6	0	0	0	112.4	N77 L101 V108 A109 S523 N526	N77-D105 HydrophobicContact CB-CB 4.47Å; L101-D105 PolarHBondContact O-N 3.3Å; D105-V108 WeakPolarHBondContact O-CB 3.43Å; D105-V108 PolarHBondContact O-N 3.02Å; D105-A109 PolarHBondContact O-N 3.07Å; D105-S523 VanDerWaalsContact OD1-CB 3.23Å; D105-S523 WeakPolarHBondContact OD1-CB 3.29Å; D105-S523 PolarHBondContact OD1-OG 3.06Å; D105-N526 PolarHBondContact OD2-ND2 3.29Å
106	L	97.1	Very high	95.9	Very high	24 Å²	24	23.8 Å²	23.8	13%	0.126	13%	0.134	C	C	.	.	H	α-helix	trans	-64.5	-40.6	175.8	-175.1	68.7	0	0	0	111.7	F74 N77 L78 I81 A102 L103 A104 V108 A109 V110	F74-L106 HydrophobicContact CD2-CD1 3.54Å; F74-L106 HydrophobicContact CE2-CD1 3.88Å; F74-L106 HydrophobicContact CG-CD1 4.12Å; F74-L106 WeakPolarHBondContact O-CD1 3.48Å; N77-L106 HydrophobicContact CB-CB 4.35Å; L78-L106 HydrophobicContact CB-CD1 4.37Å; I81-L106 HydrophobicContact CD1-CD2 4.08Å; A102-L106 WeakPolarHBondContact O-CB 3.04Å; A102-L106 PolarHBondContact O-N 3.37Å; L103-L106 PolarHBondContact O-N 3.19Å; A104-L106 PolarHBondContact O-N 3.38Å; L106-V108 VanDerWaalsContact C-N 3.29Å; L106-V108 PolarHBondContact O-N 3.14Å; L106-A109 PolarHBondContact O-N 3.29Å; L106-V110 WeakPolarHBondContact O-CG2 3.41Å; L106-V110 PolarHBondContact O-N 3.4Å
107	L	97.3	Very high	95.8	Very high	52 Å²	52	22.8 Å²	22.8	27%	0.272	13%	0.128	S	C	.	.	H	α-helix	trans	-66.2	-31.7	176.4	-71.4	173.7	0	0	0	112.1	L103 A104 V110 L111 L143 W185	L103-L107 HydrophobicContact CD1-CG 4.46Å; L103-L107 HydrophobicContact CG-CD1 4.41Å; L103-L107 VanDerWaalsContact O-CG 3.29Å; L103-L107 WeakPolarHBondContact O-CG 3.41Å; L103-L107 PolarHBondContact O-N 2.97Å; A104-L107 PolarHBondContact O-N 3.38Å; L107-V110 PolarHBondContact O-N 3.25Å; L107-L111 HydrophobicContact CB-CD1 4.48Å; L107-L111 HydrophobicContact CD2-CD1 4.07Å; L107-L111 WeakPolarHBondContact O-CB 3.44Å; L107-L111 PolarHBondContact O-N 3.32Å; L107-L143 HydrophobicContact CB-CD1 3.91Å; L107-L143 HydrophobicContact CB-CD2 3.69Å; L107-L143 HydrophobicContact CB-CG 4.47Å; L107-L143 HydrophobicContact CD1-CD2 3.92Å; L107-L143 HydrophobicContact CG-CD2 4.48Å; L107-W185 HydrophobicContact CD1-CH2 3.95Å; L107-W185 HydrophobicContact CD1-CZ3 4.28Å
108	V	96	Very high	95.6	Very high	4 Å²	4	26.5 Å²	26.5	2%	0.024	15%	0.147	C	C	.	.	H	α-helix	trans	-62.5	-46.9	172.3	170.6	0	0	0	0	110.4	A104 D105 L106 V110 V112 L113 L143 Y520	A104-V108 WeakPolarHBondContact O-CG2 3.38Å; A104-V108 PolarHBondContact O-N 3.34Å; A104-V108 VanDerWaalsContact O-N 3.1Å; D105-V108 WeakPolarHBondContact O-CB 3.43Å; D105-V108 PolarHBondContact O-N 3.02Å; L106-V108 VanDerWaalsContact C-N 3.29Å; L106-V108 PolarHBondContact O-N 3.14Å; V108-V110 VanDerWaalsContact C-N 3.32Å; V108-V110 PolarHBondContact O-N 2.68Å; V108-V112 HydrophobicContact CG1-CB 4.23Å; V108-V112 WeakPolarHBondContact O-CA 3.41Å; V108-V112 WeakPolarHBondContact O-CB 3.32Å; V108-V112 PolarHBondContact O-N 2.88Å; V108-L113 HydrophobicContact CG1-CD1 4.37Å; V108-L113 HydrophobicContact CG1-CD2 4.3Å; V108-L113 HydrophobicContact CG1-CG 3.99Å; V108-L113 PolarHBondContact O-N 3.28Å; V108-L143 HydrophobicContact CG2-CB 3.6Å; V108-L143 HydrophobicContact CG2-CD1 3.99Å; V108-L143 HydrophobicContact CG2-CG 4.4Å; V108-Y520 HydrophobicContact CG1-CD1 3.99Å; V108-Y520 HydrophobicContact CG1-CE1 4.16Å
109	A	96.4	Very high	95.2	Very high	3 Å²	3	27.1 Å²	27.1	3%	0.025	15%	0.148	C	C	.	.	H	α-helix	trans	-62.5	-36.2	176.9	0	0	0	0	0	113.3	D70 I73 F74 D105 L106 L113 P114	D70-A109 VanDerWaalsContact OD1-CA 3.28Å; D70-A109 WeakPolarHBondContact OD1-CA 3.45Å; D70-A109 VanDerWaalsContact OD1-CB 3.29Å; D70-A109 WeakPolarHBondContact OD1-CB 3.41Å; I73-A109 HydrophobicContact CB-CB 4.26Å; I73-A109 HydrophobicContact CG2-CB 3.81Å; F74-A109 HydrophobicContact CB-CB 4.1Å; D105-A109 PolarHBondContact O-N 3.07Å; L106-A109 PolarHBondContact O-N 3.29Å; A109-L113 HydrophobicContact CB-CD1 4.47Å; A109-P114 WeakPolarHBondContact O-CD 3.14Å; A109-P114 WeakPolarHBondContact O-CG 3.46Å
110	V	96.9	Very high	94.8	Very high	75 Å²	75	27.4 Å²	27.4	46%	0.455	15%	0.147	S	C	.	.	H	α-helix	trans	-80.6	-38.8	-178.7	176.1	0	0	0	0	112.5	F74 L106 L107 V108	F74-V110 HydrophobicContact CD2-CG2 3.88Å; F74-V110 HydrophobicContact CE2-CG2 3.82Å; L106-V110 WeakPolarHBondContact O-CG2 3.41Å; L106-V110 PolarHBondContact O-N 3.4Å; L107-V110 PolarHBondContact O-N 3.25Å; V108-V110 VanDerWaalsContact C-N 3.32Å; V108-V110 PolarHBondContact O-N 2.68Å
111	L	95.4	Very high	94.5	Very high	73 Å²	73	30.7 Å²	30.7	38%	0.382	17%	0.167	S	C	.	.	H	α-helix	trans	-112.4	-25.6	-165.1	-55.2	172.5	0	0	0	114.6	L107 L139	L107-L111 HydrophobicContact CB-CD1 4.48Å; L107-L111 HydrophobicContact CD2-CD1 4.07Å; L107-L111 WeakPolarHBondContact O-CB 3.44Å; L107-L111 PolarHBondContact O-N 3.32Å; L111-L139 HydrophobicContact CB-CD2 3.29Å; L111-L139 HydrophobicContact CD1-CD1 4.46Å; L111-L139 HydrophobicContact CD1-CD2 3.76Å; L111-L139 HydrophobicContact CG-CD2 4.11Å
112	V	94.5	Very high	94.2	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.7	-49.9	-173.3	177.5	0	0	0	0	111.3	V108 S116 W136 L139 N140 L143 Y520	V108-V112 HydrophobicContact CG1-CB 4.23Å; V108-V112 WeakPolarHBondContact O-CA 3.41Å; V108-V112 WeakPolarHBondContact O-CB 3.32Å; V108-V112 PolarHBondContact O-N 2.88Å; V112-S116 PolarHBondContact O-N 3.19Å; V112-S116 VanDerWaalsContact O-N 3.12Å; V112-W136 PolarHBondContact O-NE1 3.09Å; V112-L139 HydrophobicContact CG2-CD2 4.27Å; V112-L139 HydrophobicContact CG2-CG 4.38Å; V112-N140 HydrophobicContact CG1-CB 3.96Å; V112-N140 HydrophobicContact CG2-CB 4.32Å; V112-L143 HydrophobicContact CG2-CD1 3.82Å; V112-Y520 HydrophobicContact CG1-CE1 4.28Å
113	L	94.2	Very high	93.6	Very high	1 Å²	1	39.1 Å²	39.1	1%	0.005	22%	0.217	C	C	.	.	H	α-helix	trans	-64.6	-41.9	-173.7	-64.7	-175.3	0	0	0	113.9	D70 I73 V108 A109 L115 S116 I117 W517 Y520	D70-L113 HydrophobicContact CB-CB 4.44Å; D70-L113 HydrophobicContact CB-CD1 4.14Å; D70-L113 WeakPolarHBondContact OD1-CD1 3.2Å; I73-L113 HydrophobicContact CD1-CD1 3.59Å; V108-L113 HydrophobicContact CG1-CD1 4.37Å; V108-L113 HydrophobicContact CG1-CD2 4.3Å; V108-L113 HydrophobicContact CG1-CG 3.99Å; V108-L113 PolarHBondContact O-N 3.28Å; A109-L113 HydrophobicContact CB-CD1 4.47Å; L113-L115 VanDerWaalsContact C-N 3.34Å; L113-L115 PolarHBondContact O-N 3.29Å; L113-S116 WeakPolarHBondContact O-CA 3.03Å; L113-S116 WeakPolarHBondContact O-CB 3.49Å; L113-S116 PolarHBondContact O-N 3Å; L113-S116 VanDerWaalsContact O-N 3.1Å; L113-I117 WeakPolarHBondContact O-CG1 3.36Å; L113-I117 PolarHBondContact O-N 3.03Å; L113-W517 HydrophobicContact CD2-CH2 4.12Å; L113-W517 HydrophobicContact CD2-CZ3 3.92Å; L113-Y520 HydrophobicContact CD2-CD1 3.71Å; L113-Y520 HydrophobicContact CD2-CD2 3.88Å; L113-Y520 HydrophobicContact CD2-CE1 4.02Å; L113-Y520 HydrophobicContact CD2-CE2 4.2Å; L113-Y520 HydrophobicContact CD2-CG 3.65Å
114	P	94.5	Very high	93	Very high	49 Å²	49	40.8 Å²	40.8	32%	0.318	22%	0.219	S	C	.	.	H	α-helix	trans	-62.3	-40.9	-178.5	-27	37.3	0	0	0	112.6	A109 I117 M118	A109-P114 WeakPolarHBondContact O-CD 3.14Å; A109-P114 WeakPolarHBondContact O-CG 3.46Å; P114-I117 PolarHBondContact O-N 3.43Å; P114-M118 WeakPolarHBondContact O-CG 3.22Å; P114-M118 PolarHBondContact O-N 2.78Å
115	L	93.1	Very high	92.6	Very high	34 Å²	34	41 Å²	41	18%	0.178	22%	0.219	C	C	.	.	H	α-helix	trans	-70.2	-33.4	175.9	-67.6	178.3	0	0	0	112.1	L113 M118 R119 W125 Y127 L132 W136	L113-L115 VanDerWaalsContact C-N 3.34Å; L113-L115 PolarHBondContact O-N 3.29Å; L115-M118 PolarHBondContact O-N 3.14Å; L115-R119 WeakPolarHBondContact O-CB 3.48Å; L115-R119 PolarHBondContact O-N 3.3Å; L115-W125 HydrophobicContact CD1-CH2 4.5Å; L115-Y127 HydrophobicContact CD2-CE2 3.71Å; L115-L132 HydrophobicContact CD1-CD1 4.28Å; L115-W136 HydrophobicContact CB-CD2 4.49Å; L115-W136 HydrophobicContact CB-CG 4.19Å; L115-W136 HydrophobicContact CD1-CB 4Å; L115-W136 HydrophobicContact CD1-CG 3.93Å
116	S	90.7	Very high	92.2	Very high	5 Å²	5	42.5 Å²	42.5	4%	0.035	23%	0.229	C	C	.	.	H	α-helix	trans	-63.6	-45.9	172.7	-166.7	0	0	0	0	111.6	V112 L113 R119 Q120 W517	V112-S116 PolarHBondContact O-N 3.19Å; V112-S116 VanDerWaalsContact O-N 3.12Å; L113-S116 WeakPolarHBondContact O-CA 3.03Å; L113-S116 WeakPolarHBondContact O-CB 3.49Å; L113-S116 PolarHBondContact O-N 3Å; L113-S116 VanDerWaalsContact O-N 3.1Å; S116-R119 PolarHBondContact O-N 2.72Å; S116-Q120 PolarHBondContact O-N 2.84Å; S116-W517 VanDerWaalsContact OG-CZ2 3.31Å; S116-W517 WeakPolarHBondContact OG-CZ2 3.4Å
117	I	92.5	Very high	91.8	Very high	17 Å²	17	44.9 Å²	44.9	9%	0.087	24%	0.237	C	C	.	.	H	α-helix	trans	-62.5	-45.2	176.7	-66.7	164.2	0	0	0	110.2	I63 Q66 I67 D70 L113 P114 R119 Q120 V121 W517	I63-I117 HydrophobicContact CG2-CG2 4.48Å; Q66-I117 HydrophobicContact CB-CD1 4.37Å; Q66-I117 HydrophobicContact CB-CG1 3.98Å; I67-I117 HydrophobicContact CD1-CG2 4.43Å; I67-I117 HydrophobicContact CG1-CD1 4.12Å; I67-I117 HydrophobicContact CG1-CG2 4.01Å; D70-I117 HydrophobicContact CB-CD1 4.24Å; L113-I117 WeakPolarHBondContact O-CG1 3.36Å; L113-I117 PolarHBondContact O-N 3.03Å; P114-I117 PolarHBondContact O-N 3.43Å; I117-R119 PolarHBondContact O-N 3.26Å; I117-Q120 WeakPolarHBondContact O-CB 3.27Å; I117-Q120 PolarHBondContact O-N 2.99Å; I117-Q120 VanDerWaalsContact O-N 3.08Å; I117-V121 HydrophobicContact CG2-CG2 4.22Å; I117-V121 VanDerWaalsContact O-CG2 3.3Å; I117-V121 WeakPolarHBondContact O-CG2 3.39Å; I117-V121 PolarHBondContact O-N 3.45Å; I117-W517 HydrophobicContact CG1-CH2 4.31Å
118	M	92.4	Very high	91.1	Very high	83 Å²	83	49.7 Å²	49.7	41%	0.409	26%	0.258	S	S	.	.	H	α-helix	trans	-58.8	-47.1	176.9	-74.5	-64.4	-168.3	0	0	111.9	P114 L115 Q120 V121 Y122	P114-M118 WeakPolarHBondContact O-CG 3.22Å; P114-M118 PolarHBondContact O-N 2.78Å; L115-M118 PolarHBondContact O-N 3.14Å; M118-Q120 VanDerWaalsContact C-N 3.26Å; M118-Q120 PolarHBondContact O-N 3.07Å; M118-V121 PolarHBondContact O-N 3.25Å; M118-Y122 VanDerWaalsContact O-CD2 3.27Å; M118-Y122 WeakPolarHBondContact O-CD2 3.38Å; M118-Y122 PolarHBondContact O-N 3.49Å; M118-Y122 HydrophobicContact SD-CE2 4.27Å
119	R	88.3	Confident	90.6	Very high	27 Å²	27	52.2 Å²	52.2	10%	0.102	28%	0.276	C	S	.	.	H	α-helix	trans	-57.6	-39.2	174.2	173.3	-177.4	155.4	172.1	-2.6	112	L115 S116 I117 G123 Y124 W125 W136 C208 E509	L115-R119 WeakPolarHBondContact O-CB 3.48Å; L115-R119 PolarHBondContact O-N 3.3Å; S116-R119 PolarHBondContact O-N 2.72Å; I117-R119 PolarHBondContact O-N 3.26Å; R119-G123 WeakPolarHBondContact O-CA 3.37Å; R119-G123 PolarHBondContact O-N 2.9Å; R119-Y124 PolarHBondContact O-N 2.92Å; R119-W125 HydrophobicContact CB-CE3 4.43Å; R119-W136 VanDerWaalsContact NH1-CH2 3.28Å; R119-C208 PolarHBondContact NH1-O 3.46Å; R119-C208 VanDerWaalsContact NH1-O 3.1Å; R119-E509 IonicContact CZ-OE1 2.65Å; R119-E509 IonicContact NE-OE1 3.49Å; R119-E509 IonicContact NH2-OE1 4Å; R119-E509 PolarHBondContact NH2-OE1 2.81Å
120	Q	88	Confident	90	Very high	42 Å²	42	56.2 Å²	56.2	20%	0.196	29%	0.294	C	S	.	.	H	α-helix	trans	-68.7	-38	177.6	-175.8	63.1	67.1	0	0	112.8	I63 S116 I117 M118 G123	I63-Q120 HydrophobicContact CD1-CG 4.3Å; I63-Q120 HydrophobicContact CG1-CB 4.45Å; I63-Q120 HydrophobicContact CG1-CG 3.67Å; S116-Q120 PolarHBondContact O-N 2.84Å; I117-Q120 WeakPolarHBondContact O-CB 3.27Å; I117-Q120 PolarHBondContact O-N 2.99Å; I117-Q120 VanDerWaalsContact O-N 3.08Å; M118-Q120 VanDerWaalsContact C-N 3.26Å; M118-Q120 PolarHBondContact O-N 3.07Å; Q120-G123 PolarHBondContact O-N 3.31Å
121	V	90.7	Very high	89.4	Confident	77 Å²	77	57.7 Å²	57.7	47%	0.467	30%	0.296	S	S	.	.	H	α-helix	trans	-65.4	-47.8	178.4	168.5	0	0	0	0	111.3	I63 I117 M118 G123	I63-V121 HydrophobicContact CD1-CG2 3.98Å; I63-V121 HydrophobicContact CG1-CG2 4.32Å; I63-V121 HydrophobicContact CG2-CG2 3.91Å; I117-V121 HydrophobicContact CG2-CG2 4.22Å; I117-V121 VanDerWaalsContact O-CG2 3.3Å; I117-V121 WeakPolarHBondContact O-CG2 3.39Å; I117-V121 PolarHBondContact O-N 3.45Å; M118-V121 PolarHBondContact O-N 3.25Å; V121-G123 VanDerWaalsContact C-N 3.32Å
122	Y	90	Very high	89.1	Confident	124 Å²	124	57 Å²	57	49%	0.486	29%	0.293	S	S	.	.	H	α-helix	trans	-76.8	-21.7	178.3	-72.2	-78.1	0	0	0	112.6	M118 Y124 P126	M118-Y122 VanDerWaalsContact O-CD2 3.27Å; M118-Y122 WeakPolarHBondContact O-CD2 3.38Å; M118-Y122 PolarHBondContact O-N 3.49Å; M118-Y122 HydrophobicContact SD-CE2 4.27Å; Y122-Y124 HydrophobicContact CD1-CE1 4.44Å; Y122-Y124 WeakPolarHBondContact O-CD1 3.47Å; Y122-Y124 WeakPolarHBondContact O-CE1 3.38Å; Y122-Y124 PolarHBondContact O-N 2.97Å; Y122-P126 HydrophobicContact CD1-CB 4.42Å; Y122-P126 HydrophobicContact CD2-CB 3.75Å; Y122-P126 HydrophobicContact CD2-CG 3.67Å; Y122-P126 HydrophobicContact CE2-CB 4.11Å; Y122-P126 HydrophobicContact CE2-CG 4.07Å; Y122-P126 HydrophobicContact CG-CB 3.94Å; Y122-P126 HydrophobicContact CG-CG 4.28Å
123	G	84.8	Confident	88.9	Confident	58 Å²	58	57 Å²	57	60%	0.598	29%	0.293	S	S	*	.	S	Bend	trans	75.4	0.8	-172.8	0	0	0	0	0	113.8	R119 Q120 V121	R119-G123 WeakPolarHBondContact O-CA 3.37Å; R119-G123 PolarHBondContact O-N 2.9Å; Q120-G123 PolarHBondContact O-N 3.31Å; V121-G123 VanDerWaalsContact C-N 3.32Å
124	Y	86.2	Confident	88.5	Confident	109 Å²	109	58.3 Å²	58.3	43%	0.427	30%	0.299	S	S	.	.	S	Bend	trans	-151.5	169	179.6	70.4	-94.7	0	0	0	109.2	R119 Y122 P126 V205	R119-Y124 PolarHBondContact O-N 2.92Å; Y122-Y124 HydrophobicContact CD1-CE1 4.44Å; Y122-Y124 WeakPolarHBondContact O-CD1 3.47Å; Y122-Y124 WeakPolarHBondContact O-CE1 3.38Å; Y122-Y124 PolarHBondContact O-N 2.97Å; Y124-P126 HydrophobicContact CE2-CB 4.22Å; Y124-P126 VanDerWaalsContact O-CD 3.23Å; Y124-P126 WeakPolarHBondContact O-CD 3.13Å; Y124-V205 HydrophobicContact CE2-CG1 4.42Å
125	W	88.5	Confident	88.2	Confident	4 Å²	4	62.9 Å²	62.9	2%	0.015	31%	0.311	C	S	.	.			trans	-77.4	110.5	175.2	-176.9	-102.8	0	0	0	110.8	L115 R119 Y127 L132 C133 W136 G206 C208	L115-W125 HydrophobicContact CD1-CH2 4.5Å; R119-W125 HydrophobicContact CB-CE3 4.43Å; W125-Y127 VanDerWaalsContact C-N 3.34Å; W125-Y127 HydrophobicContact CD2-CD2 4.12Å; W125-Y127 AromaticContact CE2-CD2 3.72Å; W125-Y127 HydrophobicContact CE3-CD2 4.41Å; W125-Y127 HydrophobicContact CH2-CD2 4.02Å; W125-Y127 HydrophobicContact CH2-CE2 4.47Å; W125-Y127 AromaticContact CZ2-CD2 3.67Å; W125-Y127 HydrophobicContact CZ2-CD2 3.67Å; W125-Y127 HydrophobicContact CZ2-CG 4.37Å; W125-Y127 HydrophobicContact CZ3-CD2 4.37Å; W125-Y127 PolarHBondContact NE1-O 3.21Å; W125-Y127 VanDerWaalsContact NE1-O 3.12Å; W125-Y127 PolarHBondContact O-N 3.09Å; W125-L132 HydrophobicContact CH2-CG 4.32Å; W125-L132 HydrophobicContact CZ2-CB 4.21Å; W125-L132 HydrophobicContact CZ2-CD2 4.03Å; W125-L132 HydrophobicContact CZ2-CG 3.89Å; W125-C133 HydrophobicContact CZ2-CB 3.87Å; W125-W136 HydrophobicContact CE3-CE3 4.3Å; W125-W136 HydrophobicContact CE3-CZ3 4.31Å; W125-W136 HydrophobicContact CH2-CB 4.17Å; W125-W136 HydrophobicContact CH2-CD2 4.1Å; W125-W136 AromaticContact CH2-CE3 3.91Å; W125-W136 HydrophobicContact CH2-CE3 3.91Å; W125-W136 HydrophobicContact CH2-CG 4.23Å; W125-W136 AromaticContact CZ3-CD2 3.88Å; W125-W136 HydrophobicContact CZ3-CD2 3.88Å; W125-W136 AromaticContact CZ3-CE3 3.51Å; W125-W136 HydrophobicContact CZ3-CE3 3.51Å; W125-W136 HydrophobicContact CZ3-CG 4.44Å; W125-W136 AromaticContact CZ3-CZ3 3.87Å; W125-W136 HydrophobicContact CZ3-CZ3 3.87Å; W125-G206 PolarHBondContact O-N 3.48Å; W125-C208 HydrophobicContact CB-CB 3.55Å; W125-C208 HydrophobicContact CD2-CB 3.45Å; W125-C208 VanDerWaalsContact CD2-CB 3.45Å; W125-C208 HydrophobicContact CE3-CB 3.76Å; W125-C208 HydrophobicContact CG-CB 3.37Å
126	P	88.1	Confident	88.1	Confident	32 Å²	32	61.8 Å²	61.8	21%	0.208	30%	0.304	C	S	.	.			trans	-83.2	-10.4	-169.2	35.6	-37.2	0	0	0	113.6	Y122 Y124	Y122-P126 HydrophobicContact CD1-CB 4.42Å; Y122-P126 HydrophobicContact CD2-CB 3.75Å; Y122-P126 HydrophobicContact CD2-CG 3.67Å; Y122-P126 HydrophobicContact CE2-CB 4.11Å; Y122-P126 HydrophobicContact CE2-CG 4.07Å; Y122-P126 HydrophobicContact CG-CB 3.94Å; Y122-P126 HydrophobicContact CG-CG 4.28Å; Y124-P126 HydrophobicContact CE2-CB 4.22Å; Y124-P126 VanDerWaalsContact O-CD 3.23Å; Y124-P126 WeakPolarHBondContact O-CD 3.13Å
127	Y	89.1	Confident	87.9	Confident	73 Å²	73	62.2 Å²	62.2	29%	0.286	31%	0.306	S	S	.	.			trans	-92.8	132.4	-173.8	-51.6	-78	0	0	0	111.2	L115 W125 S129 L132	L115-Y127 HydrophobicContact CD2-CE2 3.71Å; W125-Y127 VanDerWaalsContact C-N 3.34Å; W125-Y127 HydrophobicContact CD2-CD2 4.12Å; W125-Y127 AromaticContact CE2-CD2 3.72Å; W125-Y127 HydrophobicContact CE3-CD2 4.41Å; W125-Y127 HydrophobicContact CH2-CD2 4.02Å; W125-Y127 HydrophobicContact CH2-CE2 4.47Å; W125-Y127 AromaticContact CZ2-CD2 3.67Å; W125-Y127 HydrophobicContact CZ2-CD2 3.67Å; W125-Y127 HydrophobicContact CZ2-CG 4.37Å; W125-Y127 HydrophobicContact CZ3-CD2 4.37Å; W125-Y127 PolarHBondContact NE1-O 3.21Å; W125-Y127 VanDerWaalsContact NE1-O 3.12Å; W125-Y127 PolarHBondContact O-N 3.09Å; Y127-S129 PolarHBondContact O-N 3.35Å; Y127-L132 HydrophobicContact CD1-CD2 4.05Å; Y127-L132 HydrophobicContact CD2-CD2 3.89Å; Y127-L132 HydrophobicContact CE2-CD2 4.42Å; Y127-L132 HydrophobicContact CG-CD2 3.69Å
128	E	82.3	Confident	87.8	Confident	154 Å²	154	61.4 Å²	61.4	72%	0.72	30%	0.302	S	S	*	.			trans	-70.7	-22.5	176.1	-60	-170.5	160.1	0	0	112.7	H130 V205	E128-H130 PolarHBondContact O-CD2 3.44Å; E128-H130 PolarHBondContact O-N 3.42Å; E128-H130 VanDerWaalsContact O-N 3.14Å; E128-V205 HydrophobicContact CB-CG2 4.26Å; E128-V205 HydrophobicContact CG-CG2 3.71Å
129	S	86.4	Confident	87.7	Confident	57 Å²	57	59.4 Å²	59.4	40%	0.399	29%	0.293	S	S	.	.			trans	-69	111	-179.3	-178.8	0	0	0	0	111.6	Y127 E131 L132	Y127-S129 PolarHBondContact O-N 3.35Å; S129-E131 VanDerWaalsContact C-N 3.3Å; S129-L132 PolarHBondContact O-N 2.7Å; S129-L132 PolarHBondContact OG-N 3.26Å
130	H	82.9	Confident	87.9	Confident	86 Å²	86	59.8 Å²	59.8	40%	0.398	30%	0.297	S	S	.	.	H	α-helix	trans	-61.3	-40.4	170.5	-64.2	-95.3	0	0	0	111.4	E128 L132 C133 I134 T203 G204	E128-H130 PolarHBondContact O-CD2 3.44Å; E128-H130 PolarHBondContact O-N 3.42Å; E128-H130 VanDerWaalsContact O-N 3.14Å; H130-L132 PolarHBondContact O-N 2.82Å; H130-C133 WeakPolarHBondContact O-CB 3.34Å; H130-C133 PolarHBondContact O-N 3.21Å; H130-I134 PolarHBondContact O-N 3.08Å; H130-I134 VanDerWaalsContact O-N 3.12Å; H130-T203 HydrophobicContact CB-CG2 4.45Å; H130-T203 PolarHBondContact CE1-O 2.75Å; H130-T203 WeakPolarHBondContact ND1-CB 3.49Å; H130-T203 PolarHBondContact ND1-O 3.39Å; H130-T203 PolarHBondContact ND1-OG1 3.32Å; H130-G204 WeakPolarHBondContact CE1-CA 3.39Å; H130-G204 PolarHBondContact ND1-N 3.5Å
131	E	85.7	Confident	87.9	Confident	106 Å²	106	59.1 Å²	59.1	50%	0.495	30%	0.296	S	S	.	.	H	α-helix	trans	-61.1	-43.2	179.8	-57.8	-51	141.5	0	0	111.8	S129 C133 I134 Y135	S129-E131 VanDerWaalsContact C-N 3.3Å; E131-C133 PolarHBondContact O-N 2.95Å; E131-I134 PolarHBondContact O-N 3.43Å; E131-I134 VanDerWaalsContact O-N 3.14Å; E131-Y135 HydrophobicContact CB-CD2 4.15Å; E131-Y135 HydrophobicContact CB-CE2 4.05Å; E131-Y135 WeakPolarHBondContact O-CB 3.26Å; E131-Y135 WeakPolarHBondContact O-CD2 3.32Å; E131-Y135 PolarHBondContact O-N 3.45Å
132	L	89.1	Confident	88.1	Confident	60 Å²	60	56.3 Å²	56.3	31%	0.314	28%	0.277	S	S	.	.	H	α-helix	trans	-58.7	-39	178.4	-175.6	65.1	0	0	0	111.6	L115 W125 Y127 S129 H130 W136	L115-L132 HydrophobicContact CD1-CD1 4.28Å; W125-L132 HydrophobicContact CH2-CG 4.32Å; W125-L132 HydrophobicContact CZ2-CB 4.21Å; W125-L132 HydrophobicContact CZ2-CD2 4.03Å; W125-L132 HydrophobicContact CZ2-CG 3.89Å; Y127-L132 HydrophobicContact CD1-CD2 4.05Å; Y127-L132 HydrophobicContact CD2-CD2 3.89Å; Y127-L132 HydrophobicContact CE2-CD2 4.42Å; Y127-L132 HydrophobicContact CG-CD2 3.69Å; S129-L132 PolarHBondContact O-N 2.7Å; S129-L132 PolarHBondContact OG-N 3.26Å; H130-L132 PolarHBondContact O-N 2.82Å; L132-W136 WeakPolarHBondContact O-CB 3.42Å; L132-W136 PolarHBondContact O-N 3.01Å
133	C	88.4	Confident	88.3	Confident	0 Å²	0	50.4 Å²	50.4	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-64.5	-48.4	175.6	172.8	0	0	0	0	111.6	W125 H130 E131 Y135 W136 L137 T203 C208	W125-C133 HydrophobicContact CZ2-CB 3.87Å; H130-C133 WeakPolarHBondContact O-CB 3.34Å; H130-C133 PolarHBondContact O-N 3.21Å; E131-C133 PolarHBondContact O-N 2.95Å; C133-Y135 PolarHBondContact O-N 3.03Å; C133-W136 PolarHBondContact O-N 3.24Å; C133-L137 WeakPolarHBondContact O-CB 3.35Å; C133-L137 VanDerWaalsContact O-CG 3.3Å; C133-L137 WeakPolarHBondContact O-CG 3.4Å; C133-L137 PolarHBondContact O-N 2.79Å; C133-T203 HydrophobicContact CB-CG2 4Å; C133-C208 VanDerWaalsContact CA-SG 3.56Å; C133-C208 HydrophobicContact CB-CB 3.92Å; C133-C208 WeakPolarHBondContact CB-SG 3.32Å; C133-C208 WeakPolarHBondContact SG-CA 3.23Å; C133-C208 WeakPolarHBondContact SG-CB 3.5Å; C133-C208 CovalentContact SG-SG 2.02Å; C133-C208 PolarHBondContact SG-SG 2.9Å
134	I	86.2	Confident	88.6	Confident	27 Å²	27	48.2 Å²	48.2	14%	0.138	23%	0.23	C	C	.	.	H	α-helix	trans	-60.8	-46.3	179.3	-63	173.2	0	0	0	110.3	H130 E131 S138 H201 T203	H130-I134 PolarHBondContact O-N 3.08Å; H130-I134 VanDerWaalsContact O-N 3.12Å; E131-I134 PolarHBondContact O-N 3.43Å; E131-I134 VanDerWaalsContact O-N 3.14Å; I134-S138 VanDerWaalsContact O-CB 3.23Å; I134-S138 WeakPolarHBondContact O-CB 3.49Å; I134-S138 PolarHBondContact O-N 3.07Å; I134-S138 PolarHBondContact O-OG 2.91Å; I134-H201 HydrophobicContact CG1-CB 4.29Å; I134-T203 HydrophobicContact CD1-CG2 4.22Å; I134-T203 HydrophobicContact CG1-CG2 3.71Å
135	Y	88.4	Confident	88.9	Confident	145 Å²	145	43.3 Å²	43.3	57%	0.569	21%	0.211	S	C	*	.	H	α-helix	trans	-62.5	-46	177.4	-76.9	-59.1	0	0	0	112	E131 C133 L137 S138 L139	E131-Y135 HydrophobicContact CB-CD2 4.15Å; E131-Y135 HydrophobicContact CB-CE2 4.05Å; E131-Y135 WeakPolarHBondContact O-CB 3.26Å; E131-Y135 WeakPolarHBondContact O-CD2 3.32Å; E131-Y135 PolarHBondContact O-N 3.45Å; C133-Y135 PolarHBondContact O-N 3.03Å; Y135-L137 PolarHBondContact O-N 3.21Å; Y135-S138 PolarHBondContact O-N 3.4Å; Y135-L139 WeakPolarHBondContact O-CB 3.49Å; Y135-L139 PolarHBondContact O-N 3.38Å
136	W	91.1	Very high	89.2	Confident	11 Å²	11	43.1 Å²	43.1	4%	0.042	21%	0.211	C	C	.	.	H	α-helix	trans	-60.7	-46.8	178.9	171.6	64.7	0	0	0	112.1	V112 L115 R119 W125 L132 C133 L139 N140	V112-W136 PolarHBondContact O-NE1 3.09Å; L115-W136 HydrophobicContact CB-CD2 4.49Å; L115-W136 HydrophobicContact CB-CG 4.19Å; L115-W136 HydrophobicContact CD1-CB 4Å; L115-W136 HydrophobicContact CD1-CG 3.93Å; R119-W136 VanDerWaalsContact NH1-CH2 3.28Å; W125-W136 HydrophobicContact CE3-CE3 4.3Å; W125-W136 HydrophobicContact CE3-CZ3 4.31Å; W125-W136 HydrophobicContact CH2-CB 4.17Å; W125-W136 HydrophobicContact CH2-CD2 4.1Å; W125-W136 AromaticContact CH2-CE3 3.91Å; W125-W136 HydrophobicContact CH2-CE3 3.91Å; W125-W136 HydrophobicContact CH2-CG 4.23Å; W125-W136 AromaticContact CZ3-CD2 3.88Å; W125-W136 HydrophobicContact CZ3-CD2 3.88Å; W125-W136 AromaticContact CZ3-CE3 3.51Å; W125-W136 HydrophobicContact CZ3-CE3 3.51Å; W125-W136 HydrophobicContact CZ3-CG 4.44Å; W125-W136 AromaticContact CZ3-CZ3 3.87Å; W125-W136 HydrophobicContact CZ3-CZ3 3.87Å; L132-W136 WeakPolarHBondContact O-CB 3.42Å; L132-W136 PolarHBondContact O-N 3.01Å; C133-W136 PolarHBondContact O-N 3.24Å; W136-L139 PolarHBondContact O-N 3.28Å; W136-N140 WeakPolarHBondContact O-CB 3.21Å; W136-N140 PolarHBondContact O-N 2.94Å
137	L	87.4	Confident	89.5	Confident	14 Å²	14	42 Å²	42	7%	0.073	20%	0.203	C	C	.	.	H	α-helix	trans	-62.8	-45.9	176.9	-70.5	169.5	0	0	0	111.6	C133 Y135 L139 N140 V141 I210	C133-L137 WeakPolarHBondContact O-CB 3.35Å; C133-L137 VanDerWaalsContact O-CG 3.3Å; C133-L137 WeakPolarHBondContact O-CG 3.4Å; C133-L137 PolarHBondContact O-N 2.79Å; Y135-L137 PolarHBondContact O-N 3.21Å; L137-L139 VanDerWaalsContact C-N 3.34Å; L137-L139 PolarHBondContact O-N 3.12Å; L137-N140 PolarHBondContact O-N 3.22Å; L137-V141 WeakPolarHBondContact O-CG2 3.44Å; L137-V141 PolarHBondContact O-N 3.18Å; L137-V141 VanDerWaalsContact O-N 3.15Å; L137-I210 HydrophobicContact CB-CD1 4.27Å; L137-I210 HydrophobicContact CB-CG1 4.32Å; L137-I210 HydrophobicContact CD1-CG1 3.75Å; L137-I210 HydrophobicContact CD2-CD1 4.22Å; L137-I210 HydrophobicContact CD2-CG1 4.06Å; L137-I210 HydrophobicContact CG-CG1 4.25Å
138	S	89.1	Confident	89.7	Confident	1 Å²	1	38.7 Å²	38.7	1%	0.007	19%	0.191	C	C	.	.	H	α-helix	trans	-63.5	-41.7	178.9	-57	0	0	0	0	111.6	I134 Y135 V141 F142 P195 I196	I134-S138 VanDerWaalsContact O-CB 3.23Å; I134-S138 WeakPolarHBondContact O-CB 3.49Å; I134-S138 PolarHBondContact O-N 3.07Å; I134-S138 PolarHBondContact O-OG 2.91Å; Y135-S138 PolarHBondContact O-N 3.4Å; S138-V141 PolarHBondContact O-N 3.46Å; S138-F142 WeakPolarHBondContact O-CB 3.3Å; S138-F142 PolarHBondContact O-N 3.49Å; S138-P195 WeakPolarHBondContact OG-CB 3.4Å; S138-I196 WeakPolarHBondContact OG-CG1 3.27Å
139	L	92	Very high	90.3	Very high	41 Å²	41	33.1 Å²	33.1	22%	0.215	17%	0.166	C	C	.	.	H	α-helix	trans	-66.9	-38.8	178.9	-170.5	75.6	0	0	0	112.1	L111 V112 Y135 W136 L137 F142 L143	L111-L139 HydrophobicContact CB-CD2 3.29Å; L111-L139 HydrophobicContact CD1-CD1 4.46Å; L111-L139 HydrophobicContact CD1-CD2 3.76Å; L111-L139 HydrophobicContact CG-CD2 4.11Å; V112-L139 HydrophobicContact CG2-CD2 4.27Å; V112-L139 HydrophobicContact CG2-CG 4.38Å; Y135-L139 WeakPolarHBondContact O-CB 3.49Å; Y135-L139 PolarHBondContact O-N 3.38Å; W136-L139 PolarHBondContact O-N 3.28Å; L137-L139 VanDerWaalsContact C-N 3.34Å; L137-L139 PolarHBondContact O-N 3.12Å; L139-F142 HydrophobicContact CD1-CD1 3.91Å; L139-F142 PolarHBondContact O-N 2.96Å; L139-L143 HydrophobicContact CD1-CD1 4.29Å; L139-L143 HydrophobicContact CD1-CG 4.42Å; L139-L143 HydrophobicContact CD2-CD1 4.31Å; L139-L143 HydrophobicContact CG-CD1 3.87Å; L139-L143 HydrophobicContact CG-CG 4.32Å; L139-L143 WeakPolarHBondContact O-CB 3.24Å; L139-L143 WeakPolarHBondContact O-CG 3.39Å; L139-L143 PolarHBondContact O-N 2.81Å
140	N	91.1	Very high	90.7	Very high	34 Å²	34	30.4 Å²	30.4	18%	0.182	15%	0.147	C	C	.	.	H	α-helix	trans	-58.6	-49.1	172.8	-175.3	35	0	0	0	110.8	V112 W136 L137 F142 L143 C144 Y520	V112-N140 HydrophobicContact CG1-CB 3.96Å; V112-N140 HydrophobicContact CG2-CB 4.32Å; W136-N140 WeakPolarHBondContact O-CB 3.21Å; W136-N140 PolarHBondContact O-N 2.94Å; L137-N140 PolarHBondContact O-N 3.22Å; N140-F142 VanDerWaalsContact C-N 3.34Å; N140-F142 PolarHBondContact O-N 2.99Å; N140-L143 PolarHBondContact O-N 3.3Å; N140-C144 VanDerWaalsContact O-CB 3.31Å; N140-C144 WeakPolarHBondContact O-CB 3.18Å; N140-C144 PolarHBondContact O-N 3.41Å; N140-C144 PolarHBondContact O-SG 3.48Å; N140-C144 PolarHBondContact OD1-SG 3.36Å; N140-Y520 PolarHBondContact ND2-OH 3.19Å; N140-Y520 PolarHBondContact OD1-OH 2.65Å; N140-Y520 VanDerWaalsContact OD1-OH 3.11Å
141	V	89	Confident	91.3	Very high	28 Å²	28	26.3 Å²	26.3	17%	0.17	13%	0.128	C	C	.	.	H	α-helix	trans	-60.4	-43.8	176.9	173.5	0	0	0	0	111.4	L137 S138 S145 V191 I224	L137-V141 WeakPolarHBondContact O-CG2 3.44Å; L137-V141 PolarHBondContact O-N 3.18Å; L137-V141 VanDerWaalsContact O-N 3.15Å; S138-V141 PolarHBondContact O-N 3.46Å; V141-S145 VanDerWaalsContact O-CB 3.3Å; V141-S145 WeakPolarHBondContact O-CB 3.46Å; V141-S145 PolarHBondContact O-N 3.07Å; V141-S145 PolarHBondContact O-OG 2.87Å; V141-V191 HydrophobicContact CG1-CG1 3.83Å; V141-I224 HydrophobicContact CG1-CD1 4.01Å
142	F	93.5	Very high	91.7	Very high	19 Å²	19	21.9 Å²	21.9	8%	0.083	11%	0.108	C	C	.	.	H	α-helix	trans	-59.7	-53.7	177.6	165.2	-124.3	0	0	0	112.6	S138 L139 N140 S145 A146 W185 L189 M192	S138-F142 WeakPolarHBondContact O-CB 3.3Å; S138-F142 PolarHBondContact O-N 3.49Å; L139-F142 HydrophobicContact CD1-CD1 3.91Å; L139-F142 PolarHBondContact O-N 2.96Å; N140-F142 VanDerWaalsContact C-N 3.34Å; N140-F142 PolarHBondContact O-N 2.99Å; F142-S145 WeakPolarHBondContact O-CB 3.11Å; F142-S145 PolarHBondContact O-N 3.18Å; F142-A146 WeakPolarHBondContact O-CB 3.29Å; F142-A146 PolarHBondContact O-N 2.97Å; F142-W185 HydrophobicContact CE1-CE3 4.43Å; F142-W185 HydrophobicContact CE1-CZ3 4.1Å; F142-W185 AromaticContact CE2-CE3 3.95Å; F142-W185 HydrophobicContact CE2-CE3 3.95Å; F142-W185 HydrophobicContact CE2-CZ3 4.32Å; F142-W185 AromaticContact CZ-CE3 3.5Å; F142-W185 HydrophobicContact CZ-CE3 3.5Å; F142-W185 AromaticContact CZ-CZ3 3.6Å; F142-W185 HydrophobicContact CZ-CZ3 3.6Å; F142-L189 HydrophobicContact CD1-CD2 4.47Å; F142-L189 HydrophobicContact CD2-CD2 3.81Å; F142-L189 HydrophobicContact CD2-CG 4.08Å; F142-L189 HydrophobicContact CE1-CD2 4.09Å; F142-L189 HydrophobicContact CE2-CB 4.28Å; F142-L189 HydrophobicContact CE2-CD2 3.39Å; F142-L189 HydrophobicContact CE2-CG 3.44Å; F142-L189 VanDerWaalsContact CE2-CG 3.44Å; F142-L189 HydrophobicContact CG-CD2 4.32Å; F142-L189 HydrophobicContact CZ-CD2 3.5Å; F142-L189 HydrophobicContact CZ-CG 3.88Å; F142-M192 HydrophobicContact CB-CB 4.07Å; F142-M192 HydrophobicContact CB-CG 4.03Å; F142-M192 HydrophobicContact CB-SD 3.91Å; F142-M192 HydrophobicContact CG-SD 4.21Å
143	L	94.9	Very high	92	Very high	0 Å²	0	19.8 Å²	19.8	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-71.7	-33.8	-174.3	-68	173.3	0	0	0	112.4	L107 V108 V112 L139 N140 A146 S147 W185	L107-L143 HydrophobicContact CB-CD1 3.91Å; L107-L143 HydrophobicContact CB-CD2 3.69Å; L107-L143 HydrophobicContact CB-CG 4.47Å; L107-L143 HydrophobicContact CD1-CD2 3.92Å; L107-L143 HydrophobicContact CG-CD2 4.48Å; V108-L143 HydrophobicContact CG2-CB 3.6Å; V108-L143 HydrophobicContact CG2-CD1 3.99Å; V108-L143 HydrophobicContact CG2-CG 4.4Å; V112-L143 HydrophobicContact CG2-CD1 3.82Å; L139-L143 HydrophobicContact CD1-CD1 4.29Å; L139-L143 HydrophobicContact CD1-CG 4.42Å; L139-L143 HydrophobicContact CD2-CD1 4.31Å; L139-L143 HydrophobicContact CG-CD1 3.87Å; L139-L143 HydrophobicContact CG-CG 4.32Å; L139-L143 WeakPolarHBondContact O-CB 3.24Å; L139-L143 WeakPolarHBondContact O-CG 3.39Å; L139-L143 PolarHBondContact O-N 2.81Å; N140-L143 PolarHBondContact O-N 3.3Å; L143-A146 PolarHBondContact O-N 2.93Å; L143-S147 PolarHBondContact O-N 3.41Å; L143-S147 PolarHBondContact O-OG 3.08Å; L143-W185 HydrophobicContact CD2-CZ3 4.26Å
144	C	91.5	Very high	92.3	Very high	12 Å²	12	20.1 Å²	20.1	8%	0.081	10%	0.1	C	C	.	.	H	α-helix	trans	-61.6	-49.7	169.6	-67.6	0	0	0	0	110.2	N140 A146 S147 I148 W490	N140-C144 VanDerWaalsContact O-CB 3.31Å; N140-C144 WeakPolarHBondContact O-CB 3.18Å; N140-C144 PolarHBondContact O-N 3.41Å; N140-C144 PolarHBondContact O-SG 3.48Å; N140-C144 PolarHBondContact OD1-SG 3.36Å; C144-A146 VanDerWaalsContact C-N 3.29Å; C144-A146 PolarHBondContact O-N 3.29Å; C144-S147 WeakPolarHBondContact O-CB 2.92Å; C144-S147 PolarHBondContact O-N 3.02Å; C144-S147 VanDerWaalsContact O-N 3.13Å; C144-I148 VanDerWaalsContact O-CG1 3.29Å; C144-I148 WeakPolarHBondContact O-CG1 3.26Å; C144-I148 PolarHBondContact O-N 2.8Å; C144-W490 HydrophobicContact CB-CH2 4.31Å; C144-W490 WeakPolarHBondContact SG-CH2 3.49Å
145	S	92.2	Very high	92.7	Very high	6 Å²	6	18.8 Å²	18.8	4%	0.042	9%	0.093	C	C	.	.	H	α-helix	trans	-58.9	-40.5	177	-58.6	0	0	0	0	112.2	V141 F142 S147 I148 L149 S188	V141-S145 VanDerWaalsContact O-CB 3.3Å; V141-S145 WeakPolarHBondContact O-CB 3.46Å; V141-S145 PolarHBondContact O-N 3.07Å; V141-S145 PolarHBondContact O-OG 2.87Å; F142-S145 WeakPolarHBondContact O-CB 3.11Å; F142-S145 PolarHBondContact O-N 3.18Å; S145-S147 VanDerWaalsContact C-N 3.34Å; S145-S147 PolarHBondContact O-N 3.07Å; S145-I148 PolarHBondContact O-N 2.89Å; S145-L149 WeakPolarHBondContact O-CB 3.34Å; S145-L149 WeakPolarHBondContact O-CG 3.43Å; S145-L149 PolarHBondContact O-N 2.84Å; S145-S188 PolarHBondContact O-OG 3.26Å
146	A	95.4	Very high	92.9	Very high	0 Å²	0	14.3 Å²	14.3	0%	0	8%	0.081	C	C	.	.	H	α-helix	trans	-61.4	-43.5	176.7	0	0	0	0	0	111.4	A104 F142 L143 C144 L149 N150 W185 S188	A104-A146 HydrophobicContact CB-CB 4.3Å; F142-A146 WeakPolarHBondContact O-CB 3.29Å; F142-A146 PolarHBondContact O-N 2.97Å; L143-A146 PolarHBondContact O-N 2.93Å; C144-A146 VanDerWaalsContact C-N 3.29Å; C144-A146 PolarHBondContact O-N 3.29Å; A146-L149 PolarHBondContact O-N 3.49Å; A146-N150 WeakPolarHBondContact O-CB 3.44Å; A146-N150 PolarHBondContact O-N 3.31Å; A146-N150 PolarHBondContact O-ND2 3.47Å; A146-W185 HydrophobicContact CB-CD2 4.44Å; A146-W185 HydrophobicContact CB-CE3 4Å; A146-W185 HydrophobicContact CB-CH2 4.31Å; A146-W185 HydrophobicContact CB-CZ3 3.94Å; A146-S188 WeakPolarHBondContact CA-OG 3.23Å; A146-S188 PolarHBondContact N-OG 3.43Å
147	S	94.1	Very high	93.1	Very high	8 Å²	8	14.1 Å²	14.1	6%	0.056	8%	0.081	C	C	.	.	H	α-helix	trans	-63	-45.4	177.4	-57.2	0	0	0	0	111.5	A104 L143 C144 S145 N150 L151	A104-S147 WeakPolarHBondContact CB-OG 3.5Å; L143-S147 PolarHBondContact O-N 3.41Å; L143-S147 PolarHBondContact O-OG 3.08Å; C144-S147 WeakPolarHBondContact O-CB 2.92Å; C144-S147 PolarHBondContact O-N 3.02Å; C144-S147 VanDerWaalsContact O-N 3.13Å; S145-S147 VanDerWaalsContact C-N 3.34Å; S145-S147 PolarHBondContact O-N 3.07Å; S147-N150 PolarHBondContact O-N 3.42Å; S147-L151 WeakPolarHBondContact O-CG 3.32Å; S147-L151 PolarHBondContact O-N 3.33Å
148	I	92.9	Very high	93.3	Very high	4 Å²	4	13.6 Å²	13.6	2%	0.021	8%	0.078	C	C	.	.	H	α-helix	trans	-61.7	-47.8	177.8	-63.1	-177.8	0	0	0	111.6	C144 S145 N150 L151 C152 I224 F225 P228 F486	C144-I148 VanDerWaalsContact O-CG1 3.29Å; C144-I148 WeakPolarHBondContact O-CG1 3.26Å; C144-I148 PolarHBondContact O-N 2.8Å; S145-I148 PolarHBondContact O-N 2.89Å; I148-N150 VanDerWaalsContact C-N 3.33Å; I148-N150 PolarHBondContact O-N 3.33Å; I148-L151 WeakPolarHBondContact O-CB 3.16Å; I148-L151 PolarHBondContact O-N 3.48Å; I148-L151 VanDerWaalsContact O-N 3.16Å; I148-C152 PolarHBondContact O-N 3.37Å; I148-C152 PolarHBondContact O-SG 3.03Å; I148-I224 HydrophobicContact CD1-CG2 4.2Å; I148-I224 WeakPolarHBondContact CD1-O 3.3Å; I148-F225 HydrophobicContact CD1-CD1 4.1Å; I148-F225 HydrophobicContact CD1-CE1 4.19Å; I148-P228 HydrophobicContact CG2-CB 3.22Å; I148-P228 HydrophobicContact CG2-CG 3.69Å; I148-F486 HydrophobicContact CB-CZ 4.38Å; I148-F486 HydrophobicContact CD1-CE2 4.31Å; I148-F486 HydrophobicContact CD1-CZ 3.81Å; I148-F486 HydrophobicContact CG1-CE1 4.45Å; I148-F486 HydrophobicContact CG1-CE2 3.72Å; I148-F486 HydrophobicContact CG1-CZ 3.44Å; I148-F486 VanDerWaalsContact CG1-CZ 3.44Å; I148-F486 HydrophobicContact CG2-CZ 4.41Å
149	L	94.5	Very high	93.5	Very high	37 Å²	37	16.7 Å²	16.7	19%	0.194	9%	0.09	C	C	.	.	H	α-helix	trans	-70.4	-30.1	-179	-69	-178.6	0	0	0	112.5	S145 A146 C152 C153 A184 I187 S188	S145-L149 WeakPolarHBondContact O-CB 3.34Å; S145-L149 WeakPolarHBondContact O-CG 3.43Å; S145-L149 PolarHBondContact O-N 2.84Å; A146-L149 PolarHBondContact O-N 3.49Å; L149-C152 WeakPolarHBondContact O-CB 3.36Å; L149-C152 PolarHBondContact O-N 3.48Å; L149-C153 PolarHBondContact O-N 2.97Å; L149-C153 PolarHBondContact O-SG 2.9Å; L149-A184 HydrophobicContact CB-CB 3.72Å; L149-A184 WeakPolarHBondContact CD1-O 3.39Å; L149-I187 HydrophobicContact CD1-CB 3.68Å; L149-I187 HydrophobicContact CD1-CG2 3.49Å; L149-I187 VanDerWaalsContact CD1-CG2 3.49Å; L149-S188 WeakPolarHBondContact CD1-OG 3.49Å
150	N	96.2	Very high	93.4	Very high	0 Å²	0	17.8 Å²	17.8	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-64.4	-42.3	168.6	-84.1	-71.3	0	0	0	111.3	S100 L101 A146 S147 I148 C152 C153 I154	S100-N150 VanDerWaalsContact CB-OD1 3.25Å; S100-N150 WeakPolarHBondContact CB-OD1 3.44Å; S100-N150 PolarHBondContact OG-ND2 3.29Å; S100-N150 PolarHBondContact OG-OD1 3.28Å; L101-N150 HydrophobicContact CB-CB 4.27Å; L101-N150 HydrophobicContact CD1-CB 4.13Å; A146-N150 WeakPolarHBondContact O-CB 3.44Å; A146-N150 PolarHBondContact O-N 3.31Å; A146-N150 PolarHBondContact O-ND2 3.47Å; S147-N150 PolarHBondContact O-N 3.42Å; I148-N150 VanDerWaalsContact C-N 3.33Å; I148-N150 PolarHBondContact O-N 3.33Å; N150-C152 VanDerWaalsContact C-N 3.34Å; N150-C152 PolarHBondContact O-N 2.99Å; N150-C153 WeakPolarHBondContact O-CB 3.46Å; N150-C153 PolarHBondContact O-N 3.28Å; N150-C153 VanDerWaalsContact O-N 3.16Å; N150-I154 VanDerWaalsContact O-CG1 3.29Å; N150-I154 WeakPolarHBondContact O-CG1 3.49Å; N150-I154 PolarHBondContact O-N 3.24Å
151	L	93.6	Very high	93.4	Very high	0 Å²	0	16.3 Å²	16.3	0%	0	9%	0.088	C	C	.	.	H	α-helix	trans	-61.3	-41	173	-71.8	172	0	0	0	112.2	L101 S147 I148 C153 I154 S155 V482 V483 F486	L101-L151 HydrophobicContact CD1-CG 4.36Å; L101-L151 HydrophobicContact CD2-CD2 3.83Å; L101-L151 HydrophobicContact CD2-CG 4.41Å; S147-L151 WeakPolarHBondContact O-CG 3.32Å; S147-L151 PolarHBondContact O-N 3.33Å; I148-L151 WeakPolarHBondContact O-CB 3.16Å; I148-L151 PolarHBondContact O-N 3.48Å; I148-L151 VanDerWaalsContact O-N 3.16Å; L151-C153 VanDerWaalsContact C-N 3.35Å; L151-C153 PolarHBondContact O-N 3.11Å; L151-I154 HydrophobicContact CD2-CD1 4.44Å; L151-I154 PolarHBondContact O-N 3.33Å; L151-S155 WeakPolarHBondContact O-CB 3.29Å; L151-S155 PolarHBondContact O-N 2.79Å; L151-S155 PolarHBondContact O-OG 3.45Å; L151-V482 HydrophobicContact CD2-CG1 3.68Å; L151-V483 HydrophobicContact CD2-CG2 4.29Å; L151-F486 HydrophobicContact CD1-CB 3.69Å; L151-F486 HydrophobicContact CD1-CD1 3.69Å; L151-F486 HydrophobicContact CD1-CD2 3.46Å; L151-F486 VanDerWaalsContact CD1-CD2 3.46Å; L151-F486 HydrophobicContact CD1-CE1 4.24Å; L151-F486 HydrophobicContact CD1-CE2 4.08Å; L151-F486 HydrophobicContact CD1-CG 3.29Å; L151-F486 HydrophobicContact CD1-CZ 4.47Å
152	C	94.8	Very high	93.3	Very high	12 Å²	12	15 Å²	15	8%	0.081	8%	0.08	C	C	.	.	H	α-helix	trans	-58.8	-45.2	172.1	-70.2	0	0	0	0	111.6	I148 L149 N150 S155 V156 V232	I148-C152 PolarHBondContact O-N 3.37Å; I148-C152 PolarHBondContact O-SG 3.03Å; L149-C152 WeakPolarHBondContact O-CB 3.36Å; L149-C152 PolarHBondContact O-N 3.48Å; N150-C152 VanDerWaalsContact C-N 3.34Å; N150-C152 PolarHBondContact O-N 2.99Å; C152-S155 WeakPolarHBondContact O-CB 3.4Å; C152-S155 PolarHBondContact O-N 3.49Å; C152-V156 WeakPolarHBondContact O-CG2 3.29Å; C152-V156 PolarHBondContact O-N 3.47Å; C152-V232 VanDerWaalsContact SG-CG2 3.56Å
153	C	95.6	Very high	93	Very high	17 Å²	17	15.6 Å²	15.6	12%	0.115	8%	0.084	C	C	.	.	H	α-helix	trans	-60.7	-46	177.4	-71.5	0	0	0	0	112.2	Y97 L149 N150 L151 S155 V156 D157 M180	Y97-C153 HydrophobicContact CD1-CB 3.97Å; Y97-C153 HydrophobicContact CE1-CB 4.01Å; L149-C153 PolarHBondContact O-N 2.97Å; L149-C153 PolarHBondContact O-SG 2.9Å; N150-C153 WeakPolarHBondContact O-CB 3.46Å; N150-C153 PolarHBondContact O-N 3.28Å; N150-C153 VanDerWaalsContact O-N 3.16Å; L151-C153 VanDerWaalsContact C-N 3.35Å; L151-C153 PolarHBondContact O-N 3.11Å; C153-S155 VanDerWaalsContact C-N 3.32Å; C153-S155 PolarHBondContact O-N 2.88Å; C153-V156 PolarHBondContact O-N 3.39Å; C153-D157 WeakPolarHBondContact O-CB 3.46Å; C153-D157 PolarHBondContact O-N 3.22Å; C153-M180 HydrophobicContact CB-CE 4.09Å
154	I	94.7	Very high	92.6	Very high	6 Å²	6	21.6 Å²	21.6	3%	0.031	11%	0.107	C	C	.	.	H	α-helix	trans	-61	-45.3	176.1	-58.4	161.3	0	0	0	109.6	Y97 L101 N150 L151 V156 D157 R158 V479	Y97-I154 HydrophobicContact CG-CG1 4.36Å; L101-I154 HydrophobicContact CD2-CD1 4.06Å; N150-I154 VanDerWaalsContact O-CG1 3.29Å; N150-I154 WeakPolarHBondContact O-CG1 3.49Å; N150-I154 PolarHBondContact O-N 3.24Å; L151-I154 HydrophobicContact CD2-CD1 4.44Å; L151-I154 PolarHBondContact O-N 3.33Å; I154-V156 VanDerWaalsContact C-N 3.35Å; I154-V156 PolarHBondContact O-N 3.05Å; I154-D157 PolarHBondContact O-N 3.29Å; I154-R158 HydrophobicContact CG2-CG 4.17Å; I154-R158 VanDerWaalsContact O-CG 3.26Å; I154-R158 WeakPolarHBondContact O-CG 3.25Å; I154-R158 PolarHBondContact O-N 3.49Å; I154-V479 HydrophobicContact CB-CG1 4.35Å; I154-V479 HydrophobicContact CG2-CB 4.37Å; I154-V479 HydrophobicContact CG2-CG1 3.37Å; I154-V479 HydrophobicContact CG2-CG2 4.05Å
155	S	94.5	Very high	92.2	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-58.5	-44.6	179.8	-54.4	0	0	0	0	112.3	L151 C152 C153 R158 Y159 Y236	L151-S155 WeakPolarHBondContact O-CB 3.29Å; L151-S155 PolarHBondContact O-N 2.79Å; L151-S155 PolarHBondContact O-OG 3.45Å; C152-S155 WeakPolarHBondContact O-CB 3.4Å; C152-S155 PolarHBondContact O-N 3.49Å; C153-S155 VanDerWaalsContact C-N 3.32Å; C153-S155 PolarHBondContact O-N 2.88Å; S155-R158 PolarHBondContact O-N 3.32Å; S155-Y159 WeakPolarHBondContact O-CB 3.22Å; S155-Y159 PolarHBondContact O-N 2.89Å; S155-Y236 WeakPolarHBondContact OG-CE2 3.31Å
156	V	93.7	Very high	91.6	Very high	50 Å²	50	27.7 Å²	27.7	30%	0.303	14%	0.138	S	C	.	.	H	α-helix	trans	-65.5	-44.4	176.5	171.1	0	0	0	0	111.3	C152 C153 I154 R158 Y159 I160 M180 I235	C152-V156 WeakPolarHBondContact O-CG2 3.29Å; C152-V156 PolarHBondContact O-N 3.47Å; C153-V156 PolarHBondContact O-N 3.39Å; I154-V156 VanDerWaalsContact C-N 3.35Å; I154-V156 PolarHBondContact O-N 3.05Å; V156-R158 PolarHBondContact O-N 2.98Å; V156-Y159 PolarHBondContact O-N 2.94Å; V156-I160 HydrophobicContact CG1-CD1 3.8Å; V156-I160 HydrophobicContact CG1-CG1 4.44Å; V156-I160 VanDerWaalsContact O-CG1 3.3Å; V156-I160 WeakPolarHBondContact O-CG1 3.29Å; V156-I160 PolarHBondContact O-N 3.09Å; V156-M180 HydrophobicContact CB-CE 4.36Å; V156-M180 HydrophobicContact CG1-CE 4.22Å; V156-I235 HydrophobicContact CG2-CD1 3.99Å
157	D	93.5	Very high	91.1	Very high	8 Å²	8	33.2 Å²	33.2	4%	0.043	16%	0.162	C	C	.	.	H	α-helix	trans	-57.4	-48.3	175.3	169.4	81.4	0	0	0	111.2	Y97 C153 I154 Y159 I160 A161 Y168	Y97-D157 HydrophobicContact CE2-CB 4.05Å; C153-D157 WeakPolarHBondContact O-CB 3.46Å; C153-D157 PolarHBondContact O-N 3.22Å; I154-D157 PolarHBondContact O-N 3.29Å; D157-Y159 PolarHBondContact O-N 3.32Å; D157-I160 PolarHBondContact O-N 2.88Å; D157-A161 WeakPolarHBondContact O-CB 3.43Å; D157-A161 PolarHBondContact O-N 2.84Å; D157-Y168 WeakPolarHBondContact OD1-CE2 3.31Å; D157-Y168 PolarHBondContact OD1-OH 3.38Å; D157-Y168 PolarHBondContact OD2-OH 2.97Å
158	R	92.9	Very high	90.8	Very high	3 Å²	3	33.6 Å²	33.6	1%	0.011	16%	0.162	C	C	.	.	H	α-helix	trans	-61.6	-41.8	176.5	-64.8	-58.5	81.4	-155.4	-8.1	112.1	I154 S155 V156 I160 A161 I162 Y168 I239 E472 T475 V476 V479	I154-R158 HydrophobicContact CG2-CG 4.17Å; I154-R158 VanDerWaalsContact O-CG 3.26Å; I154-R158 WeakPolarHBondContact O-CG 3.25Å; I154-R158 PolarHBondContact O-N 3.49Å; S155-R158 PolarHBondContact O-N 3.32Å; V156-R158 PolarHBondContact O-N 2.98Å; R158-I160 PolarHBondContact O-N 3.26Å; R158-A161 PolarHBondContact O-N 3.39Å; R158-I162 WeakPolarHBondContact O-CG1 3.35Å; R158-I162 PolarHBondContact O-N 3.19Å; R158-Y168 PolarHBondContact NH2-OH 3.25Å; R158-I239 HydrophobicContact CB-CD1 4.18Å; R158-E472 IonicContact CZ-OE2 3.04Å; R158-E472 IonicContact NH1-OE2 3.22Å; R158-E472 PolarHBondContact NH1-OE2 3.45Å; R158-E472 IonicContact NH2-OE2 3.06Å; R158-T475 VanDerWaalsContact NH1-CG2 3.32Å; R158-V476 HydrophobicContact CB-CG2 4.28Å; R158-V479 HydrophobicContact CG-CB 4.34Å; R158-V479 HydrophobicContact CG-CG1 4.4Å; R158-V479 HydrophobicContact CG-CG2 4.24Å
159	Y	91.8	Very high	90.4	Very high	65 Å²	65	37.9 Å²	37.9	26%	0.255	18%	0.184	S	C	.	.	H	α-helix	trans	-60.6	-45.6	177.5	-179.6	-95.1	0	0	0	112	S155 V156 D157 N163 I235 R238 I239	S155-Y159 WeakPolarHBondContact O-CB 3.22Å; S155-Y159 PolarHBondContact O-N 2.89Å; V156-Y159 PolarHBondContact O-N 2.94Å; D157-Y159 PolarHBondContact O-N 3.32Å; Y159-N163 WeakPolarHBondContact CD2-ND2 3.47Å; Y159-N163 WeakPolarHBondContact CE2-ND2 3.37Å; Y159-N163 WeakPolarHBondContact O-CB 3.42Å; Y159-N163 PolarHBondContact O-N 2.97Å; Y159-N163 PolarHBondContact O-ND2 2.98Å; Y159-I235 HydrophobicContact CD2-CG2 4.16Å; Y159-I235 HydrophobicContact CG-CG2 4.33Å; Y159-R238 HydrophobicContact CD2-CB 4.42Å; Y159-R238 HydrophobicContact CE2-CB 3.85Å; Y159-I239 HydrophobicContact CD2-CG1 4.01Å
160	I	91.5	Very high	89.8	Confident	65 Å²	65	40.9 Å²	40.9	33%	0.333	21%	0.209	S	C	.	.	H	α-helix	trans	-67	-42.8	179.5	-62.7	166.4	0	0	0	110.3	V156 D157 R158 I162 N163 Y164 Y168	V156-I160 HydrophobicContact CG1-CD1 3.8Å; V156-I160 HydrophobicContact CG1-CG1 4.44Å; V156-I160 VanDerWaalsContact O-CG1 3.3Å; V156-I160 WeakPolarHBondContact O-CG1 3.29Å; V156-I160 PolarHBondContact O-N 3.09Å; D157-I160 PolarHBondContact O-N 2.88Å; R158-I160 PolarHBondContact O-N 3.26Å; I160-I162 VanDerWaalsContact C-N 3.34Å; I160-I162 PolarHBondContact O-N 3.47Å; I160-N163 PolarHBondContact O-N 2.86Å; I160-Y164 PolarHBondContact O-N 3.37Å; I160-Y168 HydrophobicContact CB-CD2 4.34Å; I160-Y168 HydrophobicContact CG2-CD2 3.93Å
161	A	90.1	Very high	89.2	Confident	3 Å²	3	47.1 Å²	47.1	3%	0.025	24%	0.236	C	C	.	.	H	α-helix	trans	-57.6	-45	178	0	0	0	0	0	112.2	D157 R158 Y168	D157-A161 WeakPolarHBondContact O-CB 3.43Å; D157-A161 PolarHBondContact O-N 2.84Å; R158-A161 PolarHBondContact O-N 3.39Å; A161-Y168 HydrophobicContact CB-CD1 3.74Å; A161-Y168 HydrophobicContact CB-CD2 3.97Å; A161-Y168 HydrophobicContact CB-CE1 3.64Å; A161-Y168 HydrophobicContact CB-CE2 3.88Å; A161-Y168 HydrophobicContact CB-CG 3.89Å
162	I	88.2	Confident	88.9	Confident	1 Å²	1	50.2 Å²	50.2	1%	0.005	25%	0.247	C	C	.	.	H	α-helix	trans	-73.9	-47.1	179.7	-65.4	-60.8	0	0	0	111.6	R158 I160 I239 V242 I243 R246 E472 V476	R158-I162 WeakPolarHBondContact O-CG1 3.35Å; R158-I162 PolarHBondContact O-N 3.19Å; I160-I162 VanDerWaalsContact C-N 3.34Å; I160-I162 PolarHBondContact O-N 3.47Å; I162-I239 HydrophobicContact CG1-CG2 4.45Å; I162-V242 HydrophobicContact CG2-CB 4.28Å; I162-V242 HydrophobicContact CG2-CG1 3.67Å; I162-I243 HydrophobicContact CD1-CD1 4.46Å; I162-I243 HydrophobicContact CG2-CG1 4.16Å; I162-R246 PolarHBondContact O-NH1 3.38Å; I162-R246 PolarHBondContact O-NH2 2.89Å; I162-E472 HydrophobicContact CD1-CB 3.83Å; I162-V476 HydrophobicContact CD1-CG2 3.84Å; I162-V476 HydrophobicContact CG1-CG2 3.69Å
163	N	86.3	Confident	88.8	Confident	30 Å²	30	52.5 Å²	52.5	16%	0.16	26%	0.261	C	S	.	.	H	α-helix	trans	-74	-33.2	-173.8	-74.6	-77.2	0	0	0	113.3	Y159 I160 V242 R246	Y159-N163 WeakPolarHBondContact CD2-ND2 3.47Å; Y159-N163 WeakPolarHBondContact CE2-ND2 3.37Å; Y159-N163 WeakPolarHBondContact O-CB 3.42Å; Y159-N163 PolarHBondContact O-N 2.97Å; Y159-N163 PolarHBondContact O-ND2 2.98Å; I160-N163 PolarHBondContact O-N 2.86Å; N163-V242 WeakPolarHBondContact OD1-CG2 3.33Å; N163-R246 PolarHBondContact O-NH2 3.49Å
164	Y	85.7	Confident	88.7	Confident	126 Å²	126	56.8 Å²	56.8	49%	0.494	28%	0.275	S	S	.	.			trans	-135	64.3	-172.4	-51.5	-72.5	0	0	0	112.5	I160 M166 K167 Y168	I160-Y164 PolarHBondContact O-N 3.37Å; Y164-M166 PolarHBondContact O-N 2.92Å; Y164-K167 PolarHBondContact O-N 3.27Å; Y164-K167 VanDerWaalsContact O-N 3.14Å; Y164-Y168 WeakPolarHBondContact O-CB 3.31Å; Y164-Y168 PolarHBondContact O-N 3.46Å
165	P	83.2	Confident	88.7	Confident	32 Å²	32	66.5 Å²	66.5	21%	0.208	31%	0.311	C	S	.	.	H	α-helix	trans	-56.7	-47	-169.8	21.5	-33.6	0	0	0	113.6	K167 Y168 I169	P165-K167 PolarHBondContact O-N 3.04Å; P165-Y168 WeakPolarHBondContact O-CB 3.38Å; P165-Y168 PolarHBondContact O-N 3.48Å; P165-I169 WeakPolarHBondContact O-CG1 3.3Å; P165-I169 PolarHBondContact O-N 3.42Å
166	M	80.9	Confident	88.6	Confident	115 Å²	115	69.4 Å²	69.4	57%	0.567	33%	0.329	S	S	*	.	H	α-helix	trans	-66.7	-37.9	-179.8	-63.6	-56.5	-73.5	0	0	112.7	Y164 S170	Y164-M166 PolarHBondContact O-N 2.92Å; M166-S170 PolarHBondContact O-N 3Å
167	K	84.7	Confident	88.7	Confident	116 Å²	116	67 Å²	67	50%	0.504	32%	0.315	S	S	.	.	H	α-helix	trans	-71.4	-35.5	176	-169.4	177.9	-179.6	-178.8	0	111.2	Y164 P165 K171	Y164-K167 PolarHBondContact O-N 3.27Å; Y164-K167 VanDerWaalsContact O-N 3.14Å; P165-K167 PolarHBondContact O-N 3.04Å; K167-K171 HydrophobicContact CG-CD 3.92Å; K167-K171 HydrophobicContact CG-CG 4.24Å; K167-K171 VanDerWaalsContact O-CB 3.27Å; K167-K171 WeakPolarHBondContact O-CB 3.3Å; K167-K171 WeakPolarHBondContact O-CG 3.46Å; K167-K171 PolarHBondContact O-N 2.88Å
168	Y	87	Confident	88.9	Confident	15 Å²	15	72.4 Å²	72.4	6%	0.059	34%	0.338	C	S	.	.	H	α-helix	trans	-61.9	-52.6	176.3	179.4	-108.2	0	0	0	110.3	T94 D157 R158 I160 A161 Y164 P165 S170 K171 R172	T94-Y168 WeakPolarHBondContact CG2-OH 3.44Å; D157-Y168 WeakPolarHBondContact OD1-CE2 3.31Å; D157-Y168 PolarHBondContact OD1-OH 3.38Å; D157-Y168 PolarHBondContact OD2-OH 2.97Å; R158-Y168 PolarHBondContact NH2-OH 3.25Å; I160-Y168 HydrophobicContact CB-CD2 4.34Å; I160-Y168 HydrophobicContact CG2-CD2 3.93Å; A161-Y168 HydrophobicContact CB-CD1 3.74Å; A161-Y168 HydrophobicContact CB-CD2 3.97Å; A161-Y168 HydrophobicContact CB-CE1 3.64Å; A161-Y168 HydrophobicContact CB-CE2 3.88Å; A161-Y168 HydrophobicContact CB-CG 3.89Å; Y164-Y168 WeakPolarHBondContact O-CB 3.31Å; Y164-Y168 PolarHBondContact O-N 3.46Å; P165-Y168 WeakPolarHBondContact O-CB 3.38Å; P165-Y168 PolarHBondContact O-N 3.48Å; Y168-S170 VanDerWaalsContact C-N 3.29Å; Y168-S170 PolarHBondContact O-N 3.28Å; Y168-K171 PolarHBondContact O-N 3.07Å; Y168-R172 HydrophobicContact CD2-CB 4.42Å; Y168-R172 HydrophobicContact CE2-CB 4.3Å; Y168-R172 HydrophobicContact CE2-CG 4.15Å; Y168-R172 WeakPolarHBondContact O-CB 3.42Å; Y168-R172 PolarHBondContact O-N 3.16Å; Y168-R172 WeakPolarHBondContact OH-CD 3.36Å
169	I	84.2	Confident	89	Confident	94 Å²	94	78.6 Å²	78.6	48%	0.482	37%	0.37	S	S	.	.	H	α-helix	trans	-58.3	-42.2	179.2	-66.3	167	0	0	0	111.3	P165 I468	P165-I169 WeakPolarHBondContact O-CG1 3.3Å; P165-I169 PolarHBondContact O-N 3.42Å; I169-I468 HydrophobicContact CD1-CD1 3.64Å; I169-I468 HydrophobicContact CD1-CG1 4.47Å; I169-I468 HydrophobicContact CD1-CG2 4.44Å
170	S	82.8	Confident	89.3	Confident	101 Å²	101	78.2 Å²	78.2	71%	0.706	37%	0.371	S	S	*	.	H	α-helix	trans	-72	-32.8	-179.8	173.2	0	0	0	0	114	M166 Y168	M166-S170 PolarHBondContact O-N 3Å; Y168-S170 VanDerWaalsContact C-N 3.29Å; Y168-S170 PolarHBondContact O-N 3.28Å
171	K	84.1	Confident	89.6	Confident	131 Å²	131	76 Å²	76	57%	0.57	36%	0.36	S	S	*	.	H	α-helix	trans	-101.8	-16	-173.7	-65.7	-164	176.2	-151.8	0	114.7	K167 Y168 T173	K167-K171 HydrophobicContact CG-CD 3.92Å; K167-K171 HydrophobicContact CG-CG 4.24Å; K167-K171 VanDerWaalsContact O-CB 3.27Å; K167-K171 WeakPolarHBondContact O-CB 3.3Å; K167-K171 WeakPolarHBondContact O-CG 3.46Å; K167-K171 PolarHBondContact O-N 2.88Å; Y168-K171 PolarHBondContact O-N 3.07Å; K171-T173 PolarHBondContact O-N 3.42Å; K171-T173 VanDerWaalsContact O-N 3.12Å
172	R	87.2	Confident	89.9	Confident	64 Å²	64	77.1 Å²	77.1	24%	0.242	37%	0.373	C	S	.	.			trans	-71.6	107	-177.2	-176	-169.5	74.7	159	-0.8	109.7	I93 Y168	I93-R172 HydrophobicContact CB-CG 4.15Å; I93-R172 HydrophobicContact CD1-CG 3.73Å; I93-R172 WeakPolarHBondContact CD1-O 3.33Å; I93-R172 HydrophobicContact CG2-CG 3.86Å; Y168-R172 HydrophobicContact CD2-CB 4.42Å; Y168-R172 HydrophobicContact CE2-CB 4.3Å; Y168-R172 HydrophobicContact CE2-CG 4.15Å; Y168-R172 WeakPolarHBondContact O-CB 3.42Å; Y168-R172 PolarHBondContact O-N 3.16Å; Y168-R172 WeakPolarHBondContact OH-CD 3.36Å
173	T	92.9	Very high	90.4	Very high	60 Å²	60	78.3 Å²	78.3	37%	0.368	39%	0.385	S	S	.	.			trans	-121.9	158.5	177	69.5	0	0	0	0	111.3	K171 R175 T176 A177	K171-T173 PolarHBondContact O-N 3.42Å; K171-T173 VanDerWaalsContact O-N 3.12Å; T173-R175 PolarHBondContact O-N 2.89Å; T173-T176 PolarHBondContact N-OG1 3.34Å; T173-T176 PolarHBondContact O-N 3Å; T173-T176 PolarHBondContact O-OG1 3.13Å; T173-T176 WeakPolarHBondContact OG1-CG2 3.45Å; T173-T176 PolarHBondContact OG1-N 3.03Å; T173-T176 PolarHBondContact OG1-OG1 2.9Å; T173-T176 VanDerWaalsContact OG1-OG1 3.07Å; T173-A177 PolarHBondContact O-N 3.36Å
174	R	93.2	Very high	90.9	Very high	107 Å²	107	77.1 Å²	77.1	40%	0.404	38%	0.379	S	S	.	.	H	α-helix	trans	-59.9	-36.8	171.8	-71.9	-173.9	179.1	136.5	5.9	111.8	I93 L96 A177 F178 D376	I93-R174 HydrophobicContact CD1-CG 4.43Å; I93-R174 HydrophobicContact CG1-CG 4.02Å; L96-R174 HydrophobicContact CD1-CG 4.32Å; R174-A177 PolarHBondContact O-N 3.02Å; R174-F178 HydrophobicContact CB-CD2 4.38Å; R174-F178 HydrophobicContact CB-CE2 4.23Å; R174-F178 WeakPolarHBondContact O-CD2 3.37Å; R174-F178 PolarHBondContact O-N 3.46Å; R174-D376 IonicContact CZ-OD1 3.57Å; R174-D376 IonicContact NH1-OD1 3.64Å; R174-D376 PolarHBondContact NH1-OD1 3.2Å; R174-D376 IonicContact NH2-OD1 2.75Å
175	R	94.4	Very high	91.5	Very high	211 Å²	211	73.1 Å²	73.1	80%	0.796	36%	0.363	S	S	*	.	H	α-helix	trans	-60.4	-47.2	178.7	-69	-175.6	-179.2	170.4	0.4	112	T173 A177 F178 L179	T173-R175 PolarHBondContact O-N 2.89Å; R175-A177 VanDerWaalsContact C-N 3.28Å; R175-A177 PolarHBondContact O-N 3.4Å; R175-F178 PolarHBondContact O-N 2.99Å; R175-L179 WeakPolarHBondContact O-CG 3.33Å; R175-L179 PolarHBondContact O-N 3.32Å
176	T	93.2	Very high	92.2	Very high	61 Å²	61	76.6 Å²	76.6	37%	0.374	38%	0.379	S	S	.	.	H	α-helix	trans	-62.5	-36.9	177.4	48.8	0	0	0	0	111.9	T173 L179 M180	T173-T176 PolarHBondContact N-OG1 3.34Å; T173-T176 PolarHBondContact O-N 3Å; T173-T176 PolarHBondContact O-OG1 3.13Å; T173-T176 WeakPolarHBondContact OG1-CG2 3.45Å; T173-T176 PolarHBondContact OG1-N 3.03Å; T173-T176 PolarHBondContact OG1-OG1 2.9Å; T173-T176 VanDerWaalsContact OG1-OG1 3.07Å; T176-L179 PolarHBondContact O-N 3.23Å; T176-M180 WeakPolarHBondContact O-CG 3.34Å; T176-M180 PolarHBondContact O-N 2.65Å; T176-M180 VanDerWaalsContact O-N 3.09Å
177	A	95.2	Very high	92.8	Very high	0 Å²	0	75.4 Å²	75.4	0%	0	37%	0.374	C	S	.	.	H	α-helix	trans	-66.4	-45.7	175.8	0	0	0	0	0	112.5	I93 Y97 T173 R174 R175 L179 M180 I181	I93-A177 HydrophobicContact CG2-CB 3.7Å; Y97-A177 HydrophobicContact CE1-CB 4.46Å; Y97-A177 HydrophobicContact CE2-CB 4.1Å; Y97-A177 WeakPolarHBondContact OH-CA 3.42Å; T173-A177 PolarHBondContact O-N 3.36Å; R174-A177 PolarHBondContact O-N 3.02Å; R175-A177 VanDerWaalsContact C-N 3.28Å; R175-A177 PolarHBondContact O-N 3.4Å; A177-L179 VanDerWaalsContact C-N 3.32Å; A177-L179 PolarHBondContact O-N 3.39Å; A177-M180 PolarHBondContact O-N 3.47Å; A177-I181 WeakPolarHBondContact O-CB 3.34Å; A177-I181 WeakPolarHBondContact O-CG1 3.29Å; A177-I181 PolarHBondContact O-N 2.96Å
178	F	96.6	Very high	93.3	Very high	121 Å²	121	69.9 Å²	69.9	53%	0.531	35%	0.35	S	S	.	.	H	α-helix	trans	-62.2	-36.3	175.6	-76.4	-60.9	0	0	0	113	L96 R174 R175 G182	L96-F178 HydrophobicContact CD1-CZ 4.39Å; R174-F178 HydrophobicContact CB-CD2 4.38Å; R174-F178 HydrophobicContact CB-CE2 4.23Å; R174-F178 WeakPolarHBondContact O-CD2 3.37Å; R174-F178 PolarHBondContact O-N 3.46Å; R175-F178 PolarHBondContact O-N 2.99Å; F178-G182 PolarHBondContact O-N 2.81Å
179	L	96.7	Very high	93.6	Very high	133 Å²	133	72.7 Å²	72.7	70%	0.696	37%	0.365	S	S	*	.	H	α-helix	trans	-65.6	-42.5	174.6	-71.4	173.9	0	0	0	112.1	R175 T176 A177 G183	R175-L179 WeakPolarHBondContact O-CG 3.33Å; R175-L179 PolarHBondContact O-N 3.32Å; T176-L179 PolarHBondContact O-N 3.23Å; A177-L179 VanDerWaalsContact C-N 3.32Å; A177-L179 PolarHBondContact O-N 3.39Å; L179-G183 PolarHBondContact O-N 2.84Å
180	M	96.5	Very high	94	Very high	56 Å²	56	73.6 Å²	73.6	28%	0.276	37%	0.371	S	S	.	.	H	α-helix	trans	-64.8	-47.1	176.2	-72.5	177.4	65.8	0	0	111.8	Y97 C153 V156 T176 A177 G183 A184	Y97-M180 HydrophobicContact CE1-CB 3.98Å; Y97-M180 HydrophobicContact CE1-CE 4.24Å; Y97-M180 HydrophobicContact CE1-SD 4.37Å; Y97-M180 PolarHBondContact OH-SD 3.41Å; C153-M180 HydrophobicContact CB-CE 4.09Å; V156-M180 HydrophobicContact CB-CE 4.36Å; V156-M180 HydrophobicContact CG1-CE 4.22Å; T176-M180 WeakPolarHBondContact O-CG 3.34Å; T176-M180 PolarHBondContact O-N 2.65Å; T176-M180 VanDerWaalsContact O-N 3.09Å; A177-M180 PolarHBondContact O-N 3.47Å; M180-G183 PolarHBondContact O-N 3.09Å; M180-A184 PolarHBondContact O-N 3Å
181	I	98	Very high	94.1	Very high	18 Å²	18	70.7 Å²	70.7	9%	0.092	35%	0.348	C	S	.	.	H	α-helix	trans	-60.3	-51.8	176.6	-71	166.7	0	0	0	110	L96 Y97 S100 A177 G183 A184 W185	L96-I181 HydrophobicContact CB-CD1 4.26Å; Y97-I181 HydrophobicContact CD1-CD1 4.04Å; Y97-I181 HydrophobicContact CD1-CG1 3.74Å; Y97-I181 HydrophobicContact CE1-CD1 4.42Å; Y97-I181 HydrophobicContact CE1-CG1 4.01Å; S100-I181 VanDerWaalsContact OG-CG2 3.31Å; S100-I181 WeakPolarHBondContact OG-CG2 3.45Å; A177-I181 WeakPolarHBondContact O-CB 3.34Å; A177-I181 WeakPolarHBondContact O-CG1 3.29Å; A177-I181 PolarHBondContact O-N 2.96Å; I181-G183 VanDerWaalsContact C-N 3.28Å; I181-G183 PolarHBondContact O-N 3.43Å; I181-A184 WeakPolarHBondContact O-CB 3.16Å; I181-A184 PolarHBondContact O-N 3.44Å; I181-W185 PolarHBondContact O-N 3.36Å
182	G	98	Very high	94.1	Very high	28 Å²	28	66.4 Å²	66.4	29%	0.289	33%	0.331	S	S	.	.	H	α-helix	trans	-57.2	-41.1	177.8	0	0	0	0	0	112.4	F178 W185 I186	F178-G182 PolarHBondContact O-N 2.81Å; G182-W185 PolarHBondContact O-N 3.09Å; G182-I186 WeakPolarHBondContact O-CB 3.4Å; G182-I186 WeakPolarHBondContact O-CD1 3.48Å; G182-I186 VanDerWaalsContact O-CG1 3.23Å; G182-I186 WeakPolarHBondContact O-CG1 3.47Å; G182-I186 PolarHBondContact O-N 3.26Å
183	G	97.7	Very high	93.9	Very high	26 Å²	26	66.3 Å²	66.3	27%	0.268	34%	0.338	S	S	.	.	H	α-helix	trans	-59.9	-44.9	173	0	0	0	0	0	113	L179 M180 I181 W185 I186 I187	L179-G183 PolarHBondContact O-N 2.84Å; M180-G183 PolarHBondContact O-N 3.09Å; I181-G183 VanDerWaalsContact C-N 3.28Å; I181-G183 PolarHBondContact O-N 3.43Å; G183-W185 PolarHBondContact O-N 3.47Å; G183-I186 PolarHBondContact O-N 3.37Å; G183-I187 WeakPolarHBondContact O-CB 3.38Å; G183-I187 WeakPolarHBondContact O-CD1 3.09Å; G183-I187 WeakPolarHBondContact O-CG1 3.44Å; G183-I187 PolarHBondContact O-N 3.25Å
184	A	97	Very high	93.3	Very high	4 Å²	4	66.4 Å²	66.4	3%	0.033	34%	0.339	C	S	.	.	H	α-helix	trans	-59.3	-44.8	176.3	0	0	0	0	0	112.1	L149 M180 I181 S188	L149-A184 HydrophobicContact CB-CB 3.72Å; L149-A184 WeakPolarHBondContact CD1-O 3.39Å; M180-A184 PolarHBondContact O-N 3Å; I181-A184 WeakPolarHBondContact O-CB 3.16Å; I181-A184 PolarHBondContact O-N 3.44Å; A184-S188 WeakPolarHBondContact O-CB 3.44Å; A184-S188 PolarHBondContact O-N 3.11Å; A184-S188 PolarHBondContact O-OG 3.46Å
185	W	97.9	Very high	92.3	Very high	43 Å²	43	61.4 Å²	61.4	16%	0.163	32%	0.32	C	S	.	.	H	α-helix	trans	-67.1	-44.1	177.6	-75.2	99.4	0	0	0	112.6	S100 L103 A104 L107 F142 L143 A146 I181 G182 G183 S188 L189	S100-W185 PolarHBondContact OG-NE1 3.1Å; L103-W185 HydrophobicContact CD2-CZ2 4.27Å; L103-W185 HydrophobicContact CG-CZ2 4.37Å; A104-W185 HydrophobicContact CB-CH2 3.88Å; A104-W185 HydrophobicContact CB-CZ2 4.08Å; L107-W185 HydrophobicContact CD1-CH2 3.95Å; L107-W185 HydrophobicContact CD1-CZ3 4.28Å; F142-W185 HydrophobicContact CE1-CE3 4.43Å; F142-W185 HydrophobicContact CE1-CZ3 4.1Å; F142-W185 AromaticContact CE2-CE3 3.95Å; F142-W185 HydrophobicContact CE2-CE3 3.95Å; F142-W185 HydrophobicContact CE2-CZ3 4.32Å; F142-W185 AromaticContact CZ-CE3 3.5Å; F142-W185 HydrophobicContact CZ-CE3 3.5Å; F142-W185 AromaticContact CZ-CZ3 3.6Å; F142-W185 HydrophobicContact CZ-CZ3 3.6Å; L143-W185 HydrophobicContact CD2-CZ3 4.26Å; A146-W185 HydrophobicContact CB-CD2 4.44Å; A146-W185 HydrophobicContact CB-CE3 4Å; A146-W185 HydrophobicContact CB-CH2 4.31Å; A146-W185 HydrophobicContact CB-CZ3 3.94Å; I181-W185 PolarHBondContact O-N 3.36Å; G182-W185 PolarHBondContact O-N 3.09Å; G183-W185 PolarHBondContact O-N 3.47Å; W185-S188 WeakPolarHBondContact O-CB 3.33Å; W185-S188 PolarHBondContact O-N 3.38Å; W185-L189 WeakPolarHBondContact O-CG 3.47Å; W185-L189 PolarHBondContact O-N 3.32Å
186	I	97.2	Very high	91.5	Very high	104 Å²	104	53.9 Å²	53.9	53%	0.533	30%	0.295	S	S	.	.	H	α-helix	trans	-63.9	-47	178.9	-69.1	165.5	0	0	0	110.9	G182 G183 S188 L189 L190	G182-I186 WeakPolarHBondContact O-CB 3.4Å; G182-I186 WeakPolarHBondContact O-CD1 3.48Å; G182-I186 VanDerWaalsContact O-CG1 3.23Å; G182-I186 WeakPolarHBondContact O-CG1 3.47Å; G182-I186 PolarHBondContact O-N 3.26Å; G183-I186 PolarHBondContact O-N 3.37Å; I186-S188 VanDerWaalsContact C-N 3.25Å; I186-S188 PolarHBondContact O-N 3.39Å; I186-L189 WeakPolarHBondContact O-CB 3.36Å; I186-L189 PolarHBondContact O-N 2.98Å; I186-L190 HydrophobicContact CG2-CD1 4.47Å; I186-L190 WeakPolarHBondContact O-CG 3.44Å; I186-L190 PolarHBondContact O-N 3.05Å
187	I	94.7	Very high	90.7	Very high	90 Å²	90	58.6 Å²	58.6	46%	0.462	31%	0.311	S	S	.	.	H	α-helix	trans	-61.1	-40.1	177.7	-65.6	165.4	0	0	0	110	L149 G183 L189 L190 V191	L149-I187 HydrophobicContact CD1-CB 3.68Å; L149-I187 HydrophobicContact CD1-CG2 3.49Å; L149-I187 VanDerWaalsContact CD1-CG2 3.49Å; G183-I187 WeakPolarHBondContact O-CB 3.38Å; G183-I187 WeakPolarHBondContact O-CD1 3.09Å; G183-I187 WeakPolarHBondContact O-CG1 3.44Å; G183-I187 PolarHBondContact O-N 3.25Å; I187-L189 PolarHBondContact O-N 3.25Å; I187-L190 WeakPolarHBondContact O-CB 3.47Å; I187-L190 PolarHBondContact O-N 3.36Å; I187-L190 VanDerWaalsContact O-N 3.16Å; I187-V191 WeakPolarHBondContact O-CG2 3.47Å; I187-V191 PolarHBondContact O-N 3.32Å; I187-V191 VanDerWaalsContact O-N 3.09Å
188	S	94.7	Very high	89.3	Confident	0 Å²	0	59.7 Å²	59.7	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-63.7	-41	176.1	-55.8	0	0	0	0	112.4	S145 A146 L149 A184 W185 I186 L190 V191 M192	S145-S188 PolarHBondContact O-OG 3.26Å; A146-S188 WeakPolarHBondContact CA-OG 3.23Å; A146-S188 PolarHBondContact N-OG 3.43Å; L149-S188 WeakPolarHBondContact CD1-OG 3.49Å; A184-S188 WeakPolarHBondContact O-CB 3.44Å; A184-S188 PolarHBondContact O-N 3.11Å; A184-S188 PolarHBondContact O-OG 3.46Å; W185-S188 WeakPolarHBondContact O-CB 3.33Å; W185-S188 PolarHBondContact O-N 3.38Å; I186-S188 VanDerWaalsContact C-N 3.25Å; I186-S188 PolarHBondContact O-N 3.39Å; S188-L190 VanDerWaalsContact C-N 3.27Å; S188-L190 PolarHBondContact O-N 2.93Å; S188-V191 WeakPolarHBondContact O-CB 3.42Å; S188-V191 PolarHBondContact O-N 2.89Å; S188-M192 PolarHBondContact O-N 3.03Å
189	L	93.4	Very high	87.7	Confident	74 Å²	74	64.1 Å²	64.1	39%	0.387	34%	0.342	S	S	.	.	H	α-helix	trans	-61.9	-35.6	173.7	-75.4	170.9	0	0	0	111.6	F142 W185 I186 I187 V191 M192	F142-L189 HydrophobicContact CD1-CD2 4.47Å; F142-L189 HydrophobicContact CD2-CD2 3.81Å; F142-L189 HydrophobicContact CD2-CG 4.08Å; F142-L189 HydrophobicContact CE1-CD2 4.09Å; F142-L189 HydrophobicContact CE2-CB 4.28Å; F142-L189 HydrophobicContact CE2-CD2 3.39Å; F142-L189 HydrophobicContact CE2-CG 3.44Å; F142-L189 VanDerWaalsContact CE2-CG 3.44Å; F142-L189 HydrophobicContact CG-CD2 4.32Å; F142-L189 HydrophobicContact CZ-CD2 3.5Å; F142-L189 HydrophobicContact CZ-CG 3.88Å; W185-L189 WeakPolarHBondContact O-CG 3.47Å; W185-L189 PolarHBondContact O-N 3.32Å; I186-L189 WeakPolarHBondContact O-CB 3.36Å; I186-L189 PolarHBondContact O-N 2.98Å; I187-L189 PolarHBondContact O-N 3.25Å; L189-V191 VanDerWaalsContact C-N 3.34Å; L189-M192 HydrophobicContact CD2-CE 3.96Å; L189-M192 WeakPolarHBondContact O-CB 3.38Å; L189-M192 PolarHBondContact O-N 3.46Å
190	L	91.6	Very high	86	Confident	114 Å²	114	59.1 Å²	59.1	60%	0.597	32%	0.315	S	S	*	.	H	α-helix	trans	-67.6	-34.9	175.6	-66.9	174.1	0	0	0	112.2	I186 I187 S188 M192 V193 P194	I186-L190 HydrophobicContact CG2-CD1 4.47Å; I186-L190 WeakPolarHBondContact O-CG 3.44Å; I186-L190 PolarHBondContact O-N 3.05Å; I187-L190 WeakPolarHBondContact O-CB 3.47Å; I187-L190 PolarHBondContact O-N 3.36Å; I187-L190 VanDerWaalsContact O-N 3.16Å; S188-L190 VanDerWaalsContact C-N 3.27Å; S188-L190 PolarHBondContact O-N 2.93Å; L190-M192 PolarHBondContact O-N 3.3Å; L190-V193 WeakPolarHBondContact O-CB 3.41Å; L190-V193 PolarHBondContact O-N 3.01Å; L190-V193 VanDerWaalsContact O-N 3.16Å; L190-P194 WeakPolarHBondContact O-CD 3.28Å
191	V	86.5	Confident	84.4	Confident	39 Å²	39	57.7 Å²	57.7	24%	0.236	31%	0.307	C	S	.	.	H	α-helix	trans	-65.1	-24.6	173.4	177.4	0	0	0	0	111.8	V141 I187 S188 L189 V193 P194 P195 I224	V141-V191 HydrophobicContact CG1-CG1 3.83Å; I187-V191 WeakPolarHBondContact O-CG2 3.47Å; I187-V191 PolarHBondContact O-N 3.32Å; I187-V191 VanDerWaalsContact O-N 3.09Å; S188-V191 WeakPolarHBondContact O-CB 3.42Å; S188-V191 PolarHBondContact O-N 2.89Å; L189-V191 VanDerWaalsContact C-N 3.34Å; V191-V193 VanDerWaalsContact C-N 3.33Å; V191-P194 WeakPolarHBondContact O-CD 3.47Å; V191-P195 WeakPolarHBondContact O-CD 3.46Å; V191-I224 HydrophobicContact CG1-CD1 3.44Å; V191-I224 VanDerWaalsContact CG1-CD1 3.44Å; V191-I224 HydrophobicContact CG1-CG1 3.83Å
192	M	84.2	Confident	82.8	Confident	41 Å²	41	59.6 Å²	59.6	20%	0.202	32%	0.316	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.8	-20.8	174.8	-166.7	-176.4	63.3	0	0	113.7	F142 S188 L189 L190 P195 I196	F142-M192 HydrophobicContact CB-CB 4.07Å; F142-M192 HydrophobicContact CB-CG 4.03Å; F142-M192 HydrophobicContact CB-SD 3.91Å; F142-M192 HydrophobicContact CG-SD 4.21Å; S188-M192 PolarHBondContact O-N 3.03Å; L189-M192 HydrophobicContact CD2-CE 3.96Å; L189-M192 WeakPolarHBondContact O-CB 3.38Å; L189-M192 PolarHBondContact O-N 3.46Å; L190-M192 PolarHBondContact O-N 3.3Å; M192-P195 VanDerWaalsContact O-CD 3.29Å; M192-P195 WeakPolarHBondContact O-CD 3.45Å; M192-I196 HydrophobicContact CE-CD1 3.71Å; M192-I196 HydrophobicContact CG-CD1 3.8Å; M192-I196 HydrophobicContact CG-CG1 4.41Å; M192-I196 WeakPolarHBondContact O-CG1 3.38Å; M192-I196 HydrophobicContact SD-CD1 4.09Å
193	V	83	Confident	81.3	Confident	63 Å²	63	60 Å²	60	38%	0.382	31%	0.313	S	S	.	.	H	α-helix	trans	-65.9	-47.8	-173.3	174.5	0	0	0	0	112.6	L190 V191 I196 F197	L190-V193 WeakPolarHBondContact O-CB 3.41Å; L190-V193 PolarHBondContact O-N 3.01Å; L190-V193 VanDerWaalsContact O-N 3.16Å; V191-V193 VanDerWaalsContact C-N 3.33Å; V193-I196 PolarHBondContact O-N 3.17Å; V193-I196 VanDerWaalsContact O-N 3.1Å; V193-F197 HydrophobicContact CG1-CD2 3.71Å; V193-F197 HydrophobicContact CG1-CE2 3.97Å; V193-F197 WeakPolarHBondContact O-CD2 3.36Å; V193-F197 PolarHBondContact O-N 2.98Å
194	P	78.6	Confident	79.6	Confident	61 Å²	61	59.2 Å²	59.2	40%	0.396	30%	0.304	S	S	.	.	H	α-helix	trans	-60	-43.3	-178.3	-24.8	35.6	0	0	0	114.7	L190 V191 I196 G198 Y216	L190-P194 WeakPolarHBondContact O-CD 3.28Å; V191-P194 WeakPolarHBondContact O-CD 3.47Å; P194-I196 VanDerWaalsContact C-N 3.31Å; P194-I196 PolarHBondContact O-N 3.48Å; P194-G198 WeakPolarHBondContact O-CA 3.14Å; P194-G198 PolarHBondContact O-N 2.91Å; P194-Y216 HydrophobicContact CB-CE2 3.63Å
195	P	73	Confident	78.1	Confident	2 Å²	2	62.7 Å²	62.7	1%	0.013	33%	0.325	C	S	.	.	H	α-helix	trans	-54.7	-42.4	170.6	-25.2	31	0	0	0	113.6	S138 V191 M192 H201 Y216	S138-P195 WeakPolarHBondContact OG-CB 3.4Å; V191-P195 WeakPolarHBondContact O-CD 3.46Å; M192-P195 VanDerWaalsContact O-CD 3.29Å; M192-P195 WeakPolarHBondContact O-CD 3.45Å; P195-H201 PolarHBondContact O-NE2 3.26Å; P195-Y216 VanDerWaalsContact CD-OH 3.22Å; P195-Y216 WeakPolarHBondContact CD-OH 3.38Å; P195-Y216 VanDerWaalsContact CG-OH 3.24Å; P195-Y216 WeakPolarHBondContact CG-OH 3.21Å
196	I	77.7	Confident	76.8	Confident	53 Å²	53	62.4 Å²	62.4	27%	0.272	34%	0.335	S	S	.	.	H	α-helix	trans	-67.6	-41.9	-174	-68.1	172.5	0	0	0	112	S138 M192 V193 P194	S138-I196 WeakPolarHBondContact OG-CG1 3.27Å; M192-I196 HydrophobicContact CE-CD1 3.71Å; M192-I196 HydrophobicContact CG-CD1 3.8Å; M192-I196 HydrophobicContact CG-CG1 4.41Å; M192-I196 WeakPolarHBondContact O-CG1 3.38Å; M192-I196 HydrophobicContact SD-CD1 4.09Å; V193-I196 PolarHBondContact O-N 3.17Å; V193-I196 VanDerWaalsContact O-N 3.1Å; P194-I196 VanDerWaalsContact C-N 3.31Å; P194-I196 PolarHBondContact O-N 3.48Å
197	F	76.9	Confident	75.6	Confident	161 Å²	161	62.1 Å²	62.1	71%	0.706	33%	0.328	S	S	*	.	H	α-helix	trans	-95.8	-8.8	-176.3	-66.3	-78.7	0	0	0	114	V193	V193-F197 HydrophobicContact CG1-CD2 3.71Å; V193-F197 HydrophobicContact CG1-CE2 3.97Å; V193-F197 WeakPolarHBondContact O-CD2 3.36Å; V193-F197 PolarHBondContact O-N 2.98Å
198	G	66	Low	75	Confident	23 Å²	23	58.1 Å²	58.1	24%	0.237	31%	0.308	C	S	.	.			trans	-71	135.3	178.7	0	0	0	0	0	111.7	P194 Q200	P194-G198 WeakPolarHBondContact O-CA 3.14Å; P194-G198 PolarHBondContact O-N 2.91Å; G198-Q200 PolarHBondContact O-N 2.91Å
199	F	61.8	Low	74.1	Confident	214 Å²	214	62.9 Å²	62.9	94%	0.939	33%	0.326	S	S	*	.	S	Bend	trans	-70.3	33.7	166.8	-65	-80	0	0	0	112.6
200	Q	61.6	Low	73	Confident	28 Å²	28	61.6 Å²	61.6	13%	0.131	32%	0.32	C	S	.	.			trans	-111.9	22.7	-160.1	-69.2	175	-27.9	0	0	112.3	G198 I210 R211 T212 D213	G198-Q200 PolarHBondContact O-N 2.91Å; Q200-I210 CarbonylContact O-C 3.51Å; Q200-I210 WeakPolarHBondContact O-CA 3.25Å; Q200-R211 CarbonylContact C-O 3.46Å; Q200-R211 WeakPolarHBondContact CA-O 3.41Å; Q200-R211 WeakPolarHBondContact CB-O 3.38Å; Q200-R211 CarbonylContact O-C 3.16Å; Q200-R211 VanDerWaalsContact O-CA 3.25Å; Q200-R211 WeakPolarHBondContact O-CA 3.31Å; Q200-R211 PolarHBondContact O-N 3.37Å; Q200-T212 HydrophobicContact CB-CG2 3.85Å; Q200-T212 VanDerWaalsContact CD-CG2 3.5Å; Q200-T212 HydrophobicContact CG-CG2 4.09Å; Q200-D213 PolarHBondContact NE2-OD1 3.29Å
201	H	63.4	Low	71.6	Confident	25 Å²	25	63.7 Å²	63.7	12%	0.116	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	128.6	179.8	-60.2	-70.7	0	0	0	110.5	I134 P195 T203	I134-H201 HydrophobicContact CG1-CB 4.29Å; P195-H201 PolarHBondContact O-NE2 3.26Å; H201-T203 HydrophobicContact CB-CG2 3.53Å; H201-T203 PolarHBondContact O-N 2.92Å
202	H	63.7	Low	70.5	Confident	58 Å²	58	62.3 Å²	62.3	27%	0.269	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	103.6	155.5	-80.2	-66.4	0	0	0	106.3	R207 C208 Y209 R211	H202-R207 CarbonylContact C-O 3.26Å; H202-R207 HydrophobicContact CB-CB 4.37Å; H202-R207 CarbonylContact O-C 3.38Å; H202-R207 VanDerWaalsContact O-C 3.25Å; H202-C208 WeakPolarHBondContact O-CA 3.44Å; H202-Y209 HydrophobicContact CB-CD1 4.21Å; H202-Y209 HydrophobicContact CB-CD2 4.24Å; H202-Y209 HydrophobicContact CB-CE1 3.66Å; H202-Y209 HydrophobicContact CB-CE2 3.74Å; H202-Y209 HydrophobicContact CB-CG 4.45Å; H202-Y209 AromaticContact CD2-CE2 3.3Å; H202-Y209 WeakPolarHBondContact CD2-CE2 3.49Å; H202-Y209 AromaticContact CD2-CZ 3.45Å; H202-Y209 VanDerWaalsContact CD2-CZ 3.45Å; H202-Y209 PolarHBondContact CD2-OH 3.26Å; H202-Y209 AromaticContact CG-CE2 3.84Å; H202-Y209 AromaticContact CG-CZ 3.6Å; H202-Y209 PolarHBondContact N-O 3.17Å; H202-Y209 PolarHBondContact O-N 2.7Å; H202-R211 WeakPolarHBondContact NE2-CD 3.39Å
203	T	66.7	Low	70	Confident	37 Å²	37	64.5 Å²	64.5	23%	0.227	32%	0.324	C	S	.	.			trans	-111.4	147	177.6	52.5	0	0	0	0	109.5	H130 C133 I134 H201 R207	H130-T203 HydrophobicContact CB-CG2 4.45Å; H130-T203 PolarHBondContact CE1-O 2.75Å; H130-T203 WeakPolarHBondContact ND1-CB 3.49Å; H130-T203 PolarHBondContact ND1-O 3.39Å; H130-T203 PolarHBondContact ND1-OG1 3.32Å; C133-T203 HydrophobicContact CB-CG2 4Å; I134-T203 HydrophobicContact CD1-CG2 4.22Å; I134-T203 HydrophobicContact CG1-CG2 3.71Å; H201-T203 HydrophobicContact CB-CG2 3.53Å; H201-T203 PolarHBondContact O-N 2.92Å; T203-R207 CarbonylContact C-O 3.4Å; T203-R207 VanDerWaalsContact C-O 3.26Å; T203-R207 WeakPolarHBondContact CA-O 3.33Å
204	G	61.4	Low	69.7	Low	9 Å²	9	62.7 Å²	62.7	9%	0.093	32%	0.315	C	S	.	.	S	Bend	trans	141.3	174.2	176.7	0	0	0	0	0	111.4	H130 G206 R207	H130-G204 WeakPolarHBondContact CE1-CA 3.39Å; H130-G204 PolarHBondContact ND1-N 3.5Å; G204-G206 PolarHBondContact O-N 3.36Å; G204-G206 VanDerWaalsContact O-N 3.13Å; G204-R207 PolarHBondContact N-O 3.21Å; G204-R207 CarbonylContact O-C 3.25Å; G204-R207 PolarHBondContact O-N 2.94Å
205	V	65.5	Low	69.7	Low	77 Å²	77	61.9 Å²	61.9	47%	0.467	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56	123.7	176.5	-176.7	0	0	0	0	109.2	Y124 E128 R207	Y124-V205 HydrophobicContact CE2-CG1 4.42Å; E128-V205 HydrophobicContact CB-CG2 4.26Å; E128-V205 HydrophobicContact CG-CG2 3.71Å; V205-R207 VanDerWaalsContact C-N 3.29Å; V205-R207 PolarHBondContact O-N 2.9Å
206	G	71.6	Confident	70	Confident	37 Å²	37	63.2 Å²	63.2	38%	0.381	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	79.1	-4.1	-179.1	0	0	0	0	0	116.8	W125 G204	W125-G206 PolarHBondContact O-N 3.48Å; G204-G206 PolarHBondContact O-N 3.36Å; G204-G206 VanDerWaalsContact O-N 3.13Å
207	R	71	Confident	70	Confident	99 Å²	99	62.4 Å²	62.4	37%	0.374	32%	0.317	S	S	.	.			trans	-134.8	101.7	-179.9	-68.5	-174.1	-84	175.6	-7.1	109.9	H202 T203 G204 V205 Y209	H202-R207 CarbonylContact C-O 3.26Å; H202-R207 HydrophobicContact CB-CB 4.37Å; H202-R207 CarbonylContact O-C 3.38Å; H202-R207 VanDerWaalsContact O-C 3.25Å; T203-R207 CarbonylContact C-O 3.4Å; T203-R207 VanDerWaalsContact C-O 3.26Å; T203-R207 WeakPolarHBondContact CA-O 3.33Å; G204-R207 PolarHBondContact N-O 3.21Å; G204-R207 CarbonylContact O-C 3.25Å; G204-R207 PolarHBondContact O-N 2.94Å; V205-R207 VanDerWaalsContact C-N 3.29Å; V205-R207 PolarHBondContact O-N 2.9Å; R207-Y209 HydrophobicContact CB-CD1 4.39Å; R207-Y209 HydrophobicContact CB-CE1 3.8Å; R207-Y209 HydrophobicContact CG-CE1 3.95Å
208	C	82.2	Confident	70.4	Confident	6 Å²	6	59.2 Å²	59.2	4%	0.041	30%	0.303	C	S	.	.			trans	-133.8	86.4	170.7	-179.5	0	0	0	0	110.2	R119 W125 C133 H202	R119-C208 PolarHBondContact NH1-O 3.46Å; R119-C208 VanDerWaalsContact NH1-O 3.1Å; W125-C208 HydrophobicContact CB-CB 3.55Å; W125-C208 HydrophobicContact CD2-CB 3.45Å; W125-C208 VanDerWaalsContact CD2-CB 3.45Å; W125-C208 HydrophobicContact CE3-CB 3.76Å; W125-C208 HydrophobicContact CG-CB 3.37Å; C133-C208 VanDerWaalsContact CA-SG 3.56Å; C133-C208 HydrophobicContact CB-CB 3.92Å; C133-C208 WeakPolarHBondContact CB-SG 3.32Å; C133-C208 WeakPolarHBondContact SG-CA 3.23Å; C133-C208 WeakPolarHBondContact SG-CB 3.5Å; C133-C208 CovalentContact SG-SG 2.02Å; C133-C208 PolarHBondContact SG-SG 2.9Å; H202-C208 WeakPolarHBondContact O-CA 3.44Å
209	Y	76.1	Confident	71.3	Confident	99 Å²	99	63.1 Å²	63.1	39%	0.388	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.1	156.8	178.7	58.9	-86.8	0	0	0	111.3	H202 R207 R211	H202-Y209 HydrophobicContact CB-CD1 4.21Å; H202-Y209 HydrophobicContact CB-CD2 4.24Å; H202-Y209 HydrophobicContact CB-CE1 3.66Å; H202-Y209 HydrophobicContact CB-CE2 3.74Å; H202-Y209 HydrophobicContact CB-CG 4.45Å; H202-Y209 AromaticContact CD2-CE2 3.3Å; H202-Y209 WeakPolarHBondContact CD2-CE2 3.49Å; H202-Y209 AromaticContact CD2-CZ 3.45Å; H202-Y209 VanDerWaalsContact CD2-CZ 3.45Å; H202-Y209 PolarHBondContact CD2-OH 3.26Å; H202-Y209 AromaticContact CG-CE2 3.84Å; H202-Y209 AromaticContact CG-CZ 3.6Å; H202-Y209 PolarHBondContact N-O 3.17Å; H202-Y209 PolarHBondContact O-N 2.7Å; R207-Y209 HydrophobicContact CB-CD1 4.39Å; R207-Y209 HydrophobicContact CB-CE1 3.8Å; R207-Y209 HydrophobicContact CG-CE1 3.95Å; Y209-R211 PolarHBondContact O-N 3.22Å
210	I	69.8	Low	72.2	Confident	48 Å²	48	53.8 Å²	53.8	25%	0.246	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	104.9	-177.2	-59.5	177.6	0	0	0	109.3	L137 Q200 T212 R217	L137-I210 HydrophobicContact CB-CD1 4.27Å; L137-I210 HydrophobicContact CB-CG1 4.32Å; L137-I210 HydrophobicContact CD1-CG1 3.75Å; L137-I210 HydrophobicContact CD2-CD1 4.22Å; L137-I210 HydrophobicContact CD2-CG1 4.06Å; L137-I210 HydrophobicContact CG-CG1 4.25Å; Q200-I210 CarbonylContact O-C 3.51Å; Q200-I210 WeakPolarHBondContact O-CA 3.25Å; I210-T212 VanDerWaalsContact C-N 3.33Å; I210-T212 HydrophobicContact CG2-CG2 3.08Å; I210-T212 PolarHBondContact O-N 3.48Å; I210-R217 PolarHBondContact O-NH2 2.89Å
211	R	63.7	Low	73.3	Confident	157 Å²	157	52.5 Å²	52.5	59%	0.592	27%	0.272	S	S	*	.			trans	-81.8	74.8	164	-171.1	-158.4	157.7	81	0.4	110.1	Q200 H202 Y209	Q200-R211 CarbonylContact C-O 3.46Å; Q200-R211 WeakPolarHBondContact CA-O 3.41Å; Q200-R211 WeakPolarHBondContact CB-O 3.38Å; Q200-R211 CarbonylContact O-C 3.16Å; Q200-R211 VanDerWaalsContact O-CA 3.25Å; Q200-R211 WeakPolarHBondContact O-CA 3.31Å; Q200-R211 PolarHBondContact O-N 3.37Å; H202-R211 WeakPolarHBondContact NE2-CD 3.39Å; Y209-R211 PolarHBondContact O-N 3.22Å
212	T	62.7	Low	74.5	Confident	11 Å²	11	53.7 Å²	53.7	7%	0.067	28%	0.279	C	S	.	.			trans	-92.4	140.4	173	43	0	0	0	0	111	Q200 I210 Y216 R217	Q200-T212 HydrophobicContact CB-CG2 3.85Å; Q200-T212 VanDerWaalsContact CD-CG2 3.5Å; Q200-T212 HydrophobicContact CG-CG2 4.09Å; I210-T212 VanDerWaalsContact C-N 3.33Å; I210-T212 HydrophobicContact CG2-CG2 3.08Å; I210-T212 PolarHBondContact O-N 3.48Å; T212-Y216 VanDerWaalsContact CB-CD1 3.42Å; T212-Y216 HydrophobicContact CG2-CD1 2.97Å; T212-Y216 HydrophobicContact CG2-CE1 3.33Å; T212-Y216 HydrophobicContact CG2-CG 3.66Å; T212-R217 WeakPolarHBondContact OG1-CG 2.97Å; T212-R217 PolarHBondContact OG1-NE 3.47Å
213	D	73	Confident	75.6	Confident	87 Å²	87	54.3 Å²	54.3	47%	0.465	29%	0.289	S	S	.	.			trans	-50	149.9	161.4	55.2	-71.9	0	0	0	110.5	Q200 G215 Y216 R217	Q200-D213 PolarHBondContact NE2-OD1 3.29Å; D213-G215 PolarHBondContact O-N 2.94Å; D213-Y216 PolarHBondContact O-N 3.21Å; D213-Y216 VanDerWaalsContact O-N 3.1Å; D213-Y216 WeakPolarHBondContact OD1-CB 3.06Å; D213-Y216 WeakPolarHBondContact OD2-CB 3.45Å; D213-Y216 PolarHBondContact OD2-N 3.39Å; D213-R217 PolarHBondContact O-N 2.65Å; D213-R217 VanDerWaalsContact O-N 3.14Å
214	A	77.3	Confident	76.5	Confident	24 Å²	24	53.4 Å²	53.4	20%	0.198	28%	0.282	C	S	.	.	H	α-helix	trans	-53.5	-38.5	179.2	0	0	0	0	0	111.7	Y216 R217 F218 E504	A214-Y216 PolarHBondContact O-N 3.15Å; A214-R217 PolarHBondContact O-N 3.24Å; A214-F218 VanDerWaalsContact O-CB 3.29Å; A214-F218 WeakPolarHBondContact O-CB 3.41Å; A214-F218 PolarHBondContact O-N 3.24Å; A214-E504 HydrophobicContact CB-CB 4.44Å; A214-E504 HydrophobicContact CB-CG 3.69Å
215	G	79.3	Confident	77.7	Confident	45 Å²	45	53.7 Å²	53.7	46%	0.464	28%	0.281	S	S	.	.	H	α-helix	trans	-58.2	-46.7	176.9	0	0	0	0	0	113.1	D213 F218 L219	D213-G215 PolarHBondContact O-N 2.94Å; G215-F218 PolarHBondContact O-N 3.4Å; G215-L219 VanDerWaalsContact O-CB 3.27Å; G215-L219 WeakPolarHBondContact O-CB 3.47Å; G215-L219 PolarHBondContact O-N 3.33Å
216	Y	78.3	Confident	78.9	Confident	30 Å²	30	52.4 Å²	52.4	12%	0.118	27%	0.269	C	S	.	.	H	α-helix	trans	-65.9	-42.9	176.4	179.5	-82.2	0	0	0	112.8	P194 P195 T212 D213 A214 F218 L219 T220	P194-Y216 HydrophobicContact CB-CE2 3.63Å; P195-Y216 VanDerWaalsContact CD-OH 3.22Å; P195-Y216 WeakPolarHBondContact CD-OH 3.38Å; P195-Y216 VanDerWaalsContact CG-OH 3.24Å; P195-Y216 WeakPolarHBondContact CG-OH 3.21Å; T212-Y216 VanDerWaalsContact CB-CD1 3.42Å; T212-Y216 HydrophobicContact CG2-CD1 2.97Å; T212-Y216 HydrophobicContact CG2-CE1 3.33Å; T212-Y216 HydrophobicContact CG2-CG 3.66Å; D213-Y216 PolarHBondContact O-N 3.21Å; D213-Y216 VanDerWaalsContact O-N 3.1Å; D213-Y216 WeakPolarHBondContact OD1-CB 3.06Å; D213-Y216 WeakPolarHBondContact OD2-CB 3.45Å; D213-Y216 PolarHBondContact OD2-N 3.39Å; A214-Y216 PolarHBondContact O-N 3.15Å; Y216-F218 VanDerWaalsContact C-N 3.3Å; Y216-F218 PolarHBondContact O-N 3.45Å; Y216-L219 PolarHBondContact O-N 2.89Å; Y216-T220 HydrophobicContact CD1-CG2 3.85Å; Y216-T220 HydrophobicContact CD2-CG2 4.28Å; Y216-T220 HydrophobicContact CE1-CG2 3.37Å; Y216-T220 HydrophobicContact CE2-CG2 3.78Å; Y216-T220 HydrophobicContact CG-CG2 4.33Å; Y216-T220 WeakPolarHBondContact O-CB 3.41Å; Y216-T220 WeakPolarHBondContact O-CG2 3Å; Y216-T220 PolarHBondContact O-N 2.6Å; Y216-T220 PolarHBondContact O-OG1 3.46Å
217	R	79	Confident	79.8	Confident	36 Å²	36	54.5 Å²	54.5	14%	0.136	28%	0.275	C	S	.	.	H	α-helix	trans	-59.1	-46.3	176.3	-68	-174	177	161.9	-1.1	111	I210 T212 D213 A214 T220 G221 H497	I210-R217 PolarHBondContact O-NH2 2.89Å; T212-R217 WeakPolarHBondContact OG1-CG 2.97Å; T212-R217 PolarHBondContact OG1-NE 3.47Å; D213-R217 PolarHBondContact O-N 2.65Å; D213-R217 VanDerWaalsContact O-N 3.14Å; A214-R217 PolarHBondContact O-N 3.24Å; R217-T220 PolarHBondContact O-OG1 3.39Å; R217-T220 VanDerWaalsContact O-OG1 3.08Å; R217-G221 PolarHBondContact O-N 2.94Å; R217-H497 PolarHBondContact O-NE2 3.14Å
218	F	84	Confident	80.7	Confident	94 Å²	94	50.3 Å²	50.3	41%	0.412	26%	0.26	S	S	.	.	H	α-helix	trans	-60.7	-51.2	176.6	-176.6	-95.1	0	0	0	111.4	A214 G215 Y216 T220 G221 I222 L498 V502	A214-F218 VanDerWaalsContact O-CB 3.29Å; A214-F218 WeakPolarHBondContact O-CB 3.41Å; A214-F218 PolarHBondContact O-N 3.24Å; G215-F218 PolarHBondContact O-N 3.4Å; Y216-F218 VanDerWaalsContact C-N 3.3Å; Y216-F218 PolarHBondContact O-N 3.45Å; F218-T220 PolarHBondContact O-N 2.89Å; F218-G221 PolarHBondContact O-N 3.48Å; F218-I222 HydrophobicContact CD1-CG1 4.41Å; F218-I222 HydrophobicContact CE1-CG1 4.08Å; F218-I222 HydrophobicContact CE2-CG1 4.43Å; F218-I222 HydrophobicContact CZ-CD1 4.48Å; F218-I222 HydrophobicContact CZ-CG1 4.09Å; F218-I222 WeakPolarHBondContact O-CG1 3.47Å; F218-I222 PolarHBondContact O-N 3.22Å; F218-L498 HydrophobicContact CD2-CD1 3.69Å; F218-L498 HydrophobicContact CE2-CD1 3.8Å; F218-V502 HydrophobicContact CD2-CG2 3.88Å; F218-V502 HydrophobicContact CE2-CG2 3.94Å
219	L	84.3	Confident	81.1	Confident	105 Å²	105	50.9 Å²	50.9	55%	0.55	26%	0.262	S	S	.	.	H	α-helix	trans	-62.2	-45.7	-178.3	-177	65.7	0	0	0	112.2	G215 Y216 I222 C223	G215-L219 VanDerWaalsContact O-CB 3.27Å; G215-L219 WeakPolarHBondContact O-CB 3.47Å; G215-L219 PolarHBondContact O-N 3.33Å; Y216-L219 PolarHBondContact O-N 2.89Å; L219-I222 PolarHBondContact O-N 2.94Å; L219-C223 VanDerWaalsContact O-CB 3.29Å; L219-C223 WeakPolarHBondContact O-CB 3.49Å; L219-C223 PolarHBondContact O-N 3.42Å; L219-C223 PolarHBondContact O-SG 3.2Å; L219-C223 VanDerWaalsContact O-SG 3.37Å
220	T	81.7	Confident	81.9	Confident	18 Å²	18	52.1 Å²	52.1	11%	0.11	28%	0.275	C	S	.	.	H	α-helix	trans	-65.9	-42.5	177	50.6	0	0	0	0	111.8	Y216 R217 F218 I222 C223 I224 H497	Y216-T220 HydrophobicContact CD1-CG2 3.85Å; Y216-T220 HydrophobicContact CD2-CG2 4.28Å; Y216-T220 HydrophobicContact CE1-CG2 3.37Å; Y216-T220 HydrophobicContact CE2-CG2 3.78Å; Y216-T220 HydrophobicContact CG-CG2 4.33Å; Y216-T220 WeakPolarHBondContact O-CB 3.41Å; Y216-T220 WeakPolarHBondContact O-CG2 3Å; Y216-T220 PolarHBondContact O-N 2.6Å; Y216-T220 PolarHBondContact O-OG1 3.46Å; R217-T220 PolarHBondContact O-OG1 3.39Å; R217-T220 VanDerWaalsContact O-OG1 3.08Å; F218-T220 PolarHBondContact O-N 2.89Å; T220-I222 VanDerWaalsContact C-N 3.33Å; T220-I222 PolarHBondContact O-N 3.41Å; T220-C223 PolarHBondContact O-N 3.36Å; T220-I224 HydrophobicContact CG2-CD1 4.16Å; T220-I224 WeakPolarHBondContact O-CB 3.43Å; T220-I224 VanDerWaalsContact O-CG1 3.32Å; T220-I224 WeakPolarHBondContact O-CG1 3.14Å; T220-I224 PolarHBondContact O-N 3Å; T220-H497 PolarHBondContact OG1-NE2 3.04Å
221	G	84.3	Confident	82.9	Confident	0 Å²	0	53.8 Å²	53.8	0%	0	28%	0.284	C	S	.	.	I	π-helix	trans	-53.7	-49.6	173.4	0	0	0	0	0	111.9	R217 F218 F225 F226	R217-G221 PolarHBondContact O-N 2.94Å; F218-G221 PolarHBondContact O-N 3.48Å; G221-F225 WeakPolarHBondContact O-CB 3.26Å; G221-F225 PolarHBondContact O-N 3.16Å; G221-F226 WeakPolarHBondContact O-CD2 3.5Å; G221-F226 PolarHBondContact O-N 3.16Å
222	I	89.2	Confident	84.3	Confident	51 Å²	51	46.4 Å²	46.4	26%	0.262	26%	0.256	S	S	.	.	I	π-helix	trans	-67.5	-51.6	-179.8	-64.9	-62.3	0	0	0	112.2	F218 L219 T220 F226 V227 L498	F218-I222 HydrophobicContact CD1-CG1 4.41Å; F218-I222 HydrophobicContact CE1-CG1 4.08Å; F218-I222 HydrophobicContact CE2-CG1 4.43Å; F218-I222 HydrophobicContact CZ-CD1 4.48Å; F218-I222 HydrophobicContact CZ-CG1 4.09Å; F218-I222 WeakPolarHBondContact O-CG1 3.47Å; F218-I222 PolarHBondContact O-N 3.22Å; L219-I222 PolarHBondContact O-N 2.94Å; T220-I222 VanDerWaalsContact C-N 3.33Å; T220-I222 PolarHBondContact O-N 3.41Å; I222-F226 HydrophobicContact CD1-CB 4.28Å; I222-F226 HydrophobicContact CD1-CD2 4.3Å; I222-F226 HydrophobicContact CD1-CG 4.28Å; I222-F226 PolarHBondContact O-N 2.94Å; I222-V227 HydrophobicContact CG2-CG2 4.08Å; I222-V227 WeakPolarHBondContact O-CG2 3.27Å; I222-V227 PolarHBondContact O-N 3.28Å; I222-L498 HydrophobicContact CD1-CD1 3.78Å; I222-L498 HydrophobicContact CD1-CD2 4.37Å; I222-L498 HydrophobicContact CG1-CD1 4.1Å
223	C	86.7	Confident	85.7	Confident	71 Å²	71	46.8 Å²	46.8	48%	0.48	26%	0.263	S	S	.	.	I	π-helix	trans	-72.1	-37.4	-172.5	-70.7	0	0	0	0	113.4	L219 T220 P228	L219-C223 VanDerWaalsContact O-CB 3.29Å; L219-C223 WeakPolarHBondContact O-CB 3.49Å; L219-C223 PolarHBondContact O-N 3.42Å; L219-C223 PolarHBondContact O-SG 3.2Å; L219-C223 VanDerWaalsContact O-SG 3.37Å; T220-C223 PolarHBondContact O-N 3.36Å; C223-P228 WeakPolarHBondContact O-CD 3.32Å
224	I	85.7	Confident	86.6	Confident	17 Å²	17	48.1 Å²	48.1	9%	0.087	27%	0.265	C	S	.	.	I	π-helix	trans	-87.8	-39.3	-174.1	-57.7	176.6	0	0	0	111	V141 I148 V191 T220 P228	V141-I224 HydrophobicContact CG1-CD1 4.01Å; I148-I224 HydrophobicContact CD1-CG2 4.2Å; I148-I224 WeakPolarHBondContact CD1-O 3.3Å; V191-I224 HydrophobicContact CG1-CD1 3.44Å; V191-I224 VanDerWaalsContact CG1-CD1 3.44Å; V191-I224 HydrophobicContact CG1-CG1 3.83Å; T220-I224 HydrophobicContact CG2-CD1 4.16Å; T220-I224 WeakPolarHBondContact O-CB 3.43Å; T220-I224 VanDerWaalsContact O-CG1 3.32Å; T220-I224 WeakPolarHBondContact O-CG1 3.14Å; T220-I224 PolarHBondContact O-N 3Å; I224-P228 WeakPolarHBondContact O-CG 3.25Å
225	F	86.6	Confident	87.4	Confident	15 Å²	15	47.6 Å²	47.6	7%	0.066	26%	0.258	C	S	.	.	I	π-helix	trans	-104.6	-62.7	-175.5	-63.7	-72.9	0	0	0	112.7	I148 G221 V227 P228 F229 W490 F493 A494	I148-F225 HydrophobicContact CD1-CD1 4.1Å; I148-F225 HydrophobicContact CD1-CE1 4.19Å; G221-F225 WeakPolarHBondContact O-CB 3.26Å; G221-F225 PolarHBondContact O-N 3.16Å; F225-V227 PolarHBondContact O-N 2.99Å; F225-P228 WeakPolarHBondContact O-CD 3.34Å; F225-F229 HydrophobicContact CB-CD2 4.17Å; F225-F229 HydrophobicContact CB-CE2 3.93Å; F225-F229 HydrophobicContact CD1-CE2 4.3Å; F225-F229 WeakPolarHBondContact O-CB 3.37Å; F225-F229 WeakPolarHBondContact O-CD2 3.37Å; F225-F229 VanDerWaalsContact O-CG 3.3Å; F225-F229 WeakPolarHBondContact O-CG 3.25Å; F225-F229 PolarHBondContact O-N 3.46Å; F225-W490 HydrophobicContact CD1-CE3 4.39Å; F225-W490 HydrophobicContact CE1-CD2 4.23Å; F225-W490 AromaticContact CE1-CE3 3.44Å; F225-W490 HydrophobicContact CE1-CE3 3.44Å; F225-W490 VanDerWaalsContact CE1-CE3 3.44Å; F225-W490 AromaticContact CE1-CZ3 3.8Å; F225-W490 HydrophobicContact CE1-CZ3 3.8Å; F225-W490 HydrophobicContact CZ-CE3 4.05Å; F225-W490 AromaticContact CZ-CZ3 3.98Å; F225-W490 HydrophobicContact CZ-CZ3 3.98Å; F225-F493 HydrophobicContact CE1-CD1 4.36Å; F225-F493 HydrophobicContact CE2-CD1 4.18Å; F225-F493 AromaticContact CE2-CE1 3.96Å; F225-F493 HydrophobicContact CE2-CE1 3.96Å; F225-F493 AromaticContact CZ-CD1 3.79Å; F225-F493 HydrophobicContact CZ-CD1 3.79Å; F225-F493 AromaticContact CZ-CE1 3.75Å; F225-F493 HydrophobicContact CZ-CE1 3.75Å; F225-A494 HydrophobicContact CB-CB 3.59Å; F225-A494 HydrophobicContact CD1-CB 4.11Å; F225-A494 HydrophobicContact CD2-CB 4.36Å; F225-A494 HydrophobicContact CG-CB 3.77Å
226	F	90.4	Very high	88.1	Confident	50 Å²	50	46.8 Å²	46.8	22%	0.219	24%	0.241	C	C	.	.	I	π-helix	trans	-66.5	-45.7	-167.9	-78.7	-96.3	0	0	0	113.5	G221 I222 F229 L230 A494 I495 L498	G221-F226 WeakPolarHBondContact O-CD2 3.5Å; G221-F226 PolarHBondContact O-N 3.16Å; I222-F226 HydrophobicContact CD1-CB 4.28Å; I222-F226 HydrophobicContact CD1-CD2 4.3Å; I222-F226 HydrophobicContact CD1-CG 4.28Å; I222-F226 PolarHBondContact O-N 2.94Å; F226-F229 PolarHBondContact O-N 3Å; F226-L230 WeakPolarHBondContact O-CB 3.45Å; F226-L230 VanDerWaalsContact O-CG 3.29Å; F226-L230 WeakPolarHBondContact O-CG 3.33Å; F226-L230 PolarHBondContact O-N 3.33Å; F226-A494 HydrophobicContact CE2-CB 4.24Å; F226-A494 WeakPolarHBondContact CE2-O 3.35Å; F226-I495 HydrophobicContact CZ-CG1 4.46Å; F226-L498 HydrophobicContact CD2-CD2 4.22Å; F226-L498 HydrophobicContact CE1-CD2 4.05Å; F226-L498 HydrophobicContact CE2-CB 3.74Å; F226-L498 HydrophobicContact CE2-CD2 3.53Å; F226-L498 HydrophobicContact CE2-CG 4.14Å; F226-L498 HydrophobicContact CZ-CB 4.16Å; F226-L498 HydrophobicContact CZ-CD2 3.42Å; F226-L498 VanDerWaalsContact CZ-CD2 3.42Å; F226-L498 HydrophobicContact CZ-CG 4.4Å
227	V	91.1	Very high	88.8	Confident	81 Å²	81	50 Å²	50	49%	0.491	26%	0.259	S	S	.	.	H	α-helix	trans	-60.8	-49.4	179.8	168.2	0	0	0	0	111	I222 F225 L230 L231	I222-V227 HydrophobicContact CG2-CG2 4.08Å; I222-V227 WeakPolarHBondContact O-CG2 3.27Å; I222-V227 PolarHBondContact O-N 3.28Å; F225-V227 PolarHBondContact O-N 2.99Å; V227-L230 PolarHBondContact O-N 2.96Å; V227-L231 WeakPolarHBondContact O-CB 3.41Å; V227-L231 PolarHBondContact O-N 2.92Å
228	P	89.7	Confident	89.5	Confident	11 Å²	11	54.6 Å²	54.6	7%	0.071	28%	0.277	C	S	.	.	H	α-helix	trans	-62	-40.2	173.6	-29.9	39.9	0	0	0	114.6	I148 C223 I224 F225 L230 L231 V232	I148-P228 HydrophobicContact CG2-CB 3.22Å; I148-P228 HydrophobicContact CG2-CG 3.69Å; C223-P228 WeakPolarHBondContact O-CD 3.32Å; I224-P228 WeakPolarHBondContact O-CG 3.25Å; F225-P228 WeakPolarHBondContact O-CD 3.34Å; P228-L230 PolarHBondContact O-N 3.1Å; P228-L231 PolarHBondContact O-N 3.27Å; P228-V232 WeakPolarHBondContact O-CB 3.42Å; P228-V232 VanDerWaalsContact O-CG2 3.32Å; P228-V232 WeakPolarHBondContact O-CG2 3.3Å; P228-V232 PolarHBondContact O-N 2.76Å
229	F	90.4	Very high	89.9	Confident	18 Å²	18	50.2 Å²	50.2	8%	0.079	26%	0.258	C	S	.	.	H	α-helix	trans	-60.5	-45.9	176.1	-77.1	-44.7	0	0	0	112.5	F225 F226 G233 F486 I487 W490 A494	F225-F229 HydrophobicContact CB-CD2 4.17Å; F225-F229 HydrophobicContact CB-CE2 3.93Å; F225-F229 HydrophobicContact CD1-CE2 4.3Å; F225-F229 WeakPolarHBondContact O-CB 3.37Å; F225-F229 WeakPolarHBondContact O-CD2 3.37Å; F225-F229 VanDerWaalsContact O-CG 3.3Å; F225-F229 WeakPolarHBondContact O-CG 3.25Å; F225-F229 PolarHBondContact O-N 3.46Å; F226-F229 PolarHBondContact O-N 3Å; F229-G233 PolarHBondContact O-N 2.94Å; F229-F486 HydrophobicContact CD1-CD1 4.14Å; F229-F486 AromaticContact CD1-CE1 3.53Å; F229-F486 HydrophobicContact CD1-CE1 3.53Å; F229-F486 HydrophobicContact CD1-CZ 4.32Å; F229-F486 AromaticContact CE1-CD1 3.67Å; F229-F486 HydrophobicContact CE1-CD1 3.67Å; F229-F486 AromaticContact CE1-CE1 3.09Å; F229-F486 HydrophobicContact CE1-CE1 3.09Å; F229-F486 AromaticContact CE1-CZ 3.61Å; F229-F486 HydrophobicContact CE1-CZ 3.61Å; F229-F486 HydrophobicContact CZ-CE1 4.04Å; F229-F486 HydrophobicContact CZ-CZ 4.12Å; F229-I487 HydrophobicContact CD1-CG1 3.82Å; F229-I487 HydrophobicContact CE1-CB 4.38Å; F229-I487 HydrophobicContact CE1-CG1 4.04Å; F229-W490 HydrophobicContact CE1-CB 4.25Å; F229-W490 HydrophobicContact CZ-CB 3.56Å; F229-A494 HydrophobicContact CE2-CB 3.72Å
230	L	92	Very high	90.3	Very high	126 Å²	126	51.4 Å²	51.4	66%	0.66	26%	0.259	S	S	*	.	H	α-helix	trans	-64.6	-42.2	177.9	-69.4	176.3	0	0	0	111.1	F226 V227 P228 F234	F226-L230 WeakPolarHBondContact O-CB 3.45Å; F226-L230 VanDerWaalsContact O-CG 3.29Å; F226-L230 WeakPolarHBondContact O-CG 3.33Å; F226-L230 PolarHBondContact O-N 3.33Å; V227-L230 PolarHBondContact O-N 2.96Å; P228-L230 PolarHBondContact O-N 3.1Å; L230-F234 WeakPolarHBondContact O-CB 3.42Å; L230-F234 PolarHBondContact O-N 3.35Å
231	L	92	Very high	90.8	Very high	82 Å²	82	58.1 Å²	58.1	43%	0.429	28%	0.282	S	S	.	.	H	α-helix	trans	-61.3	-52.6	177.5	177.3	63.8	0	0	0	111.5	V227 P228 F234 I235	V227-L231 WeakPolarHBondContact O-CB 3.41Å; V227-L231 PolarHBondContact O-N 2.92Å; P228-L231 PolarHBondContact O-N 3.27Å; L231-F234 PolarHBondContact O-N 3.04Å; L231-I235 HydrophobicContact CD1-CD1 3.96Å; L231-I235 HydrophobicContact CD1-CG1 4.49Å; L231-I235 HydrophobicContact CG-CD1 4.02Å; L231-I235 VanDerWaalsContact O-CG1 3.25Å; L231-I235 WeakPolarHBondContact O-CG1 3.36Å; L231-I235 PolarHBondContact O-N 3.06Å
232	V	92.2	Very high	91.1	Very high	2 Å²	2	59.6 Å²	59.6	1%	0.012	29%	0.291	C	S	.	.	H	α-helix	trans	-65.1	-47.6	-178.8	171.8	0	0	0	0	110.3	C152 P228 F234 I235 Y236 V483	C152-V232 VanDerWaalsContact SG-CG2 3.56Å; P228-V232 WeakPolarHBondContact O-CB 3.42Å; P228-V232 VanDerWaalsContact O-CG2 3.32Å; P228-V232 WeakPolarHBondContact O-CG2 3.3Å; P228-V232 PolarHBondContact O-N 2.76Å; V232-F234 PolarHBondContact O-N 3.45Å; V232-I235 PolarHBondContact O-N 2.91Å; V232-Y236 HydrophobicContact CG1-CD2 3.9Å; V232-Y236 HydrophobicContact CG1-CE2 4.04Å; V232-Y236 WeakPolarHBondContact O-CD2 3.34Å; V232-Y236 PolarHBondContact O-N 2.9Å; V232-V483 HydrophobicContact CG1-CB 4.25Å; V232-V483 HydrophobicContact CG1-CG1 3.23Å; V232-V483 HydrophobicContact CG1-CG2 4.01Å
233	G	92	Very high	91.1	Very high	20 Å²	20	58.2 Å²	58.2	21%	0.206	28%	0.284	C	S	.	.	H	α-helix	trans	-56.4	-47.6	176.5	0	0	0	0	0	112.2	F229 I235 Y236 I237	F229-G233 PolarHBondContact O-N 2.94Å; G233-I235 PolarHBondContact O-N 3.31Å; G233-Y236 PolarHBondContact O-N 3.24Å; G233-I237 WeakPolarHBondContact O-CD1 3.31Å; G233-I237 VanDerWaalsContact O-CG1 3.25Å; G233-I237 WeakPolarHBondContact O-CG1 3.44Å; G233-I237 PolarHBondContact O-N 3.32Å
234	F	93.3	Very high	91.2	Very high	115 Å²	115	59 Å²	59	50%	0.504	28%	0.28	S	S	.	.	H	α-helix	trans	-59.5	-44.6	176	175.3	-100.2	0	0	0	112.5	L230 L231 V232 Y236 I237 R238	L230-F234 WeakPolarHBondContact O-CB 3.42Å; L230-F234 PolarHBondContact O-N 3.35Å; L231-F234 PolarHBondContact O-N 3.04Å; V232-F234 PolarHBondContact O-N 3.45Å; F234-Y236 PolarHBondContact O-N 3.5Å; F234-I237 PolarHBondContact O-N 3.32Å; F234-R238 HydrophobicContact CE1-CG 4.11Å; F234-R238 HydrophobicContact CE2-CG 4.31Å; F234-R238 HydrophobicContact CZ-CG 4.01Å; F234-R238 WeakPolarHBondContact O-CG 3.29Å; F234-R238 PolarHBondContact O-N 2.94Å
235	I	94.1	Very high	91.3	Very high	13 Å²	13	64.7 Å²	64.7	7%	0.067	30%	0.301	C	S	.	.	H	α-helix	trans	-59.7	-46.9	177.9	-73.1	167.8	0	0	0	110.7	V156 Y159 L231 V232 G233 R238 I239	V156-I235 HydrophobicContact CG2-CD1 3.99Å; Y159-I235 HydrophobicContact CD2-CG2 4.16Å; Y159-I235 HydrophobicContact CG-CG2 4.33Å; L231-I235 HydrophobicContact CD1-CD1 3.96Å; L231-I235 HydrophobicContact CD1-CG1 4.49Å; L231-I235 HydrophobicContact CG-CD1 4.02Å; L231-I235 VanDerWaalsContact O-CG1 3.25Å; L231-I235 WeakPolarHBondContact O-CG1 3.36Å; L231-I235 PolarHBondContact O-N 3.06Å; V232-I235 PolarHBondContact O-N 2.91Å; G233-I235 PolarHBondContact O-N 3.31Å; I235-R238 WeakPolarHBondContact O-CB 3.33Å; I235-R238 PolarHBondContact O-N 3.33Å; I235-I239 HydrophobicContact CG2-CD1 3.69Å; I235-I239 HydrophobicContact CG2-CG1 4.33Å; I235-I239 VanDerWaalsContact O-CG1 3.3Å; I235-I239 WeakPolarHBondContact O-CG1 3.33Å; I235-I239 PolarHBondContact O-N 3.49Å
236	Y	93.1	Very high	91.2	Very high	27 Å²	27	67 Å²	67	11%	0.106	31%	0.309	C	S	.	.	H	α-helix	trans	-70.1	-35.3	-179.1	-85.5	-83.4	0	0	0	113.6	S155 V232 G233 F234 R238 I239 F240 V479 A480 V483	S155-Y236 WeakPolarHBondContact OG-CE2 3.31Å; V232-Y236 HydrophobicContact CG1-CD2 3.9Å; V232-Y236 HydrophobicContact CG1-CE2 4.04Å; V232-Y236 WeakPolarHBondContact O-CD2 3.34Å; V232-Y236 PolarHBondContact O-N 2.9Å; G233-Y236 PolarHBondContact O-N 3.24Å; F234-Y236 PolarHBondContact O-N 3.5Å; Y236-R238 VanDerWaalsContact C-N 3.29Å; Y236-R238 PolarHBondContact O-N 2.95Å; Y236-I239 HydrophobicContact CD1-CD1 4.35Å; Y236-I239 HydrophobicContact CE1-CD1 4.35Å; Y236-I239 PolarHBondContact O-N 2.94Å; Y236-F240 WeakPolarHBondContact O-CB 3.5Å; Y236-F240 PolarHBondContact O-N 3.49Å; Y236-V479 WeakPolarHBondContact OH-CB 3.29Å; Y236-V479 WeakPolarHBondContact OH-CG1 3.07Å; Y236-A480 HydrophobicContact CD1-CB 3.74Å; Y236-A480 VanDerWaalsContact CE1-CA 3.47Å; Y236-A480 HydrophobicContact CE1-CB 3.63Å; Y236-V483 HydrophobicContact CD2-CB 4.3Å; Y236-V483 HydrophobicContact CD2-CG1 3.76Å; Y236-V483 HydrophobicContact CD2-CG2 4.33Å; Y236-V483 HydrophobicContact CE2-CB 3.93Å; Y236-V483 HydrophobicContact CE2-CG1 3.84Å; Y236-V483 HydrophobicContact CE2-CG2 3.54Å; Y236-V483 HydrophobicContact CG-CG1 4.44Å
237	I	93.1	Very high	90.8	Very high	97 Å²	97	66.3 Å²	66.3	50%	0.497	31%	0.311	S	S	.	.	H	α-helix	trans	-57.9	-47	171.2	-70.2	164.7	0	0	0	109.5	G233 F234 F240 W241	G233-I237 WeakPolarHBondContact O-CD1 3.31Å; G233-I237 VanDerWaalsContact O-CG1 3.25Å; G233-I237 WeakPolarHBondContact O-CG1 3.44Å; G233-I237 PolarHBondContact O-N 3.32Å; F234-I237 PolarHBondContact O-N 3.32Å; I237-F240 PolarHBondContact O-N 3.04Å; I237-W241 PolarHBondContact O-N 3.41Å; I237-W241 VanDerWaalsContact O-N 3.09Å
238	R	94.1	Very high	90.4	Very high	133 Å²	133	68.6 Å²	68.6	50%	0.502	31%	0.31	S	S	.	.	H	α-helix	trans	-61.8	-45	176.2	-71.5	-66.8	-140.7	177.6	4.4	112.4	Y159 F234 I235 Y236 F240 W241 V242	Y159-R238 HydrophobicContact CD2-CB 4.42Å; Y159-R238 HydrophobicContact CE2-CB 3.85Å; F234-R238 HydrophobicContact CE1-CG 4.11Å; F234-R238 HydrophobicContact CE2-CG 4.31Å; F234-R238 HydrophobicContact CZ-CG 4.01Å; F234-R238 WeakPolarHBondContact O-CG 3.29Å; F234-R238 PolarHBondContact O-N 2.94Å; I235-R238 WeakPolarHBondContact O-CB 3.33Å; I235-R238 PolarHBondContact O-N 3.33Å; Y236-R238 VanDerWaalsContact C-N 3.29Å; Y236-R238 PolarHBondContact O-N 2.95Å; R238-F240 VanDerWaalsContact C-N 3.33Å; R238-F240 PolarHBondContact O-N 3.39Å; R238-W241 PolarHBondContact O-N 3.47Å; R238-V242 VanDerWaalsContact O-CG2 3.26Å; R238-V242 WeakPolarHBondContact O-CG2 3.45Å; R238-V242 PolarHBondContact O-N 2.91Å
239	I	92.1	Very high	90	Very high	2 Å²	2	72 Å²	72	1%	0.01	33%	0.325	C	S	.	.	H	α-helix	trans	-58.9	-46.2	177.6	-70.6	169.3	0	0	0	110.6	R158 Y159 I162 I235 Y236 W241 V242 I243 V476	R158-I239 HydrophobicContact CB-CD1 4.18Å; Y159-I239 HydrophobicContact CD2-CG1 4.01Å; I162-I239 HydrophobicContact CG1-CG2 4.45Å; I235-I239 HydrophobicContact CG2-CD1 3.69Å; I235-I239 HydrophobicContact CG2-CG1 4.33Å; I235-I239 VanDerWaalsContact O-CG1 3.3Å; I235-I239 WeakPolarHBondContact O-CG1 3.33Å; I235-I239 PolarHBondContact O-N 3.49Å; Y236-I239 HydrophobicContact CD1-CD1 4.35Å; Y236-I239 HydrophobicContact CE1-CD1 4.35Å; Y236-I239 PolarHBondContact O-N 2.94Å; I239-W241 PolarHBondContact O-N 3.47Å; I239-V242 PolarHBondContact O-N 2.83Å; I239-I243 HydrophobicContact CG2-CD1 3.66Å; I239-I243 HydrophobicContact CG2-CG1 4.38Å; I239-I243 WeakPolarHBondContact O-CG1 3.09Å; I239-I243 PolarHBondContact O-N 3.18Å; I239-V476 HydrophobicContact CG2-CG1 3.51Å
240	F	92.3	Very high	89.2	Confident	131 Å²	131	72.2 Å²	72.2	58%	0.575	33%	0.327	S	S	*	.	H	α-helix	trans	-57.4	-49.7	178	175.1	-97.4	0	0	0	111.6	Y236 I237 R238 V242 I243 H244	Y236-F240 WeakPolarHBondContact O-CB 3.5Å; Y236-F240 PolarHBondContact O-N 3.49Å; I237-F240 PolarHBondContact O-N 3.04Å; R238-F240 VanDerWaalsContact C-N 3.33Å; R238-F240 PolarHBondContact O-N 3.39Å; F240-V242 VanDerWaalsContact C-N 3.35Å; F240-V242 PolarHBondContact O-N 3.44Å; F240-I243 PolarHBondContact O-N 3Å; F240-H244 WeakPolarHBondContact O-CB 3.48Å; F240-H244 PolarHBondContact O-N 3.41Å
241	W	92.6	Very high	88.3	Confident	159 Å²	159	71.7 Å²	71.7	60%	0.602	32%	0.321	S	S	*	.	H	α-helix	trans	-61.6	-40.4	178.4	-79	114.4	0	0	0	113	I237 R238 I239 H244 R245	I237-W241 PolarHBondContact O-N 3.41Å; I237-W241 VanDerWaalsContact O-N 3.09Å; R238-W241 PolarHBondContact O-N 3.47Å; I239-W241 PolarHBondContact O-N 3.47Å; W241-H244 PolarHBondContact O-N 2.81Å; W241-R245 WeakPolarHBondContact O-CB 3.45Å; W241-R245 PolarHBondContact O-N 3.5Å
242	V	90.1	Very high	87.1	Confident	31 Å²	31	74.7 Å²	74.7	19%	0.188	33%	0.331	C	S	.	.	H	α-helix	trans	-66.5	-42.5	178.1	173.1	0	0	0	0	111.1	I162 N163 R238 I239 F240 R246	I162-V242 HydrophobicContact CG2-CB 4.28Å; I162-V242 HydrophobicContact CG2-CG1 3.67Å; N163-V242 WeakPolarHBondContact OD1-CG2 3.33Å; R238-V242 VanDerWaalsContact O-CG2 3.26Å; R238-V242 WeakPolarHBondContact O-CG2 3.45Å; R238-V242 PolarHBondContact O-N 2.91Å; I239-V242 PolarHBondContact O-N 2.83Å; F240-V242 VanDerWaalsContact C-N 3.35Å; F240-V242 PolarHBondContact O-N 3.44Å; V242-R246 WeakPolarHBondContact O-CG 3.48Å; V242-R246 PolarHBondContact O-N 2.93Å
243	I	89.4	Confident	85.6	Confident	22 Å²	22	76.2 Å²	76.2	11%	0.113	35%	0.347	C	S	.	.	H	α-helix	trans	-64.7	-46.2	176.6	-70.7	171.8	0	0	0	110.6	I162 I239 F240 R245 R246 S247 F469 Q473 V476	I162-I243 HydrophobicContact CD1-CD1 4.46Å; I162-I243 HydrophobicContact CG2-CG1 4.16Å; I239-I243 HydrophobicContact CG2-CD1 3.66Å; I239-I243 HydrophobicContact CG2-CG1 4.38Å; I239-I243 WeakPolarHBondContact O-CG1 3.09Å; I239-I243 PolarHBondContact O-N 3.18Å; F240-I243 PolarHBondContact O-N 3Å; I243-R245 VanDerWaalsContact C-N 3.33Å; I243-R245 PolarHBondContact O-N 3.41Å; I243-R246 PolarHBondContact O-N 2.9Å; I243-S247 WeakPolarHBondContact O-CB 3.47Å; I243-S247 PolarHBondContact O-N 3.47Å; I243-F469 HydrophobicContact CB-CZ 4.48Å; I243-F469 HydrophobicContact CG1-CE2 4.44Å; I243-F469 HydrophobicContact CG1-CZ 4.3Å; I243-F469 HydrophobicContact CG2-CZ 4.34Å; I243-Q473 HydrophobicContact CD1-CG 4.45Å; I243-Q473 HydrophobicContact CG2-CG 4.13Å; I243-V476 HydrophobicContact CD1-CB 4.31Å; I243-V476 HydrophobicContact CD1-CG1 3.72Å
244	H	88.9	Confident	83.7	Confident	86 Å²	86	82.2 Å²	82.2	40%	0.398	37%	0.368	S	S	.	.	H	α-helix	trans	-60.1	-44.9	179.3	-175.6	69.7	0	0	0	111.4	F240 W241 S247 R248	F240-H244 WeakPolarHBondContact O-CB 3.48Å; F240-H244 PolarHBondContact O-N 3.41Å; W241-H244 PolarHBondContact O-N 2.81Å; H244-S247 PolarHBondContact O-N 2.99Å; H244-R248 WeakPolarHBondContact O-CG 3.37Å; H244-R248 PolarHBondContact O-N 3.09Å
245	R	87.8	Confident	81.1	Confident	137 Å²	137	86 Å²	86	52%	0.517	38%	0.384	S	S	.	.	H	α-helix	trans	-59.7	-49.1	175.5	-179.9	179	174.1	163.9	5.4	112.3	W241 I243 R248 E249 L270	W241-R245 WeakPolarHBondContact O-CB 3.45Å; W241-R245 PolarHBondContact O-N 3.5Å; I243-R245 VanDerWaalsContact C-N 3.33Å; I243-R245 PolarHBondContact O-N 3.41Å; R245-R248 PolarHBondContact O-N 3.19Å; R245-E249 WeakPolarHBondContact CG-OE1 3.47Å; R245-E249 IonicContact CZ-OE1 3.76Å; R245-E249 IonicContact NE-OE1 3.57Å; R245-E249 PolarHBondContact NE-OE1 3.47Å; R245-E249 IonicContact NH2-OE1 2.99Å; R245-E249 WeakPolarHBondContact O-CG 3.42Å; R245-E249 PolarHBondContact O-N 3.33Å; R245-E249 VanDerWaalsContact O-N 3.1Å; R245-L270 VanDerWaalsContact NH2-CD2 3.27Å
246	R	84	Confident	78.4	Confident	64 Å²	64	87.1 Å²	87.1	24%	0.242	39%	0.393	C	S	.	.	H	α-helix	trans	-68.4	-34.3	-178.9	-75.3	-173.8	-178.7	170.2	9.5	113	I162 N163 V242 I243 R248 E249 L250 F469	I162-R246 PolarHBondContact O-NH1 3.38Å; I162-R246 PolarHBondContact O-NH2 2.89Å; N163-R246 PolarHBondContact O-NH2 3.49Å; V242-R246 WeakPolarHBondContact O-CG 3.48Å; V242-R246 PolarHBondContact O-N 2.93Å; I243-R246 PolarHBondContact O-N 2.9Å; R246-R248 VanDerWaalsContact C-N 3.29Å; R246-R248 PolarHBondContact O-N 2.88Å; R246-E249 PolarHBondContact O-N 2.88Å; R246-L250 WeakPolarHBondContact O-CB 3.41Å; R246-L250 VanDerWaalsContact O-CG 3.27Å; R246-L250 WeakPolarHBondContact O-CG 3.49Å; R246-L250 PolarHBondContact O-N 3.24Å; R246-F469 HydrophobicContact CB-CE1 4.2Å; R246-F469 HydrophobicContact CB-CE2 4.01Å; R246-F469 HydrophobicContact CB-CZ 3.63Å; R246-F469 HydrophobicContact CG-CE2 4.42Å
247	S	83.5	Confident	75.8	Confident	36 Å²	36	91.4 Å²	91.4	25%	0.252	43%	0.427	S	S	.	.	H	α-helix	trans	-58.8	-44.7	173.8	-162.8	0	0	0	0	110.7	I243 H244 L250 E251	I243-S247 WeakPolarHBondContact O-CB 3.47Å; I243-S247 PolarHBondContact O-N 3.47Å; H244-S247 PolarHBondContact O-N 2.99Å; S247-L250 PolarHBondContact O-N 3.24Å; S247-E251 WeakPolarHBondContact O-CG 3.4Å; S247-E251 PolarHBondContact O-N 3Å; S247-E251 PolarHBondContact OG-OE1 3.44Å
248	R	82.5	Confident	73	Confident	129 Å²	129	91.8 Å²	91.8	49%	0.487	43%	0.43	S	S	.	.	H	α-helix	trans	-63.2	-44	176.1	-67	-177	68.2	-170.2	-0.2	112.1	H244 R245 R246 L250 E251 F252	H244-R248 WeakPolarHBondContact O-CG 3.37Å; H244-R248 PolarHBondContact O-N 3.09Å; R245-R248 PolarHBondContact O-N 3.19Å; R246-R248 VanDerWaalsContact C-N 3.29Å; R246-R248 PolarHBondContact O-N 2.88Å; R248-L250 VanDerWaalsContact C-N 3.31Å; R248-L250 PolarHBondContact O-N 3.48Å; R248-E251 PolarHBondContact O-N 2.86Å; R248-F252 HydrophobicContact CB-CD2 4.48Å; R248-F252 HydrophobicContact CB-CE2 4.3Å; R248-F252 WeakPolarHBondContact O-CD2 3.11Å; R248-F252 PolarHBondContact O-N 3.11Å
249	E	79.8	Confident	70.6	Confident	83 Å²	83	91 Å²	91	39%	0.388	44%	0.442	S	S	.	.	H	α-helix	trans	-61.2	-38.1	176.7	-69.3	169.2	-175.7	0	0	112.1	R245 R246 G253	R245-E249 WeakPolarHBondContact CG-OE1 3.47Å; R245-E249 IonicContact CZ-OE1 3.76Å; R245-E249 IonicContact NE-OE1 3.57Å; R245-E249 PolarHBondContact NE-OE1 3.47Å; R245-E249 IonicContact NH2-OE1 2.99Å; R245-E249 WeakPolarHBondContact O-CG 3.42Å; R245-E249 PolarHBondContact O-N 3.33Å; R245-E249 VanDerWaalsContact O-N 3.1Å; R246-E249 PolarHBondContact O-N 2.88Å; E249-G253 PolarHBondContact O-N 3.49Å
250	L	73.9	Confident	68.3	Low	21 Å²	21	99.6 Å²	99.6	11%	0.11	48%	0.482	C	S	.	.	H	α-helix	trans	-73.4	-22.5	176.2	-70.2	173.1	0	0	0	114.1	R246 S247 R248 Y462 R466 F469	R246-L250 WeakPolarHBondContact O-CB 3.41Å; R246-L250 VanDerWaalsContact O-CG 3.27Å; R246-L250 WeakPolarHBondContact O-CG 3.49Å; R246-L250 PolarHBondContact O-N 3.24Å; S247-L250 PolarHBondContact O-N 3.24Å; R248-L250 VanDerWaalsContact C-N 3.31Å; R248-L250 PolarHBondContact O-N 3.48Å; L250-Y462 HydrophobicContact CD2-CE1 4.38Å; L250-Y462 HydrophobicContact CD2-CE2 4.39Å; L250-Y462 WeakPolarHBondContact CD2-OH 3.37Å; L250-R466 HydrophobicContact CD1-CG 4.26Å; L250-R466 HydrophobicContact CD2-CB 4.39Å; L250-R466 HydrophobicContact CD2-CG 3.98Å; L250-R466 PolarHBondContact O-NH2 3.25Å; L250-F469 HydrophobicContact CD1-CD1 3.75Å; L250-F469 HydrophobicContact CD1-CE1 3.95Å
251	E	73.5	Confident	65.9	Low	115 Å²	115	100.3 Å²	100.3	54%	0.537	49%	0.487	S	S	.	.	H	α-helix	trans	-80.2	-45.3	173.4	-75.6	162.6	-157.9	0	0	110.8	S247 R248 G253 K254	S247-E251 WeakPolarHBondContact O-CG 3.4Å; S247-E251 PolarHBondContact O-N 3Å; S247-E251 PolarHBondContact OG-OE1 3.44Å; R248-E251 PolarHBondContact O-N 2.86Å; E251-G253 VanDerWaalsContact C-N 3.34Å; E251-G253 PolarHBondContact O-N 3.08Å; E251-K254 WeakPolarHBondContact O-CB 3.42Å; E251-K254 PolarHBondContact O-N 3.01Å; E251-K254 VanDerWaalsContact O-N 3.16Å
252	F	67.4	Low	63.5	Low	145 Å²	145	98 Å²	98	64%	0.636	48%	0.483	S	S	*	.	H	α-helix	trans	-65.4	-36.9	174.4	-71.4	-64	0	0	0	112.3	R248 K254 F255	R248-F252 HydrophobicContact CB-CD2 4.48Å; R248-F252 HydrophobicContact CB-CE2 4.3Å; R248-F252 WeakPolarHBondContact O-CD2 3.11Å; R248-F252 PolarHBondContact O-N 3.11Å; F252-K254 PolarHBondContact O-N 3.31Å; F252-K254 VanDerWaalsContact O-N 3.16Å; F252-F255 PolarHBondContact O-N 3.33Å; F252-F255 VanDerWaalsContact O-N 3.17Å
253	G	59.8	Low	61	Low	34 Å²	34	105.4 Å²	105.4	35%	0.351	51%	0.507	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-8.3	174.5	0	0	0	0	0	114.9	E249 E251	E249-G253 PolarHBondContact O-N 3.49Å; E251-G253 VanDerWaalsContact C-N 3.34Å; E251-G253 PolarHBondContact O-N 3.08Å
254	K	52.3	Low	58.6	Low	147 Å²	147	114.2 Å²	114.2	64%	0.639	55%	0.546	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.3	-9	173.3	-87.8	177.2	157.8	179.2	0	113.6	E251 F252	E251-K254 WeakPolarHBondContact O-CB 3.42Å; E251-K254 PolarHBondContact O-N 3.01Å; E251-K254 VanDerWaalsContact O-N 3.16Å; F252-K254 PolarHBondContact O-N 3.31Å; F252-K254 VanDerWaalsContact O-N 3.16Å
255	F	39.5	Very low	56	Low	195 Å²	195	113.1 Å²	113.1	86%	0.855	56%	0.557	S	S	*	*	S	Bend	trans	-97.2	1	-176.8	-124.8	-87.4	0	0	0	115	F252	F252-F255 PolarHBondContact O-N 3.33Å; F252-F255 VanDerWaalsContact O-N 3.17Å
256	S	36.1	Very low	53.8	Low	36 Å²	36	110.8 Å²	110.8	25%	0.252	56%	0.562	S	S	.	*			trans	-110.8	85.2	174.7	-163.8	0	0	0	0	110.5
257	S	39.4	Very low	51.6	Low	116 Å²	116	115.3 Å²	115.3	81%	0.811	58%	0.584	S	S	*	*			trans	-86.5	16.5	165.7	52.6	0	0	0	0	112.3
258	N	34.7	Very low	49.5	Very low	106 Å²	106	125.5 Å²	125.5	57%	0.567	62%	0.617	S	S	*	*			trans	-110.6	109.1	176.2	-103.7	-17.1	0	0	0	110.7	E260 E261	N258-E260 PolarHBondContact O-N 3.13Å; N258-E261 PolarHBondContact O-N 3.44Å
259	P	43.1	Very low	47.4	Very low	117 Å²	117	127.1 Å²	127.1	76%	0.76	63%	0.634	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.2	-9.7	-176.1	21.6	-29.9	0	0	0	114.8
260	E	43.5	Very low	45.4	Very low	182 Å²	182	128.4 Å²	128.4	85%	0.85	64%	0.643	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.3	-25.8	179.9	-69.3	-110.2	123.5	0	0	113.8	N258	N258-E260 PolarHBondContact O-N 3.13Å
261	E	42.6	Very low	43.8	Very low	145 Å²	145	135.4 Å²	135.4	68%	0.678	67%	0.673	S	S	*	*	G	3₁₀ helix	trans	-82.6	-18.1	-179.2	-89	-172.8	145.4	0	0	113.9	N258 R263	N258-E261 PolarHBondContact O-N 3.44Å; E261-R263 PolarHBondContact O-N 2.9Å
262	H	41.2	Very low	41.9	Very low	110 Å²	110	134 Å²	134	51%	0.509	67%	0.669	S	S	.	*	G	3₁₀ helix	trans	-73.7	-8	-175	-102.6	-87.6	0	0	0	114.7	F264	H262-F264 PolarHBondContact O-N 3.49Å
263	R	38.4	Very low	40.3	Very low	187 Å²	187	132.6 Å²	132.6	71%	0.706	68%	0.675	S	S	*	*	G	3₁₀ helix	trans	-81	-11.4	-176.3	-138.8	-179.9	-149.8	156.2	18.8	114.8	E261	E261-R263 PolarHBondContact O-N 2.9Å
264	F	38.9	Very low	38.9	Very low	208 Å²	208	135.8 Å²	135.8	91%	0.912	68%	0.684	S	S	*	*	T	Hydrogen-bonded Turn	trans	-128.9	-6.8	-172.3	-118.1	-95.9	0	0	0	115.9	H262	H262-F264 PolarHBondContact O-N 3.49Å
265	G	35	Very low	38	Very low	63 Å²	63	132.6 Å²	132.6	65%	0.649	67%	0.674	S	S	*	*	S	Bend	trans	-103.3	-36.5	-163.9	0	0	0	0	0	119.2
266	S	40.7	Very low	37.9	Very low	88 Å²	88	130.7 Å²	130.7	62%	0.615	67%	0.671	S	S	*	*	S	Bend	trans	-131	-1.9	-147.7	-158.8	0	0	0	0	119.4
267	F	39	Very low	37.6	Very low	159 Å²	159	139.5 Å²	139.5	70%	0.697	70%	0.7	S	S	*	*	S	Bend	trans	-123.4	-5.8	-172.9	-102.7	-91	0	0	0	117.1
268	R	37.8	Very low	37.3	Very low	249 Å²	249	142 Å²	142	94%	0.94	69%	0.692	S	S	*	*	S	Bend	trans	-106	-5.3	-176.7	-97.4	-174.4	-173.8	-172.7	3.5	117
269	L	39.5	Very low	37.5	Very low	163 Å²	163	140.9 Å²	140.9	85%	0.853	68%	0.683	S	S	*	*	S	Bend	trans	-103.4	-11.7	-174.1	-89.1	156.6	0	0	0	115.4
270	L	37.9	Very low	37.1	Very low	111 Å²	111	145.5 Å²	145.5	58%	0.581	69%	0.685	S	S	*	*	S	Bend	trans	-117.5	-6.6	-172.8	-72.4	170.7	0	0	0	115.4	R245	R245-L270 VanDerWaalsContact NH2-CD2 3.27Å
271	F	39.3	Very low	36.7	Very low	167 Å²	167	145 Å²	145	73%	0.732	68%	0.68	S	S	*	*			trans	-115.9	51.5	178.4	-71	-76.8	0	0	0	113.3
272	N	33	Very low	36.6	Very low	85 Å²	85	140.9 Å²	140.9	46%	0.455	67%	0.665	S	S	.	*			trans	-118.4	87.2	162	-166	-19	0	0	0	111.2	N274 N275	N272-N274 PolarHBondContact O-N 3.47Å; N272-N274 WeakPolarHBondContact OD1-CA 3.46Å; N272-N274 PolarHBondContact OD1-N 2.97Å; N272-N275 WeakPolarHBondContact ND2-CB 3.45Å; N272-N275 PolarHBondContact ND2-ND2 3.43Å; N272-N275 VanDerWaalsContact ND2-ND2 3.11Å; N272-N275 PolarHBondContact OD1-N 3.5Å; N272-N275 VanDerWaalsContact OD1-N 3.17Å
273	P	34	Very low	36.4	Very low	117 Å²	117	143.9 Å²	143.9	76%	0.76	67%	0.672	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.2	9.4	170.4	-10.3	27.7	0	0	0	113.7
274	N	31.9	Very low	36.6	Very low	100 Å²	100	139.6 Å²	139.6	54%	0.535	66%	0.662	S	S	.	*	T	Hydrogen-bonded Turn	trans	-130.6	8.9	-163.6	-82.6	-32.3	0	0	0	116.6	N272 R278	N272-N274 PolarHBondContact O-N 3.47Å; N272-N274 WeakPolarHBondContact OD1-CA 3.46Å; N272-N274 PolarHBondContact OD1-N 2.97Å; N274-R278 WeakPolarHBondContact O-CB 3.43Å
275	N	32.3	Very low	36.5	Very low	80 Å²	80	137.8 Å²	137.8	43%	0.428	65%	0.654	S	S	.	*	T	Hydrogen-bonded Turn	trans	-99.8	6.7	-173	-105.8	14	0	0	0	118.8	N272 H279	N272-N275 WeakPolarHBondContact ND2-CB 3.45Å; N272-N275 PolarHBondContact ND2-ND2 3.43Å; N272-N275 VanDerWaalsContact ND2-ND2 3.11Å; N272-N275 PolarHBondContact OD1-N 3.5Å; N272-N275 VanDerWaalsContact OD1-N 3.17Å; N275-H279 PolarHBondContact OD1-CD2 2.86Å
276	I	37.1	Very low	36.6	Very low	156 Å²	156	143 Å²	143	80%	0.8	65%	0.654	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.5	-19.8	173.5	-65.1	178.4	0	0	0	113.1
277	Y	31.2	Very low	36.3	Very low	220 Å²	220	147.4 Å²	147.4	86%	0.863	66%	0.658	S	S	*	*	T	Hydrogen-bonded Turn	trans	-122.2	-10.5	177.7	-79.1	-87.8	0	0	0	115.7
278	R	33	Very low	36.3	Very low	170 Å²	170	146.3 Å²	146.3	64%	0.642	66%	0.659	S	S	*	*	S	Bend	trans	-107.9	-12.2	-176.4	-130.9	177	-166.5	-156.4	3.2	115.6	N274 V282	N274-R278 WeakPolarHBondContact O-CB 3.43Å; R278-V282 PolarHBondContact O-N 3.1Å
279	H	37.5	Very low	36.2	Very low	82 Å²	82	138.6 Å²	138.6	38%	0.38	64%	0.644	S	S	.	*	T	Hydrogen-bonded Turn	trans	-89.3	-5.9	-173.4	-136.7	-100.5	0	0	0	115.1	N275	N275-H279 PolarHBondContact OD1-CD2 2.86Å
280	R	34.4	Very low	36	Very low	213 Å²	213	134.9 Å²	134.9	80%	0.804	63%	0.631	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.8	-39	167.5	-105.1	179.9	176.3	178.5	-1.8	112.2	I284	R280-I284 WeakPolarHBondContact O-CD1 3.44Å; R280-I284 WeakPolarHBondContact O-CG1 3.19Å; R280-I284 PolarHBondContact O-N 3Å
281	F	36.3	Very low	36	Very low	171 Å²	171	135.1 Å²	135.1	75%	0.75	64%	0.637	S	S	*	*	H	α-helix	trans	-78.3	-30.9	-175.8	-122.6	-97.7	0	0	0	113.8	K285	F281-K285 PolarHBondContact O-N 3.41Å
282	V	41.1	Very low	35.7	Very low	60 Å²	60	134.5 Å²	134.5	36%	0.364	64%	0.641	S	S	.	*	H	α-helix	trans	-84.2	-22.8	178.2	-179.5	0	0	0	0	112.3	R278 R286	R278-V282 PolarHBondContact O-N 3.1Å; V282-R286 PolarHBondContact O-N 3.12Å
283	R	37.1	Very low	35.9	Very low	172 Å²	172	135.5 Å²	135.5	65%	0.649	66%	0.655	S	S	*	*	H	α-helix	trans	-74	-38.6	168.6	-87.8	-173.6	-172.8	176.4	2.9	111.9	R286 Y287	R283-R286 PolarHBondContact O-N 3.35Å; R283-Y287 WeakPolarHBondContact O-CB 3.4Å; R283-Y287 PolarHBondContact O-N 3.05Å
284	I	42.6	Very low	36	Very low	98 Å²	98	137 Å²	137	50%	0.503	66%	0.657	S	S	.	*	H	α-helix	trans	-67.3	-37.6	176.5	-69.3	166.8	0	0	0	111.1	R280 Y287 L288	R280-I284 WeakPolarHBondContact O-CD1 3.44Å; R280-I284 WeakPolarHBondContact O-CG1 3.19Å; R280-I284 PolarHBondContact O-N 3Å; I284-Y287 PolarHBondContact O-N 2.9Å; I284-L288 HydrophobicContact CG2-CD1 3.73Å; I284-L288 WeakPolarHBondContact O-CB 3.25Å; I284-L288 WeakPolarHBondContact O-CD1 3.12Å; I284-L288 WeakPolarHBondContact O-CG 3.33Å; I284-L288 PolarHBondContact O-N 3.04Å
285	K	36	Very low	36.1	Very low	169 Å²	169	141.3 Å²	141.3	74%	0.735	67%	0.674	S	S	*	*	H	α-helix	trans	-74	-23.5	177.9	-151.9	173.5	-175	178.4	0	114.5	F281 S289	F281-K285 PolarHBondContact O-N 3.41Å; K285-S289 PolarHBondContact O-OG 3.39Å
286	R	37.6	Very low	36	Very low	173 Å²	173	146 Å²	146	65%	0.653	70%	0.698	S	S	*	*	H	α-helix	trans	-92.7	-24.3	172.2	-100.1	-178.3	-95.6	173.1	-10.8	113.8	V282 R283 S289 S290	V282-R286 PolarHBondContact O-N 3.12Å; R283-R286 PolarHBondContact O-N 3.35Å; R286-S289 PolarHBondContact O-OG 2.66Å; R286-S290 PolarHBondContact O-N 3.46Å
287	Y	32.8	Very low	35.7	Very low	180 Å²	180	148.9 Å²	148.9	71%	0.706	70%	0.699	S	S	*	*	H	α-helix	trans	-77.9	-26.1	173.2	-164.9	-96.5	0	0	0	111.8	R283 I284 V291	R283-Y287 WeakPolarHBondContact O-CB 3.4Å; R283-Y287 PolarHBondContact O-N 3.05Å; I284-Y287 PolarHBondContact O-N 2.9Å; Y287-V291 VanDerWaalsContact O-CG2 3.27Å; Y287-V291 WeakPolarHBondContact O-CG2 3.29Å
288	L	39.8	Very low	35.7	Very low	136 Å²	136	146.3 Å²	146.3	71%	0.712	70%	0.699	S	S	*	*	S	Bend	trans	-84.3	-10.2	170.9	-76.3	160	0	0	0	113.7	I284	I284-L288 HydrophobicContact CG2-CD1 3.73Å; I284-L288 WeakPolarHBondContact O-CB 3.25Å; I284-L288 WeakPolarHBondContact O-CD1 3.12Å; I284-L288 WeakPolarHBondContact O-CG 3.33Å; I284-L288 PolarHBondContact O-N 3.04Å
289	S	36.7	Very low	35.5	Very low	88 Å²	88	146.4 Å²	146.4	62%	0.615	70%	0.704	S	S	*	*	S	Bend	trans	-109.8	-0.5	179.8	79	0	0	0	0	114.4	K285 R286	K285-S289 PolarHBondContact O-OG 3.39Å; R286-S289 PolarHBondContact O-OG 2.66Å
290	S	33.8	Very low	35.4	Very low	84 Å²	84	149 Å²	149	59%	0.587	73%	0.726	S	S	*	*			trans	-122.6	19.6	179	96.6	0	0	0	0	113.6	R286 N292	R286-S290 PolarHBondContact O-N 3.46Å; S290-N292 PolarHBondContact O-N 2.84Å
291	V	38.9	Very low	35.3	Very low	116 Å²	116	144.3 Å²	144.3	70%	0.703	73%	0.726	S	S	*	*	S	Bend	trans	-79.8	5.4	171.9	171.7	0	0	0	0	111.9	Y287	Y287-V291 VanDerWaalsContact O-CG2 3.27Å; Y287-V291 WeakPolarHBondContact O-CG2 3.29Å
292	N	33.2	Very low	35.1	Very low	154 Å²	154	145.8 Å²	145.8	82%	0.824	73%	0.732	S	S	*	*	S	Bend	trans	-117.8	122.8	166.2	-97.1	-16.3	0	0	0	109.6	S290	S290-N292 PolarHBondContact O-N 2.84Å
293	S	37.6	Very low	34.7	Very low	107 Å²	107	148 Å²	148	75%	0.748	75%	0.749	S	S	*	*	S	Bend	trans	99.2	82.8	169.7	-146.7	0	0	0	0	117.9
294	N	34.9	Very low	34.8	Very low	149 Å²	149	151.6 Å²	151.6	80%	0.797	76%	0.762	S	S	*	*				59.8	102.4	129.5	-60.4	-13	0	0	0	122.3
295	Q	33.9	Very low	34.6	Very low	190 Å²	190	155.6 Å²	155.6	89%	0.888	78%	0.779	S	S	*	*			trans	40.6	110.4	136.2	-61.8	-162	-0.1	0	0	122
296	L	31.1	Very low	34.6	Very low	179 Å²	179	152.2 Å²	152.2	94%	0.937	78%	0.776	S	S	*	*				-167.7	121.9	124.5	-147.3	72.2	0	0	0	110.2
297	R	31.2	Very low	34.5	Very low	215 Å²	215	154.6 Å²	154.6	81%	0.811	79%	0.791	S	S	*	*			trans	-97.5	140.3	-177.2	-69.3	-175.5	-166.2	-172.7	3.4	111.8
298	L	30	Very low	34.3	Very low	167 Å²	167	152.5 Å²	152.5	87%	0.874	79%	0.791	S	S	*	*			trans	-134.1	118.7	160.9	-121.6	145.1	0	0	0	108.9
299	F	30.1	Very low	34	Very low	171 Å²	171	152.3 Å²	152.3	75%	0.75	80%	0.799	S	S	*	*			trans	-91.3	136.4	-178.4	-86.4	-95.6	0	0	0	110.6
300	V	34.5	Very low	33.9	Very low	137 Å²	137	154.3 Å²	154.3	83%	0.83	80%	0.802	S	S	*	*			trans	-130.1	114.9	163.6	179.3	0	0	0	0	109
301	S	32.2	Very low	33.9	Very low	115 Å²	115	155.3 Å²	155.3	80%	0.804	82%	0.815	S	S	*	*			trans	-77.5	143.8	172.4	167.9	0	0	0	0	110.6
302	K	32.7	Very low	33.6	Very low	201 Å²	201	155 Å²	155	87%	0.874	82%	0.817	S	S	*	*			trans	-107.9	106.7	-174.9	-150.7	177.4	-170.3	179.9	0	109.6
303	C	32.5	Very low	33.7	Very low	107 Å²	107	153.7 Å²	153.7	72%	0.723	82%	0.815	S	S	*	*			trans	-78.8	135.5	171.1	-172.4	0	0	0	0	110.4
304	R	37.7	Very low	33.6	Very low	248 Å²	248	154.5 Å²	154.5	94%	0.936	82%	0.817	S	S	*	*	S	Bend	trans	-92	8	-163.9	-135.3	177.2	-172	-177.1	1.6	115.1
305	Q	39.5	Very low	33.3	Very low	182 Å²	182	153.6 Å²	153.6	85%	0.85	82%	0.821	S	S	*	*	S	Bend	trans	-138.1	5.3	-171.4	-82.5	176.9	-18.7	0	0	117.1
306	C	36.8	Very low	33.4	Very low	98 Å²	98	153.8 Å²	153.8	66%	0.662	82%	0.822	S	S	*	*			trans	-136.8	117.3	175.8	-61.4	0	0	0	0	110.8	L308	C306-L308 PolarHBondContact O-N 3.26Å
307	K	33.9	Very low	33.4	Very low	223 Å²	223	155.5 Å²	155.5	97%	0.97	82%	0.816	S	S	*	*			trans	-80.4	51.9	177	-74	-175.9	178.6	174.7	0	112
308	L	29.4	Very low	33.3	Very low	136 Å²	136	157.1 Å²	157.1	71%	0.712	82%	0.822	S	S	*	*			trans	-136.6	107.6	171.2	-161.3	77.2	0	0	0	108.8	C306 I310	C306-L308 PolarHBondContact O-N 3.26Å; L308-I310 HydrophobicContact CD2-CD1 4.27Å; L308-I310 HydrophobicContact CD2-CG1 4.38Å; L308-I310 HydrophobicContact CG-CG1 4.44Å
309	C	33	Very low	33.4	Very low	132 Å²	132	154.9 Å²	154.9	89%	0.892	81%	0.811	S	S	*	*			trans	-111.2	102.6	169.9	-71.1	0	0	0	0	108.5
310	I	34.1	Very low	33.6	Very low	130 Å²	130	154.8 Å²	154.8	67%	0.667	82%	0.818	S	S	*	*			trans	-80.1	123.6	166.2	-59.1	171.3	0	0	0	106.5	L308 C312	L308-I310 HydrophobicContact CD2-CD1 4.27Å; L308-I310 HydrophobicContact CD2-CG1 4.38Å; L308-I310 HydrophobicContact CG-CG1 4.44Å; I310-C312 PolarHBondContact O-N 2.99Å
311	A	34.7	Very low	33.5	Very low	104 Å²	104	155.9 Å²	155.9	86%	0.86	82%	0.819	S	S	*	*			trans	-86.5	103.1	169.3	0	0	0	0	0	108.4
312	C	32.1	Very low	33.3	Very low	110 Å²	110	155 Å²	155	74%	0.743	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-88.3	125.4	169.2	-63.3	0	0	0	0	109.3	I310	I310-C312 PolarHBondContact O-N 2.99Å
313	T	36.3	Very low	33.4	Very low	127 Å²	127	155.4 Å²	155.4	78%	0.779	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-78.5	140.2	162.3	43.9	0	0	0	0	109.4	C315	T313-C315 PolarHBondContact O-N 3.49Å
314	P	34.4	Very low	33.2	Very low	123 Å²	123	159.8 Å²	159.8	80%	0.799	82%	0.822	S	S	*	*	P	Polyproline II helix	trans	-68.9	123.8	175.7	-6.5	22.1	0	0	0	109.7	E316	P314-E316 PolarHBondContact O-N 2.9Å
315	C	29.1	Very low	33	Very low	130 Å²	130	153 Å²	153	88%	0.878	81%	0.809	S	S	*	*			trans	-69	115.8	159.9	-94.2	0	0	0	0	108.3	T313 R317	T313-C315 PolarHBondContact O-N 3.49Å; C315-R317 PolarHBondContact O-N 3.17Å; C315-R317 VanDerWaalsContact O-N 3.12Å
316	E	36.8	Very low	32.6	Very low	195 Å²	195	150 Å²	150	91%	0.911	80%	0.804	S	S	*	*			trans	-69.5	107.9	162.6	-96.8	-174.5	165.8	0	0	109.4	P314 R318	P314-E316 PolarHBondContact O-N 2.9Å; E316-R318 PolarHBondContact O-N 3.37Å
317	R	29.4	Very low	32.2	Very low	214 Å²	214	151 Å²	151	81%	0.808	81%	0.806	S	S	*	*			trans	-63.3	95.7	169.6	-175.8	-173.9	-96.2	-174.4	-8.6	108.6	C315 N319	C315-R317 PolarHBondContact O-N 3.17Å; C315-R317 VanDerWaalsContact O-N 3.12Å; R317-N319 PolarHBondContact O-N 3.29Å
318	R	30.7	Very low	32.1	Very low	249 Å²	249	148.9 Å²	148.9	94%	0.94	80%	0.8	S	S	*	*			trans	-75	76.5	165.5	-123.2	-176.2	-160.4	173.7	5.5	109.1	E316 N320	E316-R318 PolarHBondContact O-N 3.37Å; R318-N320 PolarHBondContact O-N 3.06Å
319	N	31.8	Very low	32	Very low	121 Å²	121	146.3 Å²	146.3	65%	0.647	79%	0.793	S	S	*	*			trans	-78.4	100.3	157.8	-81.9	0.5	0	0	0	106.7	R317	R317-N319 PolarHBondContact O-N 3.29Å
320	N	33.8	Very low	31.8	Very low	168 Å²	168	149.9 Å²	149.9	90%	0.898	79%	0.79	S	S	*	*			trans	-144.6	122.8	138.1	-99.6	-20.6	0	0	0	109.7	R318	R318-N320 PolarHBondContact O-N 3.06Å
321	L	31.8	Very low	31.6	Very low	161 Å²	161	147.8 Å²	147.8	84%	0.843	79%	0.786	S	S	*	*			trans	-67.3	138.1	-167	-159.4	70.1	0	0	0	109.8
322	S	29.3	Very low	31.6	Very low	96 Å²	96	150.8 Å²	150.8	67%	0.671	78%	0.782	S	S	*	*			trans	-23.4	127.2	158.3	52.7	0	0	0	0	115.1
323	K	34.4	Very low	31.5	Very low	209 Å²	209	150.5 Å²	150.5	91%	0.909	78%	0.782	S	S	*	*			trans	-174.1	106.4	133.2	-101.2	165.7	-174.7	-173.8	0	110.9
324	F	27.7	Very low	31.4	Very low	200 Å²	200	149 Å²	149	88%	0.877	78%	0.777	S	S	*	*			trans	-58.2	173.7	150.5	-90.9	-105.2	0	0	0	110.1
325	P	35.1	Very low	31.3	Very low	105 Å²	105	150.6 Å²	150.6	68%	0.682	78%	0.775	S	S	*	*			cis	-132.7	-159.8	-42.4	32.6	-12.8	0	0	0	111.3
326	V	30.6	Very low	31.4	Very low	120 Å²	120	150.8 Å²	150.8	73%	0.727	77%	0.767	S	S	*	*			trans	118	92.9	150.3	-175.4	0	0	0	0	115.6
327	T	27.5	Very low	31.3	Very low	117 Å²	117	146.1 Å²	146.1	72%	0.718	76%	0.756	S	S	*	*				59.2	146.8	123.3	-1.8	0	0	0	0	123.6
328	Q	32.5	Very low	31.2	Very low	179 Å²	179	145.3 Å²	145.3	84%	0.836	76%	0.759	S	S	*	*			trans	82.9	138.7	154.9	-75.1	177.3	-5.8	0	0	117
329	S	27.6	Very low	31.3	Very low	82 Å²	82	138.4 Å²	138.4	57%	0.573	75%	0.749	S	S	*	*			cis	168.9	163.9	-20.3	44	0	0	0	0	105.7
330	Y	28.7	Very low	31.2	Very low	208 Å²	208	139.7 Å²	139.7	82%	0.816	76%	0.756	S	S	*	*			trans	78	105.5	165.9	-79.3	-90.9	0	0	0	116.3
331	S	30.4	Very low	31.1	Very low	85 Å²	85	141.3 Å²	141.3	59%	0.594	76%	0.758	S	S	*	*				78	140.2	85.8	79.5	0	0	0	0	110.9
332	Q	32.9	Very low	30.9	Very low	167 Å²	167	145 Å²	145	78%	0.78	76%	0.761	S	S	*	*			cis	179.7	150.7	38.1	-148.1	170.4	8.5	0	0	107.1
333	S	30.9	Very low	30.8	Very low	104 Å²	104	144.6 Å²	144.6	73%	0.727	76%	0.763	S	S	*	*			trans	62.7	144	139.3	52.9	0	0	0	0	119.6
334	S	35.1	Very low	30.8	Very low	96 Å²	96	141.3 Å²	141.3	67%	0.671	76%	0.76	S	S	*	*			cis	-173.2	145.3	26.7	40.3	0	0	0	0	111.5
335	M	30.4	Very low	30.9	Very low	157 Å²	157	139.8 Å²	139.8	77%	0.773	76%	0.756	S	S	*	*				58.8	119	127.8	-69.2	-178.2	135.1	0	0	119.9
336	N	32.7	Very low	30.8	Very low	133 Å²	133	140.5 Å²	140.5	71%	0.711	76%	0.76	S	S	*	*				116.4	148.3	84	-87.7	1.1	0	0	0	105.9
337	S	33.2	Very low	30.6	Very low	97 Å²	97	141.2 Å²	141.2	68%	0.678	76%	0.756	S	S	*	*			cis	-176.2	154.1	14.1	39.8	0	0	0	0	107.7
338	F	27.6	Very low	30.9	Very low	197 Å²	197	147.3 Å²	147.3	86%	0.864	77%	0.766	S	S	*	*			trans	33.4	136.1	137	-94.1	-107.8	0	0	0	119.5
339	S	34.5	Very low	30.6	Very low	104 Å²	104	144.1 Å²	144.1	73%	0.727	75%	0.754	S	S	*	*				-174.8	160.2	50.1	-30.1	0	0	0	0	110.9
340	N	28.7	Very low	30.8	Very low	148 Å²	148	146.2 Å²	146.2	79%	0.791	76%	0.764	S	S	*	*			trans	-32.6	148	161	-71.6	-36	0	0	0	116.6
341	E	32.5	Very low	30.7	Very low	203 Å²	203	140.9 Å²	140.9	95%	0.949	76%	0.757	S	S	*	*				-170.6	163.6	113.8	-107.1	173.9	150.7	0	0	113.9
342	R	26.5	Very low	30.9	Very low	238 Å²	238	145.8 Å²	145.8	90%	0.898	77%	0.77	S	S	*	*			trans	-105.9	158.6	-152.1	-144.8	-176.9	-70.6	172.8	-2.5	110.7
343	A	27.4	Very low	30.7	Very low	87 Å²	87	144.1 Å²	144.1	72%	0.719	77%	0.772	S	S	*	*			trans	74.9	128.5	154.9	0	0	0	0	0	118.8
344	V	33.7	Very low	30.9	Very low	140 Å²	140	144.1 Å²	144.1	85%	0.848	77%	0.769	S	S	*	*				168.4	123.1	116.8	161.2	0	0	0	0	108.2
345	Q	29.7	Very low	30.5	Very low	168 Å²	168	148.4 Å²	148.4	79%	0.785	78%	0.775	S	S	*	*			trans	-76.1	164.2	168.8	-80	-122.5	-25.6	0	0	111.1
346	P	34.4	Very low	30.4	Very low	120 Å²	120	148.7 Å²	148.7	78%	0.779	78%	0.775	S	S	*	*				-132.7	134.6	128.4	32.3	-18.9	0	0	0	113.5
347	E	26.2	Very low	30.2	Very low	135 Å²	135	148.7 Å²	148.7	63%	0.631	77%	0.771	S	S	*	*			trans	-76.9	141.6	170.5	-171.2	179.6	175.2	0	0	110.4	N349	E347-N349 PolarHBondContact OE1-ND2 2.91Å
348	W	32.9	Very low	29.8	Very low	246 Å²	246	150.4 Å²	150.4	93%	0.932	78%	0.777	S	S	*	*			trans	-132.9	102	157	-89.2	90.3	0	0	0	108.8
349	N	26.5	Very low	29.8	Very low	111 Å²	111	148.9 Å²	148.9	59%	0.594	77%	0.77	S	S	*	*			trans	-63	154.9	157.3	-72.6	-48.7	0	0	0	108.7	E347	E347-N349 PolarHBondContact OE1-ND2 2.91Å
350	V	32.3	Very low	29.3	Very low	127 Å²	127	153.4 Å²	153.4	77%	0.77	78%	0.777	S	S	*	*				-179.1	122.6	78.9	159	0	0	0	0	109.8
351	S	27.4	Very low	29.2	Very low	95 Å²	95	153.8 Å²	153.8	66%	0.664	78%	0.777	S	S	*	*			trans	48.4	128.2	136.3	87.2	0	0	0	0	124.1
352	E	34.4	Very low	28.9	Very low	189 Å²	189	148.2 Å²	148.2	88%	0.883	76%	0.759	S	S	*	*				-175.3	118.1	100.9	-97.1	178.9	-178.7	0	0	111.6
353	T	29	Very low	28.8	Very low	132 Å²	132	146 Å²	146	81%	0.81	76%	0.761	S	S	*	*			trans	-78.5	166.2	170.4	50.6	0	0	0	0	111
354	P	33.2	Very low	28.7	Very low	103 Å²	103	150.2 Å²	150.2	67%	0.669	76%	0.763	S	S	*	*				-159.2	159.6	50.3	39.9	-15.3	0	0	0	121.4
355	K	27.5	Very low	28.2	Very low	186 Å²	186	154.7 Å²	154.7	81%	0.809	77%	0.765	S	S	*	*			trans	70.4	140.1	137.6	-74.9	171.3	-174.7	178.6	0	121.5
356	Q	28.1	Very low	28	Very low	164 Å²	164	153.5 Å²	153.5	77%	0.766	76%	0.763	S	S	*	*			trans	80.8	130	154.5	-71.8	167.5	3.8	0	0	116.3
357	H	28	Very low	27.5	Very low	133 Å²	133	153.6 Å²	153.6	62%	0.616	76%	0.761	S	S	*	*			cis	-157.3	122.9	22.1	-113.4	-71.4	0	0	0	109.7	K359	H357-K359 PolarHBondContact O-N 2.98Å
358	T	24.9	Very low	27.6	Very low	132 Å²	132	155.2 Å²	155.2	81%	0.81	77%	0.771	S	S	*	*			trans	-63.4	120.3	147.5	17.3	0	0	0	0	107.5
359	K	27.6	Very low	27.1	Very low	166 Å²	166	151.3 Å²	151.3	72%	0.722	77%	0.767	S	S	*	*			trans	-125.3	97.6	165.7	-92.9	-175.3	177.7	176.8	0	109.5	H357 I361	H357-K359 PolarHBondContact O-N 2.98Å; K359-I361 PolarHBondContact O-N 3.4Å
360	F	25.1	Very low	27	Very low	198 Å²	198	157.2 Å²	157.2	87%	0.868	78%	0.781	S	S	*	*			trans	-45.9	122.3	144.1	-82.4	-100.7	0	0	0	108.4
361	I	26.7	Very low	26.7	Very low	157 Å²	157	163.1 Å²	163.1	81%	0.805	79%	0.79	S	S	*	*			trans	-98.2	113.5	166.5	-62.5	178.6	0	0	0	106.6	K359	K359-I361 PolarHBondContact O-N 3.4Å
362	P	25.7	Very low	26.8	Very low	85 Å²	85	165.1 Å²	165.1	55%	0.552	80%	0.798	S	S	*	*			trans	-73.1	137.2	178.7	30.9	-32	0	0	0	109.5	F364	P362-F364 HydrophobicContact CG-CD2 4.06Å; P362-F364 HydrophobicContact CG-CE2 3.79Å; P362-F364 PolarHBondContact O-N 2.98Å
363	M	24	Very low	26.7	Very low	193 Å²	193	161.9 Å²	161.9	95%	0.951	79%	0.791	S	S	*	*			trans	-64	95.9	172	-167.1	-173.5	-66.7	0	0	108.9	R365	M363-R365 PolarHBondContact O-N 2.85Å
364	F	25.6	Very low	26.7	Very low	174 Å²	174	165.8 Å²	165.8	76%	0.763	80%	0.797	S	S	*	*			trans	-80.1	113.1	171	-91.9	-84.5	0	0	0	110.1	P362 I366	P362-F364 HydrophobicContact CG-CD2 4.06Å; P362-F364 HydrophobicContact CG-CE2 3.79Å; P362-F364 PolarHBondContact O-N 2.98Å; F364-I366 PolarHBondContact O-N 3.19Å
365	R	22.6	Very low	26.7	Very low	234 Å²	234	163.7 Å²	163.7	88%	0.883	79%	0.785	S	S	*	*			trans	-59.9	112.3	160.3	-94.2	-179.2	169.7	178.5	-2.6	108.7	M363	M363-R365 PolarHBondContact O-N 2.85Å
366	I	27.1	Very low	27	Very low	144 Å²	144	160.5 Å²	160.5	74%	0.738	78%	0.777	S	S	*	*			trans	-111.8	97.9	157.7	-61.2	179.7	0	0	0	107.3	F364 M368	F364-I366 PolarHBondContact O-N 3.19Å; I366-M368 HydrophobicContact CG2-CG 4.21Å; I366-M368 PolarHBondContact O-N 3.36Å
367	T	23.7	Very low	27.3	Very low	122 Å²	122	160.3 Å²	160.3	75%	0.748	78%	0.78	S	S	*	*			trans	-70.4	109.2	164.1	-24.7	0	0	0	0	107.3
368	M	26.9	Very low	27.4	Very low	168 Å²	168	159 Å²	159	83%	0.828	78%	0.777	S	S	*	*			trans	-140.1	111.3	163.1	-90	-65.3	-150.3	0	0	109.2	I366 R370	I366-M368 HydrophobicContact CG2-CG 4.21Å; I366-M368 PolarHBondContact O-N 3.36Å; M368-R370 PolarHBondContact O-N 2.85Å
369	L	23.3	Very low	27.9	Very low	165 Å²	165	157.7 Å²	157.7	86%	0.864	77%	0.766	S	S	*	*			trans	-53.9	124.6	171.4	-82	87.6	0	0	0	110.9
370	R	24.8	Very low	28.2	Very low	235 Å²	235	158.1 Å²	158.1	89%	0.887	77%	0.768	S	S	*	*			trans	-158	120.1	142.5	-134.7	169.9	-168.8	157.6	3.3	112.2	M368 T372	M368-R370 PolarHBondContact O-N 2.85Å; R370-T372 PolarHBondContact O-N 3.4Å
371	R	24.5	Very low	28.3	Very low	251 Å²	251	152.2 Å²	152.2	95%	0.947	75%	0.751	S	S	*	*			trans	-41.2	118	170.9	-81.6	172	171.4	154.2	-2.5	111.6
372	T	30.4	Very low	28.4	Very low	137 Å²	137	151.8 Å²	151.8	84%	0.84	75%	0.747	S	S	*	*			trans	-124.2	127.9	156.4	48.9	0	0	0	0	109.1	R370	R370-T372 PolarHBondContact O-N 3.4Å
373	T	31.4	Very low	28.4	Very low	121 Å²	121	154.9 Å²	154.9	74%	0.742	75%	0.753	S	S	*	*			trans	-69.1	132.3	-169.1	41.9	0	0	0	0	111.9	S375	T373-S375 PolarHBondContact O-N 2.89Å
374	K	28.9	Very low	28.7	Very low	213 Å²	213	150.4 Å²	150.4	93%	0.926	74%	0.736	S	S	*	*	S	Bend	trans	-69.7	50.2	179.5	-153.2	177.6	-172.6	-179.5	0	112.8
375	S	33.3	Very low	28.9	Very low	59 Å²	59	148.2 Å²	148.2	41%	0.413	74%	0.736	S	S	.	*			trans	-116.3	-3.2	-168.1	61	0	0	0	0	117	T373	T373-S375 PolarHBondContact O-N 2.89Å
376	D	34.1	Very low	29.3	Very low	120 Å²	120	145.8 Å²	145.8	64%	0.642	74%	0.735	S	S	*	*	S	Bend	trans	-110.7	13.3	-173.2	-68.1	-15.3	0	0	0	114.2	R174	R174-D376 IonicContact CZ-OD1 3.57Å; R174-D376 IonicContact NH1-OD1 3.64Å; R174-D376 PolarHBondContact NH1-OD1 3.2Å; R174-D376 IonicContact NH2-OD1 2.75Å
377	L	33.7	Very low	29.4	Very low	160 Å²	160	147.4 Å²	147.4	84%	0.838	74%	0.739	S	S	*	*	S	Bend	trans	-108.3	1.7	175	-101.6	140.9	0	0	0	114.2
378	N	31.9	Very low	29.5	Very low	104 Å²	104	147 Å²	147	56%	0.556	74%	0.742	S	S	*	*			trans	-96.4	10.6	-178.2	-75.4	-4	0	0	0	114.3	F380	N378-F380 PolarHBondContact O-N 2.98Å
379	D	34.8	Very low	29.7	Very low	106 Å²	106	145.5 Å²	145.5	57%	0.567	74%	0.742	S	S	*	*	S	Bend	trans	-82.1	7.3	178.9	-121.6	6.8	0	0	0	113.1
380	F	34.7	Very low	29.9	Very low	175 Å²	175	145.6 Å²	145.6	77%	0.768	74%	0.738	S	S	*	*	S	Bend	trans	-126.2	-6.5	178.4	-90.5	-86.6	0	0	0	116	N378	N378-F380 PolarHBondContact O-N 2.98Å
381	S	26.4	Very low	30.2	Very low	74 Å²	74	141.1 Å²	141.1	52%	0.517	73%	0.732	S	S	.	*			trans	-127.5	94.1	-178.1	59	0	0	0	0	113
382	M	28.6	Very low	30.4	Very low	147 Å²	147	134.3 Å²	134.3	72%	0.724	72%	0.718	S	S	*	*			trans	-144.4	72.8	157.4	-164.4	170.4	-177.1	0	0	109.1	V384	M382-V384 HydrophobicContact CE-CG2 3.83Å; M382-V384 HydrophobicContact CG-CG2 4.11Å
383	F	25.6	Very low	30.4	Very low	151 Å²	151	136.2 Å²	136.2	66%	0.662	72%	0.717	S	S	*	*			trans	-85.6	112.3	156.1	-110.8	-89.7	0	0	0	106.8	D405	F383-D405 HydrophobicContact CE1-CB 4.48Å; F383-D405 HydrophobicContact CE2-CB 3.97Å; F383-D405 HydrophobicContact CZ-CB 3.53Å
384	V	31.3	Very low	30.2	Very low	98 Å²	98	134.8 Å²	134.8	59%	0.594	72%	0.718	S	S	*	*			trans	-96.4	117.6	168.6	173.2	0	0	0	0	107.1	M382	M382-V384 HydrophobicContact CE-CG2 3.83Å; M382-V384 HydrophobicContact CG-CG2 4.11Å
385	V	28.7	Very low	30.1	Very low	129 Å²	129	134.6 Å²	134.6	78%	0.782	72%	0.717	S	S	*	*			trans	-64.5	130.5	168.4	174.1	0	0	0	0	108.4
386	H	30.7	Very low	29.8	Very low	182 Å²	182	137.3 Å²	137.3	84%	0.843	73%	0.731	S	S	*	*			trans	-109.3	126.6	161.7	-117.6	-74.7	0	0	0	108.5
387	E	29.5	Very low	29.5	Very low	179 Å²	179	137 Å²	137	84%	0.836	74%	0.739	S	S	*	*			trans	-70	134	-179	-164.8	163.6	-166.1	0	0	110.6
388	S	25.4	Very low	29.4	Very low	114 Å²	114	135.6 Å²	135.6	80%	0.797	74%	0.739	S	S	*	*			trans	-97.6	125.2	-179.9	49.6	0	0	0	0	110.7
389	T	30.9	Very low	29.2	Very low	136 Å²	136	137.5 Å²	137.5	83%	0.834	76%	0.755	S	S	*	*			trans	-131.5	141.5	157.9	0.3	0	0	0	0	108.9
390	E	28.5	Very low	28.9	Very low	167 Å²	167	136.4 Å²	136.4	78%	0.78	76%	0.76	S	S	*	*			trans	-67.2	148.9	-161.1	-61.9	156.5	127.9	0	0	114.6
391	N	30	Very low	28.7	Very low	141 Å²	141	135.3 Å²	135.3	75%	0.754	76%	0.757	S	S	*	*				166.1	117.6	110.5	-81.9	-35	0	0	0	112.2
392	T	29.4	Very low	29	Very low	108 Å²	108	138 Å²	138	66%	0.663	77%	0.771	S	S	*	*				75.6	123.5	127.8	-40.8	0	0	0	0	120.8
393	E	30.4	Very low	29.3	Very low	176 Å²	176	139.9 Å²	139.9	82%	0.822	78%	0.775	S	S	*	*			trans	89.5	96.6	152.6	-78.5	162.4	-148.7	0	0	122
394	A	26.5	Very low	29.8	Very low	91 Å²	91	137.8 Å²	137.8	75%	0.752	77%	0.771	S	S	*	*				57	95.1	123.3	0	0	0	0	0	120.7
395	F	28	Very low	30	Very low	209 Å²	209	137.8 Å²	137.8	92%	0.917	77%	0.767	S	S	*	*				-164.1	144.9	125.1	-134.2	-103.2	0	0	0	112.1
396	T	27.2	Very low	30.5	Very low	116 Å²	116	138.6 Å²	138.6	71%	0.712	77%	0.766	S	S	*	*			trans	-75.1	124.7	-166.1	42.6	0	0	0	0	116.3
397	S	27.4	Very low	30.8	Very low	114 Å²	114	135.9 Å²	135.9	80%	0.797	76%	0.756	S	S	*	*			trans	-177.5	149	136	-92.2	0	0	0	0	112.4
398	P	32.6	Very low	31.3	Very low	131 Å²	131	131.6 Å²	131.6	85%	0.851	74%	0.738	S	S	*	*			trans	-79.6	125.9	-151.8	-10.9	28	0	0	0	114.5
399	T	25.8	Very low	31.8	Very low	144 Å²	144	133 Å²	133	88%	0.883	73%	0.732	S	S	*	*			trans	-66.7	132.3	165.2	31.1	0	0	0	0	113
400	A	30.3	Very low	32.2	Very low	82 Å²	82	134.6 Å²	134.6	68%	0.678	73%	0.73	S	S	*	*			trans	-147.6	138.4	152.1	0	0	0	0	0	109.3
401	H	30.7	Very low	32.6	Very low	153 Å²	153	129.8 Å²	129.8	71%	0.708	71%	0.714	S	S	*	*			trans	98.7	70.5	176.6	-54.6	-60.8	0	0	0	117.1
402	T	32	Very low	32.9	Very low	129 Å²	129	129.4 Å²	129.4	79%	0.791	71%	0.711	S	S	*	*	S	Bend	trans	-156.5	60.7	147.5	-12.2	0	0	0	0	110.7
403	K	34.8	Very low	33.3	Very low	188 Å²	188	132 Å²	132	82%	0.817	72%	0.716	S	S	*	*	S	Bend	trans	-154.2	-9.8	169.6	-117.2	172.3	-175.5	177.2	0	116.3
404	D	35.6	Very low	33.6	Very low	107 Å²	107	126.2 Å²	126.2	57%	0.572	70%	0.699	S	S	*	*	S	Bend	trans	-98	-4.8	-176.9	-62.7	-29.8	0	0	0	114.8	I406	D404-I406 VanDerWaalsContact C-N 3.35Å; D404-I406 PolarHBondContact O-N 3.02Å
405	D	36.1	Very low	34.1	Very low	98 Å²	98	127.1 Å²	127.1	52%	0.524	70%	0.695	S	S	.	*	T	Hydrogen-bonded Turn	trans	-83.1	-5.2	-171.1	-67.6	-34.1	0	0	0	114.6	F383	F383-D405 HydrophobicContact CE1-CB 4.48Å; F383-D405 HydrophobicContact CE2-CB 3.97Å; F383-D405 HydrophobicContact CZ-CB 3.53Å
406	I	39.1	Very low	34.5	Very low	145 Å²	145	125.6 Å²	125.6	74%	0.744	69%	0.69	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.7	-14.2	-178.3	-62	175	0	0	0	112.5	D404	D404-I406 VanDerWaalsContact C-N 3.35Å; D404-I406 PolarHBondContact O-N 3.02Å
407	I	37.6	Very low	35	Very low	126 Å²	126	129.1 Å²	129.1	65%	0.646	70%	0.695	S	S	*	*	S	Bend	trans	-88	-11.2	-175.3	-63.6	176.4	0	0	0	112.8
408	I	38.9	Very low	35.3	Very low	89 Å²	89	129.1 Å²	129.1	46%	0.456	69%	0.691	S	S	.	*	S	Bend	trans	-89.4	-19.3	-167.7	-58.5	-177.6	0	0	0	113.8	S411	I408-S411 PolarHBondContact O-OG 3.36Å
409	E	36.3	Very low	35.4	Very low	142 Å²	142	128.5 Å²	128.5	66%	0.664	69%	0.685	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.8	-24.8	176.3	-86.9	-166.2	146	0	0	114
410	H	39	Very low	35.7	Very low	171 Å²	171	129.3 Å²	129.3	79%	0.792	68%	0.684	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.4	-16	-177.6	-113.1	-96.1	0	0	0	114.4
411	S	37.6	Very low	35.9	Very low	65 Å²	65	130.2 Å²	130.2	46%	0.455	69%	0.691	S	S	.	*	T	Hydrogen-bonded Turn	trans	-91	-17.2	-176.2	34.7	0	0	0	0	113.8	I408	I408-S411 PolarHBondContact O-OG 3.36Å
412	L	35.6	Very low	36.2	Very low	133 Å²	133	128.8 Å²	128.8	70%	0.696	70%	0.698	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.8	-14.4	-179.5	-93.4	147.6	0	0	0	114.7
413	Q	36.8	Very low	36.2	Very low	163 Å²	163	130.4 Å²	130.4	76%	0.762	70%	0.701	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.7	-15.5	173.3	-73.7	-176.5	-3.1	0	0	113.8
414	A	37	Very low	36.1	Very low	55 Å²	55	128.3 Å²	128.3	46%	0.455	70%	0.699	S	S	.	*	T	Hydrogen-bonded Turn	trans	-83.6	-29.2	-178.6	0	0	0	0	0	113.4	H416 K417 T418	A414-H416 VanDerWaalsContact C-N 3.33Å; A414-H416 PolarHBondContact O-N 3.19Å; A414-K417 PolarHBondContact O-N 2.88Å; A414-T418 PolarHBondContact O-OG1 3.47Å
415	V	37.6	Very low	36.3	Very low	110 Å²	110	129.9 Å²	129.9	67%	0.667	71%	0.707	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.5	-15.3	-172.8	178.8	0	0	0	0	113.4
416	H	36.5	Very low	36.4	Very low	177 Å²	177	132.7 Å²	132.7	82%	0.819	72%	0.717	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.3	4.4	176.4	-95.3	-66.9	0	0	0	114.7	A414	A414-H416 VanDerWaalsContact C-N 3.33Å; A414-H416 PolarHBondContact O-N 3.19Å
417	K	36.7	Very low	36.3	Very low	189 Å²	189	132.6 Å²	132.6	82%	0.822	71%	0.714	S	S	*	*	S	Bend	trans	-117.1	1.6	-178.4	-90.8	-177	177.7	-179.5	0	115.4	A414	A414-K417 PolarHBondContact O-N 2.88Å
418	T	35.2	Very low	36.2	Very low	114 Å²	114	133.2 Å²	133.2	70%	0.699	72%	0.718	S	S	*	*	S	Bend	trans	-110.2	27.9	-169.9	42.1	0	0	0	0	115.2	A414	A414-T418 PolarHBondContact O-OG1 3.47Å
419	T	34.7	Very low	36	Very low	119 Å²	119	134.6 Å²	134.6	73%	0.73	74%	0.736	S	S	*	*	S	Bend	trans	-123.3	14.4	-178.6	-12.2	0	0	0	0	115.3
420	D	31.5	Very low	35.9	Very low	161 Å²	161	133.2 Å²	133.2	86%	0.861	74%	0.739	S	S	*	*	S	Bend	trans	-144.3	64.6	-179.4	-68.5	-48.7	0	0	0	111.5
421	A	33.4	Very low	35.7	Very low	100 Å²	100	134 Å²	134	83%	0.826	74%	0.743	S	S	*	*			trans	-176.6	92.5	163.1	0	0	0	0	0	112.8
422	S	37.2	Very low	35.6	Very low	123 Å²	123	139.4 Å²	139.4	86%	0.86	76%	0.761	S	S	*	*			trans	-177.7	82.9	139.2	65.5	0	0	0	0	110
423	L	32.1	Very low	35.6	Very low	164 Å²	164	142.6 Å²	142.6	86%	0.859	77%	0.769	S	S	*	*			trans	-110.7	139	158.4	-91.7	146.7	0	0	0	106.1
424	N	34.3	Very low	35.8	Very low	143 Å²	143	140.7 Å²	140.7	77%	0.765	76%	0.764	S	S	*	*			trans	85.8	127.4	-178.2	-52.2	-9.6	0	0	0	113.2
425	D	38.3	Very low	35.8	Very low	141 Å²	141	141.6 Å²	141.6	75%	0.754	76%	0.764	S	S	*	*			cis	-154.8	147.7	40.7	-90.8	-46.1	0	0	0	115.2
426	Q	39	Very low	35.9	Very low	156 Å²	156	144.7 Å²	144.7	73%	0.729	77%	0.771	S	S	*	*			trans	44.4	123.1	139	-75.4	-176.1	-33.4	0	0	126
427	Q	35.9	Very low	36.3	Very low	143 Å²	143	140.9 Å²	140.9	67%	0.668	76%	0.761	S	S	*	*				65.8	109.9	126.6	-83.9	170.7	-49.2	0	0	122.3
428	N	36.1	Very low	36.5	Very low	139 Å²	139	137.7 Å²	137.7	74%	0.743	75%	0.748	S	S	*	*				160.1	125.9	97.3	-89.4	-27.6	0	0	0	114.4
429	S	34.5	Very low	36.8	Very low	118 Å²	118	136.4 Å²	136.4	83%	0.825	74%	0.737	S	S	*	*			trans	65.8	153.5	147.2	-79.2	0	0	0	0	122.9
430	P	35.7	Very low	37.4	Very low	114 Å²	114	133.9 Å²	133.9	74%	0.74	73%	0.725	S	S	*	*			trans	-107.1	130.4	-137.2	36.8	-29	0	0	0	114.5
431	Q	34.8	Very low	38.4	Very low	186 Å²	186	131.7 Å²	131.7	87%	0.869	71%	0.709	S	S	*	*			trans	-127	80.9	160.4	-80.2	-170.1	-10.2	0	0	110.3	K433	Q431-K433 PolarHBondContact O-N 3.28Å
432	H	34.3	Very low	39.4	Very low	179 Å²	179	131.5 Å²	131.5	83%	0.829	69%	0.693	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.4	97.1	171	-127.9	-86.1	0	0	0	108.4
433	K	36.1	Very low	40.1	Very low	200 Å²	200	130.2 Å²	130.2	87%	0.87	68%	0.68	S	S	*	*	T	Hydrogen-bonded Turn	trans	179	-1.6	150.9	-99.9	165.8	-173.8	-175.2	0	116.9	Q431	Q431-K433 PolarHBondContact O-N 3.28Å
434	N	40.3	Very low	41.3	Very low	124 Å²	124	128.6 Å²	128.6	66%	0.663	67%	0.669	S	S	*	*	S	Bend	trans	-115.9	9.1	174.9	-80.8	-12.2	0	0	0	115
435	V	37.9	Very low	42.1	Very low	73 Å²	73	126.9 Å²	126.9	44%	0.442	66%	0.659	S	S	.	*	H	α-helix	trans	-82.4	-27.7	-167.8	-179.5	0	0	0	0	113.4	N439	V435-N439 VanDerWaalsContact O-CB 3.32Å; V435-N439 WeakPolarHBondContact O-CB 3.49Å; V435-N439 VanDerWaalsContact O-CG 3.26Å; V435-N439 PolarHBondContact O-N 3.44Å; V435-N439 PolarHBondContact O-ND2 2.94Å
436	E	40.7	Very low	42.8	Very low	176 Å²	176	123.7 Å²	123.7	82%	0.822	65%	0.645	S	S	*	*	H	α-helix	trans	-74.9	-31.3	-179.4	-77.5	179.9	152.2	0	0	113.4	S440	E436-S440 PolarHBondContact O-N 3.26Å
437	T	42.9	Very low	43.3	Very low	97 Å²	97	118.6 Å²	118.6	60%	0.595	63%	0.629	S	S	*	*	H	α-helix	trans	-77.4	-37.4	176.4	-39.8	0	0	0	0	111.9	Q441	T437-Q441 PolarHBondContact O-N 2.92Å
438	Q	42.4	Very low	44	Very low	121 Å²	121	114.5 Å²	114.5	57%	0.565	62%	0.62	S	S	*	*	H	α-helix	trans	-69.1	-39.1	174.7	-83	-176.7	-19.8	0	0	112.3	S440 Q441 I442	Q438-S440 VanDerWaalsContact C-N 3.32Å; Q438-S440 PolarHBondContact O-N 2.96Å; Q438-Q441 PolarHBondContact O-N 2.97Å; Q438-I442 WeakPolarHBondContact O-CB 3.45Å; Q438-I442 WeakPolarHBondContact O-CD1 3.18Å; Q438-I442 VanDerWaalsContact O-CG1 3.23Å; Q438-I442 WeakPolarHBondContact O-CG1 3.45Å; Q438-I442 PolarHBondContact O-N 3.43Å
439	N	40.2	Very low	44.6	Very low	87 Å²	87	116 Å²	116	47%	0.465	62%	0.619	S	S	.	*	H	α-helix	trans	-64.8	-34.4	176.7	-78.7	-14.8	0	0	0	112.7	V435 T443	V435-N439 VanDerWaalsContact O-CB 3.32Å; V435-N439 WeakPolarHBondContact O-CB 3.49Å; V435-N439 VanDerWaalsContact O-CG 3.26Å; V435-N439 PolarHBondContact O-N 3.44Å; V435-N439 PolarHBondContact O-ND2 2.94Å; N439-T443 WeakPolarHBondContact O-CB 3.47Å; N439-T443 PolarHBondContact O-N 3.3Å; N439-T443 PolarHBondContact O-OG1 3.33Å
440	S	47.5	Very low	45	Very low	67 Å²	67	115 Å²	115	47%	0.469	61%	0.605	S	S	.	*	H	α-helix	trans	-68.5	-41.8	175.8	-165.5	0	0	0	0	112.3	E436 Q438 T443 Q444	E436-S440 PolarHBondContact O-N 3.26Å; Q438-S440 VanDerWaalsContact C-N 3.32Å; Q438-S440 PolarHBondContact O-N 2.96Å; S440-T443 PolarHBondContact O-N 2.89Å; S440-Q444 WeakPolarHBondContact O-CG 3.08Å; S440-Q444 PolarHBondContact O-N 3.19Å
441	Q	53.3	Low	45.6	Very low	115 Å²	115	115 Å²	115	54%	0.537	59%	0.593	S	S	.	*	H	α-helix	trans	-67.6	-39.6	175.4	-75.2	178.9	-14.2	0	0	112.8	T437 Q438 Q444 N445	T437-Q441 PolarHBondContact O-N 2.92Å; Q438-Q441 PolarHBondContact O-N 2.97Å; Q441-Q444 PolarHBondContact O-N 2.92Å; Q441-N445 WeakPolarHBondContact O-CB 3.41Å; Q441-N445 VanDerWaalsContact O-CG 3.26Å; Q441-N445 PolarHBondContact O-N 3.5Å; Q441-N445 PolarHBondContact O-ND2 3.19Å
442	I	54.1	Low	46.3	Very low	96 Å²	96	113 Å²	113	49%	0.492	58%	0.583	S	S	.	*	H	α-helix	trans	-63.2	-43.5	175	-68.1	165.3	0	0	0	110.2	Q438 Q444 N445 V446	Q438-I442 WeakPolarHBondContact O-CB 3.45Å; Q438-I442 WeakPolarHBondContact O-CD1 3.18Å; Q438-I442 VanDerWaalsContact O-CG1 3.23Å; Q438-I442 WeakPolarHBondContact O-CG1 3.45Å; Q438-I442 PolarHBondContact O-N 3.43Å; I442-Q444 PolarHBondContact O-N 2.94Å; I442-N445 PolarHBondContact O-N 2.97Å; I442-V446 HydrophobicContact CG2-CG2 4.27Å; I442-V446 WeakPolarHBondContact O-CB 3.3Å; I442-V446 VanDerWaalsContact O-CG2 3.23Å; I442-V446 WeakPolarHBondContact O-CG2 3.4Å; I442-V446 PolarHBondContact O-N 2.99Å
443	T	51.1	Low	47.1	Very low	95 Å²	95	107.8 Å²	107.8	58%	0.583	57%	0.567	S	S	*	*	H	α-helix	trans	-64.1	-39.4	178.7	-51	0	0	0	0	111.9	N439 S440 A447	N439-T443 WeakPolarHBondContact O-CB 3.47Å; N439-T443 PolarHBondContact O-N 3.3Å; N439-T443 PolarHBondContact O-OG1 3.33Å; S440-T443 PolarHBondContact O-N 2.89Å; T443-A447 VanDerWaalsContact O-CB 3.31Å; T443-A447 WeakPolarHBondContact O-CB 3.34Å; T443-A447 PolarHBondContact O-N 3.32Å
444	Q	57.8	Low	48.2	Very low	131 Å²	131	102.4 Å²	102.4	61%	0.612	55%	0.548	S	S	*	.	H	α-helix	trans	-67.2	-42.3	174.7	-73.7	-177.5	-0.2	0	0	112.6	S440 Q441 I442 A447 A448	S440-Q444 WeakPolarHBondContact O-CG 3.08Å; S440-Q444 PolarHBondContact O-N 3.19Å; Q441-Q444 PolarHBondContact O-N 2.92Å; I442-Q444 PolarHBondContact O-N 2.94Å; Q444-A447 PolarHBondContact O-N 3.35Å; Q444-A448 WeakPolarHBondContact O-CB 3.27Å; Q444-A448 PolarHBondContact O-N 3.34Å
445	N	51.2	Low	49.2	Very low	107 Å²	107	99.5 Å²	99.5	57%	0.572	53%	0.534	S	S	*	.	H	α-helix	trans	-66.7	-38.1	177.8	-74	-19.1	0	0	0	112.2	Q441 I442 A448 K449	Q441-N445 WeakPolarHBondContact O-CB 3.41Å; Q441-N445 VanDerWaalsContact O-CG 3.26Å; Q441-N445 PolarHBondContact O-N 3.5Å; Q441-N445 PolarHBondContact O-ND2 3.19Å; I442-N445 PolarHBondContact O-N 2.97Å; N445-A448 PolarHBondContact O-N 3.46Å; N445-K449 WeakPolarHBondContact O-CB 3.42Å; N445-K449 PolarHBondContact O-N 2.97Å
446	V	54.4	Low	50.4	Low	74 Å²	74	101.1 Å²	101.1	45%	0.448	54%	0.537	S	S	.	.	H	α-helix	trans	-66.4	-44	173.3	172.2	0	0	0	0	110.5	I442 A448 K449 L450	I442-V446 HydrophobicContact CG2-CG2 4.27Å; I442-V446 WeakPolarHBondContact O-CB 3.3Å; I442-V446 VanDerWaalsContact O-CG2 3.23Å; I442-V446 WeakPolarHBondContact O-CG2 3.4Å; I442-V446 PolarHBondContact O-N 2.99Å; V446-A448 VanDerWaalsContact C-N 3.34Å; V446-A448 PolarHBondContact O-N 3.07Å; V446-K449 PolarHBondContact O-N 3.02Å; V446-L450 HydrophobicContact CG1-CD1 3.75Å; V446-L450 WeakPolarHBondContact O-CB 3.47Å; V446-L450 PolarHBondContact O-N 3.44Å
447	A	48.3	Very low	51.7	Low	49 Å²	49	96.5 Å²	96.5	41%	0.405	52%	0.521	S	S	.	.	H	α-helix	trans	-64.3	-35.9	176.4	0	0	0	0	0	113	T443 Q444 K451	T443-A447 VanDerWaalsContact O-CB 3.31Å; T443-A447 WeakPolarHBondContact O-CB 3.34Å; T443-A447 PolarHBondContact O-N 3.32Å; Q444-A447 PolarHBondContact O-N 3.35Å; A447-K451 WeakPolarHBondContact O-CB 3.19Å; A447-K451 WeakPolarHBondContact O-CG 3.32Å; A447-K451 PolarHBondContact O-N 3.11Å
448	A	50	Low	52.9	Low	56 Å²	56	98.3 Å²	98.3	46%	0.463	52%	0.523	S	S	.	.	H	α-helix	trans	-69	-44.5	174.5	0	0	0	0	0	111.9	Q444 N445 V446 K451 H452	Q444-A448 WeakPolarHBondContact O-CB 3.27Å; Q444-A448 PolarHBondContact O-N 3.34Å; N445-A448 PolarHBondContact O-N 3.46Å; V446-A448 VanDerWaalsContact C-N 3.34Å; V446-A448 PolarHBondContact O-N 3.07Å; A448-K451 PolarHBondContact O-N 3.4Å; A448-H452 WeakPolarHBondContact O-CB 3.45Å; A448-H452 PolarHBondContact O-N 3.33Å
449	K	50.1	Low	54.3	Low	170 Å²	170	96.9 Å²	96.9	74%	0.739	52%	0.518	S	S	*	.	H	α-helix	trans	-61.9	-42.2	173.2	-81.3	-174.2	177	-176.9	0	112.2	N445 V446 H452 S453	N445-K449 WeakPolarHBondContact O-CB 3.42Å; N445-K449 PolarHBondContact O-N 2.97Å; V446-K449 PolarHBondContact O-N 3.02Å; K449-H452 PolarHBondContact O-N 2.73Å; K449-S453 WeakPolarHBondContact O-CB 3.3Å; K449-S453 PolarHBondContact O-N 2.97Å
450	L	43.2	Very low	55.9	Low	98 Å²	98	97 Å²	97	51%	0.513	52%	0.515	S	S	.	.	H	α-helix	trans	-63.8	-41.5	174.8	-105.6	125.2	0	0	0	112.1	V446 N454	V446-L450 HydrophobicContact CG1-CD1 3.75Å; V446-L450 WeakPolarHBondContact O-CB 3.47Å; V446-L450 PolarHBondContact O-N 3.44Å; L450-N454 WeakPolarHBondContact O-CB 3.45Å; L450-N454 PolarHBondContact O-N 3.48Å; L450-N454 PolarHBondContact O-ND2 3.42Å
451	K	46.7	Very low	56.9	Low	115 Å²	115	96.7 Å²	96.7	50%	0.5	51%	0.513	S	S	.	.	H	α-helix	trans	-61.7	-44.5	173.6	-85.4	173.2	173.1	178.5	0	111.7	A447 A448 N454 T455	A447-K451 WeakPolarHBondContact O-CB 3.19Å; A447-K451 WeakPolarHBondContact O-CG 3.32Å; A447-K451 PolarHBondContact O-N 3.11Å; A448-K451 PolarHBondContact O-N 3.4Å; K451-N454 PolarHBondContact O-N 2.9Å; K451-T455 WeakPolarHBondContact O-CG2 3.19Å; K451-T455 PolarHBondContact O-N 2.8Å; K451-T455 PolarHBondContact O-OG1 3.5Å
452	H	49.6	Very low	57.7	Low	143 Å²	143	95.3 Å²	95.3	66%	0.662	50%	0.504	S	S	*	.	H	α-helix	trans	-68.3	-40	179.9	-163.1	56.3	0	0	0	112.3	A448 K449 T455 H456	A448-H452 WeakPolarHBondContact O-CB 3.45Å; A448-H452 PolarHBondContact O-N 3.33Å; K449-H452 PolarHBondContact O-N 2.73Å; H452-T455 VanDerWaalsContact C-OG1 3.31Å; H452-T455 VanDerWaalsContact CA-OG1 3.29Å; H452-T455 WeakPolarHBondContact CA-OG1 3.47Å; H452-T455 PolarHBondContact O-N 3.32Å; H452-T455 PolarHBondContact O-OG1 3.15Å; H452-H456 PolarHBondContact O-N 3.37Å
453	S	52.7	Low	58.8	Low	70 Å²	70	98.8 Å²	98.8	49%	0.49	51%	0.511	S	S	.	.	H	α-helix	trans	-60.7	-47.8	172.9	-169.7	0	0	0	0	111.1	K449 T455 H456 T457	K449-S453 WeakPolarHBondContact O-CB 3.3Å; K449-S453 PolarHBondContact O-N 2.97Å; S453-T455 VanDerWaalsContact C-N 3.34Å; S453-T455 PolarHBondContact O-N 3.36Å; S453-H456 PolarHBondContact O-N 2.96Å; S453-H456 VanDerWaalsContact O-N 3.15Å; S453-T457 PolarHBondContact O-N 2.9Å; S453-T457 VanDerWaalsContact O-N 3.07Å; S453-T457 PolarHBondContact O-OG1 3.18Å
454	N	57.6	Low	60	Low	87 Å²	87	99 Å²	99	47%	0.465	51%	0.505	S	S	.	.	H	α-helix	trans	-62.1	-39.8	178.6	-71.8	-14.6	0	0	0	112.2	L450 K451 H456 T457 E458	L450-N454 WeakPolarHBondContact O-CB 3.45Å; L450-N454 PolarHBondContact O-N 3.48Å; L450-N454 PolarHBondContact O-ND2 3.42Å; K451-N454 PolarHBondContact O-N 2.9Å; N454-H456 VanDerWaalsContact C-N 3.33Å; N454-H456 PolarHBondContact O-N 3.33Å; N454-T457 PolarHBondContact O-N 3.25Å; N454-E458 WeakPolarHBondContact O-CG 3.17Å; N454-E458 PolarHBondContact O-N 3.19Å
455	T	62.2	Low	60.7	Low	62 Å²	62	96.7 Å²	96.7	38%	0.38	49%	0.494	S	S	.	.	H	α-helix	trans	-63.9	-36.9	175	46.5	0	0	0	0	112.6	K451 H452 S453 E458 I459	K451-T455 WeakPolarHBondContact O-CG2 3.19Å; K451-T455 PolarHBondContact O-N 2.8Å; K451-T455 PolarHBondContact O-OG1 3.5Å; H452-T455 VanDerWaalsContact C-OG1 3.31Å; H452-T455 VanDerWaalsContact CA-OG1 3.29Å; H452-T455 WeakPolarHBondContact CA-OG1 3.47Å; H452-T455 PolarHBondContact O-N 3.32Å; H452-T455 PolarHBondContact O-OG1 3.15Å; S453-T455 VanDerWaalsContact C-N 3.34Å; S453-T455 PolarHBondContact O-N 3.36Å; T455-E458 PolarHBondContact O-N 2.91Å; T455-I459 WeakPolarHBondContact O-CD1 3.45Å; T455-I459 VanDerWaalsContact O-CG1 3.23Å; T455-I459 WeakPolarHBondContact O-CG1 3.48Å; T455-I459 PolarHBondContact O-N 3.43Å
456	H	62.4	Low	62	Low	107 Å²	107	94.5 Å²	94.5	50%	0.495	48%	0.478	S	S	.	.	H	α-helix	trans	-66.9	-43	177.2	-167.3	-95.4	0	0	0	111.4	H452 S453 N454 E458 I459 Q460	H452-H456 PolarHBondContact O-N 3.37Å; S453-H456 PolarHBondContact O-N 2.96Å; S453-H456 VanDerWaalsContact O-N 3.15Å; N454-H456 VanDerWaalsContact C-N 3.33Å; N454-H456 PolarHBondContact O-N 3.33Å; H456-E458 PolarHBondContact O-N 3.09Å; H456-I459 PolarHBondContact O-N 3.47Å; H456-Q460 VanDerWaalsContact CE1-CD 3.48Å; H456-Q460 PolarHBondContact CE1-NE2 3.4Å; H456-Q460 WeakPolarHBondContact O-CB 3.08Å; H456-Q460 WeakPolarHBondContact O-CG 3.43Å; H456-Q460 PolarHBondContact O-N 3.5Å
457	T	69.5	Low	63.3	Low	79 Å²	79	96.9 Å²	96.9	49%	0.485	49%	0.487	S	S	.	.	H	α-helix	trans	-64.1	-39.1	176.2	-28	0	0	0	0	112.1	S453 N454 Q460 S461	S453-T457 PolarHBondContact O-N 2.9Å; S453-T457 VanDerWaalsContact O-N 3.07Å; S453-T457 PolarHBondContact O-OG1 3.18Å; N454-T457 PolarHBondContact O-N 3.25Å; T457-Q460 PolarHBondContact O-N 2.84Å; T457-S461 WeakPolarHBondContact O-CB 3.23Å; T457-S461 PolarHBondContact O-N 3.33Å
458	E	66.5	Low	64.7	Low	136 Å²	136	95.9 Å²	95.9	64%	0.636	48%	0.475	S	S	*	.	H	α-helix	trans	-65.6	-43.4	176.2	-76.4	179.1	175.2	0	0	112.3	N454 T455 H456 S461 Y462	N454-E458 WeakPolarHBondContact O-CG 3.17Å; N454-E458 PolarHBondContact O-N 3.19Å; T455-E458 PolarHBondContact O-N 2.91Å; H456-E458 PolarHBondContact O-N 3.09Å; E458-S461 PolarHBondContact O-N 3.42Å; E458-Y462 WeakPolarHBondContact O-CB 3.21Å; E458-Y462 PolarHBondContact O-N 3.16Å
459	I	73.4	Confident	66.1	Low	90 Å²	90	94 Å²	94	46%	0.462	46%	0.457	S	S	.	.	H	α-helix	trans	-64.2	-42.5	176.5	-68.4	165.6	0	0	0	110.8	T455 H456 Y462 R463	T455-I459 WeakPolarHBondContact O-CD1 3.45Å; T455-I459 VanDerWaalsContact O-CG1 3.23Å; T455-I459 WeakPolarHBondContact O-CG1 3.48Å; T455-I459 PolarHBondContact O-N 3.43Å; H456-I459 PolarHBondContact O-N 3.47Å; I459-Y462 PolarHBondContact O-N 3.19Å; I459-R463 WeakPolarHBondContact O-CG 3.49Å; I459-R463 PolarHBondContact O-N 2.84Å
460	Q	73.1	Confident	67.6	Low	89 Å²	89	88.8 Å²	88.8	42%	0.416	44%	0.437	S	S	.	.	H	α-helix	trans	-63.3	-44.3	176.2	-76	-177.5	-32.2	0	0	111.9	H456 T457 Y462 R463 H464	H456-Q460 VanDerWaalsContact CE1-CD 3.48Å; H456-Q460 PolarHBondContact CE1-NE2 3.4Å; H456-Q460 WeakPolarHBondContact O-CB 3.08Å; H456-Q460 WeakPolarHBondContact O-CG 3.43Å; H456-Q460 PolarHBondContact O-N 3.5Å; T457-Q460 PolarHBondContact O-N 2.84Å; Q460-Y462 PolarHBondContact O-N 2.85Å; Q460-R463 PolarHBondContact O-N 3.39Å; Q460-H464 WeakPolarHBondContact O-CB 3.46Å; Q460-H464 PolarHBondContact O-N 3.47Å
461	S	68.5	Low	69.4	Low	61 Å²	61	91.2 Å²	91.2	43%	0.427	44%	0.439	S	S	.	.	H	α-helix	trans	-58.7	-46.9	175.2	-175.3	0	0	0	0	111.6	T457 E458 R463 H464 E465	T457-S461 WeakPolarHBondContact O-CB 3.23Å; T457-S461 PolarHBondContact O-N 3.33Å; E458-S461 PolarHBondContact O-N 3.42Å; S461-R463 PolarHBondContact O-N 2.91Å; S461-H464 WeakPolarHBondContact O-CB 3.37Å; S461-H464 PolarHBondContact O-N 3.09Å; S461-E465 WeakPolarHBondContact O-CG 3.1Å; S461-E465 PolarHBondContact O-N 2.91Å
462	Y	70.8	Confident	71.1	Confident	86 Å²	86	87 Å²	87	34%	0.337	42%	0.421	S	S	.	.	H	α-helix	trans	-62.7	-41.9	177.9	-176.4	-98.6	0	0	0	112.9	L250 E458 I459 Q460 H464 E465 R466	L250-Y462 HydrophobicContact CD2-CE1 4.38Å; L250-Y462 HydrophobicContact CD2-CE2 4.39Å; L250-Y462 WeakPolarHBondContact CD2-OH 3.37Å; E458-Y462 WeakPolarHBondContact O-CB 3.21Å; E458-Y462 PolarHBondContact O-N 3.16Å; I459-Y462 PolarHBondContact O-N 3.19Å; Q460-Y462 PolarHBondContact O-N 2.85Å; Y462-H464 VanDerWaalsContact C-N 3.34Å; Y462-E465 PolarHBondContact O-N 3.32Å; Y462-R466 WeakPolarHBondContact O-CB 3.39Å; Y462-R466 PolarHBondContact O-N 3.42Å
463	R	75.9	Confident	72.8	Confident	170 Å²	170	82.2 Å²	82.2	64%	0.642	40%	0.399	S	S	*	.	H	α-helix	trans	-61.6	-44	173.9	-74.1	-180	-176.4	-173.4	2.2	111.1	I459 Q460 S461 R466 L467	I459-R463 WeakPolarHBondContact O-CG 3.49Å; I459-R463 PolarHBondContact O-N 2.84Å; Q460-R463 PolarHBondContact O-N 3.39Å; S461-R463 PolarHBondContact O-N 2.91Å; R463-R466 PolarHBondContact O-N 3.26Å; R463-L467 WeakPolarHBondContact O-CG 3.42Å; R463-L467 PolarHBondContact O-N 2.68Å
464	H	75.8	Confident	74.4	Confident	99 Å²	99	86.2 Å²	86.2	46%	0.458	41%	0.408	S	S	.	.	H	α-helix	trans	-62.8	-45.6	177.8	-169.2	-28.6	0	0	0	111.6	Q460 S461 Y462 R466 L467 I468	Q460-H464 WeakPolarHBondContact O-CB 3.46Å; Q460-H464 PolarHBondContact O-N 3.47Å; S461-H464 WeakPolarHBondContact O-CB 3.37Å; S461-H464 PolarHBondContact O-N 3.09Å; Y462-H464 VanDerWaalsContact C-N 3.34Å; H464-R466 VanDerWaalsContact C-N 3.32Å; H464-R466 PolarHBondContact O-N 2.85Å; H464-L467 PolarHBondContact O-N 3.49Å; H464-I468 WeakPolarHBondContact CE1-CD1 3.36Å; H464-I468 WeakPolarHBondContact ND1-CD1 3.46Å; H464-I468 WeakPolarHBondContact O-CG1 3.18Å; H464-I468 PolarHBondContact O-N 3.04Å
465	E	73.1	Confident	75.8	Confident	83 Å²	83	84 Å²	84	39%	0.388	40%	0.397	S	S	.	.	H	α-helix	trans	-61.5	-40.9	176	-74.4	-168.9	163	0	0	111.7	S461 Y462 I468 F469	S461-E465 WeakPolarHBondContact O-CG 3.1Å; S461-E465 PolarHBondContact O-N 2.91Å; Y462-E465 PolarHBondContact O-N 3.32Å; E465-I468 PolarHBondContact O-N 2.86Å; E465-F469 VanDerWaalsContact O-CB 3.27Å; E465-F469 WeakPolarHBondContact O-CB 3.32Å; E465-F469 PolarHBondContact O-N 3.04Å
466	R	79	Confident	77.1	Confident	60 Å²	60	81.3 Å²	81.3	23%	0.226	38%	0.381	C	S	.	.	H	α-helix	trans	-63.6	-43.2	176.2	-172.8	-178.5	-169.2	155.1	17.8	112.2	L250 Y462 R463 H464 F469 N470	L250-R466 HydrophobicContact CD1-CG 4.26Å; L250-R466 HydrophobicContact CD2-CB 4.39Å; L250-R466 HydrophobicContact CD2-CG 3.98Å; L250-R466 PolarHBondContact O-NH2 3.25Å; Y462-R466 WeakPolarHBondContact O-CB 3.39Å; Y462-R466 PolarHBondContact O-N 3.42Å; R463-R466 PolarHBondContact O-N 3.26Å; H464-R466 VanDerWaalsContact C-N 3.32Å; H464-R466 PolarHBondContact O-N 2.85Å; R466-F469 PolarHBondContact O-N 3.05Å; R466-N470 WeakPolarHBondContact O-CB 3.49Å; R466-N470 PolarHBondContact O-N 3.09Å
467	L	80.3	Confident	78.4	Confident	124 Å²	124	82.5 Å²	82.5	65%	0.649	39%	0.385	S	S	*	.	H	α-helix	trans	-63.5	-45.2	177.3	-73.8	172	0	0	0	111.3	R463 H464 N470 R471	R463-L467 WeakPolarHBondContact O-CG 3.42Å; R463-L467 PolarHBondContact O-N 2.68Å; H464-L467 PolarHBondContact O-N 3.49Å; L467-N470 PolarHBondContact O-N 3.43Å; L467-R471 WeakPolarHBondContact O-CB 3.47Å; L467-R471 PolarHBondContact O-N 3.44Å
468	I	78	Confident	79.5	Confident	28 Å²	28	79 Å²	79	14%	0.144	36%	0.364	C	S	.	.	H	α-helix	trans	-58.4	-50.4	173.3	-66.2	162.2	0	0	0	109.6	I169 H464 E465 N470 R471 E472	I169-I468 HydrophobicContact CD1-CD1 3.64Å; I169-I468 HydrophobicContact CD1-CG1 4.47Å; I169-I468 HydrophobicContact CD1-CG2 4.44Å; H464-I468 WeakPolarHBondContact CE1-CD1 3.36Å; H464-I468 WeakPolarHBondContact ND1-CD1 3.46Å; H464-I468 WeakPolarHBondContact O-CG1 3.18Å; H464-I468 PolarHBondContact O-N 3.04Å; E465-I468 PolarHBondContact O-N 2.86Å; I468-N470 PolarHBondContact O-N 2.82Å; I468-R471 WeakPolarHBondContact O-CB 3.31Å; I468-R471 PolarHBondContact O-N 3.02Å; I468-R471 VanDerWaalsContact O-N 3.13Å; I468-E472 HydrophobicContact CG2-CG 4.07Å; I468-E472 WeakPolarHBondContact O-CG 3.48Å; I468-E472 PolarHBondContact O-N 2.65Å
469	F	79.8	Confident	80.6	Confident	17 Å²	17	72.8 Å²	72.8	8%	0.075	34%	0.335	C	S	.	.	H	α-helix	trans	-58.9	-45.8	-178.1	179.3	-100.6	0	0	0	112.4	I243 R246 L250 E465 R466 R471 E472 Q473	I243-F469 HydrophobicContact CB-CZ 4.48Å; I243-F469 HydrophobicContact CG1-CE2 4.44Å; I243-F469 HydrophobicContact CG1-CZ 4.3Å; I243-F469 HydrophobicContact CG2-CZ 4.34Å; R246-F469 HydrophobicContact CB-CE1 4.2Å; R246-F469 HydrophobicContact CB-CE2 4.01Å; R246-F469 HydrophobicContact CB-CZ 3.63Å; R246-F469 HydrophobicContact CG-CE2 4.42Å; L250-F469 HydrophobicContact CD1-CD1 3.75Å; L250-F469 HydrophobicContact CD1-CE1 3.95Å; E465-F469 VanDerWaalsContact O-CB 3.27Å; E465-F469 WeakPolarHBondContact O-CB 3.32Å; E465-F469 PolarHBondContact O-N 3.04Å; R466-F469 PolarHBondContact O-N 3.05Å; F469-R471 VanDerWaalsContact C-N 3.3Å; F469-R471 PolarHBondContact O-N 3.18Å; F469-E472 PolarHBondContact O-N 3.35Å; F469-Q473 WeakPolarHBondContact O-CB 3.39Å; F469-Q473 PolarHBondContact O-N 3.32Å
470	N	81.2	Confident	81.6	Confident	60 Å²	60	70.1 Å²	70.1	32%	0.321	33%	0.326	S	S	.	.	H	α-helix	trans	-62.1	-38	177	-73.4	-11.5	0	0	0	112	R466 L467 I468 K474	R466-N470 WeakPolarHBondContact O-CB 3.49Å; R466-N470 PolarHBondContact O-N 3.09Å; L467-N470 PolarHBondContact O-N 3.43Å; I468-N470 PolarHBondContact O-N 2.82Å; N470-K474 PolarHBondContact O-N 2.84Å
471	R	81.4	Confident	82.5	Confident	149 Å²	149	68.9 Å²	68.9	56%	0.562	33%	0.325	S	S	*	.	H	α-helix	trans	-66.8	-48.2	175.9	-169	177.3	-171	173.9	3.2	111	L467 I468 F469 Q473 K474 T475	L467-R471 WeakPolarHBondContact O-CB 3.47Å; L467-R471 PolarHBondContact O-N 3.44Å; I468-R471 WeakPolarHBondContact O-CB 3.31Å; I468-R471 PolarHBondContact O-N 3.02Å; I468-R471 VanDerWaalsContact O-N 3.13Å; F469-R471 VanDerWaalsContact C-N 3.3Å; F469-R471 PolarHBondContact O-N 3.18Å; R471-Q473 VanDerWaalsContact C-N 3.3Å; R471-Q473 PolarHBondContact O-N 3.27Å; R471-K474 PolarHBondContact O-N 2.95Å; R471-T475 PolarHBondContact O-N 2.9Å; R471-T475 PolarHBondContact O-OG1 3.28Å
472	E	83	Confident	83.7	Confident	28 Å²	28	66 Å²	66	13%	0.131	30%	0.304	C	S	.	.	H	α-helix	trans	-63.5	-35.7	178.4	-67.4	-56.4	144.6	0	0	112.1	R158 I162 I468 F469 K474 T475 V476	R158-E472 IonicContact CZ-OE2 3.04Å; R158-E472 IonicContact NH1-OE2 3.22Å; R158-E472 PolarHBondContact NH1-OE2 3.45Å; R158-E472 IonicContact NH2-OE2 3.06Å; I162-E472 HydrophobicContact CD1-CB 3.83Å; I468-E472 HydrophobicContact CG2-CG 4.07Å; I468-E472 WeakPolarHBondContact O-CG 3.48Å; I468-E472 PolarHBondContact O-N 2.65Å; F469-E472 PolarHBondContact O-N 3.35Å; E472-K474 VanDerWaalsContact C-N 3.34Å; E472-K474 PolarHBondContact O-N 3.41Å; E472-T475 PolarHBondContact O-N 3.32Å; E472-V476 WeakPolarHBondContact O-CG2 3.47Å; E472-V476 PolarHBondContact O-N 2.89Å
473	Q	84	Confident	84.7	Confident	41 Å²	41	62.1 Å²	62.1	19%	0.192	29%	0.289	C	S	.	.	H	α-helix	trans	-60.8	-40.4	176.5	-172.2	-174.3	7.7	0	0	112.2	I243 F469 R471 V476 K477	I243-Q473 HydrophobicContact CD1-CG 4.45Å; I243-Q473 HydrophobicContact CG2-CG 4.13Å; F469-Q473 WeakPolarHBondContact O-CB 3.39Å; F469-Q473 PolarHBondContact O-N 3.32Å; R471-Q473 VanDerWaalsContact C-N 3.3Å; R471-Q473 PolarHBondContact O-N 3.27Å; Q473-V476 PolarHBondContact O-N 3.35Å; Q473-K477 WeakPolarHBondContact O-CG 3.42Å; Q473-K477 PolarHBondContact O-N 3.4Å
474	K	86.6	Confident	85.5	Confident	154 Å²	154	57.2 Å²	57.2	67%	0.67	28%	0.28	S	S	*	.	H	α-helix	trans	-63.2	-44.8	177.3	-69.4	176.1	-178.6	178.6	0	111.3	N470 R471 E472 K477 T478	N470-K474 PolarHBondContact O-N 2.84Å; R471-K474 PolarHBondContact O-N 2.95Å; E472-K474 VanDerWaalsContact C-N 3.34Å; E472-K474 PolarHBondContact O-N 3.41Å; K474-K477 PolarHBondContact O-N 3.47Å; K474-T478 PolarHBondContact O-N 2.9Å; K474-T478 PolarHBondContact O-OG1 3.12Å
475	T	86.9	Confident	86.3	Confident	41 Å²	41	53.5 Å²	53.5	25%	0.252	27%	0.266	S	S	.	.	H	α-helix	trans	-62	-45.5	175.7	-52	0	0	0	0	110.8	R158 R471 E472 K477 T478 V479	R158-T475 VanDerWaalsContact NH1-CG2 3.32Å; R471-T475 PolarHBondContact O-N 2.9Å; R471-T475 PolarHBondContact O-OG1 3.28Å; E472-T475 PolarHBondContact O-N 3.32Å; T475-K477 VanDerWaalsContact C-N 3.33Å; T475-K477 PolarHBondContact O-N 3.37Å; T475-T478 WeakPolarHBondContact O-CB 3.32Å; T475-T478 PolarHBondContact O-N 3.33Å; T475-T478 VanDerWaalsContact O-N 3.14Å; T475-V479 HydrophobicContact CG2-CG2 4.45Å; T475-V479 WeakPolarHBondContact O-CG2 3.47Å; T475-V479 PolarHBondContact O-N 2.89Å
476	V	89.7	Confident	87.2	Confident	6 Å²	6	49.8 Å²	49.8	4%	0.036	25%	0.248	C	C	.	.	H	α-helix	trans	-59.6	-40.8	177.7	167	0	0	0	0	112.3	R158 I162 I239 I243 E472 Q473 T478 V479 A480	R158-V476 HydrophobicContact CB-CG2 4.28Å; I162-V476 HydrophobicContact CD1-CG2 3.84Å; I162-V476 HydrophobicContact CG1-CG2 3.69Å; I239-V476 HydrophobicContact CG2-CG1 3.51Å; I243-V476 HydrophobicContact CD1-CB 4.31Å; I243-V476 HydrophobicContact CD1-CG1 3.72Å; E472-V476 WeakPolarHBondContact O-CG2 3.47Å; E472-V476 PolarHBondContact O-N 2.89Å; Q473-V476 PolarHBondContact O-N 3.35Å; V476-T478 VanDerWaalsContact C-N 3.29Å; V476-T478 PolarHBondContact O-N 3.1Å; V476-V479 PolarHBondContact O-N 2.02Å; V476-A480 WeakPolarHBondContact O-CB 3.23Å; V476-A480 PolarHBondContact O-N 2.68Å
477	K	90.1	Very high	87.8	Confident	131 Å²	131	49 Å²	49	57%	0.57	25%	0.248	S	C	*	.	H	α-helix	trans	-58.3	-43.3	175.8	-74.6	178.7	179	-173.7	0	111.8	Q473 K474 T475 T481	Q473-K477 WeakPolarHBondContact O-CG 3.42Å; Q473-K477 PolarHBondContact O-N 3.4Å; K474-K477 PolarHBondContact O-N 3.47Å; T475-K477 VanDerWaalsContact C-N 3.33Å; T475-K477 PolarHBondContact O-N 3.37Å; K477-T481 PolarHBondContact O-N 3.16Å; K477-T481 VanDerWaalsContact O-N 3.08Å; K477-T481 PolarHBondContact O-OG1 3.12Å
478	T	91.8	Very high	88.3	Confident	7 Å²	7	48.9 Å²	48.9	4%	0.043	25%	0.247	C	C	.	.	H	α-helix	trans	-62.5	-51.1	177.1	-57.7	0	0	0	0	110.8	K474 T475 V476 A480 T481 V482 I529 Y530 C533 T534	K474-T478 PolarHBondContact O-N 2.9Å; K474-T478 PolarHBondContact O-OG1 3.12Å; T475-T478 WeakPolarHBondContact O-CB 3.32Å; T475-T478 PolarHBondContact O-N 3.33Å; T475-T478 VanDerWaalsContact O-N 3.14Å; V476-T478 VanDerWaalsContact C-N 3.29Å; V476-T478 PolarHBondContact O-N 3.1Å; T478-A480 VanDerWaalsContact C-N 3.34Å; T478-A480 PolarHBondContact O-N 3.47Å; T478-T481 WeakPolarHBondContact O-CA 3.22Å; T478-T481 VanDerWaalsContact O-CB 3.27Å; T478-T481 WeakPolarHBondContact O-CB 3.24Å; T478-T481 PolarHBondContact O-N 3Å; T478-V482 PolarHBondContact O-N 3.27Å; T478-I529 HydrophobicContact CG2-CG2 3.92Å; T478-Y530 HydrophobicContact CG2-CD1 4.11Å; T478-Y530 HydrophobicContact CG2-CE1 4.28Å; T478-C533 HydrophobicContact CG2-CB 3.91Å; T478-T534 HydrophobicContact CG2-CG2 3.73Å; T478-T534 WeakPolarHBondContact OG1-CG2 3.16Å
479	V	91	Very high	89	Confident	5 Å²	5	48.5 Å²	48.5	3%	0.03	25%	0.247	C	C	.	.	H	α-helix	trans	-67.4	-35.1	-178.4	-169.2	0	0	0	0	112	I154 R158 Y236 T475 V476 T481 V482 V483	I154-V479 HydrophobicContact CB-CG1 4.35Å; I154-V479 HydrophobicContact CG2-CB 4.37Å; I154-V479 HydrophobicContact CG2-CG1 3.37Å; I154-V479 HydrophobicContact CG2-CG2 4.05Å; R158-V479 HydrophobicContact CG-CB 4.34Å; R158-V479 HydrophobicContact CG-CG1 4.4Å; R158-V479 HydrophobicContact CG-CG2 4.24Å; Y236-V479 WeakPolarHBondContact OH-CB 3.29Å; Y236-V479 WeakPolarHBondContact OH-CG1 3.07Å; T475-V479 HydrophobicContact CG2-CG2 4.45Å; T475-V479 WeakPolarHBondContact O-CG2 3.47Å; T475-V479 PolarHBondContact O-N 2.89Å; V476-V479 PolarHBondContact O-N 2.02Å; V479-T481 PolarHBondContact O-N 3.14Å; V479-V482 WeakPolarHBondContact O-CB 3.46Å; V479-V482 PolarHBondContact O-N 3.18Å; V479-V483 HydrophobicContact CG1-CG2 4.49Å; V479-V483 WeakPolarHBondContact O-CG2 3.46Å; V479-V483 PolarHBondContact O-N 3.46Å
480	A	92.9	Very high	89.6	Confident	33 Å²	33	48.6 Å²	48.6	27%	0.273	25%	0.247	S	C	.	.	H	α-helix	trans	-60	-35.9	172.5	0	0	0	0	0	111.7	Y236 V476 T478 V483 C484	Y236-A480 HydrophobicContact CD1-CB 3.74Å; Y236-A480 VanDerWaalsContact CE1-CA 3.47Å; Y236-A480 HydrophobicContact CE1-CB 3.63Å; V476-A480 WeakPolarHBondContact O-CB 3.23Å; V476-A480 PolarHBondContact O-N 2.68Å; T478-A480 VanDerWaalsContact C-N 3.34Å; T478-A480 PolarHBondContact O-N 3.47Å; A480-V483 PolarHBondContact O-N 3.1Å; A480-C484 VanDerWaalsContact O-CB 3.31Å; A480-C484 WeakPolarHBondContact O-CB 2.99Å; A480-C484 PolarHBondContact O-N 2.82Å
481	T	93	Very high	90	Very high	64 Å²	64	48.7 Å²	48.7	39%	0.393	25%	0.247	S	C	.	.	H	α-helix	trans	-66.2	-45.8	174.6	-51.6	0	0	0	0	111	K477 T478 V479 V483 C484 C485 I529	K477-T481 PolarHBondContact O-N 3.16Å; K477-T481 VanDerWaalsContact O-N 3.08Å; K477-T481 PolarHBondContact O-OG1 3.12Å; T478-T481 WeakPolarHBondContact O-CA 3.22Å; T478-T481 VanDerWaalsContact O-CB 3.27Å; T478-T481 WeakPolarHBondContact O-CB 3.24Å; T478-T481 PolarHBondContact O-N 3Å; V479-T481 PolarHBondContact O-N 3.14Å; T481-V483 VanDerWaalsContact C-N 3.31Å; T481-V483 PolarHBondContact O-N 3.41Å; T481-C484 PolarHBondContact O-N 3.49Å; T481-C485 WeakPolarHBondContact O-CB 3.43Å; T481-C485 PolarHBondContact O-N 3.14Å; T481-I529 HydrophobicContact CG2-CD1 4.15Å; T481-I529 HydrophobicContact CG2-CG1 4.21Å; T481-I529 HydrophobicContact CG2-CG2 4.18Å
482	V	92.5	Very high	90.5	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-56	-46.9	174.2	171.9	0	0	0	0	111	L101 L151 T478 V479 C485 F486 N526 I529 Y530	L101-V482 HydrophobicContact CD2-CG1 4.5Å; L151-V482 HydrophobicContact CD2-CG1 3.68Å; T478-V482 PolarHBondContact O-N 3.27Å; V479-V482 WeakPolarHBondContact O-CB 3.46Å; V479-V482 PolarHBondContact O-N 3.18Å; V482-C485 WeakPolarHBondContact O-CB 3.01Å; V482-C485 PolarHBondContact O-N 2.85Å; V482-F486 PolarHBondContact O-N 2.83Å; V482-N526 WeakPolarHBondContact CG1-OD1 3.2Å; V482-I529 HydrophobicContact CG2-CB 4.28Å; V482-I529 HydrophobicContact CG2-CD1 4.03Å; V482-I529 HydrophobicContact CG2-CG2 3.75Å; V482-Y530 HydrophobicContact CG2-CE1 4.34Å
483	V	91.8	Very high	90.8	Very high	4 Å²	4	44.6 Å²	44.6	2%	0.024	24%	0.239	C	C	.	.	H	α-helix	trans	-67.9	-39.4	-179.2	162.6	0	0	0	0	112.7	L151 V232 Y236 V479 A480 T481 C485 F486 I487	L151-V483 HydrophobicContact CD2-CG2 4.29Å; V232-V483 HydrophobicContact CG1-CB 4.25Å; V232-V483 HydrophobicContact CG1-CG1 3.23Å; V232-V483 HydrophobicContact CG1-CG2 4.01Å; Y236-V483 HydrophobicContact CD2-CB 4.3Å; Y236-V483 HydrophobicContact CD2-CG1 3.76Å; Y236-V483 HydrophobicContact CD2-CG2 4.33Å; Y236-V483 HydrophobicContact CE2-CB 3.93Å; Y236-V483 HydrophobicContact CE2-CG1 3.84Å; Y236-V483 HydrophobicContact CE2-CG2 3.54Å; Y236-V483 HydrophobicContact CG-CG1 4.44Å; V479-V483 HydrophobicContact CG1-CG2 4.49Å; V479-V483 WeakPolarHBondContact O-CG2 3.46Å; V479-V483 PolarHBondContact O-N 3.46Å; A480-V483 PolarHBondContact O-N 3.1Å; T481-V483 VanDerWaalsContact C-N 3.31Å; T481-V483 PolarHBondContact O-N 3.41Å; V483-C485 VanDerWaalsContact C-N 3.35Å; V483-F486 PolarHBondContact O-N 3.17Å; V483-I487 HydrophobicContact CG1-CD1 4.14Å; V483-I487 WeakPolarHBondContact O-CG1 3.41Å; V483-I487 PolarHBondContact O-N 3.24Å
484	C	92.7	Very high	91.1	Very high	67 Å²	67	42.6 Å²	42.6	45%	0.453	23%	0.23	S	C	.	.	H	α-helix	trans	-63.1	-43.8	175.3	-175.8	0	0	0	0	111.1	A480 T481 F486 I487 L488	A480-C484 VanDerWaalsContact O-CB 3.31Å; A480-C484 WeakPolarHBondContact O-CB 2.99Å; A480-C484 PolarHBondContact O-N 2.82Å; T481-C484 PolarHBondContact O-N 3.49Å; C484-F486 VanDerWaalsContact C-N 3.33Å; C484-F486 PolarHBondContact O-N 3.41Å; C484-I487 PolarHBondContact O-N 3.36Å; C484-L488 WeakPolarHBondContact O-CG 3.37Å; C484-L488 PolarHBondContact O-N 3.41Å
485	C	93.6	Very high	91.2	Very high	22 Å²	22	39.2 Å²	39.2	15%	0.149	22%	0.218	C	C	.	.	H	α-helix	trans	-58.1	-46.4	174.2	-170.4	0	0	0	0	111.3	T481 V482 V483 I487 L488 C489 C525 I529	T481-C485 WeakPolarHBondContact O-CB 3.43Å; T481-C485 PolarHBondContact O-N 3.14Å; V482-C485 WeakPolarHBondContact O-CB 3.01Å; V482-C485 PolarHBondContact O-N 2.85Å; V483-C485 VanDerWaalsContact C-N 3.35Å; C485-I487 PolarHBondContact O-N 3.41Å; C485-L488 PolarHBondContact O-N 3.43Å; C485-C489 VanDerWaalsContact O-CB 3.3Å; C485-C489 WeakPolarHBondContact O-CB 3.34Å; C485-C489 PolarHBondContact O-N 2.74Å; C485-C489 PolarHBondContact O-SG 3.28Å; C485-C489 VanDerWaalsContact O-SG 3.38Å; C485-C525 WeakPolarHBondContact SG-CB 3.44Å; C485-I529 HydrophobicContact CB-CD1 4.2Å
486	F	91.4	Very high	91.3	Very high	4 Å²	4	38.3 Å²	38.3	2%	0.018	21%	0.21	C	C	.	.	H	α-helix	trans	-56.9	-48.3	177.1	171.4	-102.7	0	0	0	112.7	I148 L151 F229 V482 V483 C484 C489 W490 N522	I148-F486 HydrophobicContact CB-CZ 4.38Å; I148-F486 HydrophobicContact CD1-CE2 4.31Å; I148-F486 HydrophobicContact CD1-CZ 3.81Å; I148-F486 HydrophobicContact CG1-CE1 4.45Å; I148-F486 HydrophobicContact CG1-CE2 3.72Å; I148-F486 HydrophobicContact CG1-CZ 3.44Å; I148-F486 VanDerWaalsContact CG1-CZ 3.44Å; I148-F486 HydrophobicContact CG2-CZ 4.41Å; L151-F486 HydrophobicContact CD1-CB 3.69Å; L151-F486 HydrophobicContact CD1-CD1 3.69Å; L151-F486 HydrophobicContact CD1-CD2 3.46Å; L151-F486 VanDerWaalsContact CD1-CD2 3.46Å; L151-F486 HydrophobicContact CD1-CE1 4.24Å; L151-F486 HydrophobicContact CD1-CE2 4.08Å; L151-F486 HydrophobicContact CD1-CG 3.29Å; L151-F486 HydrophobicContact CD1-CZ 4.47Å; F229-F486 HydrophobicContact CD1-CD1 4.14Å; F229-F486 AromaticContact CD1-CE1 3.53Å; F229-F486 HydrophobicContact CD1-CE1 3.53Å; F229-F486 HydrophobicContact CD1-CZ 4.32Å; F229-F486 AromaticContact CE1-CD1 3.67Å; F229-F486 HydrophobicContact CE1-CD1 3.67Å; F229-F486 AromaticContact CE1-CE1 3.09Å; F229-F486 HydrophobicContact CE1-CE1 3.09Å; F229-F486 AromaticContact CE1-CZ 3.61Å; F229-F486 HydrophobicContact CE1-CZ 3.61Å; F229-F486 HydrophobicContact CZ-CE1 4.04Å; F229-F486 HydrophobicContact CZ-CZ 4.12Å; V482-F486 PolarHBondContact O-N 2.83Å; V483-F486 PolarHBondContact O-N 3.17Å; C484-F486 VanDerWaalsContact C-N 3.33Å; C484-F486 PolarHBondContact O-N 3.41Å; F486-C489 PolarHBondContact O-N 3.24Å; F486-W490 AromaticContact CD2-CD1 3.33Å; F486-W490 HydrophobicContact CD2-CG 4.18Å; F486-W490 AromaticContact CD2-NE1 3.88Å; F486-W490 HydrophobicContact CE2-CB 4.23Å; F486-W490 AromaticContact CE2-CD1 3.24Å; F486-W490 HydrophobicContact CE2-CD2 4.46Å; F486-W490 AromaticContact CE2-CG 3.73Å; F486-W490 HydrophobicContact CE2-CG 3.73Å; F486-W490 AromaticContact CE2-NE1 3.71Å; F486-W490 HydrophobicContact CZ-CB 4.38Å; F486-W490 HydrophobicContact CZ-CG 4.3Å; F486-W490 WeakPolarHBondContact O-CB 3.42Å; F486-W490 PolarHBondContact O-N 2.97Å; F486-N522 WeakPolarHBondContact CA-OD1 3.18Å; F486-N522 WeakPolarHBondContact CB-OD1 3.1Å; F486-N522 PolarHBondContact N-OD1 2.86Å
487	I	91.5	Very high	91	Very high	45 Å²	45	39.7 Å²	39.7	23%	0.231	22%	0.216	C	C	.	.	H	α-helix	trans	-60.6	-48.5	177.6	-66.1	167.2	0	0	0	110.6	F229 V483 C484 C485 C489 W490 L491	F229-I487 HydrophobicContact CD1-CG1 3.82Å; F229-I487 HydrophobicContact CE1-CB 4.38Å; F229-I487 HydrophobicContact CE1-CG1 4.04Å; V483-I487 HydrophobicContact CG1-CD1 4.14Å; V483-I487 WeakPolarHBondContact O-CG1 3.41Å; V483-I487 PolarHBondContact O-N 3.24Å; C484-I487 PolarHBondContact O-N 3.36Å; C485-I487 PolarHBondContact O-N 3.41Å; I487-C489 VanDerWaalsContact C-N 3.34Å; I487-C489 PolarHBondContact O-N 3.49Å; I487-W490 PolarHBondContact O-N 3.15Å; I487-L491 HydrophobicContact CG2-CB 4.47Å; I487-L491 HydrophobicContact CG2-CD2 4.41Å; I487-L491 WeakPolarHBondContact O-CB 3.3Å; I487-L491 PolarHBondContact O-N 2.89Å
488	L	92.1	Very high	90.8	Very high	121 Å²	121	35 Å²	35	63%	0.634	20%	0.198	S	C	*	.	H	α-helix	trans	-64.2	-38.4	-177.3	-68.4	173.1	0	0	0	112.9	C484 C485 P492	C484-L488 WeakPolarHBondContact O-CG 3.37Å; C484-L488 PolarHBondContact O-N 3.41Å; C485-L488 PolarHBondContact O-N 3.43Å; L488-P492 WeakPolarHBondContact O-CD 3.44Å
489	C	92.6	Very high	90.6	Very high	19 Å²	19	38 Å²	38	13%	0.128	22%	0.216	C	C	.	.	H	α-helix	trans	-72.2	-40	180	-77.8	0	0	0	0	113.1	C485 F486 I487 P518 G519 N522	C485-C489 VanDerWaalsContact O-CB 3.3Å; C485-C489 WeakPolarHBondContact O-CB 3.34Å; C485-C489 PolarHBondContact O-N 2.74Å; C485-C489 PolarHBondContact O-SG 3.28Å; C485-C489 VanDerWaalsContact O-SG 3.38Å; F486-C489 PolarHBondContact O-N 3.24Å; I487-C489 VanDerWaalsContact C-N 3.34Å; I487-C489 PolarHBondContact O-N 3.49Å; C489-P518 WeakPolarHBondContact CB-O 3.29Å; C489-P518 CarbonylContact O-C 3.58Å; C489-P518 PolarHBondContact SG-O 3.28Å; C489-P518 VanDerWaalsContact SG-O 3.39Å; C489-G519 PolarHBondContact O-N 3.32Å; C489-N522 HydrophobicContact CB-CB 3.88Å
490	W	91.1	Very high	90.2	Very high	19 Å²	19	38.6 Å²	38.6	7%	0.072	22%	0.218	C	C	.	.	H	α-helix	trans	-99.2	-21.8	-171.5	-79.1	96.6	0	0	0	114.6	C144 F225 F229 F486 I487 F493 A494 G519	C144-W490 HydrophobicContact CB-CH2 4.31Å; C144-W490 WeakPolarHBondContact SG-CH2 3.49Å; F225-W490 HydrophobicContact CD1-CE3 4.39Å; F225-W490 HydrophobicContact CE1-CD2 4.23Å; F225-W490 AromaticContact CE1-CE3 3.44Å; F225-W490 HydrophobicContact CE1-CE3 3.44Å; F225-W490 VanDerWaalsContact CE1-CE3 3.44Å; F225-W490 AromaticContact CE1-CZ3 3.8Å; F225-W490 HydrophobicContact CE1-CZ3 3.8Å; F225-W490 HydrophobicContact CZ-CE3 4.05Å; F225-W490 AromaticContact CZ-CZ3 3.98Å; F225-W490 HydrophobicContact CZ-CZ3 3.98Å; F229-W490 HydrophobicContact CE1-CB 4.25Å; F229-W490 HydrophobicContact CZ-CB 3.56Å; F486-W490 AromaticContact CD2-CD1 3.33Å; F486-W490 HydrophobicContact CD2-CG 4.18Å; F486-W490 AromaticContact CD2-NE1 3.88Å; F486-W490 HydrophobicContact CE2-CB 4.23Å; F486-W490 AromaticContact CE2-CD1 3.24Å; F486-W490 HydrophobicContact CE2-CD2 4.46Å; F486-W490 AromaticContact CE2-CG 3.73Å; F486-W490 HydrophobicContact CE2-CG 3.73Å; F486-W490 AromaticContact CE2-NE1 3.71Å; F486-W490 HydrophobicContact CZ-CB 4.38Å; F486-W490 HydrophobicContact CZ-CG 4.3Å; F486-W490 WeakPolarHBondContact O-CB 3.42Å; F486-W490 PolarHBondContact O-N 2.97Å; I487-W490 PolarHBondContact O-N 3.15Å; W490-F493 HydrophobicContact CE3-CD1 4.13Å; W490-F493 HydrophobicContact CZ3-CD1 4.01Å; W490-F493 HydrophobicContact CZ3-CE1 4.46Å; W490-F493 PolarHBondContact O-N 3.16Å; W490-A494 WeakPolarHBondContact O-CB 3.46Å; W490-A494 PolarHBondContact O-N 3.39Å; W490-G519 PolarHBondContact NE1-O 3.38Å; W490-G519 VanDerWaalsContact NE1-O 3.09Å
491	L	91	Very high	89.7	Confident	63 Å²	63	37.3 Å²	37.3	33%	0.33	21%	0.208	S	C	.	.	H	α-helix	trans	-58.7	-41.7	-177.8	-178.8	64.9	0	0	0	113.6	I487 F493 A494 I495	I487-L491 HydrophobicContact CG2-CB 4.47Å; I487-L491 HydrophobicContact CG2-CD2 4.41Å; I487-L491 WeakPolarHBondContact O-CB 3.3Å; I487-L491 PolarHBondContact O-N 2.89Å; L491-F493 PolarHBondContact O-N 3.02Å; L491-A494 PolarHBondContact O-N 3.25Å; L491-I495 HydrophobicContact CD1-CD1 3.94Å; L491-I495 HydrophobicContact CD1-CG1 4.01Å; L491-I495 HydrophobicContact CD2-CD1 4.47Å; L491-I495 HydrophobicContact CG-CD1 3.8Å; L491-I495 HydrophobicContact CG-CG1 4.31Å; L491-I495 WeakPolarHBondContact O-CG1 3.43Å; L491-I495 PolarHBondContact O-N 3.01Å
492	P	91.5	Very high	89.4	Confident	59 Å²	59	39.1 Å²	39.1	38%	0.383	22%	0.219	S	C	.	.	H	α-helix	trans	-59.4	-45.8	178	-25	35.5	0	0	0	112.8	L488 I495 F496	L488-P492 WeakPolarHBondContact O-CD 3.44Å; P492-I495 PolarHBondContact O-N 2.75Å; P492-F496 WeakPolarHBondContact O-CB 3.43Å; P492-F496 PolarHBondContact O-N 3.47Å
493	F	89.6	Confident	89	Confident	31 Å²	31	41.9 Å²	41.9	14%	0.136	24%	0.237	C	C	.	.	H	α-helix	trans	-63.4	-44	175.9	-177.6	-104.3	0	0	0	111.8	F225 W490 L491 I495 F496 H497 T512 T515 A516	F225-F493 HydrophobicContact CE1-CD1 4.36Å; F225-F493 HydrophobicContact CE2-CD1 4.18Å; F225-F493 AromaticContact CE2-CE1 3.96Å; F225-F493 HydrophobicContact CE2-CE1 3.96Å; F225-F493 AromaticContact CZ-CD1 3.79Å; F225-F493 HydrophobicContact CZ-CD1 3.79Å; F225-F493 AromaticContact CZ-CE1 3.75Å; F225-F493 HydrophobicContact CZ-CE1 3.75Å; W490-F493 HydrophobicContact CE3-CD1 4.13Å; W490-F493 HydrophobicContact CZ3-CD1 4.01Å; W490-F493 HydrophobicContact CZ3-CE1 4.46Å; W490-F493 PolarHBondContact O-N 3.16Å; L491-F493 PolarHBondContact O-N 3.02Å; F493-I495 PolarHBondContact O-N 3.47Å; F493-F496 PolarHBondContact O-N 2.91Å; F493-H497 HydrophobicContact CE1-CB 4.49Å; F493-H497 VanDerWaalsContact O-CB 3.31Å; F493-H497 WeakPolarHBondContact O-CB 3.44Å; F493-H497 PolarHBondContact O-N 3.45Å; F493-T512 HydrophobicContact CE2-CG2 4.06Å; F493-T515 WeakPolarHBondContact CB-O 2.93Å; F493-A516 HydrophobicContact CD2-CB 3.67Å; F493-A516 HydrophobicContact CE2-CB 3.79Å; F493-A516 HydrophobicContact CG-CB 4.44Å
494	A	89.5	Confident	88.3	Confident	0 Å²	0	49 Å²	49	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-61.8	-42.7	179.6	0	0	0	0	0	112.6	F225 F226 F229 W490 L491 L498	F225-A494 HydrophobicContact CB-CB 3.59Å; F225-A494 HydrophobicContact CD1-CB 4.11Å; F225-A494 HydrophobicContact CD2-CB 4.36Å; F225-A494 HydrophobicContact CG-CB 3.77Å; F226-A494 HydrophobicContact CE2-CB 4.24Å; F226-A494 WeakPolarHBondContact CE2-O 3.35Å; F229-A494 HydrophobicContact CE2-CB 3.72Å; W490-A494 WeakPolarHBondContact O-CB 3.46Å; W490-A494 PolarHBondContact O-N 3.39Å; L491-A494 PolarHBondContact O-N 3.25Å; A494-L498 WeakPolarHBondContact O-CB 3.39Å; A494-L498 PolarHBondContact O-N 3.08Å
495	I	89.8	Confident	87.6	Confident	83 Å²	83	48.2 Å²	48.2	43%	0.426	27%	0.265	S	S	.	.	H	α-helix	trans	-61.8	-48.6	175.1	-68.6	168.1	0	0	0	109.8	F226 L491 P492 F493 H497 L498 V499	F226-I495 HydrophobicContact CZ-CG1 4.46Å; L491-I495 HydrophobicContact CD1-CD1 3.94Å; L491-I495 HydrophobicContact CD1-CG1 4.01Å; L491-I495 HydrophobicContact CD2-CD1 4.47Å; L491-I495 HydrophobicContact CG-CD1 3.8Å; L491-I495 HydrophobicContact CG-CG1 4.31Å; L491-I495 WeakPolarHBondContact O-CG1 3.43Å; L491-I495 PolarHBondContact O-N 3.01Å; P492-I495 PolarHBondContact O-N 2.75Å; F493-I495 PolarHBondContact O-N 3.47Å; I495-H497 PolarHBondContact O-N 2.86Å; I495-L498 PolarHBondContact O-N 2.85Å; I495-V499 HydrophobicContact CG2-CG2 4.39Å; I495-V499 WeakPolarHBondContact O-CG2 3.19Å; I495-V499 PolarHBondContact O-N 3.33Å
496	F	87.3	Confident	86.5	Confident	21 Å²	21	54.6 Å²	54.6	9%	0.092	30%	0.296	C	S	.	.	H	α-helix	trans	-60.5	-47.4	-178.6	-174.7	-86.7	0	0	0	112.3	P492 F493 L498 V499 E500 L507 I511 T512 T515	P492-F496 WeakPolarHBondContact O-CB 3.43Å; P492-F496 PolarHBondContact O-N 3.47Å; F493-F496 PolarHBondContact O-N 2.91Å; F496-L498 VanDerWaalsContact C-N 3.3Å; F496-L498 PolarHBondContact O-N 3.33Å; F496-V499 WeakPolarHBondContact O-CB 3.34Å; F496-V499 PolarHBondContact O-N 3.25Å; F496-V499 VanDerWaalsContact O-N 3.15Å; F496-E500 HydrophobicContact CD1-CG 4.31Å; F496-E500 HydrophobicContact CE1-CG 4.09Å; F496-E500 WeakPolarHBondContact CE1-OE1 3.37Å; F496-E500 PolarHBondContact O-N 3.13Å; F496-L507 HydrophobicContact CD2-CD2 3.62Å; F496-L507 HydrophobicContact CD2-CG 4.42Å; F496-L507 HydrophobicContact CE1-CB 3.98Å; F496-L507 HydrophobicContact CE1-CD2 4.17Å; F496-L507 HydrophobicContact CE1-CG 4.23Å; F496-L507 HydrophobicContact CE2-CB 4.01Å; F496-L507 HydrophobicContact CE2-CD2 2.94Å; F496-L507 HydrophobicContact CE2-CG 3.32Å; F496-L507 HydrophobicContact CG-CD2 4.49Å; F496-L507 HydrophobicContact CZ-CB 3.4Å; F496-L507 HydrophobicContact CZ-CD2 3.3Å; F496-L507 HydrophobicContact CZ-CG 3.21Å; F496-I511 HydrophobicContact CD2-CG2 3.95Å; F496-I511 HydrophobicContact CE2-CB 3.73Å; F496-I511 HydrophobicContact CE2-CG2 3.2Å; F496-I511 HydrophobicContact CZ-CB 3.82Å; F496-I511 HydrophobicContact CZ-CG2 3.81Å; F496-T512 HydrophobicContact CE1-CG2 4.36Å; F496-T512 WeakPolarHBondContact CE1-OG1 3.32Å; F496-T515 HydrophobicContact CB-CG2 4.49Å; F496-T515 HydrophobicContact CD2-CG2 4.4Å
497	H	83.9	Confident	85.6	Confident	35 Å²	35	57.3 Å²	57.3	16%	0.162	31%	0.31	C	S	.	.	H	α-helix	trans	-62.5	-36.3	177.1	-170.8	81.7	0	0	0	112.2	R217 T220 F493 I495 G501	R217-H497 PolarHBondContact O-NE2 3.14Å; T220-H497 PolarHBondContact OG1-NE2 3.04Å; F493-H497 HydrophobicContact CE1-CB 4.49Å; F493-H497 VanDerWaalsContact O-CB 3.31Å; F493-H497 WeakPolarHBondContact O-CB 3.44Å; F493-H497 PolarHBondContact O-N 3.45Å; I495-H497 PolarHBondContact O-N 2.86Å; H497-G501 PolarHBondContact O-N 3.29Å
498	L	87	Confident	85	Confident	34 Å²	34	58 Å²	58	18%	0.178	32%	0.319	C	S	.	.	H	α-helix	trans	-68.2	-42	173.5	-175.7	66.7	0	0	0	111.7	F218 I222 F226 A494 I495 F496 G501 V502	F218-L498 HydrophobicContact CD2-CD1 3.69Å; F218-L498 HydrophobicContact CE2-CD1 3.8Å; I222-L498 HydrophobicContact CD1-CD1 3.78Å; I222-L498 HydrophobicContact CD1-CD2 4.37Å; I222-L498 HydrophobicContact CG1-CD1 4.1Å; F226-L498 HydrophobicContact CD2-CD2 4.22Å; F226-L498 HydrophobicContact CE1-CD2 4.05Å; F226-L498 HydrophobicContact CE2-CB 3.74Å; F226-L498 HydrophobicContact CE2-CD2 3.53Å; F226-L498 HydrophobicContact CE2-CG 4.14Å; F226-L498 HydrophobicContact CZ-CB 4.16Å; F226-L498 HydrophobicContact CZ-CD2 3.42Å; F226-L498 VanDerWaalsContact CZ-CD2 3.42Å; F226-L498 HydrophobicContact CZ-CG 4.4Å; A494-L498 WeakPolarHBondContact O-CB 3.39Å; A494-L498 PolarHBondContact O-N 3.08Å; I495-L498 PolarHBondContact O-N 2.85Å; F496-L498 VanDerWaalsContact C-N 3.3Å; F496-L498 PolarHBondContact O-N 3.33Å; L498-G501 PolarHBondContact O-N 3.26Å; L498-G501 VanDerWaalsContact O-N 3.16Å; L498-V502 HydrophobicContact CG-CG2 4.46Å; L498-V502 WeakPolarHBondContact O-CG2 3.45Å; L498-V502 PolarHBondContact O-N 2.64Å
499	V	87.3	Confident	84.1	Confident	70 Å²	70	57.5 Å²	57.5	42%	0.424	31%	0.313	S	S	.	.	H	α-helix	trans	-59.2	-48.6	176.6	169.8	0	0	0	0	110.2	I495 F496 G501 V502 C503	I495-V499 HydrophobicContact CG2-CG2 4.39Å; I495-V499 WeakPolarHBondContact O-CG2 3.19Å; I495-V499 PolarHBondContact O-N 3.33Å; F496-V499 WeakPolarHBondContact O-CB 3.34Å; F496-V499 PolarHBondContact O-N 3.25Å; F496-V499 VanDerWaalsContact O-N 3.15Å; V499-G501 PolarHBondContact O-N 2.97Å; V499-V502 PolarHBondContact O-N 3.37Å; V499-C503 PolarHBondContact O-N 3.4Å; V499-C503 PolarHBondContact O-SG 2.69Å
500	E	82.6	Confident	83.3	Confident	17 Å²	17	62.9 Å²	62.9	8%	0.079	33%	0.331	C	S	.	.	H	α-helix	trans	-55.5	-36	175.8	-73.3	-168.9	151.7	0	0	113.1	F496 C503 E504 L507	F496-E500 HydrophobicContact CD1-CG 4.31Å; F496-E500 HydrophobicContact CE1-CG 4.09Å; F496-E500 WeakPolarHBondContact CE1-OE1 3.37Å; F496-E500 PolarHBondContact O-N 3.13Å; E500-C503 VanDerWaalsContact CA-SG 3.58Å; E500-E504 PolarHBondContact O-N 3.37Å; E500-L507 HydrophobicContact CG-CB 4.01Å; E500-L507 VanDerWaalsContact OE1-CB 3.32Å; E500-L507 WeakPolarHBondContact OE1-CB 3.22Å; E500-L507 PolarHBondContact OE1-N 3.02Å
501	G	82.8	Confident	82.9	Confident	6 Å²	6	65.5 Å²	65.5	6%	0.062	35%	0.346	C	S	.	.	H	α-helix	trans	-70.8	-33.7	174.4	0	0	0	0	0	113.9	H497 L498 V499	H497-G501 PolarHBondContact O-N 3.29Å; L498-G501 PolarHBondContact O-N 3.26Å; L498-G501 VanDerWaalsContact O-N 3.16Å; V499-G501 PolarHBondContact O-N 2.97Å
502	V	86.2	Confident	82.4	Confident	101 Å²	101	64.2 Å²	64.2	61%	0.612	34%	0.341	S	S	*	.	H	α-helix	trans	-84	-41.2	-177.8	173.1	0	0	0	0	112.5	F218 L498 V499 E504	F218-V502 HydrophobicContact CD2-CG2 3.88Å; F218-V502 HydrophobicContact CE2-CG2 3.94Å; L498-V502 HydrophobicContact CG-CG2 4.46Å; L498-V502 WeakPolarHBondContact O-CG2 3.45Å; L498-V502 PolarHBondContact O-N 2.64Å; V499-V502 PolarHBondContact O-N 3.37Å; V502-E504 VanDerWaalsContact C-N 3.31Å
503	C	84.9	Confident	81.8	Confident	58 Å²	58	62.9 Å²	62.9	39%	0.392	33%	0.33	S	S	.	.	H	α-helix	trans	-81.6	-9.9	-179.2	61.4	0	0	0	0	113.4	V499 E500 C505	V499-C503 PolarHBondContact O-N 3.4Å; V499-C503 PolarHBondContact O-SG 2.69Å; E500-C503 VanDerWaalsContact CA-SG 3.58Å; C503-C505 HydrophobicContact CB-CB 3.89Å; C503-C505 WeakPolarHBondContact CB-SG 3.35Å; C503-C505 PolarHBondContact O-N 2.9Å; C503-C505 WeakPolarHBondContact SG-CB 3.4Å; C503-C505 PolarHBondContact SG-N 3.37Å; C503-C505 CovalentContact SG-SG 2.03Å; C503-C505 PolarHBondContact SG-SG 3.04Å
504	E	76.6	Confident	81.5	Confident	155 Å²	155	64.6 Å²	64.6	72%	0.724	35%	0.349	S	S	*	.			trans	51.3	25.2	-166.6	-49.3	-163.6	160.5	0	0	113.6	A214 E500 V502	A214-E504 HydrophobicContact CB-CB 4.44Å; A214-E504 HydrophobicContact CB-CG 3.69Å; E500-E504 PolarHBondContact O-N 3.37Å; V502-E504 VanDerWaalsContact C-N 3.31Å
505	C	77.1	Confident	81.4	Confident	49 Å²	49	65.6 Å²	65.6	33%	0.331	36%	0.356	S	S	.	.			trans	-97.1	149	-174.2	66.2	0	0	0	0	111.4	C503	C503-C505 HydrophobicContact CB-CB 3.89Å; C503-C505 WeakPolarHBondContact CB-SG 3.35Å; C503-C505 PolarHBondContact O-N 2.9Å; C503-C505 WeakPolarHBondContact SG-CB 3.4Å; C503-C505 PolarHBondContact SG-N 3.37Å; C503-C505 CovalentContact SG-SG 2.03Å; C503-C505 PolarHBondContact SG-SG 3.04Å
506	I	71.1	Confident	81.2	Confident	156 Å²	156	62.3 Å²	62.3	80%	0.8	34%	0.341	S	S	*	.			trans	-95.7	103.1	171.7	-58.3	174.3	0	0	0	106.1
507	L	71.6	Confident	81.2	Confident	61 Å²	61	62.9 Å²	62.9	32%	0.319	34%	0.342	S	S	.	.			trans	-84.1	156	177.7	-160.4	42.8	0	0	0	109.3	F496 E500 E509 I511	F496-L507 HydrophobicContact CD2-CD2 3.62Å; F496-L507 HydrophobicContact CD2-CG 4.42Å; F496-L507 HydrophobicContact CE1-CB 3.98Å; F496-L507 HydrophobicContact CE1-CD2 4.17Å; F496-L507 HydrophobicContact CE1-CG 4.23Å; F496-L507 HydrophobicContact CE2-CB 4.01Å; F496-L507 HydrophobicContact CE2-CD2 2.94Å; F496-L507 HydrophobicContact CE2-CG 3.32Å; F496-L507 HydrophobicContact CG-CD2 4.49Å; F496-L507 HydrophobicContact CZ-CB 3.4Å; F496-L507 HydrophobicContact CZ-CD2 3.3Å; F496-L507 HydrophobicContact CZ-CG 3.21Å; E500-L507 HydrophobicContact CG-CB 4.01Å; E500-L507 VanDerWaalsContact OE1-CB 3.32Å; E500-L507 WeakPolarHBondContact OE1-CB 3.22Å; E500-L507 PolarHBondContact OE1-N 3.02Å; L507-E509 PolarHBondContact O-N 3.06Å; L507-I511 HydrophobicContact CD1-CD1 4.2Å; L507-I511 HydrophobicContact CG-CD1 4.34Å
508	S	79.3	Confident	81.4	Confident	59 Å²	59	63.2 Å²	63.2	41%	0.413	35%	0.347	S	S	.	.			trans	-57.7	129.9	-170.5	-178.6	0	0	0	0	111.1	R510 I511 T512	S508-R510 PolarHBondContact O-N 3.3Å; S508-I511 WeakPolarHBondContact O-CA 3.34Å; S508-I511 WeakPolarHBondContact O-CB 3.02Å; S508-I511 PolarHBondContact O-N 3.37Å; S508-T512 PolarHBondContact O-N 2.83Å; S508-T512 VanDerWaalsContact O-N 3.09Å; S508-T512 PolarHBondContact O-OG1 3.34Å
509	E	74.4	Confident	81.5	Confident	111 Å²	111	61.6 Å²	61.6	52%	0.519	34%	0.339	S	S	.	.	H	α-helix	trans	-52.4	-32.6	177.5	-175.7	-176.7	179.6	0	0	112.3	R119 L507 I511 T512 M513	R119-E509 IonicContact CZ-OE1 2.65Å; R119-E509 IonicContact NE-OE1 3.49Å; R119-E509 IonicContact NH2-OE1 4Å; R119-E509 PolarHBondContact NH2-OE1 2.81Å; L507-E509 PolarHBondContact O-N 3.06Å; E509-I511 VanDerWaalsContact C-N 3.3Å; E509-I511 PolarHBondContact O-N 2.89Å; E509-T512 WeakPolarHBondContact O-CB 3.37Å; E509-T512 PolarHBondContact O-N 3.44Å; E509-M513 WeakPolarHBondContact O-CB 3.33Å; E509-M513 WeakPolarHBondContact O-CG 3.37Å; E509-M513 PolarHBondContact O-N 2.91Å
510	R	75.8	Confident	81.6	Confident	132 Å²	132	59 Å²	59	50%	0.498	32%	0.322	S	S	.	.	H	α-helix	trans	-61.2	-40.1	175.5	-65.8	179	-177.7	-80.4	-29.2	112	R55 S508 A514	R55-R510 VanDerWaalsContact CZ-CZ 3.42Å; S508-R510 PolarHBondContact O-N 3.3Å; R510-A514 VanDerWaalsContact O-CB 3.25Å; R510-A514 WeakPolarHBondContact O-CB 3.34Å; R510-A514 PolarHBondContact O-N 2.99Å
511	I	81.6	Confident	81.9	Confident	75 Å²	75	61.2 Å²	61.2	39%	0.385	33%	0.334	S	S	.	.	H	α-helix	trans	-75.4	-38.9	179.2	-51.5	169.6	0	0	0	109.8	F496 L507 S508 E509 M513 A514 T515	F496-I511 HydrophobicContact CD2-CG2 3.95Å; F496-I511 HydrophobicContact CE2-CB 3.73Å; F496-I511 HydrophobicContact CE2-CG2 3.2Å; F496-I511 HydrophobicContact CZ-CB 3.82Å; F496-I511 HydrophobicContact CZ-CG2 3.81Å; L507-I511 HydrophobicContact CD1-CD1 4.2Å; L507-I511 HydrophobicContact CG-CD1 4.34Å; S508-I511 WeakPolarHBondContact O-CA 3.34Å; S508-I511 WeakPolarHBondContact O-CB 3.02Å; S508-I511 PolarHBondContact O-N 3.37Å; E509-I511 VanDerWaalsContact C-N 3.3Å; E509-I511 PolarHBondContact O-N 2.89Å; I511-M513 VanDerWaalsContact C-N 3.3Å; I511-M513 PolarHBondContact O-N 3.48Å; I511-A514 PolarHBondContact O-N 2.91Å; I511-T515 HydrophobicContact CG2-CG2 4.25Å; I511-T515 WeakPolarHBondContact O-CB 3.34Å; I511-T515 WeakPolarHBondContact O-CG2 3.5Å; I511-T515 PolarHBondContact O-N 2.03Å; I511-T515 PolarHBondContact O-OG1 3.28Å
512	T	80.2	Confident	82.3	Confident	36 Å²	36	61 Å²	61	22%	0.221	33%	0.331	C	S	.	.	H	α-helix	trans	-56.7	-46.8	172.1	-44.4	0	0	0	0	110.7	F493 F496 S508 E509 T515 A516	F493-T512 HydrophobicContact CE2-CG2 4.06Å; F496-T512 HydrophobicContact CE1-CG2 4.36Å; F496-T512 WeakPolarHBondContact CE1-OG1 3.32Å; S508-T512 PolarHBondContact O-N 2.83Å; S508-T512 VanDerWaalsContact O-N 3.09Å; S508-T512 PolarHBondContact O-OG1 3.34Å; E509-T512 WeakPolarHBondContact O-CB 3.37Å; E509-T512 PolarHBondContact O-N 3.44Å; T512-T515 PolarHBondContact O-N 3.07Å; T512-T515 PolarHBondContact O-OG1 2.91Å; T512-T515 VanDerWaalsContact O-OG1 3.04Å; T512-A516 WeakPolarHBondContact O-CB 3.49Å; T512-A516 PolarHBondContact O-N 2.96Å
513	M	79.9	Confident	82.6	Confident	31 Å²	31	56.5 Å²	56.5	15%	0.153	30%	0.304	C	S	.	.	H	α-helix	trans	-63.7	-47.8	175.4	-73.5	-64.8	174.6	0	0	112.1	E509 I511 T515 A516 W517	E509-M513 WeakPolarHBondContact O-CB 3.33Å; E509-M513 WeakPolarHBondContact O-CG 3.37Å; E509-M513 PolarHBondContact O-N 2.91Å; I511-M513 VanDerWaalsContact C-N 3.3Å; I511-M513 PolarHBondContact O-N 3.48Å; M513-T515 PolarHBondContact O-N 3.16Å; M513-A516 PolarHBondContact O-N 2.92Å; M513-W517 PolarHBondContact O-N 2.86Å
514	A	83	Confident	83	Confident	66 Å²	66	55.6 Å²	55.6	55%	0.545	30%	0.295	S	S	.	.	H	α-helix	trans	-61.8	-31.8	-179.1	0	0	0	0	0	113	R510 I511 P518	R510-A514 VanDerWaalsContact O-CB 3.25Å; R510-A514 WeakPolarHBondContact O-CB 3.34Å; R510-A514 PolarHBondContact O-N 2.99Å; I511-A514 PolarHBondContact O-N 2.91Å; A514-P518 WeakPolarHBondContact O-CD 3.46Å; A514-P518 WeakPolarHBondContact O-CG 3.19Å
515	T	86.3	Confident	83.8	Confident	22 Å²	22	49.9 Å²	49.9	14%	0.135	27%	0.271	C	S	.	.	H	α-helix	trans	-83.7	-31.8	175.8	54	0	0	0	0	112.6	F493 F496 I511 T512 M513 P518	F493-T515 WeakPolarHBondContact CB-O 2.93Å; F496-T515 HydrophobicContact CB-CG2 4.49Å; F496-T515 HydrophobicContact CD2-CG2 4.4Å; I511-T515 HydrophobicContact CG2-CG2 4.25Å; I511-T515 WeakPolarHBondContact O-CB 3.34Å; I511-T515 WeakPolarHBondContact O-CG2 3.5Å; I511-T515 PolarHBondContact O-N 2.03Å; I511-T515 PolarHBondContact O-OG1 3.28Å; T512-T515 PolarHBondContact O-N 3.07Å; T512-T515 PolarHBondContact O-OG1 2.91Å; T512-T515 VanDerWaalsContact O-OG1 3.04Å; M513-T515 PolarHBondContact O-N 3.16Å; T515-P518 WeakPolarHBondContact O-CD 3.36Å
516	A	86.4	Confident	84.6	Confident	13 Å²	13	47.6 Å²	47.6	11%	0.107	26%	0.256	C	S	.	.	H	α-helix	trans	-73.8	-40.5	179	0	0	0	0	0	113.6	F493 T512 M513 G519	F493-A516 HydrophobicContact CD2-CB 3.67Å; F493-A516 HydrophobicContact CE2-CB 3.79Å; F493-A516 HydrophobicContact CG-CB 4.44Å; T512-A516 WeakPolarHBondContact O-CB 3.49Å; T512-A516 PolarHBondContact O-N 2.96Å; M513-A516 PolarHBondContact O-N 2.92Å; A516-G519 WeakPolarHBondContact O-CA 3.17Å; A516-G519 PolarHBondContact O-N 2.97Å
517	W	86.9	Confident	85.7	Confident	33 Å²	33	40.6 Å²	40.6	13%	0.125	22%	0.221	C	C	.	.	H	α-helix	trans	-57.9	-40.9	-176.7	-86.1	108.8	0	0	0	115	Q66 L113 S116 I117 M513 G519 Y520 L521	Q66-W517 HydrophobicContact CB-CH2 3.78Å; Q66-W517 HydrophobicContact CB-CZ2 4.32Å; Q66-W517 HydrophobicContact CB-CZ3 3.93Å; Q66-W517 VanDerWaalsContact CD-CH2 3.44Å; Q66-W517 HydrophobicContact CG-CD2 3.89Å; Q66-W517 HydrophobicContact CG-CE3 3.76Å; Q66-W517 HydrophobicContact CG-CH2 3.46Å; Q66-W517 VanDerWaalsContact CG-CH2 3.46Å; Q66-W517 HydrophobicContact CG-CZ2 3.58Å; Q66-W517 HydrophobicContact CG-CZ3 3.56Å; L113-W517 HydrophobicContact CD2-CH2 4.12Å; L113-W517 HydrophobicContact CD2-CZ3 3.92Å; S116-W517 VanDerWaalsContact OG-CZ2 3.31Å; S116-W517 WeakPolarHBondContact OG-CZ2 3.4Å; I117-W517 HydrophobicContact CG1-CH2 4.31Å; M513-W517 PolarHBondContact O-N 2.86Å; W517-G519 PolarHBondContact O-N 3.22Å; W517-Y520 AromaticContact CD2-CD2 3.92Å; W517-Y520 HydrophobicContact CD2-CD2 3.92Å; W517-Y520 HydrophobicContact CD2-CE2 4.45Å; W517-Y520 AromaticContact CE3-CD2 3.5Å; W517-Y520 HydrophobicContact CE3-CD2 3.5Å; W517-Y520 VanDerWaalsContact CE3-CD2 3.5Å; W517-Y520 HydrophobicContact CE3-CE2 4.35Å; W517-Y520 HydrophobicContact CE3-CG 4.29Å; W517-Y520 HydrophobicContact CH2-CD2 4.38Å; W517-Y520 AromaticContact CZ3-CD2 3.76Å; W517-Y520 HydrophobicContact CZ3-CD2 3.76Å; W517-Y520 HydrophobicContact CZ3-CE2 4.47Å; W517-Y520 HydrophobicContact CZ3-CG 4.41Å; W517-Y520 WeakPolarHBondContact O-CB 3.45Å; W517-Y520 PolarHBondContact O-N 3.3Å; W517-L521 PolarHBondContact O-N 3.1Å
518	P	89.1	Confident	86.8	Confident	42 Å²	42	41.9 Å²	41.9	27%	0.273	22%	0.224	S	C	.	.	H	α-helix	trans	-53.5	-31.8	169.4	-29.4	35.9	0	0	0	113.9	C489 A514 T515 Y520 L521 N522	C489-P518 WeakPolarHBondContact CB-O 3.29Å; C489-P518 CarbonylContact O-C 3.58Å; C489-P518 PolarHBondContact SG-O 3.28Å; C489-P518 VanDerWaalsContact SG-O 3.39Å; A514-P518 WeakPolarHBondContact O-CD 3.46Å; A514-P518 WeakPolarHBondContact O-CG 3.19Å; T515-P518 WeakPolarHBondContact O-CD 3.36Å; P518-Y520 VanDerWaalsContact C-N 3.34Å; P518-Y520 PolarHBondContact O-N 3.19Å; P518-L521 WeakPolarHBondContact O-CB 3.39Å; P518-L521 PolarHBondContact O-N 2.8Å; P518-N522 PolarHBondContact O-N 2.81Å
519	G	88.3	Confident	87.6	Confident	0 Å²	0	40 Å²	40	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-61.6	-38.6	173.6	0	0	0	0	0	112.9	C489 W490 A516 W517 N522	C489-G519 PolarHBondContact O-N 3.32Å; W490-G519 PolarHBondContact NE1-O 3.38Å; W490-G519 VanDerWaalsContact NE1-O 3.09Å; A516-G519 WeakPolarHBondContact O-CA 3.17Å; A516-G519 PolarHBondContact O-N 2.97Å; W517-G519 PolarHBondContact O-N 3.22Å; G519-N522 WeakPolarHBondContact O-CB 3.4Å; G519-N522 PolarHBondContact O-N 3.36Å
520	Y	89.1	Confident	88.5	Confident	16 Å²	16	35 Å²	35	6%	0.063	19%	0.186	C	C	.	.	H	α-helix	trans	-70.6	-30.2	174.9	-61.7	-54.7	0	0	0	112.7	I73 V108 V112 L113 N140 W517 P518 N522 S523	I73-Y520 WeakPolarHBondContact CD1-O 3.48Å; V108-Y520 HydrophobicContact CG1-CD1 3.99Å; V108-Y520 HydrophobicContact CG1-CE1 4.16Å; V112-Y520 HydrophobicContact CG1-CE1 4.28Å; L113-Y520 HydrophobicContact CD2-CD1 3.71Å; L113-Y520 HydrophobicContact CD2-CD2 3.88Å; L113-Y520 HydrophobicContact CD2-CE1 4.02Å; L113-Y520 HydrophobicContact CD2-CE2 4.2Å; L113-Y520 HydrophobicContact CD2-CG 3.65Å; N140-Y520 PolarHBondContact ND2-OH 3.19Å; N140-Y520 PolarHBondContact OD1-OH 2.65Å; N140-Y520 VanDerWaalsContact OD1-OH 3.11Å; W517-Y520 AromaticContact CD2-CD2 3.92Å; W517-Y520 HydrophobicContact CD2-CD2 3.92Å; W517-Y520 HydrophobicContact CD2-CE2 4.45Å; W517-Y520 AromaticContact CE3-CD2 3.5Å; W517-Y520 HydrophobicContact CE3-CD2 3.5Å; W517-Y520 VanDerWaalsContact CE3-CD2 3.5Å; W517-Y520 HydrophobicContact CE3-CE2 4.35Å; W517-Y520 HydrophobicContact CE3-CG 4.29Å; W517-Y520 HydrophobicContact CH2-CD2 4.38Å; W517-Y520 AromaticContact CZ3-CD2 3.76Å; W517-Y520 HydrophobicContact CZ3-CD2 3.76Å; W517-Y520 HydrophobicContact CZ3-CE2 4.47Å; W517-Y520 HydrophobicContact CZ3-CG 4.41Å; W517-Y520 WeakPolarHBondContact O-CB 3.45Å; W517-Y520 PolarHBondContact O-N 3.3Å; P518-Y520 VanDerWaalsContact C-N 3.34Å; P518-Y520 PolarHBondContact O-N 3.19Å; Y520-N522 PolarHBondContact O-N 3.49Å; Y520-S523 WeakPolarHBondContact O-CB 3.37Å; Y520-S523 PolarHBondContact O-N 3.46Å; Y520-S523 VanDerWaalsContact O-N 3.15Å
521	L	88.7	Confident	89.2	Confident	64 Å²	64	30.1 Å²	30.1	34%	0.335	17%	0.173	S	C	.	.	H	α-helix	trans	-62.7	-23.3	173.3	-60.9	178.4	0	0	0	112.5	W517 P518 S523 M524 C525	W517-L521 PolarHBondContact O-N 3.1Å; P518-L521 WeakPolarHBondContact O-CB 3.39Å; P518-L521 PolarHBondContact O-N 2.8Å; L521-S523 VanDerWaalsContact C-N 3.29Å; L521-S523 PolarHBondContact O-N 3.42Å; L521-M524 HydrophobicContact CD2-CE 3.96Å; L521-M524 HydrophobicContact CD2-SD 4.39Å; L521-M524 VanDerWaalsContact O-CB 3.29Å; L521-M524 WeakPolarHBondContact O-CB 3.27Å; L521-M524 PolarHBondContact O-N 2.97Å; L521-C525 PolarHBondContact O-N 3.49Å; L521-C525 PolarHBondContact O-SG 3.16Å; L521-C525 VanDerWaalsContact O-SG 3.36Å
522	N	91.3	Very high	89.8	Confident	0 Å²	0	34.7 Å²	34.7	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-55.9	-44.8	172.7	177.7	66.2	0	0	0	112	F486 C489 P518 G519 Y520 M524 C525 N526	F486-N522 WeakPolarHBondContact CA-OD1 3.18Å; F486-N522 WeakPolarHBondContact CB-OD1 3.1Å; F486-N522 PolarHBondContact N-OD1 2.86Å; C489-N522 HydrophobicContact CB-CB 3.88Å; P518-N522 PolarHBondContact O-N 2.81Å; G519-N522 WeakPolarHBondContact O-CB 3.4Å; G519-N522 PolarHBondContact O-N 3.36Å; Y520-N522 PolarHBondContact O-N 3.49Å; N522-M524 PolarHBondContact O-N 3.46Å; N522-C525 PolarHBondContact O-N 3.39Å; N522-N526 PolarHBondContact O-N 3.44Å
523	S	92.5	Very high	90.3	Very high	7 Å²	7	36 Å²	36	5%	0.049	20%	0.201	C	C	.	.	H	α-helix	trans	-65	-25.2	178.6	-59.2	0	0	0	0	112.2	N77 D105 Y520 L521	N77-S523 PolarHBondContact ND2-O 2.95Å; D105-S523 VanDerWaalsContact OD1-CB 3.23Å; D105-S523 WeakPolarHBondContact OD1-CB 3.29Å; D105-S523 PolarHBondContact OD1-OG 3.06Å; Y520-S523 WeakPolarHBondContact O-CB 3.37Å; Y520-S523 PolarHBondContact O-N 3.46Å; Y520-S523 VanDerWaalsContact O-N 3.15Å; L521-S523 VanDerWaalsContact C-N 3.29Å; L521-S523 PolarHBondContact O-N 3.42Å
524	M	93.7	Very high	90.8	Very high	39 Å²	39	35.7 Å²	35.7	19%	0.192	20%	0.2	C	C	.	.	H	α-helix	trans	-77.5	-41.2	175.6	-170.9	-174.7	68.1	0	0	111.5	F72 I73 L521 N522 N526 P527 F528	F72-M524 HydrophobicContact CB-CG 3.86Å; F72-M524 HydrophobicContact CB-SD 4.08Å; I73-M524 HydrophobicContact CD1-CB 4.32Å; I73-M524 HydrophobicContact CG1-CB 3.63Å; I73-M524 HydrophobicContact CG1-CG 4.29Å; L521-M524 HydrophobicContact CD2-CE 3.96Å; L521-M524 HydrophobicContact CD2-SD 4.39Å; L521-M524 VanDerWaalsContact O-CB 3.29Å; L521-M524 WeakPolarHBondContact O-CB 3.27Å; L521-M524 PolarHBondContact O-N 2.97Å; N522-M524 PolarHBondContact O-N 3.46Å; M524-N526 VanDerWaalsContact C-N 3.29Å; M524-N526 PolarHBondContact O-N 2.87Å; M524-P527 WeakPolarHBondContact O-CD 3.3Å; M524-F528 HydrophobicContact CG-CE2 4.02Å; M524-F528 VanDerWaalsContact O-CD2 3.27Å; M524-F528 WeakPolarHBondContact O-CD2 3.42Å
525	C	94.3	Very high	91.2	Very high	35 Å²	35	40.9 Å²	40.9	24%	0.236	21%	0.21	C	C	.	.	H	α-helix	trans	-64.4	-30.1	-176.6	-71.2	0	0	0	0	113.5	C485 L521 N522 F528 I529	C485-C525 WeakPolarHBondContact SG-CB 3.44Å; L521-C525 PolarHBondContact O-N 3.49Å; L521-C525 PolarHBondContact O-SG 3.16Å; L521-C525 VanDerWaalsContact O-SG 3.36Å; N522-C525 PolarHBondContact O-N 3.39Å; C525-F528 PolarHBondContact O-N 2.86Å; C525-I529 HydrophobicContact CB-CD1 4.29Å; C525-I529 WeakPolarHBondContact O-CG1 3.31Å; C525-I529 PolarHBondContact O-N 3.21Å
526	N	92.9	Very high	91.4	Very high	1 Å²	1	44.1 Å²	44.1	1%	0.005	22%	0.224	C	C	.	.	H	α-helix	trans	-53.8	-59.2	-175.4	-74.7	-18.5	0	0	0	113.1	D105 V482 N522 M524 F528 I529 Y530	D105-N526 PolarHBondContact OD2-ND2 3.29Å; V482-N526 WeakPolarHBondContact CG1-OD1 3.2Å; N522-N526 PolarHBondContact O-N 3.44Å; M524-N526 VanDerWaalsContact C-N 3.29Å; M524-N526 PolarHBondContact O-N 2.87Å; N526-F528 VanDerWaalsContact C-N 3.3Å; N526-F528 PolarHBondContact O-N 3.07Å; N526-I529 PolarHBondContact O-N 2.96Å; N526-I529 VanDerWaalsContact O-N 3.17Å; N526-Y530 HydrophobicContact CB-CE2 4.22Å; N526-Y530 WeakPolarHBondContact O-CD2 3.08Å; N526-Y530 PolarHBondContact O-N 3.5Å; N526-Y530 VanDerWaalsContact O-N 3.09Å
527	P	94.6	Very high	91.8	Very high	9 Å²	9	43.7 Å²	43.7	6%	0.058	22%	0.22	C	C	.	.	H	α-helix	trans	-52.2	-41.9	174.4	-29.1	33.2	0	0	0	114.7	G76 V80 M524 Y530 A531	G76-P527 WeakPolarHBondContact O-CG 3.25Å; V80-P527 HydrophobicContact CG2-CB 4.14Å; V80-P527 HydrophobicContact CG2-CG 4.09Å; M524-P527 WeakPolarHBondContact O-CD 3.3Å; P527-Y530 PolarHBondContact O-N 2.97Å; P527-A531 WeakPolarHBondContact O-CB 3.5Å; P527-A531 PolarHBondContact O-N 2.89Å
528	F	94.7	Very high	92.1	Very high	89 Å²	89	43.2 Å²	43.2	39%	0.39	22%	0.223	S	C	.	.	H	α-helix	trans	-64.2	-44.4	178.3	-71.2	-71.8	0	0	0	111.6	F72 M524 C525 N526 Y530 A531 F532	F72-F528 HydrophobicContact CD1-CZ 4.11Å; F72-F528 HydrophobicContact CE1-CZ 4.36Å; M524-F528 HydrophobicContact CG-CE2 4.02Å; M524-F528 VanDerWaalsContact O-CD2 3.27Å; M524-F528 WeakPolarHBondContact O-CD2 3.42Å; C525-F528 PolarHBondContact O-N 2.86Å; N526-F528 VanDerWaalsContact C-N 3.3Å; N526-F528 PolarHBondContact O-N 3.07Å; F528-Y530 VanDerWaalsContact C-N 3.29Å; F528-Y530 PolarHBondContact O-N 3.15Å; F528-A531 PolarHBondContact O-N 3.46Å; F528-F532 HydrophobicContact CB-CD2 4.34Å; F528-F532 HydrophobicContact CB-CE2 4.34Å; F528-F532 AromaticContact CD1-CE2 3.94Å; F528-F532 HydrophobicContact CD1-CE2 3.94Å; F528-F532 WeakPolarHBondContact O-CD2 3.35Å; F528-F532 PolarHBondContact O-N 3.43Å
529	I	95	Very high	92.3	Very high	20 Å²	20	44.6 Å²	44.6	10%	0.103	23%	0.233	C	C	.	.	H	α-helix	trans	-58.8	-43.6	176.7	-66.7	165.5	0	0	0	110.1	T478 T481 V482 C485 C525 N526 F532 C533	T478-I529 HydrophobicContact CG2-CG2 3.92Å; T481-I529 HydrophobicContact CG2-CD1 4.15Å; T481-I529 HydrophobicContact CG2-CG1 4.21Å; T481-I529 HydrophobicContact CG2-CG2 4.18Å; V482-I529 HydrophobicContact CG2-CB 4.28Å; V482-I529 HydrophobicContact CG2-CD1 4.03Å; V482-I529 HydrophobicContact CG2-CG2 3.75Å; C485-I529 HydrophobicContact CB-CD1 4.2Å; C525-I529 HydrophobicContact CB-CD1 4.29Å; C525-I529 WeakPolarHBondContact O-CG1 3.31Å; C525-I529 PolarHBondContact O-N 3.21Å; N526-I529 PolarHBondContact O-N 2.96Å; N526-I529 VanDerWaalsContact O-N 3.17Å; I529-F532 PolarHBondContact O-N 3.33Å; I529-C533 HydrophobicContact CG2-CB 4.37Å; I529-C533 WeakPolarHBondContact O-CA 3.48Å; I529-C533 WeakPolarHBondContact O-CB 3.38Å; I529-C533 PolarHBondContact O-N 3.47Å
530	Y	93.5	Very high	92.6	Very high	6 Å²	6	44.6 Å²	44.6	2%	0.024	23%	0.233	C	C	.	.	H	α-helix	trans	-65.8	-42.5	176.6	-59.9	-53.7	0	0	0	112.5	V80 I98 T478 V482 N526 P527 F528 F532 T534	V80-Y530 HydrophobicContact CG1-CD2 4.48Å; V80-Y530 HydrophobicContact CG2-CD2 3.91Å; I98-Y530 HydrophobicContact CD1-CE1 3.84Å; I98-Y530 HydrophobicContact CG1-CE1 4.28Å; I98-Y530 HydrophobicContact CG2-CD2 4.4Å; I98-Y530 HydrophobicContact CG2-CE1 4.15Å; I98-Y530 HydrophobicContact CG2-CE2 3.71Å; T478-Y530 HydrophobicContact CG2-CD1 4.11Å; T478-Y530 HydrophobicContact CG2-CE1 4.28Å; V482-Y530 HydrophobicContact CG2-CE1 4.34Å; N526-Y530 HydrophobicContact CB-CE2 4.22Å; N526-Y530 WeakPolarHBondContact O-CD2 3.08Å; N526-Y530 PolarHBondContact O-N 3.5Å; N526-Y530 VanDerWaalsContact O-N 3.09Å; P527-Y530 PolarHBondContact O-N 2.97Å; F528-Y530 VanDerWaalsContact C-N 3.29Å; F528-Y530 PolarHBondContact O-N 3.15Å; Y530-F532 VanDerWaalsContact C-N 3.31Å; Y530-F532 PolarHBondContact O-N 3.27Å; Y530-T534 PolarHBondContact O-N 3.45Å; Y530-T534 VanDerWaalsContact O-N 3.15Å; Y530-T534 PolarHBondContact O-OG1 3.15Å
531	A	92.3	Very high	92.9	Very high	28 Å²	28	44.5 Å²	44.5	23%	0.231	23%	0.233	C	C	.	.	H	α-helix	trans	-60.1	-38.4	178.7	0	0	0	0	0	112.9	P527 F528 A538 F541	P527-A531 WeakPolarHBondContact O-CB 3.5Å; P527-A531 PolarHBondContact O-N 2.89Å; F528-A531 PolarHBondContact O-N 3.46Å; A531-A538 VanDerWaalsContact O-CB 3.23Å; A531-A538 WeakPolarHBondContact O-CB 3.49Å; A531-F541 HydrophobicContact CB-CD2 3.78Å; A531-F541 HydrophobicContact CB-CE2 3.89Å
532	F	92.8	Very high	93.1	Very high	172 Å²	172	47.6 Å²	47.6	75%	0.754	24%	0.244	S	C	*	.	H	α-helix	trans	-96.2	-33	-175.8	-65.4	-63.9	0	0	0	114.1	F528 I529 Y530	F528-F532 HydrophobicContact CB-CD2 4.34Å; F528-F532 HydrophobicContact CB-CE2 4.34Å; F528-F532 AromaticContact CD1-CE2 3.94Å; F528-F532 HydrophobicContact CD1-CE2 3.94Å; F528-F532 WeakPolarHBondContact O-CD2 3.35Å; F528-F532 PolarHBondContact O-N 3.43Å; I529-F532 PolarHBondContact O-N 3.33Å; Y530-F532 VanDerWaalsContact C-N 3.31Å; Y530-F532 PolarHBondContact O-N 3.27Å
533	C	91.3	Very high	93.2	Very high	64 Å²	64	53.6 Å²	53.6	43%	0.432	27%	0.267	S	S	.	.	H	α-helix	trans	-93.9	-15.6	-174.9	-61.4	0	0	0	0	113.8	T478 I529	T478-C533 HydrophobicContact CG2-CB 3.91Å; I529-C533 HydrophobicContact CG2-CB 4.37Å; I529-C533 WeakPolarHBondContact O-CA 3.48Å; I529-C533 WeakPolarHBondContact O-CB 3.38Å; I529-C533 PolarHBondContact O-N 3.47Å
534	T	90.3	Very high	93.2	Very high	23 Å²	23	55.7 Å²	55.7	14%	0.141	28%	0.277	C	S	.	.			trans	-128.1	114.4	-177.7	57.9	0	0	0	0	112.8	T478 Y530 E536 Y537 A538	T478-T534 HydrophobicContact CG2-CG2 3.73Å; T478-T534 WeakPolarHBondContact OG1-CG2 3.16Å; Y530-T534 PolarHBondContact O-N 3.45Å; Y530-T534 VanDerWaalsContact O-N 3.15Å; Y530-T534 PolarHBondContact O-OG1 3.15Å; T534-E536 VanDerWaalsContact C-N 3.27Å; T534-E536 PolarHBondContact O-N 2.62Å; T534-Y537 PolarHBondContact O-N 3.44Å; T534-Y537 WeakPolarHBondContact OG1-CB 3.43Å; T534-Y537 WeakPolarHBondContact OG1-CD2 3.49Å; T534-A538 PolarHBondContact O-N 3.42Å
535	K	91.1	Very high	93.1	Very high	175 Å²	175	58.4 Å²	58.4	76%	0.761	29%	0.292	S	S	*	.	H	α-helix	trans	-61.4	-35.5	-175.7	-66.9	-170.6	177.1	-169.4	0	112.6	A538 S539	K535-A538 PolarHBondContact O-N 3.22Å; K535-S539 WeakPolarHBondContact O-CB 3.41Å; K535-S539 PolarHBondContact O-N 3.36Å; K535-S539 PolarHBondContact O-OG 3.31Å
536	E	91.7	Very high	92.9	Very high	90 Å²	90	63.3 Å²	63.3	42%	0.421	31%	0.311	S	S	.	.	H	α-helix	trans	-67.3	-42.8	-179.5	-61.8	86.5	163	0	0	111.7	L90 T534 A540	L90-E536 HydrophobicContact CD2-CB 3.64Å; L90-E536 HydrophobicContact CG-CB 4.48Å; T534-E536 VanDerWaalsContact C-N 3.27Å; T534-E536 PolarHBondContact O-N 2.62Å; E536-A540 WeakPolarHBondContact O-CB 3.29Å; E536-A540 PolarHBondContact O-N 3.43Å
537	Y	93.6	Very high	92.2	Very high	4 Å²	4	68.5 Å²	68.5	2%	0.016	34%	0.338	C	S	.	.	H	α-helix	trans	-69	-43.7	173.3	-78.2	-93	0	0	0	111.4	V80 A83 V84 L90 D95 I98 T534 S539 A540 F541	V80-Y537 HydrophobicContact CG1-CE1 4.26Å; A83-Y537 HydrophobicContact CB-CD1 4.37Å; V84-Y537 HydrophobicContact CG2-CE1 3.92Å; V84-Y537 WeakPolarHBondContact CG2-OH 3.33Å; L90-Y537 HydrophobicContact CD1-CD1 4.08Å; L90-Y537 HydrophobicContact CD1-CD2 4.48Å; L90-Y537 HydrophobicContact CD1-CE1 4.19Å; L90-Y537 HydrophobicContact CD1-CG 4.23Å; L90-Y537 HydrophobicContact CD2-CD2 3.82Å; L90-Y537 HydrophobicContact CD2-CE2 3.68Å; L90-Y537 HydrophobicContact CD2-CG 4.38Å; D95-Y537 WeakPolarHBondContact OD1-CE2 3.46Å; D95-Y537 PolarHBondContact OD1-OH 2.69Å; I98-Y537 HydrophobicContact CD1-CE2 4.42Å; T534-Y537 PolarHBondContact O-N 3.44Å; T534-Y537 WeakPolarHBondContact OG1-CB 3.43Å; T534-Y537 WeakPolarHBondContact OG1-CD2 3.49Å; Y537-S539 VanDerWaalsContact C-N 3.27Å; Y537-S539 PolarHBondContact O-N 3.04Å; Y537-A540 CarbonylContact O-C 3.6Å; Y537-A540 WeakPolarHBondContact O-CB 3.32Å; Y537-A540 PolarHBondContact O-N 3Å; Y537-A540 VanDerWaalsContact O-N 3.08Å; Y537-F541 HydrophobicContact CD1-CE1 4.09Å; Y537-F541 HydrophobicContact CD1-CZ 4.19Å; Y537-F541 WeakPolarHBondContact O-CB 3.08Å; Y537-F541 WeakPolarHBondContact O-CD1 3.19Å; Y537-F541 WeakPolarHBondContact O-CG 3.47Å; Y537-F541 PolarHBondContact O-N 3.32Å
538	A	93.8	Very high	90.8	Very high	23 Å²	23	71.3 Å²	71.3	19%	0.19	37%	0.368	C	S	.	.	H	α-helix	trans	-53.9	-45.4	176.2	0	0	0	0	0	112	A531 T534 K535 F541 K542	A531-A538 VanDerWaalsContact O-CB 3.23Å; A531-A538 WeakPolarHBondContact O-CB 3.49Å; T534-A538 PolarHBondContact O-N 3.42Å; K535-A538 PolarHBondContact O-N 3.22Å; A538-F541 PolarHBondContact O-N 3.48Å; A538-K542 WeakPolarHBondContact O-CG 3.34Å; A538-K542 PolarHBondContact O-N 3.2Å
539	S	93.4	Very high	89.2	Confident	71 Å²	71	76.8 Å²	76.8	50%	0.497	39%	0.386	S	S	.	.	H	α-helix	trans	-68	-38	178.4	-54.7	0	0	0	0	112.1	K535 Y537 R543	K535-S539 WeakPolarHBondContact O-CB 3.41Å; K535-S539 PolarHBondContact O-N 3.36Å; K535-S539 PolarHBondContact O-OG 3.31Å; Y537-S539 VanDerWaalsContact C-N 3.27Å; Y537-S539 PolarHBondContact O-N 3.04Å; S539-R543 WeakPolarHBondContact O-CB 3.36Å; S539-R543 PolarHBondContact O-N 3.19Å; S539-R543 VanDerWaalsContact O-N 3.17Å
540	A	94.1	Very high	87	Confident	0 Å²	0	83.6 Å²	83.6	0%	0	42%	0.423	C	S	.	.	H	α-helix	trans	-65.8	-42.6	174.7	0	0	0	0	0	112.1	A83 T87 L90 E536 Y537 R543 L544	A83-A540 HydrophobicContact CB-CB 3.8Å; T87-A540 WeakPolarHBondContact OG1-CB 3.26Å; L90-A540 HydrophobicContact CD1-CB 3.78Å; E536-A540 WeakPolarHBondContact O-CB 3.29Å; E536-A540 PolarHBondContact O-N 3.43Å; Y537-A540 CarbonylContact O-C 3.6Å; Y537-A540 WeakPolarHBondContact O-CB 3.32Å; Y537-A540 PolarHBondContact O-N 3Å; Y537-A540 VanDerWaalsContact O-N 3.08Å; A540-R543 PolarHBondContact O-N 2.68Å; A540-L544 WeakPolarHBondContact O-CB 3.05Å; A540-L544 WeakPolarHBondContact O-CG 3.41Å; A540-L544 PolarHBondContact O-N 3.04Å
541	F	94.8	Very high	84.4	Confident	15 Å²	15	94.2 Å²	94.2	7%	0.066	48%	0.478	C	S	.	.	H	α-helix	trans	-64.4	-46.6	178.2	-70.7	0.9	0	0	0	111.6	L79 V80 A83 A531 Y537 A538 R543 L544 L545	L79-F541 HydrophobicContact CB-CE1 4.42Å; L79-F541 HydrophobicContact CD1-CD1 4.29Å; L79-F541 HydrophobicContact CD2-CB 3.99Å; L79-F541 HydrophobicContact CD2-CD1 3.73Å; L79-F541 HydrophobicContact CD2-CD2 3.75Å; L79-F541 HydrophobicContact CD2-CE1 4.07Å; L79-F541 HydrophobicContact CD2-CE2 4.1Å; L79-F541 HydrophobicContact CD2-CG 3.56Å; L79-F541 HydrophobicContact CD2-CZ 4.25Å; L79-F541 HydrophobicContact CG-CD1 3.57Å; L79-F541 HydrophobicContact CG-CD2 4.45Å; L79-F541 HydrophobicContact CG-CE1 3.71Å; L79-F541 HydrophobicContact CG-CG 3.97Å; L79-F541 HydrophobicContact CG-CZ 4.22Å; V80-F541 HydrophobicContact CG2-CZ 3.8Å; A83-F541 HydrophobicContact CB-CD1 3.83Å; A83-F541 HydrophobicContact CB-CE1 3.59Å; A531-F541 HydrophobicContact CB-CD2 3.78Å; A531-F541 HydrophobicContact CB-CE2 3.89Å; Y537-F541 HydrophobicContact CD1-CE1 4.09Å; Y537-F541 HydrophobicContact CD1-CZ 4.19Å; Y537-F541 WeakPolarHBondContact O-CB 3.08Å; Y537-F541 WeakPolarHBondContact O-CD1 3.19Å; Y537-F541 WeakPolarHBondContact O-CG 3.47Å; Y537-F541 PolarHBondContact O-N 3.32Å; A538-F541 PolarHBondContact O-N 3.48Å; F541-R543 VanDerWaalsContact C-N 3.29Å; F541-R543 PolarHBondContact O-N 2.85Å; F541-L544 PolarHBondContact O-N 2.96Å; F541-L545 WeakPolarHBondContact O-CB 3.29Å; F541-L545 WeakPolarHBondContact O-CG 3.47Å; F541-L545 PolarHBondContact O-N 3.01Å
542	K	93.5	Very high	84	Confident	129 Å²	129	97.6 Å²	97.6	56%	0.561	49%	0.49	S	S	*	.	H	α-helix	trans	-55.1	-45.1	174.4	-74.5	179.3	-179.4	-172.3	0	111.9	A538 H546 I547	A538-K542 WeakPolarHBondContact O-CG 3.34Å; A538-K542 PolarHBondContact O-N 3.2Å; K542-H546 PolarHBondContact O-N 2.87Å; K542-I547 PolarHBondContact O-N 3.4Å
543	R	92.9	Very high	83.5	Confident	125 Å²	125	93.6 Å²	93.6	47%	0.472	48%	0.476	S	S	.	.	H	α-helix	trans	-65.2	-41.8	178.1	-172.2	178	64.8	-102.5	-6.6	112.6	T87 S539 A540 F541 H546	T87-R543 PolarHBondContact OG1-NH2 2.84Å; S539-R543 WeakPolarHBondContact O-CB 3.36Å; S539-R543 PolarHBondContact O-N 3.19Å; S539-R543 VanDerWaalsContact O-N 3.17Å; A540-R543 PolarHBondContact O-N 2.68Å; F541-R543 VanDerWaalsContact C-N 3.29Å; F541-R543 PolarHBondContact O-N 2.85Å; R543-H546 PolarHBondContact O-N 3.29Å
544	L	92.7	Very high	83.1	Confident	51 Å²	51	95.3 Å²	95.3	27%	0.267	48%	0.479	S	S	.	.	H	α-helix	trans	-70.5	-37.2	-179.8	-75.2	173.9	0	0	0	112.9	L79 A83 T86 A540 F541 H546	L79-L544 HydrophobicContact CD1-CB 3.86Å; L79-L544 HydrophobicContact CD1-CD1 3.84Å; A83-L544 HydrophobicContact CB-CD1 4.04Å; T86-L544 HydrophobicContact CG2-CD2 4.08Å; A540-L544 WeakPolarHBondContact O-CB 3.05Å; A540-L544 WeakPolarHBondContact O-CG 3.41Å; A540-L544 PolarHBondContact O-N 3.04Å; F541-L544 PolarHBondContact O-N 2.96Å; L544-H546 PolarHBondContact O-N 2.93Å
545	L	92.7	Very high	82.7	Confident	96 Å²	96	99.5 Å²	99.5	50%	0.503	50%	0.499	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.5	4	178.2	-62.9	174.8	0	0	0	112.9	L79 F541 I547	L79-L545 HydrophobicContact CD1-CD2 4.23Å; L79-L545 HydrophobicContact CD1-CG 4.25Å; L79-L545 HydrophobicContact CD2-CD1 3.99Å; L79-L545 HydrophobicContact CD2-CG 4.32Å; F541-L545 WeakPolarHBondContact O-CB 3.29Å; F541-L545 WeakPolarHBondContact O-CG 3.47Å; F541-L545 PolarHBondContact O-N 3.01Å; L545-I547 HydrophobicContact CB-CD1 3.66Å; L545-I547 HydrophobicContact CB-CG1 3.77Å; L545-I547 HydrophobicContact CD1-CD1 3.87Å; L545-I547 HydrophobicContact CG-CD1 4.44Å; L545-I547 PolarHBondContact O-N 3.18Å; L545-I547 VanDerWaalsContact O-N 3.09Å
546	H	88.9	Confident	82.2	Confident	139 Å²	139	94.8 Å²	94.8	64%	0.644	48%	0.482	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.7	23.2	-174	-59.9	104.4	0	0	0	114.7	K542 R543 L544 G548	K542-H546 PolarHBondContact O-N 2.87Å; R543-H546 PolarHBondContact O-N 3.29Å; L544-H546 PolarHBondContact O-N 2.93Å; H546-G548 PolarHBondContact O-N 3.39Å
547	I	78.7	Confident	81.5	Confident	109 Å²	109	95.1 Å²	95.1	56%	0.559	49%	0.486	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.2	112.8	179.8	-61.1	170.6	0	0	0	108.2	K542 L545	K542-I547 PolarHBondContact O-N 3.4Å; L545-I547 HydrophobicContact CB-CD1 3.66Å; L545-I547 HydrophobicContact CB-CG1 3.77Å; L545-I547 HydrophobicContact CD1-CD1 3.87Å; L545-I547 HydrophobicContact CG-CD1 4.44Å; L545-I547 PolarHBondContact O-N 3.18Å; L545-I547 VanDerWaalsContact O-N 3.09Å
548	G	66.1	Low	80.7	Confident	68 Å²	68	101.6 Å²	101.6	70%	0.701	52%	0.52	S	S	*	.	T	Hydrogen-bonded Turn	trans	96.6	19.5	175.8	0	0	0	0	0	115.9	H546 N550	H546-G548 PolarHBondContact O-N 3.39Å; G548-N550 PolarHBondContact O-N 3.05Å
549	R	61.1	Low	79.7	Confident	204 Å²	204	107.7 Å²	107.7	77%	0.77	55%	0.545	S	S	*	.			trans	-87.4	25.3	172.2	-157.2	178.3	150.2	125.5	-1.1	113.4
550	N	48.6	Very low	78.5	Confident	164 Å²	164	110.8 Å²	110.8	88%	0.877	55%	0.549	S	S	*	.			trans	-122.5	39.5	179	-79.8	-7.8	0	0	0	112.5	G548	G548-N550 PolarHBondContact O-N 3.05Å
551	I	38.1	Very low	77.1	Confident	229 Å²	229	120.8 Å²	120.8	100%	1.174	60%	0.599	S	S	*	*			trans	-144.2	0	159.2	-51.3	177.1	0	0	0	105

Retrieved 551 of 551 residues in 101.3 ms (Link to these results)

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