A0A096M0Z9_POEFO Loading...

Transporter

AlphaFold DB , UniProt , Accession A0A096M0Z9, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 611 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	36.2	Very low	28.8	Very low	249 Å²	249	147.4 Å²	147.4	100%	1.227	85%	0.853	S	S	*	*				0	92.5	0	-84.3	174.8	162.1	0	0	107.7
2	T	30.8	Very low	28.5	Very low	146 Å²	146	141.5 Å²	141.5	90%	0.896	85%	0.848	S	S	*	*			trans	-124.1	128	176.2	32.5	0	0	0	0	105.8
3	A	27.5	Very low	28.3	Very low	101 Å²	101	143 Å²	143	84%	0.835	84%	0.837	S	S	*	*			trans	-134.3	104.2	168.5	0	0	0	0	0	105.7
4	E	29.1	Very low	28.5	Very low	190 Å²	190	141.6 Å²	141.6	89%	0.888	84%	0.835	S	S	*	*				65.8	118.9	80.3	-107.8	-169.9	-175.3	0	0	116.2
5	K	29.1	Very low	28.6	Very low	201 Å²	201	140.9 Å²	140.9	87%	0.874	82%	0.82	S	S	*	*			trans	166.2	139.3	133.1	-92.4	174.8	-176.1	-175.8	0	108.2
6	S	27.2	Very low	28.6	Very low	111 Å²	111	142.7 Å²	142.7	78%	0.776	83%	0.825	S	S	*	*			cis	179.7	125.6	-7.9	42.4	0	0	0	0	105.4
7	G	27.7	Very low	28.5	Very low	70 Å²	70	138.5 Å²	138.5	72%	0.722	82%	0.82	S	S	*	*			trans	-105.6	150.5	165	0	0	0	0	0	110.1
8	P	28.7	Very low	28.4	Very low	136 Å²	136	143.7 Å²	143.7	88%	0.883	82%	0.823	S	S	*	*			trans	-91.9	136.4	169.1	13.6	4.1	0	0	0	112.3
9	V	26.3	Very low	28.3	Very low	123 Å²	123	144.8 Å²	144.8	75%	0.745	83%	0.826	S	S	*	*			trans	-84.1	154.1	176.8	-173.9	0	0	0	0	107.9
10	I	29	Very low	28.6	Very low	139 Å²	139	142.8 Å²	142.8	71%	0.713	82%	0.819	S	S	*	*				171.3	132.1	99	-86	175	0	0	0	112.8
11	N	25.2	Very low	28.6	Very low	155 Å²	155	144.1 Å²	144.1	83%	0.829	82%	0.823	S	S	*	*			trans	53.9	140.8	144.2	-60.5	-9.9	0	0	0	122.5
12	G	25.1	Very low	28.3	Very low	77 Å²	77	136.1 Å²	136.1	79%	0.794	81%	0.805	S	S	*	*			cis	-171.2	164	12.9	0	0	0	0	0	114.4
13	K	25.4	Very low	28	Very low	161 Å²	161	134.5 Å²	134.5	70%	0.7	80%	0.799	S	S	*	*			trans	-85.1	166.8	173.6	-120.9	178.3	-177.5	-176.5	0	110.4	E15	K13-E15 HydrophobicContact CD-CB 4.4Å; K13-E15 HydrophobicContact CD-CG 3.93Å; K13-E15 IonicContact NZ-OE1 3.29Å; K13-E15 PolarHBondContact NZ-OE1 3.35Å
14	P	32.1	Very low	28.5	Very low	124 Å²	124	135.4 Å²	135.4	81%	0.805	80%	0.799	S	S	*	*				-136.9	133.6	75.1	30.1	-11.1	0	0	0	113
15	E	29.9	Very low	28.4	Very low	131 Å²	131	130.9 Å²	130.9	61%	0.612	79%	0.789	S	S	*	*				59.1	105.6	74.9	-102.8	-179.9	-156.6	0	0	117.2	K13	K13-E15 HydrophobicContact CD-CB 4.4Å; K13-E15 HydrophobicContact CD-CG 3.93Å; K13-E15 IonicContact NZ-OE1 3.29Å; K13-E15 PolarHBondContact NZ-OE1 3.35Å
16	D	29	Very low	28.6	Very low	169 Å²	169	126.8 Å²	126.8	90%	0.904	79%	0.785	S	S	*	*				173.8	140.7	123.8	-96.8	-19.3	0	0	0	109.1
17	G	25.4	Very low	28.9	Very low	71 Å²	71	128.2 Å²	128.2	73%	0.732	78%	0.784	S	S	*	*			cis	-157.4	160.6	2.9	0	0	0	0	0	109.6
18	R	27.4	Very low	29.4	Very low	232 Å²	232	132 Å²	132	88%	0.875	79%	0.787	S	S	*	*			trans	-82.5	145	174.3	-67.1	174.1	-168.4	163.3	4.9	109.3
19	D	26.1	Very low	30.1	Very low	166 Å²	166	132.9 Å²	132.9	89%	0.888	78%	0.784	S	S	*	*			trans	-131.7	136.8	130.8	-94.9	-34	0	0	0	109.5
20	P	35.6	Very low	31.2	Very low	104 Å²	104	131.4 Å²	131.4	68%	0.675	77%	0.772	S	S	*	*			trans	-98.6	132	-178.7	35.7	-25.9	0	0	0	110.4
21	D	28.3	Very low	33	Very low	171 Å²	171	132.9 Å²	132.9	91%	0.914	78%	0.776	S	S	*	*			trans	-152.9	113.8	146.1	-102.5	-26.1	0	0	0	109.7
22	G	29.2	Very low	35.3	Very low	81 Å²	81	130.9 Å²	130.9	84%	0.835	76%	0.758	S	S	*	*			trans	-74.2	127.7	173	0	0	0	0	0	110
23	S	25.2	Very low	37.8	Very low	111 Å²	111	131.3 Å²	131.3	78%	0.776	74%	0.742	S	S	*	*			trans	-132.9	122.1	139.8	58.6	0	0	0	0	108	S25	S23-S25 PolarHBondContact O-N 2.97Å
24	S	37.3	Very low	40.3	Very low	121 Å²	121	132.5 Å²	132.5	85%	0.846	75%	0.75	S	S	*	*			trans	-49.1	111.9	177.2	48.2	0	0	0	0	112.4
25	S	27.7	Very low	42.7	Very low	95 Å²	95	129.1 Å²	129.1	66%	0.664	72%	0.721	S	S	*	*			trans	-122.9	84.9	147.4	55.6	0	0	0	0	107.8	S23 L27	S23-S25 PolarHBondContact O-N 2.97Å; S25-L27 PolarHBondContact O-N 3.37Å
26	S	32.4	Very low	45.2	Very low	115 Å²	115	124.3 Å²	124.3	80%	0.804	71%	0.707	S	S	*	*			trans	-63.3	79.1	152.7	52.5	0	0	0	0	107.5
27	L	34.2	Very low	48	Very low	141 Å²	141	122.1 Å²	122.1	74%	0.738	69%	0.693	S	S	*	*			trans	-84.7	112.3	158.6	-74.1	166.7	0	0	0	104.9	S25 N29	S25-L27 PolarHBondContact O-N 3.37Å; L27-N29 PolarHBondContact O-N 2.82Å
28	D	37.4	Very low	51.2	Low	149 Å²	149	119.9 Å²	119.9	80%	0.797	66%	0.662	S	S	*	*			trans	-45.9	106.5	168.2	-74	-40.7	0	0	0	108.7	D30	D28-D30 PolarHBondContact O-N 3.45Å
29	N	43.1	Very low	54.1	Low	154 Å²	154	112.9 Å²	112.9	82%	0.824	64%	0.642	S	S	*	*			trans	-68.6	85	159.1	-84.4	-19.5	0	0	0	105.7	L27 E31	L27-N29 PolarHBondContact O-N 2.82Å; N29-E31 PolarHBondContact O-N 2.77Å
30	D	49.9	Very low	57.2	Low	92 Å²	92	107.6 Å²	107.6	49%	0.492	61%	0.614	S	S	.	*			trans	-57.9	85.7	161.4	-98.7	-28.1	0	0	0	107.1	D28 Y32 K414	D28-D30 PolarHBondContact O-N 3.45Å; D30-Y32 WeakPolarHBondContact O-CD2 3.26Å; D30-Y32 PolarHBondContact O-N 2.92Å; D30-K414 IonicContact OD1-NZ 2.84Å; D30-K414 IonicContact OD2-NZ 2.7Å; D30-K414 PolarHBondContact OD2-NZ 2.86Å
31	E	66.9	Low	59.9	Low	170 Å²	170	107.1 Å²	107.1	79%	0.794	60%	0.601	S	S	*	*			trans	-63.1	101.4	178.2	-115.9	-178.8	171.2	0	0	108.3	N29 N33	N29-E31 PolarHBondContact O-N 2.77Å; E31-N33 PolarHBondContact O-N 3.24Å
32	Y	74.1	Confident	63.1	Low	114 Å²	114	103.7 Å²	103.7	45%	0.447	58%	0.582	S	S	.	*	B	Isolated β-bridge	trans	-68.8	124.1	171.1	-73.4	-75.2	0	0	0	109	D30 E34 E410 K414	D30-Y32 WeakPolarHBondContact O-CD2 3.26Å; D30-Y32 PolarHBondContact O-N 2.92Å; Y32-E34 PolarHBondContact O-N 2.92Å; Y32-E410 HydrophobicContact CE1-CB 4.34Å; Y32-K414 HydrophobicContact CD1-CG 4.1Å; Y32-K414 HydrophobicContact CE1-CD 4.21Å; Y32-K414 HydrophobicContact CE1-CG 3.97Å; Y32-K414 VanDerWaalsContact OH-CE 3.3Å; Y32-K414 WeakPolarHBondContact OH-CE 3.35Å; Y32-K414 PolarHBondContact OH-NZ 3.19Å
33	N	76.5	Confident	66.2	Low	86 Å²	86	99.8 Å²	99.8	46%	0.46	54%	0.542	S	S	.	.	P	Polyproline II helix	trans	-64.5	123.2	169.6	-69	-38	0	0	0	108.7	E31 R413 G415	E31-N33 PolarHBondContact O-N 3.24Å; N33-R413 VanDerWaalsContact CB-O 3.27Å; N33-R413 WeakPolarHBondContact CB-O 3.19Å; N33-R413 PolarHBondContact N-O 2.8Å; N33-R413 PolarHBondContact ND2-O 3.27Å; N33-G415 PolarHBondContact ND2-O 2.95Å; N33-G415 VanDerWaalsContact ND2-O 3.16Å
34	E	79.5	Confident	69.5	Low	186 Å²	186	94.6 Å²	94.6	87%	0.869	51%	0.505	S	S	*	.	P	Polyproline II helix	trans	-58.2	147.7	172.6	-69.2	-170.2	163.5	0	0	110.7	Y32 G36	Y32-E34 PolarHBondContact O-N 2.92Å; E34-G36 PolarHBondContact O-N 3.28Å
35	R	81.3	Confident	72.3	Confident	52 Å²	52	90 Å²	90	20%	0.196	47%	0.471	C	S	.	.	P	Polyproline II helix	trans	-60	128.3	176.1	-167	174	-167	-106.6	1	108.7	S100 S304 Y305 D406	R35-S100 PolarHBondContact NH1-O 3.23Å; R35-S304 PolarHBondContact NH1-O 3.34Å; R35-S304 PolarHBondContact NH1-OG 3.21Å; R35-S304 PolarHBondContact NH2-OG 3.17Å; R35-Y305 HydrophobicContact CG-CE1 4.32Å; R35-D406 IonicContact CZ-OD2 3.86Å; R35-D406 IonicContact NE-OD1 2.66Å; R35-D406 PolarHBondContact NE-OD1 3.28Å; R35-D406 IonicContact NE-OD2 2.71Å; R35-D406 PolarHBondContact NE-OD2 3.15Å; R35-D406 IonicContact NH2-OD2 3.93Å; R35-D406 PolarHBondContact NH2-OD2 3.49Å
36	G	81.8	Confident	75.5	Confident	30 Å²	30	87 Å²	87	31%	0.309	45%	0.447	S	S	.	.	P	Polyproline II helix	trans	-60	153.6	179.1	0	0	0	0	0	112.3	E34 Y305	E34-G36 PolarHBondContact O-N 3.28Å; G36-Y305 WeakPolarHBondContact O-CD1 3.4Å
37	M	89.4	Confident	78.5	Confident	123 Å²	123	81.5 Å²	81.5	61%	0.606	41%	0.409	S	S	*	.			trans	-128.3	160.3	168.1	-66.9	-174.5	-70	0	0	108.6
38	W	91.8	Very high	81.4	Confident	24 Å²	24	74.9 Å²	74.9	9%	0.091	37%	0.374	C	S	.	.			trans	-60.6	137	169	-62.4	113.2	0	0	0	110.6	N40 E43 F44 S47 P229 L302 Y305	W38-N40 VanDerWaalsContact C-N 3.28Å; W38-N40 PolarHBondContact O-N 3.38Å; W38-E43 HydrophobicContact CE3-CB 4.14Å; W38-F44 HydrophobicContact CB-CB 4.48Å; W38-F44 AromaticContact CD1-CD2 3.98Å; W38-F44 HydrophobicContact CD2-CB 4.12Å; W38-F44 HydrophobicContact CG-CB 3.88Å; W38-F44 HydrophobicContact CZ2-CD2 4.48Å; W38-F44 AromaticContact NE1-CD2 3.43Å; W38-S47 WeakPolarHBondContact CH2-OG 3.39Å; W38-S47 WeakPolarHBondContact CZ3-OG 3.26Å; W38-P229 HydrophobicContact CD2-CB 4.23Å; W38-P229 HydrophobicContact CE3-CB 3.75Å; W38-P229 HydrophobicContact CH2-CB 4.17Å; W38-P229 HydrophobicContact CZ3-CB 3.73Å; W38-L302 HydrophobicContact CH2-CD2 3.91Å; W38-L302 HydrophobicContact CZ2-CB 4.37Å; W38-L302 HydrophobicContact CZ2-CD2 3.62Å; W38-L302 PolarHBondContact NE1-O 2.93Å; W38-Y305 HydrophobicContact CZ2-CD2 4.22Å; W38-Y305 PolarHBondContact N-O 2.91Å
39	N	89.1	Confident	84.2	Confident	85 Å²	85	68 Å²	68	46%	0.455	34%	0.338	S	S	.	.	S	Bend	trans	-70.3	-32.2	178.9	-56.7	-63.5	0	0	0	111.3	E43	N39-E43 VanDerWaalsContact CB-OE2 3.27Å; N39-E43 WeakPolarHBondContact CB-OE2 3.48Å; N39-E43 PolarHBondContact N-OE2 2.99Å; N39-E43 PolarHBondContact ND2-OE2 3.18Å
40	N	91.4	Very high	86.6	Confident	56 Å²	56	60.8 Å²	60.8	30%	0.299	30%	0.3	S	S	.	.	S	Bend	trans	-152.7	167.3	177	67.2	62.1	0	0	0	110.9	W38 I42 E43	W38-N40 VanDerWaalsContact C-N 3.28Å; W38-N40 PolarHBondContact O-N 3.38Å; N40-I42 VanDerWaalsContact C-N 3.32Å; N40-I42 PolarHBondContact O-N 2.92Å; N40-I42 WeakPolarHBondContact OD1-CA 3.32Å; N40-I42 WeakPolarHBondContact OD1-CB 3.37Å; N40-I42 PolarHBondContact OD1-N 3.41Å; N40-E43 PolarHBondContact ND2-OE1 3.2Å; N40-E43 PolarHBondContact O-N 2.89Å; N40-E43 WeakPolarHBondContact OD1-CG 3.4Å; N40-E43 PolarHBondContact OD1-N 3.39Å
41	K	92.4	Very high	88.6	Confident	93 Å²	93	56.9 Å²	56.9	40%	0.404	28%	0.279	S	S	.	.	H	α-helix	trans	-66.1	-30.7	-178.3	-178.6	164.7	179.3	138.7	0	113.7	E43 F44 I45 N310 D315	K41-E43 VanDerWaalsContact C-N 3.35Å; K41-F44 PolarHBondContact O-N 3.27Å; K41-I45 HydrophobicContact CG-CG1 4.27Å; K41-I45 WeakPolarHBondContact O-CG1 3.27Å; K41-I45 PolarHBondContact O-N 3.08Å; K41-N310 PolarHBondContact NZ-OD1 3.25Å; K41-D315 WeakPolarHBondContact CE-OD1 3.2Å; K41-D315 WeakPolarHBondContact CE-OD2 3.43Å; K41-D315 IonicContact NZ-OD1 2.71Å; K41-D315 PolarHBondContact NZ-OD1 3.09Å; K41-D315 IonicContact NZ-OD2 2.86Å; K41-D315 PolarHBondContact NZ-OD2 3.42Å
42	I	93.8	Very high	89.9	Confident	99 Å²	99	48.9 Å²	48.9	51%	0.508	24%	0.242	S	C	.	.	H	α-helix	trans	-67.4	-40.3	-179.7	-65.2	167.6	0	0	0	110	N40 F44 I45 L46 Y237	N40-I42 VanDerWaalsContact C-N 3.32Å; N40-I42 PolarHBondContact O-N 2.92Å; N40-I42 WeakPolarHBondContact OD1-CA 3.32Å; N40-I42 WeakPolarHBondContact OD1-CB 3.37Å; N40-I42 PolarHBondContact OD1-N 3.41Å; I42-F44 VanDerWaalsContact C-N 3.31Å; I42-F44 PolarHBondContact O-N 3.41Å; I42-I45 PolarHBondContact O-N 3.46Å; I42-L46 HydrophobicContact CG2-CD1 3.67Å; I42-L46 HydrophobicContact CG2-CG 3.98Å; I42-L46 WeakPolarHBondContact O-CB 3.27Å; I42-L46 WeakPolarHBondContact O-CG 3.41Å; I42-L46 PolarHBondContact O-N 3.48Å; I42-Y237 HydrophobicContact CG2-CE1 3.76Å
43	E	94.1	Very high	90.8	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-58.8	-42.6	175.7	-68.7	179.7	-174.4	0	0	111.5	W38 N39 N40 K41 S47 G233 K234 Y237	W38-E43 HydrophobicContact CE3-CB 4.14Å; N39-E43 VanDerWaalsContact CB-OE2 3.27Å; N39-E43 WeakPolarHBondContact CB-OE2 3.48Å; N39-E43 PolarHBondContact N-OE2 2.99Å; N39-E43 PolarHBondContact ND2-OE2 3.18Å; N40-E43 PolarHBondContact ND2-OE1 3.2Å; N40-E43 PolarHBondContact O-N 2.89Å; N40-E43 WeakPolarHBondContact OD1-CG 3.4Å; N40-E43 PolarHBondContact OD1-N 3.39Å; K41-E43 VanDerWaalsContact C-N 3.35Å; E43-S47 VanDerWaalsContact O-CB 3.25Å; E43-S47 WeakPolarHBondContact O-CB 3.27Å; E43-S47 PolarHBondContact O-N 2.74Å; E43-S47 PolarHBondContact O-OG 2.88Å; E43-G233 WeakPolarHBondContact CG-O 3.24Å; E43-K234 WeakPolarHBondContact OE1-CE 3.32Å; E43-K234 IonicContact OE1-NZ 3.79Å; E43-K234 PolarHBondContact OE1-NZ 2.83Å; E43-Y237 HydrophobicContact CG-CE2 3.83Å
44	F	94.5	Very high	91.5	Very high	2 Å²	2	39.9 Å²	39.9	1%	0.009	20%	0.202	C	C	.	.	H	α-helix	trans	-61.7	-53.2	172.7	168.8	-113.1	0	0	0	111.9	W38 K41 I42 L46 S47 V48 T93 L302 N306 D315	W38-F44 HydrophobicContact CB-CB 4.48Å; W38-F44 AromaticContact CD1-CD2 3.98Å; W38-F44 HydrophobicContact CD2-CB 4.12Å; W38-F44 HydrophobicContact CG-CB 3.88Å; W38-F44 HydrophobicContact CZ2-CD2 4.48Å; W38-F44 AromaticContact NE1-CD2 3.43Å; K41-F44 PolarHBondContact O-N 3.27Å; I42-F44 VanDerWaalsContact C-N 3.31Å; I42-F44 PolarHBondContact O-N 3.41Å; F44-L46 PolarHBondContact O-N 3.37Å; F44-S47 PolarHBondContact O-N 2.83Å; F44-V48 HydrophobicContact CD2-CG2 3.78Å; F44-V48 HydrophobicContact CE2-CG2 3.36Å; F44-V48 HydrophobicContact CZ-CG2 3.78Å; F44-V48 WeakPolarHBondContact O-CG2 3.39Å; F44-V48 PolarHBondContact O-N 3.4Å; F44-T93 HydrophobicContact CZ-CG2 4.11Å; F44-L302 HydrophobicContact CE2-CB 4.4Å; F44-N306 VanDerWaalsContact CD2-OD1 3.28Å; F44-N306 WeakPolarHBondContact CD2-OD1 3.5Å; F44-N306 WeakPolarHBondContact CE1-ND2 3.3Å; F44-N306 VanDerWaalsContact CE2-ND2 3.31Å; F44-N306 WeakPolarHBondContact CE2-ND2 3.27Å; F44-N306 VanDerWaalsContact CG-OD1 3.26Å; F44-N306 WeakPolarHBondContact CG-OD1 3.24Å; F44-N306 WeakPolarHBondContact CZ-ND2 3.21Å; F44-D315 HydrophobicContact CE1-CB 4.23Å
45	I	96.2	Very high	91.9	Very high	25 Å²	25	31.1 Å²	31.1	13%	0.128	16%	0.161	C	C	.	.	H	α-helix	trans	-60.6	-43.6	-177.3	-67.1	-62.4	0	0	0	111.5	K41 I42 A49 D315 M318 L319	K41-I45 HydrophobicContact CG-CG1 4.27Å; K41-I45 WeakPolarHBondContact O-CG1 3.27Å; K41-I45 PolarHBondContact O-N 3.08Å; I42-I45 PolarHBondContact O-N 3.46Å; I45-A49 WeakPolarHBondContact O-CB 3.21Å; I45-A49 PolarHBondContact O-N 2.93Å; I45-D315 HydrophobicContact CD1-CB 3.76Å; I45-M318 HydrophobicContact CD1-CE 3.93Å; I45-M318 HydrophobicContact CG1-CE 4.34Å; I45-M318 HydrophobicContact CG2-CE 3.71Å; I45-L319 HydrophobicContact CD1-CD1 3.98Å; I45-L319 HydrophobicContact CD1-CG 4.37Å; I45-L319 HydrophobicContact CG2-CD2 4.15Å
46	L	95.4	Very high	92.2	Very high	31 Å²	31	29.6 Å²	29.6	16%	0.162	16%	0.162	C	C	.	.	H	α-helix	trans	-69.4	-37	178.1	-70.3	179.4	0	0	0	112.1	I42 F44 A49 G50 V236 Y237 T241	I42-L46 HydrophobicContact CG2-CD1 3.67Å; I42-L46 HydrophobicContact CG2-CG 3.98Å; I42-L46 WeakPolarHBondContact O-CB 3.27Å; I42-L46 WeakPolarHBondContact O-CG 3.41Å; I42-L46 PolarHBondContact O-N 3.48Å; F44-L46 PolarHBondContact O-N 3.37Å; L46-A49 PolarHBondContact O-N 3.4Å; L46-G50 PolarHBondContact O-N 3Å; L46-V236 HydrophobicContact CB-CB 4.16Å; L46-V236 HydrophobicContact CB-CG2 3.8Å; L46-Y237 HydrophobicContact CD1-CD1 3.74Å; L46-Y237 HydrophobicContact CD1-CE1 3.9Å; L46-Y237 HydrophobicContact CD1-CG 4.18Å; L46-T241 HydrophobicContact CD2-CG2 4.38Å
47	S	94.8	Very high	92.7	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-65.5	-42.9	176.1	-57	0	0	0	0	111.6	W38 E43 F44 G50 E51	W38-S47 WeakPolarHBondContact CH2-OG 3.39Å; W38-S47 WeakPolarHBondContact CZ3-OG 3.26Å; E43-S47 VanDerWaalsContact O-CB 3.25Å; E43-S47 WeakPolarHBondContact O-CB 3.27Å; E43-S47 PolarHBondContact O-N 2.74Å; E43-S47 PolarHBondContact O-OG 2.88Å; F44-S47 PolarHBondContact O-N 2.83Å; S47-G50 PolarHBondContact O-N 3.35Å; S47-E51 PolarHBondContact O-N 3.4Å; S47-E51 VanDerWaalsContact O-N 3.1Å
48	V	96.1	Very high	92.6	Very high	1 Å²	1	22.7 Å²	22.7	1%	0.006	12%	0.121	C	C	.	.	H	α-helix	trans	-69.3	-37.9	175.1	-177.4	0	0	0	0	111.2	F44 E51 I52 F89 L299 L302 L319	F44-V48 HydrophobicContact CD2-CG2 3.78Å; F44-V48 HydrophobicContact CE2-CG2 3.36Å; F44-V48 HydrophobicContact CZ-CG2 3.78Å; F44-V48 WeakPolarHBondContact O-CG2 3.39Å; F44-V48 PolarHBondContact O-N 3.4Å; V48-E51 PolarHBondContact O-N 3.25Å; V48-I52 HydrophobicContact CG1-CG2 4.32Å; V48-I52 WeakPolarHBondContact O-CG1 3.34Å; V48-I52 WeakPolarHBondContact O-CG2 3.34Å; V48-I52 PolarHBondContact O-N 2.94Å; V48-I52 VanDerWaalsContact O-N 3.11Å; V48-F89 HydrophobicContact CG1-CE1 4.42Å; V48-F89 HydrophobicContact CG1-CZ 3.63Å; V48-L299 HydrophobicContact CG1-CD2 4Å; V48-L302 HydrophobicContact CB-CD1 4.46Å; V48-L302 HydrophobicContact CG2-CB 4.27Å; V48-L302 HydrophobicContact CG2-CD1 3.76Å; V48-L319 HydrophobicContact CB-CD1 3.89Å; V48-L319 HydrophobicContact CB-CD2 4.33Å; V48-L319 HydrophobicContact CG1-CD1 3.62Å; V48-L319 HydrophobicContact CG1-CD2 4.31Å; V48-L319 HydrophobicContact CG1-CG 4.45Å
49	A	95.5	Very high	92.1	Very high	5 Å²	5	22.8 Å²	22.8	4%	0.041	12%	0.121	C	C	.	.	H	α-helix	trans	-62.8	-42.9	174.9	0	0	0	0	0	111.6	I45 L46 E51 I52 I53 L319 L322	I45-A49 WeakPolarHBondContact O-CB 3.21Å; I45-A49 PolarHBondContact O-N 2.93Å; L46-A49 PolarHBondContact O-N 3.4Å; A49-E51 VanDerWaalsContact C-N 3.32Å; A49-E51 PolarHBondContact O-N 3.47Å; A49-I52 PolarHBondContact O-N 2.89Å; A49-I53 HydrophobicContact CB-CD1 3.98Å; A49-I53 VanDerWaalsContact O-CB 3.25Å; A49-I53 WeakPolarHBondContact O-CB 3.34Å; A49-I53 WeakPolarHBondContact O-CD1 3.49Å; A49-I53 PolarHBondContact O-N 2.95Å; A49-L319 HydrophobicContact CB-CD2 4.02Å; A49-L322 HydrophobicContact CB-CD2 4.17Å
50	G	93.6	Very high	92.1	Very high	3 Å²	3	22.1 Å²	22.1	3%	0.031	11%	0.112	C	C	.	.	H	α-helix	trans	-64	-35.2	176.5	0	0	0	0	0	113	L46 S47 D391	L46-G50 PolarHBondContact O-N 3Å; S47-G50 PolarHBondContact O-N 3.35Å; G50-D391 WeakPolarHBondContact O-CB 3.42Å
51	E	93.6	Very high	92.2	Very high	10 Å²	10	19.5 Å²	19.5	5%	0.047	10%	0.098	C	C	.	.	H	α-helix	trans	-64.2	-52	174	171.1	63	173.2	0	0	112.1	S47 V48 A49 A293 C298 S392 V395	S47-E51 PolarHBondContact O-N 3.4Å; S47-E51 VanDerWaalsContact O-N 3.1Å; V48-E51 PolarHBondContact O-N 3.25Å; A49-E51 VanDerWaalsContact C-N 3.32Å; A49-E51 PolarHBondContact O-N 3.47Å; E51-A293 HydrophobicContact CG-CB 3.76Å; E51-A293 WeakPolarHBondContact OE1-CB 3.44Å; E51-C298 PolarHBondContact OE1-SG 3.28Å; E51-S392 PolarHBondContact O-OG 2.87Å; E51-S392 WeakPolarHBondContact OE2-CA 3.45Å; E51-V395 HydrophobicContact CB-CB 4.23Å; E51-V395 HydrophobicContact CB-CG1 4.14Å; E51-V395 HydrophobicContact CB-CG2 4.02Å; E51-V395 HydrophobicContact CG-CB 4.36Å; E51-V395 HydrophobicContact CG-CG1 3.91Å; E51-V395 WeakPolarHBondContact OE2-CB 3.25Å
52	I	94.3	Very high	92.2	Very high	2 Å²	2	15 Å²	15	1%	0.01	8%	0.079	C	C	.	.	H	α-helix	trans	-81	-24.5	-170.7	71.4	-171.2	0	0	0	112.6	V48 A49 N57 F89 L319 N323	V48-I52 HydrophobicContact CG1-CG2 4.32Å; V48-I52 WeakPolarHBondContact O-CG1 3.34Å; V48-I52 WeakPolarHBondContact O-CG2 3.34Å; V48-I52 PolarHBondContact O-N 2.94Å; V48-I52 VanDerWaalsContact O-N 3.11Å; A49-I52 PolarHBondContact O-N 2.89Å; I52-N57 PolarHBondContact O-OD1 2.99Å; I52-F89 HydrophobicContact CG2-CE2 3.72Å; I52-F89 HydrophobicContact CG2-CZ 4.21Å; I52-L319 HydrophobicContact CD1-CB 3.96Å; I52-L319 HydrophobicContact CD1-CD2 4.23Å; I52-L319 WeakPolarHBondContact CD1-O 3.27Å; I52-N323 HydrophobicContact CD1-CB 3.85Å; I52-N323 HydrophobicContact CG1-CB 4.01Å; I52-N323 PolarHBondContact O-OD1 3.44Å
53	I	92.9	Very high	91.9	Very high	5 Å²	5	12.9 Å²	12.9	3%	0.026	7%	0.065	C	C	.	.	S	Bend	trans	-100.7	87.8	175.4	-63.4	126.3	0	0	0	108.2	A49 N57 Y244 L322 T326 L388	A49-I53 HydrophobicContact CB-CD1 3.98Å; A49-I53 VanDerWaalsContact O-CB 3.25Å; A49-I53 WeakPolarHBondContact O-CB 3.34Å; A49-I53 WeakPolarHBondContact O-CD1 3.49Å; A49-I53 PolarHBondContact O-N 2.95Å; I53-N57 WeakPolarHBondContact CA-OD1 3.28Å; I53-Y244 WeakPolarHBondContact CD1-OH 3.41Å; I53-L322 HydrophobicContact CD1-CD2 4.02Å; I53-L322 HydrophobicContact CD1-CG 4.08Å; I53-T326 HydrophobicContact CG1-CG2 4.47Å; I53-T326 HydrophobicContact CG2-CG2 3.72Å; I53-L388 HydrophobicContact CG2-CD2 4.08Å; I53-L388 VanDerWaalsContact O-CD2 3.29Å; I53-L388 WeakPolarHBondContact O-CD2 3.29Å
54	G	89.5	Confident	91.7	Very high	5 Å²	5	13.5 Å²	13.5	5%	0.052	7%	0.068	C	C	.	.	S	Bend	trans	-115.4	-161.7	179.3	0	0	0	0	0	112.7	G56 N57	G54-G56 PolarHBondContact O-N 3.33Å; G54-N57 PolarHBondContact N-OD1 2.63Å; G54-N57 PolarHBondContact O-N 3.22Å; G54-N57 PolarHBondContact O-OD1 3.48Å
55	L	88	Confident	91.6	Very high	2 Å²	2	13.4 Å²	13.4	1%	0.01	7%	0.067	C	C	.	.	H	α-helix	trans	-58	-36.5	177.5	-61.5	168.3	0	0	0	111.9	N57 V58 W59 Y132 I135 L385 L388	L55-N57 PolarHBondContact O-N 2.83Å; L55-V58 PolarHBondContact O-N 3.21Å; L55-W59 HydrophobicContact CB-CD2 4.29Å; L55-W59 HydrophobicContact CB-CH2 4.37Å; L55-W59 HydrophobicContact CB-CZ2 3.67Å; L55-W59 HydrophobicContact CD1-CH2 4.03Å; L55-W59 HydrophobicContact CD1-CZ2 3.9Å; L55-W59 HydrophobicContact CG-CZ2 4.39Å; L55-W59 PolarHBondContact O-N 3.22Å; L55-W59 PolarHBondContact O-NE1 3.12Å; L55-Y132 HydrophobicContact CD1-CE2 4.19Å; L55-I135 HydrophobicContact CD1-CB 4.14Å; L55-I135 HydrophobicContact CD1-CD1 4.03Å; L55-I135 HydrophobicContact CD1-CG2 3.51Å; L55-L385 HydrophobicContact CD2-CB 4.06Å; L55-L385 HydrophobicContact CD2-CD2 3.57Å; L55-L385 HydrophobicContact CD2-CG 4.35Å; L55-L388 HydrophobicContact CD2-CB 4.3Å
56	G	88	Confident	91.2	Very high	20 Å²	20	14.6 Å²	14.6	21%	0.206	7%	0.071	C	C	.	.	H	α-helix	trans	-53.1	-36.3	179.4	0	0	0	0	0	114.2	G54 V58 R60 F61	G54-G56 PolarHBondContact O-N 3.33Å; G56-V58 VanDerWaalsContact C-N 3.32Å; G56-V58 PolarHBondContact O-N 3.06Å; G56-R60 WeakPolarHBondContact O-CB 3.39Å; G56-R60 PolarHBondContact O-N 3.38Å; G56-R60 VanDerWaalsContact O-N 3.11Å; G56-F61 PolarHBondContact O-N 2.69Å
57	N	92.2	Very high	90.9	Very high	3 Å²	3	17 Å²	17	2%	0.016	8%	0.08	C	C	.	.	H	α-helix	trans	-67.7	-33.8	178.8	-59	74.1	0	0	0	112.3	I52 I53 G54 L55 S291 N323 S327	I52-N57 PolarHBondContact O-OD1 2.99Å; I53-N57 WeakPolarHBondContact CA-OD1 3.28Å; G54-N57 PolarHBondContact N-OD1 2.63Å; G54-N57 PolarHBondContact O-N 3.22Å; G54-N57 PolarHBondContact O-OD1 3.48Å; L55-N57 PolarHBondContact O-N 2.83Å; N57-S291 PolarHBondContact ND2-OG 3.45Å; N57-N323 PolarHBondContact ND2-OD1 3.12Å; N57-S327 PolarHBondContact ND2-OG 2.92Å
58	V	87.5	Confident	90.8	Very high	6 Å²	6	17 Å²	17	4%	0.036	8%	0.08	C	C	.	.	H	α-helix	trans	-86.7	-45.4	-175.9	-177.1	0	0	0	0	111	L55 G56 P62 L247 A330 I334 M384 L388	L55-V58 PolarHBondContact O-N 3.21Å; G56-V58 VanDerWaalsContact C-N 3.32Å; G56-V58 PolarHBondContact O-N 3.06Å; V58-P62 WeakPolarHBondContact O-CD 3.27Å; V58-P62 VanDerWaalsContact O-CG 3.3Å; V58-P62 WeakPolarHBondContact O-CG 2.84Å; V58-L247 HydrophobicContact CG2-CD2 4.38Å; V58-A330 HydrophobicContact CG2-CB 4.45Å; V58-I334 HydrophobicContact CG1-CD1 3.79Å; V58-I334 HydrophobicContact CG1-CG1 3.99Å; V58-I334 WeakPolarHBondContact O-CG1 3.48Å; V58-M384 HydrophobicContact CG1-CE 4.5Å; V58-L388 HydrophobicContact CG2-CD1 3.78Å
59	W	82.3	Confident	90.6	Very high	25 Å²	25	17.4 Å²	17.4	10%	0.095	8%	0.084	C	C	.	.	H	α-helix	trans	-106.7	-21.4	-169.7	65.8	3.4	0	0	0	116.6	L55 Y63 I135 P357 L359 A360 F361	L55-W59 HydrophobicContact CB-CD2 4.29Å; L55-W59 HydrophobicContact CB-CH2 4.37Å; L55-W59 HydrophobicContact CB-CZ2 3.67Å; L55-W59 HydrophobicContact CD1-CH2 4.03Å; L55-W59 HydrophobicContact CD1-CZ2 3.9Å; L55-W59 HydrophobicContact CG-CZ2 4.39Å; L55-W59 PolarHBondContact O-N 3.22Å; L55-W59 PolarHBondContact O-NE1 3.12Å; W59-Y63 WeakPolarHBondContact O-CB 3.41Å; W59-I135 HydrophobicContact CH2-CD1 4.01Å; W59-I135 HydrophobicContact CH2-CG1 4.41Å; W59-I135 HydrophobicContact CH2-CG2 3.6Å; W59-I135 HydrophobicContact CZ2-CD1 4Å; W59-I135 HydrophobicContact CZ2-CG2 4.47Å; W59-I135 HydrophobicContact CZ3-CG2 4.32Å; W59-P357 HydrophobicContact CH2-CG 4.4Å; W59-P357 HydrophobicContact CZ3-CB 4.34Å; W59-L359 HydrophobicContact CB-CB 4.38Å; W59-L359 HydrophobicContact CB-CD2 4.02Å; W59-L359 VanDerWaalsContact O-CD2 3.27Å; W59-L359 WeakPolarHBondContact O-CD2 3.44Å; W59-A360 HydrophobicContact CE3-CB 3.38Å; W59-A360 HydrophobicContact CZ3-CB 3.75Å; W59-F361 HydrophobicContact CH2-CE2 4.36Å; W59-F361 HydrophobicContact CZ3-CD2 4.28Å; W59-F361 AromaticContact CZ3-CE2 3.83Å; W59-F361 HydrophobicContact CZ3-CE2 3.83Å
60	R	88.9	Confident	90.5	Very high	72 Å²	72	17.3 Å²	17.3	27%	0.272	8%	0.083	S	C	.	.	T	Hydrogen-bonded Turn	trans	-105.2	-49.1	-169.1	-176.8	-179.1	176.1	150	-0.5	109.6	G56 Y63 L64	G56-R60 WeakPolarHBondContact O-CB 3.39Å; G56-R60 PolarHBondContact O-N 3.38Å; G56-R60 VanDerWaalsContact O-N 3.11Å; R60-Y63 PolarHBondContact O-N 2.89Å; R60-L64 HydrophobicContact CG-CD1 4.01Å; R60-L64 HydrophobicContact CG-CG 4.28Å; R60-L64 WeakPolarHBondContact O-CB 3.37Å; R60-L64 WeakPolarHBondContact O-CG 3.48Å; R60-L64 PolarHBondContact O-N 3.29Å
61	F	92.9	Very high	90.5	Very high	0 Å²	0	18.1 Å²	18.1	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-56.1	-49.9	177.3	176.4	-90.9	0	0	0	112.5	G56 Y63 L64 C65 F73 F74 Y77 Y267 Q287 S327	G56-F61 PolarHBondContact O-N 2.69Å; F61-Y63 VanDerWaalsContact C-N 3.34Å; F61-Y63 PolarHBondContact O-N 3.44Å; F61-L64 PolarHBondContact O-N 2.91Å; F61-C65 WeakPolarHBondContact O-CB 3.29Å; F61-C65 PolarHBondContact O-N 2.96Å; F61-F73 HydrophobicContact CE2-CE1 4.27Å; F61-F74 HydrophobicContact CE1-CE1 4.49Å; F61-F74 HydrophobicContact CE1-CZ 4.28Å; F61-F74 AromaticContact CZ-CE1 3.76Å; F61-F74 HydrophobicContact CZ-CE1 3.76Å; F61-F74 AromaticContact CZ-CZ 3.89Å; F61-F74 HydrophobicContact CZ-CZ 3.89Å; F61-Y77 HydrophobicContact CD2-CD2 4.39Å; F61-Y77 AromaticContact CD2-CE2 3.76Å; F61-Y77 HydrophobicContact CD2-CE2 3.76Å; F61-Y77 HydrophobicContact CE2-CD1 4.37Å; F61-Y77 AromaticContact CE2-CD2 3.79Å; F61-Y77 HydrophobicContact CE2-CD2 3.79Å; F61-Y77 HydrophobicContact CE2-CE1 4.04Å; F61-Y77 AromaticContact CE2-CE2 3.41Å; F61-Y77 HydrophobicContact CE2-CE2 3.41Å; F61-Y77 VanDerWaalsContact CE2-CE2 3.41Å; F61-Y77 HydrophobicContact CE2-CG 4.26Å; F61-Y77 AromaticContact CE2-CZ 3.54Å; F61-Y267 WeakPolarHBondContact CE1-OH 3.17Å; F61-Q287 HydrophobicContact CD2-CG 4.07Å; F61-S327 WeakPolarHBondContact CD1-O 3.41Å
62	P	91.4	Very high	90.6	Very high	0 Å²	0	17.9 Å²	17.9	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-63.6	-41.8	-179.1	-25.9	39.9	0	0	0	112.1	V58 C65 Y66 G331 F335	V58-P62 WeakPolarHBondContact O-CD 3.27Å; V58-P62 VanDerWaalsContact O-CG 3.3Å; V58-P62 WeakPolarHBondContact O-CG 2.84Å; P62-C65 WeakPolarHBondContact O-CB 3.41Å; P62-C65 PolarHBondContact O-N 3.2Å; P62-Y66 PolarHBondContact O-N 3.24Å; P62-Y66 VanDerWaalsContact O-N 3.13Å; P62-G331 VanDerWaalsContact CG-CA 3.5Å; P62-F335 HydrophobicContact CB-CD2 3.8Å; P62-F335 HydrophobicContact CB-CE2 3.47Å; P62-F335 VanDerWaalsContact CB-CE2 3.47Å; P62-F335 VanDerWaalsContact O-CE2 3.3Å; P62-F335 WeakPolarHBondContact O-CE2 3.46Å
63	Y	88.1	Confident	90.7	Very high	54 Å²	54	17.8 Å²	17.8	21%	0.212	9%	0.091	C	C	.	.	H	α-helix	trans	-59.6	-47.3	176.4	173.3	-96	0	0	0	112	W59 R60 F61 C65 Y66 K67 E354	W59-Y63 WeakPolarHBondContact O-CB 3.41Å; R60-Y63 PolarHBondContact O-N 2.89Å; F61-Y63 VanDerWaalsContact C-N 3.34Å; F61-Y63 PolarHBondContact O-N 3.44Å; Y63-C65 VanDerWaalsContact C-N 3.32Å; Y63-C65 PolarHBondContact O-N 3Å; Y63-Y66 PolarHBondContact O-N 3.38Å; Y63-K67 HydrophobicContact CE1-CB 4.46Å; Y63-K67 HydrophobicContact CE1-CD 3.77Å; Y63-K67 VanDerWaalsContact O-CB 3.3Å; Y63-K67 WeakPolarHBondContact O-CB 3.42Å; Y63-K67 PolarHBondContact O-N 3.07Å; Y63-E354 WeakPolarHBondContact CD2-O 3.38Å
64	L	90.4	Very high	90.8	Very high	12 Å²	12	19.8 Å²	19.8	6%	0.063	10%	0.1	C	C	.	.	H	α-helix	trans	-64.1	-38	178.1	-72.2	-178.9	0	0	0	112.1	R60 F61 N68 F73 D283 Q287	R60-L64 HydrophobicContact CG-CD1 4.01Å; R60-L64 HydrophobicContact CG-CG 4.28Å; R60-L64 WeakPolarHBondContact O-CB 3.37Å; R60-L64 WeakPolarHBondContact O-CG 3.48Å; R60-L64 PolarHBondContact O-N 3.29Å; F61-L64 PolarHBondContact O-N 2.91Å; L64-N68 WeakPolarHBondContact O-CB 3.25Å; L64-N68 PolarHBondContact O-N 2.67Å; L64-N68 PolarHBondContact O-ND2 3.06Å; L64-N68 VanDerWaalsContact O-ND2 3.16Å; L64-F73 HydrophobicContact CB-CE1 4.37Å; L64-F73 HydrophobicContact CB-CZ 4.1Å; L64-D283 HydrophobicContact CD2-CB 4.21Å; L64-Q287 HydrophobicContact CD1-CB 3.86Å; L64-Q287 HydrophobicContact CD1-CG 4.12Å
65	C	92.3	Very high	91.1	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-59.6	-51.6	177.2	-168.8	0	0	0	0	110.8	F61 P62 Y63 N68 G70 F73 F74 Y267	F61-C65 WeakPolarHBondContact O-CB 3.29Å; F61-C65 PolarHBondContact O-N 2.96Å; P62-C65 WeakPolarHBondContact O-CB 3.41Å; P62-C65 PolarHBondContact O-N 3.2Å; Y63-C65 VanDerWaalsContact C-N 3.32Å; Y63-C65 PolarHBondContact O-N 3Å; C65-N68 PolarHBondContact O-N 2.92Å; C65-G70 WeakPolarHBondContact O-CA 3.41Å; C65-G70 PolarHBondContact O-N 3.04Å; C65-G70 PolarHBondContact SG-O 2.99Å; C65-F73 HydrophobicContact CB-CD1 4.05Å; C65-F74 WeakPolarHBondContact SG-CE2 3.36Å; C65-Y267 HydrophobicContact CB-CD2 4Å; C65-Y267 HydrophobicContact CB-CE2 3.62Å; C65-Y267 VanDerWaalsContact SG-CE2 3.52Å
66	Y	88.2	Confident	91.4	Very high	50 Å²	50	23 Å²	23	20%	0.196	12%	0.118	C	C	.	.	H	α-helix	trans	-60.8	-54.1	177	158.1	-110.9	0	0	0	112.2	P62 Y63 N68 G69 G70 F266 F335 E350 A353	P62-Y66 PolarHBondContact O-N 3.24Å; P62-Y66 VanDerWaalsContact O-N 3.13Å; Y63-Y66 PolarHBondContact O-N 3.38Å; Y66-N68 PolarHBondContact O-N 2.85Å; Y66-G69 PolarHBondContact O-N 3.25Å; Y66-G70 PolarHBondContact O-N 2.91Å; Y66-F266 HydrophobicContact CD2-CD1 4.39Å; Y66-F266 AromaticContact CE2-CD1 3.83Å; Y66-F266 HydrophobicContact CE2-CD1 3.83Å; Y66-F335 VanDerWaalsContact CB-CZ 3.42Å; Y66-F335 HydrophobicContact CD1-CZ 4.4Å; Y66-F335 HydrophobicContact CD2-CE1 4.49Å; Y66-F335 HydrophobicContact CG-CE1 4.03Å; Y66-F335 HydrophobicContact CG-CZ 4.02Å; Y66-E350 WeakPolarHBondContact OH-CG 3.41Å; Y66-E350 PolarHBondContact OH-OE1 3.35Å; Y66-A353 HydrophobicContact CD1-CB 4.46Å; Y66-A353 HydrophobicContact CE1-CB 4.18Å
67	K	89.4	Confident	91.8	Very high	83 Å²	83	22.4 Å²	22.4	36%	0.361	11%	0.11	S	C	.	.	H	α-helix	trans	-54.6	-32.8	-178.3	178.4	-169.3	168.1	-150.1	0	112.8	Y63 R274 D283	Y63-K67 HydrophobicContact CE1-CB 4.46Å; Y63-K67 HydrophobicContact CE1-CD 3.77Å; Y63-K67 VanDerWaalsContact O-CB 3.3Å; Y63-K67 WeakPolarHBondContact O-CB 3.42Å; Y63-K67 PolarHBondContact O-N 3.07Å; K67-R274 PolarHBondContact O-NE 3.43Å; K67-D283 IonicContact NZ-OD2 3.45Å; K67-D283 PolarHBondContact NZ-OD2 3.09Å
68	N	92.7	Very high	91.9	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	13%	0.13	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104.7	29.4	-172.7	-65.4	-41.7	0	0	0	113.8	L64 C65 Y66 F73 R274 V280 D283	L64-N68 WeakPolarHBondContact O-CB 3.25Å; L64-N68 PolarHBondContact O-N 2.67Å; L64-N68 PolarHBondContact O-ND2 3.06Å; L64-N68 VanDerWaalsContact O-ND2 3.16Å; C65-N68 PolarHBondContact O-N 2.92Å; Y66-N68 PolarHBondContact O-N 2.85Å; N68-F73 HydrophobicContact CB-CB 4.35Å; N68-F73 HydrophobicContact CB-CD2 3.45Å; N68-F73 VanDerWaalsContact CB-CD2 3.45Å; N68-F73 HydrophobicContact CB-CE2 4.01Å; N68-F73 HydrophobicContact CB-CG 4.15Å; N68-R274 PolarHBondContact OD1-NH2 3.35Å; N68-V280 HydrophobicContact CB-CB 4.34Å; N68-V280 HydrophobicContact CB-CG1 4Å; N68-V280 HydrophobicContact CB-CG2 3.85Å; N68-D283 VanDerWaalsContact ND2-CB 3.3Å; N68-D283 WeakPolarHBondContact ND2-CB 3.15Å; N68-D283 PolarHBondContact ND2-OD2 2.87Å
69	G	91.4	Very high	92.3	Very high	8 Å²	8	28.6 Å²	28.6	8%	0.082	15%	0.145	C	C	.	.	T	Hydrogen-bonded Turn	trans	95.8	28.7	170.4	0	0	0	0	0	114.3	Y66 G71 A72 D271	Y66-G69 PolarHBondContact O-N 3.25Å; G69-G71 PolarHBondContact O-N 3.15Å; G69-A72 WeakPolarHBondContact O-CB 3.4Å; G69-A72 PolarHBondContact O-N 3.19Å; G69-D271 PolarHBondContact O-N 3.06Å
70	G	93.2	Very high	92.9	Very high	3 Å²	3	27.6 Å²	27.6	3%	0.031	14%	0.141	C	C	.	.	G	3₁₀ helix	trans	54.5	-121.2	176.7	0	0	0	0	0	111.8	C65 Y66 A72 F73 Y267	C65-G70 WeakPolarHBondContact O-CA 3.41Å; C65-G70 PolarHBondContact O-N 3.04Å; C65-G70 PolarHBondContact SG-O 2.99Å; Y66-G70 PolarHBondContact O-N 2.91Å; G70-A72 PolarHBondContact O-N 2.87Å; G70-A72 VanDerWaalsContact O-N 3.11Å; G70-F73 VanDerWaalsContact O-CB 3.27Å; G70-F73 WeakPolarHBondContact O-CB 3.3Å; G70-F73 PolarHBondContact O-N 3.31Å; G70-F73 VanDerWaalsContact O-N 3.07Å; G70-Y267 CarbonylContact C-O 3.51Å; G70-Y267 WeakPolarHBondContact CA-O 3.5Å
71	G	93.3	Very high	93.2	Very high	21 Å²	21	25.7 Å²	25.7	22%	0.216	14%	0.135	C	C	.	.	G	3₁₀ helix	trans	-58.5	-24.2	179.8	0	0	0	0	0	114.9	G69 F73 F74 L268	G69-G71 PolarHBondContact O-N 3.15Å; G71-F73 VanDerWaalsContact C-N 3.27Å; G71-F73 PolarHBondContact O-N 3.06Å; G71-F74 WeakPolarHBondContact O-CD2 3.18Å; G71-F74 PolarHBondContact O-N 3.04Å; G71-L268 VanDerWaalsContact CA-O 3.23Å; G71-L268 WeakPolarHBondContact CA-O 2.93Å; G71-L268 PolarHBondContact N-O 3.27Å
72	A	95.5	Very high	93.4	Very high	5 Å²	5	28.5 Å²	28.5	4%	0.041	15%	0.152	C	C	.	.	G	3₁₀ helix	trans	-66.7	-30	177.9	0	0	0	0	0	112.1	G69 G70 F74 V75 P76 P270 D271 L275	G69-A72 WeakPolarHBondContact O-CB 3.4Å; G69-A72 PolarHBondContact O-N 3.19Å; G70-A72 PolarHBondContact O-N 2.87Å; G70-A72 VanDerWaalsContact O-N 3.11Å; A72-F74 PolarHBondContact O-N 3.45Å; A72-F74 VanDerWaalsContact O-N 3.12Å; A72-V75 PolarHBondContact O-N 3.09Å; A72-V75 VanDerWaalsContact O-N 3.08Å; A72-P76 WeakPolarHBondContact O-CD 3.42Å; A72-P270 HydrophobicContact CB-CB 4.38Å; A72-D271 WeakPolarHBondContact CB-O 3.49Å; A72-L275 HydrophobicContact CB-CD1 4.49Å; A72-L275 HydrophobicContact CB-CD2 4.42Å; A72-L275 HydrophobicContact CB-CG 4.23Å; A72-L275 WeakPolarHBondContact O-CD2 3.14Å
73	F	95.9	Very high	93.5	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	16%	0.159	C	C	.	.	G	3₁₀ helix	trans	-58.9	-25.1	178.8	-178	-111.6	0	0	0	113.4	F61 L64 C65 N68 G70 G71 V75 P76 Y77 V280 D283 A284	F61-F73 HydrophobicContact CE2-CE1 4.27Å; L64-F73 HydrophobicContact CB-CE1 4.37Å; L64-F73 HydrophobicContact CB-CZ 4.1Å; C65-F73 HydrophobicContact CB-CD1 4.05Å; N68-F73 HydrophobicContact CB-CB 4.35Å; N68-F73 HydrophobicContact CB-CD2 3.45Å; N68-F73 VanDerWaalsContact CB-CD2 3.45Å; N68-F73 HydrophobicContact CB-CE2 4.01Å; N68-F73 HydrophobicContact CB-CG 4.15Å; G70-F73 VanDerWaalsContact O-CB 3.27Å; G70-F73 WeakPolarHBondContact O-CB 3.3Å; G70-F73 PolarHBondContact O-N 3.31Å; G70-F73 VanDerWaalsContact O-N 3.07Å; G71-F73 VanDerWaalsContact C-N 3.27Å; G71-F73 PolarHBondContact O-N 3.06Å; F73-V75 PolarHBondContact O-N 3.44Å; F73-P76 WeakPolarHBondContact O-CD 3.49Å; F73-P76 VanDerWaalsContact O-CG 3.27Å; F73-P76 WeakPolarHBondContact O-CG 3.5Å; F73-Y77 HydrophobicContact CE1-CD2 4.05Å; F73-Y77 HydrophobicContact CZ-CD2 4.48Å; F73-Y77 VanDerWaalsContact O-CB 3.31Å; F73-Y77 WeakPolarHBondContact O-CB 3.48Å; F73-Y77 PolarHBondContact O-N 2.98Å; F73-Y77 VanDerWaalsContact O-N 3.14Å; F73-V280 HydrophobicContact CD2-CG1 4.09Å; F73-D283 HydrophobicContact CE2-CB 4.41Å; F73-A284 HydrophobicContact CD2-CB 4.41Å; F73-A284 HydrophobicContact CE2-CB 3.63Å; F73-A284 HydrophobicContact CZ-CB 3.92Å
74	F	95.1	Very high	93.9	Very high	46 Å²	46	27 Å²	27	20%	0.202	15%	0.149	C	C	.	.	H	α-helix	trans	-65.3	-25	177.7	-73.8	-85.2	0	0	0	113.2	F61 C65 G71 A72 V78 L268 F328	F61-F74 HydrophobicContact CE1-CE1 4.49Å; F61-F74 HydrophobicContact CE1-CZ 4.28Å; F61-F74 AromaticContact CZ-CE1 3.76Å; F61-F74 HydrophobicContact CZ-CE1 3.76Å; F61-F74 AromaticContact CZ-CZ 3.89Å; F61-F74 HydrophobicContact CZ-CZ 3.89Å; C65-F74 WeakPolarHBondContact SG-CE2 3.36Å; G71-F74 WeakPolarHBondContact O-CD2 3.18Å; G71-F74 PolarHBondContact O-N 3.04Å; A72-F74 PolarHBondContact O-N 3.45Å; A72-F74 VanDerWaalsContact O-N 3.12Å; F74-V78 VanDerWaalsContact O-CB 3.29Å; F74-V78 WeakPolarHBondContact O-CB 3.47Å; F74-V78 WeakPolarHBondContact O-CG2 3.25Å; F74-V78 PolarHBondContact O-N 2.62Å; F74-L268 HydrophobicContact CE2-CD2 3.99Å; F74-F328 AromaticContact CE1-CD2 3.71Å; F74-F328 HydrophobicContact CE1-CD2 3.71Å; F74-F328 HydrophobicContact CE1-CE2 4.16Å; F74-F328 HydrophobicContact CE2-CE2 4.38Å; F74-F328 AromaticContact CZ-CD2 3.49Å; F74-F328 HydrophobicContact CZ-CD2 3.49Å; F74-F328 VanDerWaalsContact CZ-CD2 3.49Å; F74-F328 AromaticContact CZ-CE2 3.74Å; F74-F328 HydrophobicContact CZ-CE2 3.74Å
75	V	95.6	Very high	94.1	Very high	75 Å²	75	26.4 Å²	26.4	46%	0.455	15%	0.146	S	C	.	.	H	α-helix	trans	-61.2	-61.1	177.5	175.7	0	0	0	0	111.1	A72 F73 Y77 V78 I79 L275	A72-V75 PolarHBondContact O-N 3.09Å; A72-V75 VanDerWaalsContact O-N 3.08Å; F73-V75 PolarHBondContact O-N 3.44Å; V75-Y77 VanDerWaalsContact C-N 3.33Å; V75-Y77 PolarHBondContact O-N 2.92Å; V75-V78 PolarHBondContact O-N 3.23Å; V75-I79 HydrophobicContact CG1-CD1 4.27Å; V75-I79 WeakPolarHBondContact O-CG1 3.43Å; V75-I79 PolarHBondContact O-N 2.95Å; V75-L275 HydrophobicContact CB-CD1 4.42Å; V75-L275 HydrophobicContact CB-CD2 4.45Å; V75-L275 HydrophobicContact CG2-CD1 4.46Å
76	P	94.9	Very high	94.3	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-63.3	-40	176.1	24	-33	0	0	0	111.4	A72 F73 V78 I79 F80 L275 V280 W281 A284	A72-P76 WeakPolarHBondContact O-CD 3.42Å; F73-P76 WeakPolarHBondContact O-CD 3.49Å; F73-P76 VanDerWaalsContact O-CG 3.27Å; F73-P76 WeakPolarHBondContact O-CG 3.5Å; P76-V78 PolarHBondContact O-N 3.15Å; P76-I79 WeakPolarHBondContact O-CB 3.48Å; P76-I79 PolarHBondContact O-N 2.62Å; P76-I79 VanDerWaalsContact O-N 3.15Å; P76-F80 HydrophobicContact CB-CE2 4.49Å; P76-F80 WeakPolarHBondContact O-CD2 3.29Å; P76-F80 PolarHBondContact O-N 3.01Å; P76-L275 HydrophobicContact CG-CD2 4.1Å; P76-V280 HydrophobicContact CG-CG1 3.92Å; P76-W281 HydrophobicContact CB-CD2 3.77Å; P76-W281 HydrophobicContact CB-CE3 3.55Å; P76-W281 HydrophobicContact CB-CG 4.38Å; P76-W281 HydrophobicContact CB-CH2 4.17Å; P76-W281 HydrophobicContact CB-CZ2 4.37Å; P76-W281 HydrophobicContact CB-CZ3 3.76Å; P76-A284 HydrophobicContact CB-CB 3.81Å; P76-A284 HydrophobicContact CG-CB 4.1Å
77	Y	95.7	Very high	94.7	Very high	7 Å²	7	25.2 Å²	25.2	3%	0.027	14%	0.142	C	C	.	.	H	α-helix	trans	-56.9	-46.4	179.5	-174.7	-92.2	0	0	0	112.9	F61 F73 V75 I79 F80 F81 Q287 I288 S324	F61-Y77 HydrophobicContact CD2-CD2 4.39Å; F61-Y77 AromaticContact CD2-CE2 3.76Å; F61-Y77 HydrophobicContact CD2-CE2 3.76Å; F61-Y77 HydrophobicContact CE2-CD1 4.37Å; F61-Y77 AromaticContact CE2-CD2 3.79Å; F61-Y77 HydrophobicContact CE2-CD2 3.79Å; F61-Y77 HydrophobicContact CE2-CE1 4.04Å; F61-Y77 AromaticContact CE2-CE2 3.41Å; F61-Y77 HydrophobicContact CE2-CE2 3.41Å; F61-Y77 VanDerWaalsContact CE2-CE2 3.41Å; F61-Y77 HydrophobicContact CE2-CG 4.26Å; F61-Y77 AromaticContact CE2-CZ 3.54Å; F73-Y77 HydrophobicContact CE1-CD2 4.05Å; F73-Y77 HydrophobicContact CZ-CD2 4.48Å; F73-Y77 VanDerWaalsContact O-CB 3.31Å; F73-Y77 WeakPolarHBondContact O-CB 3.48Å; F73-Y77 PolarHBondContact O-N 2.98Å; F73-Y77 VanDerWaalsContact O-N 3.14Å; V75-Y77 VanDerWaalsContact C-N 3.33Å; V75-Y77 PolarHBondContact O-N 2.92Å; Y77-I79 PolarHBondContact O-N 3.13Å; Y77-F80 PolarHBondContact O-N 3.39Å; Y77-F81 WeakPolarHBondContact O-CB 3.39Å; Y77-F81 PolarHBondContact O-N 2.94Å; Y77-Q287 HydrophobicContact CE2-CG 4.05Å; Y77-I288 HydrophobicContact CD1-CD1 4.31Å; Y77-I288 HydrophobicContact CD2-CD1 3.9Å; Y77-I288 HydrophobicContact CD2-CG1 3.99Å; Y77-I288 HydrophobicContact CE1-CD1 3.82Å; Y77-I288 HydrophobicContact CE2-CD1 3.36Å; Y77-I288 HydrophobicContact CE2-CG1 3.81Å; Y77-I288 HydrophobicContact CG-CD1 4.34Å; Y77-S324 VanDerWaalsContact CE1-OG 3.32Å; Y77-S324 WeakPolarHBondContact CE1-OG 3.5Å; Y77-S324 PolarHBondContact OH-OG 3.27Å
78	V	95.9	Very high	95.1	Very high	74 Å²	74	21.3 Å²	21.3	45%	0.448	13%	0.126	S	C	.	.	H	α-helix	trans	-67.8	-35	178.2	170.8	0	0	0	0	111.7	F74 V75 P76 F81 V82	F74-V78 VanDerWaalsContact O-CB 3.29Å; F74-V78 WeakPolarHBondContact O-CB 3.47Å; F74-V78 WeakPolarHBondContact O-CG2 3.25Å; F74-V78 PolarHBondContact O-N 2.62Å; V75-V78 PolarHBondContact O-N 3.23Å; P76-V78 PolarHBondContact O-N 3.15Å; V78-F81 WeakPolarHBondContact O-CB 3.43Å; V78-F81 PolarHBondContact O-N 3.41Å; V78-V82 HydrophobicContact CG1-CG2 4.49Å; V78-V82 WeakPolarHBondContact O-CG2 3.45Å; V78-V82 PolarHBondContact O-N 3.02Å
79	I	94.9	Very high	95.4	Very high	66 Å²	66	21.3 Å²	21.3	34%	0.338	13%	0.126	S	C	.	.	H	α-helix	trans	-61.6	-48.3	173.7	-68.9	166	0	0	0	110	V75 P76 Y77 F81 V82 C83 W281	V75-I79 HydrophobicContact CG1-CD1 4.27Å; V75-I79 WeakPolarHBondContact O-CG1 3.43Å; V75-I79 PolarHBondContact O-N 2.95Å; P76-I79 WeakPolarHBondContact O-CB 3.48Å; P76-I79 PolarHBondContact O-N 2.62Å; P76-I79 VanDerWaalsContact O-N 3.15Å; Y77-I79 PolarHBondContact O-N 3.13Å; I79-F81 VanDerWaalsContact C-N 3.34Å; I79-F81 PolarHBondContact O-N 3.39Å; I79-V82 PolarHBondContact O-N 3.15Å; I79-C83 VanDerWaalsContact O-CB 3.22Å; I79-C83 WeakPolarHBondContact O-CB 3.5Å; I79-C83 PolarHBondContact O-N 3.43Å; I79-C83 PolarHBondContact O-SG 3.35Å; I79-W281 HydrophobicContact CD1-CH2 3.72Å; I79-W281 HydrophobicContact CD1-CZ3 3.77Å
80	F	95	Very high	95.7	Very high	3 Å²	3	21 Å²	21	1%	0.013	12%	0.122	C	C	.	.	H	α-helix	trans	-63.6	-40.3	176	-78	-73.2	0	0	0	112.7	P76 Y77 V82 C84 G85 W281 A284 I288 I505 I509	P76-F80 HydrophobicContact CB-CE2 4.49Å; P76-F80 WeakPolarHBondContact O-CD2 3.29Å; P76-F80 PolarHBondContact O-N 3.01Å; Y77-F80 PolarHBondContact O-N 3.39Å; F80-V82 VanDerWaalsContact C-N 3.34Å; F80-V82 PolarHBondContact O-N 3.48Å; F80-C84 HydrophobicContact CD1-CB 4.38Å; F80-C84 CarbonylContact O-C 3.55Å; F80-C84 WeakPolarHBondContact O-CA 3.43Å; F80-C84 WeakPolarHBondContact O-CB 3.42Å; F80-C84 PolarHBondContact O-N 3.14Å; F80-G85 PolarHBondContact O-N 3.4Å; F80-W281 HydrophobicContact CE2-CE3 4.05Å; F80-W281 VanDerWaalsContact CE2-O 3.25Å; F80-W281 WeakPolarHBondContact CE2-O 3.49Å; F80-A284 HydrophobicContact CD2-CB 3.88Å; F80-A284 HydrophobicContact CE2-CB 4.13Å; F80-I288 HydrophobicContact CB-CB 4.16Å; F80-I288 HydrophobicContact CB-CG1 3.74Å; F80-I288 HydrophobicContact CB-CG2 4.45Å; F80-I505 HydrophobicContact CD1-CG2 4.12Å; F80-I505 HydrophobicContact CE1-CG2 3.35Å; F80-I505 HydrophobicContact CZ-CG2 3.98Å; F80-I509 HydrophobicContact CD1-CD1 4.47Å; F80-I509 HydrophobicContact CE1-CD1 3.15Å; F80-I509 HydrophobicContact CE2-CD1 4.45Å; F80-I509 HydrophobicContact CZ-CD1 3.14Å; F80-I509 HydrophobicContact CZ-CG1 4.24Å
81	F	95.8	Very high	95.8	Very high	33 Å²	33	20.9 Å²	20.9	15%	0.145	12%	0.121	C	C	.	.	I	π-helix	trans	-55.5	-47.4	176.6	170.9	-111.3	0	0	0	112.1	Y77 V78 I79 I86 I288 Y292 C320	Y77-F81 WeakPolarHBondContact O-CB 3.39Å; Y77-F81 PolarHBondContact O-N 2.94Å; V78-F81 WeakPolarHBondContact O-CB 3.43Å; V78-F81 PolarHBondContact O-N 3.41Å; I79-F81 VanDerWaalsContact C-N 3.34Å; I79-F81 PolarHBondContact O-N 3.39Å; F81-I86 HydrophobicContact CD1-CD1 4.28Å; F81-I86 HydrophobicContact CD2-CD1 4.43Å; F81-I86 HydrophobicContact CD2-CG1 4.33Å; F81-I86 HydrophobicContact CE1-CD1 3.72Å; F81-I86 HydrophobicContact CE2-CD1 3.9Å; F81-I86 HydrophobicContact CE2-CG1 3.93Å; F81-I86 HydrophobicContact CZ-CD1 3.53Å; F81-I86 HydrophobicContact CZ-CG1 4.09Å; F81-I86 PolarHBondContact O-N 3.06Å; F81-I288 HydrophobicContact CB-CD1 4.06Å; F81-Y292 HydrophobicContact CD2-CE2 4.17Å; F81-Y292 AromaticContact CD2-CZ 3.82Å; F81-Y292 WeakPolarHBondContact CD2-OH 3.23Å; F81-Y292 HydrophobicContact CE2-CE2 4.22Å; F81-Y292 WeakPolarHBondContact CE2-OH 3.3Å; F81-C320 HydrophobicContact CE2-CB 3.96Å
82	V	95.9	Very high	96	Very high	58 Å²	58	19.9 Å²	19.9	35%	0.352	11%	0.11	S	C	.	.	I	π-helix	trans	-80.6	-40.7	-178	177.3	0	0	0	0	112.5	V78 I79 F80 P87 L493	V78-V82 HydrophobicContact CG1-CG2 4.49Å; V78-V82 WeakPolarHBondContact O-CG2 3.45Å; V78-V82 PolarHBondContact O-N 3.02Å; I79-V82 PolarHBondContact O-N 3.15Å; F80-V82 VanDerWaalsContact C-N 3.34Å; F80-V82 PolarHBondContact O-N 3.48Å; V82-P87 VanDerWaalsContact O-CD 3.28Å; V82-P87 WeakPolarHBondContact O-CD 3.5Å; V82-P87 WeakPolarHBondContact O-CG 3.44Å; V82-L493 HydrophobicContact CG1-CD2 4.17Å
83	C	95.3	Very high	96.1	Very high	23 Å²	23	19.7 Å²	19.7	16%	0.155	11%	0.109	C	C	.	.	I	π-helix	trans	-90.4	-21.4	-171.7	-63.4	0	0	0	0	114.3	I79 T502 I505	I79-C83 VanDerWaalsContact O-CB 3.22Å; I79-C83 WeakPolarHBondContact O-CB 3.5Å; I79-C83 PolarHBondContact O-N 3.43Å; I79-C83 PolarHBondContact O-SG 3.35Å; C83-T502 PolarHBondContact O-OG1 2.04Å; C83-I505 HydrophobicContact CB-CD1 3.75Å
84	C	94.9	Very high	96.2	Very high	0 Å²	0	19.7 Å²	19.7	0%	0	11%	0.109	C	C	.	.	I	π-helix	trans	-128	-54.9	-177	-58.4	0	0	0	0	112.2	F80 P87 V88 F289 T502	F80-C84 HydrophobicContact CD1-CB 4.38Å; F80-C84 CarbonylContact O-C 3.55Å; F80-C84 WeakPolarHBondContact O-CA 3.43Å; F80-C84 WeakPolarHBondContact O-CB 3.42Å; F80-C84 PolarHBondContact O-N 3.14Å; C84-P87 WeakPolarHBondContact O-CD 3.3Å; C84-V88 WeakPolarHBondContact O-CB 3.49Å; C84-V88 VanDerWaalsContact O-CG2 3.26Å; C84-V88 WeakPolarHBondContact O-CG2 3.34Å; C84-V88 PolarHBondContact O-N 3.23Å; C84-F289 HydrophobicContact CB-CE2 3.74Å; C84-F289 HydrophobicContact CB-CZ 4.01Å; C84-T502 HydrophobicContact CB-CG2 4.37Å
85	G	95.7	Very high	96.2	Very high	0 Å²	0	17.6 Å²	17.6	0%	0	10%	0.1	C	C	.	.	I	π-helix	trans	-55.4	-69.3	-175.1	0	0	0	0	0	113.3	F80 V88 F89	F80-G85 PolarHBondContact O-N 3.4Å; G85-V88 PolarHBondContact O-N 3.3Å; G85-F89 WeakPolarHBondContact O-CB 3.35Å; G85-F89 PolarHBondContact O-N 3.04Å
86	I	96.9	Very high	96.3	Very high	23 Å²	23	14 Å²	14	12%	0.118	8%	0.078	C	C	.	.	H	α-helix	trans	-55.5	-48.4	179.8	-68.1	167.4	0	0	0	111.9	F81 F90 I317 C320	F81-I86 HydrophobicContact CD1-CD1 4.28Å; F81-I86 HydrophobicContact CD2-CD1 4.43Å; F81-I86 HydrophobicContact CD2-CG1 4.33Å; F81-I86 HydrophobicContact CE1-CD1 3.72Å; F81-I86 HydrophobicContact CE2-CD1 3.9Å; F81-I86 HydrophobicContact CE2-CG1 3.93Å; F81-I86 HydrophobicContact CZ-CD1 3.53Å; F81-I86 HydrophobicContact CZ-CG1 4.09Å; F81-I86 PolarHBondContact O-N 3.06Å; I86-F90 VanDerWaalsContact O-CB 3.29Å; I86-F90 WeakPolarHBondContact O-CB 3.37Å; I86-F90 PolarHBondContact O-N 3.46Å; I86-I317 HydrophobicContact CG2-CG1 4.44Å; I86-C320 HydrophobicContact CG1-CB 3.72Å
87	P	96.9	Very high	96.3	Very high	1 Å²	1	14 Å²	14	1%	0.006	8%	0.078	C	C	.	.	H	α-helix	trans	-59.3	-51.7	-179.5	-26.7	35.7	0	0	0	113.4	V82 C84 F90 L91 C497 W498	V82-P87 VanDerWaalsContact O-CD 3.28Å; V82-P87 WeakPolarHBondContact O-CD 3.5Å; V82-P87 WeakPolarHBondContact O-CG 3.44Å; C84-P87 WeakPolarHBondContact O-CD 3.3Å; P87-F90 PolarHBondContact O-N 3.33Å; P87-L91 WeakPolarHBondContact O-CB 3.46Å; P87-L91 PolarHBondContact O-N 3.17Å; P87-C497 HydrophobicContact CB-CB 3.61Å; P87-C497 HydrophobicContact CG-CB 3.42Å; P87-C497 VanDerWaalsContact CG-CB 3.42Å; P87-W498 PolarHBondContact O-NE1 3.34Å
88	V	97.1	Very high	96.3	Very high	1 Å²	1	13.8 Å²	13.8	1%	0.006	8%	0.077	C	C	.	.	H	α-helix	trans	-68.6	-40.3	-176.6	179.7	0	0	0	0	110.7	C84 G85 F90 L91 E92 I294 T502	C84-V88 WeakPolarHBondContact O-CB 3.49Å; C84-V88 VanDerWaalsContact O-CG2 3.26Å; C84-V88 WeakPolarHBondContact O-CG2 3.34Å; C84-V88 PolarHBondContact O-N 3.23Å; G85-V88 PolarHBondContact O-N 3.3Å; V88-F90 VanDerWaalsContact C-N 3.29Å; V88-F90 PolarHBondContact O-N 3.13Å; V88-L91 WeakPolarHBondContact O-CB 3.2Å; V88-L91 PolarHBondContact O-N 3.3Å; V88-L91 VanDerWaalsContact O-N 3.11Å; V88-E92 PolarHBondContact O-N 3.15Å; V88-I294 HydrophobicContact CB-CB 4.48Å; V88-I294 HydrophobicContact CB-CD1 3.91Å; V88-I294 HydrophobicContact CB-CG2 4.46Å; V88-I294 HydrophobicContact CG1-CB 3.86Å; V88-I294 HydrophobicContact CG1-CD1 4.01Å; V88-I294 HydrophobicContact CG1-CG1 4.48Å; V88-I294 HydrophobicContact CG1-CG2 4.19Å; V88-T502 HydrophobicContact CG2-CG2 3.49Å; V88-T502 VanDerWaalsContact CG2-CG2 3.49Å
89	F	97.8	Very high	96.3	Very high	1 Å²	1	10.4 Å²	10.4	0%	0.004	6%	0.057	C	C	.	.	H	α-helix	trans	-55.8	-46.5	174.8	-167.6	-78.9	0	0	0	112	V48 I52 G85 T93 Y292 I294 L299 C316 L319	V48-F89 HydrophobicContact CG1-CE1 4.42Å; V48-F89 HydrophobicContact CG1-CZ 3.63Å; I52-F89 HydrophobicContact CG2-CE2 3.72Å; I52-F89 HydrophobicContact CG2-CZ 4.21Å; G85-F89 WeakPolarHBondContact O-CB 3.35Å; G85-F89 PolarHBondContact O-N 3.04Å; F89-T93 WeakPolarHBondContact O-CB 3.3Å; F89-T93 PolarHBondContact O-N 3.22Å; F89-T93 VanDerWaalsContact O-N 3.16Å; F89-T93 PolarHBondContact O-OG1 3.29Å; F89-Y292 AromaticContact CD2-CD2 3.98Å; F89-Y292 HydrophobicContact CD2-CD2 3.98Å; F89-Y292 WeakPolarHBondContact CE2-O 3.42Å; F89-I294 HydrophobicContact CB-CG2 3.95Å; F89-I294 HydrophobicContact CD2-CG2 3.96Å; F89-I294 HydrophobicContact CG-CG2 4.43Å; F89-L299 HydrophobicContact CB-CD1 4.37Å; F89-L299 HydrophobicContact CD1-CD1 4.3Å; F89-L299 HydrophobicContact CD2-CD1 3.29Å; F89-L299 HydrophobicContact CD2-CD2 4.3Å; F89-L299 HydrophobicContact CD2-CG 4.42Å; F89-L299 HydrophobicContact CE1-CD1 4.41Å; F89-L299 HydrophobicContact CE1-CD2 4.33Å; F89-L299 HydrophobicContact CE2-CD1 3.41Å; F89-L299 VanDerWaalsContact CE2-CD1 3.41Å; F89-L299 HydrophobicContact CE2-CD2 3.53Å; F89-L299 HydrophobicContact CE2-CG 4.11Å; F89-L299 HydrophobicContact CG-CD1 3.77Å; F89-L299 HydrophobicContact CZ-CD1 4.01Å; F89-L299 HydrophobicContact CZ-CD2 3.56Å; F89-L299 HydrophobicContact CZ-CG 4.43Å; F89-C316 HydrophobicContact CD1-CB 3.79Å; F89-C316 HydrophobicContact CE1-CB 4.15Å; F89-L319 HydrophobicContact CE1-CB 4.45Å; F89-L319 HydrophobicContact CE1-CD1 4.5Å; F89-L319 HydrophobicContact CZ-CB 4.38Å
90	F	97.6	Very high	96.2	Very high	1 Å²	1	9 Å²	9	0%	0.004	5%	0.052	C	C	.	.	H	α-helix	trans	-69	-37.6	177.4	178.7	-130	0	0	0	112.2	I86 P87 V88 A94 Y313 C316 I482 P490 I494 W498	I86-F90 VanDerWaalsContact O-CB 3.29Å; I86-F90 WeakPolarHBondContact O-CB 3.37Å; I86-F90 PolarHBondContact O-N 3.46Å; P87-F90 PolarHBondContact O-N 3.33Å; V88-F90 VanDerWaalsContact C-N 3.29Å; V88-F90 PolarHBondContact O-N 3.13Å; F90-A94 HydrophobicContact CD2-CB 4.29Å; F90-A94 HydrophobicContact CE2-CB 3.99Å; F90-A94 HydrophobicContact CZ-CB 4.4Å; F90-A94 WeakPolarHBondContact O-CB 3.33Å; F90-A94 PolarHBondContact O-N 3Å; F90-Y313 HydrophobicContact CD1-CD2 4.1Å; F90-Y313 HydrophobicContact CD2-CD2 4.31Å; F90-Y313 AromaticContact CE1-CD2 3.8Å; F90-Y313 HydrophobicContact CE1-CD2 3.8Å; F90-Y313 VanDerWaalsContact CE2-CA 3.4Å; F90-Y313 HydrophobicContact CE2-CD2 4.05Å; F90-Y313 HydrophobicContact CE2-CG 4.36Å; F90-Y313 HydrophobicContact CG-CD2 4.34Å; F90-Y313 AromaticContact CZ-CD2 3.77Å; F90-Y313 HydrophobicContact CZ-CD2 3.77Å; F90-Y313 HydrophobicContact CZ-CG 4.17Å; F90-C316 HydrophobicContact CB-CB 4.17Å; F90-C316 HydrophobicContact CD2-CB 4.16Å; F90-I482 HydrophobicContact CE1-CD1 3.9Å; F90-I482 HydrophobicContact CE1-CG2 4.46Å; F90-I482 HydrophobicContact CZ-CD1 3.97Å; F90-I482 HydrophobicContact CZ-CG1 4.43Å; F90-I482 HydrophobicContact CZ-CG2 3.79Å; F90-P490 HydrophobicContact CE1-CB 4.24Å; F90-P490 HydrophobicContact CE1-CG 3.93Å; F90-P490 HydrophobicContact CZ-CG 4.04Å; F90-I494 HydrophobicContact CD1-CD1 4.33Å; F90-I494 HydrophobicContact CD1-CG2 3.94Å; F90-I494 HydrophobicContact CE1-CG2 4.44Å; F90-W498 AromaticContact CD1-CH2 3.76Å; F90-W498 HydrophobicContact CD1-CH2 3.76Å; F90-W498 AromaticContact CD1-CZ2 3.58Å; F90-W498 HydrophobicContact CD1-CZ2 3.58Å; F90-W498 AromaticContact CE1-CH2 3.83Å; F90-W498 HydrophobicContact CE1-CH2 3.83Å; F90-W498 HydrophobicContact CE1-CZ2 4.16Å; F90-W498 HydrophobicContact CG-CZ2 4.4Å
91	L	97	Very high	96.1	Very high	0 Å²	0	10.2 Å²	10.2	0%	0	6%	0.058	C	C	.	.	H	α-helix	trans	-56.2	-55.6	175.8	-177.4	159.3	0	0	0	110.3	P87 V88 A94 L95 I469 F478 W498	P87-L91 WeakPolarHBondContact O-CB 3.46Å; P87-L91 PolarHBondContact O-N 3.17Å; V88-L91 WeakPolarHBondContact O-CB 3.2Å; V88-L91 PolarHBondContact O-N 3.3Å; V88-L91 VanDerWaalsContact O-N 3.11Å; L91-A94 PolarHBondContact O-N 3.44Å; L91-L95 HydrophobicContact CD2-CD2 4.35Å; L91-L95 WeakPolarHBondContact O-CB 3.26Å; L91-L95 PolarHBondContact O-N 2.82Å; L91-I469 HydrophobicContact CD1-CB 3.98Å; L91-I469 HydrophobicContact CD1-CG1 4.03Å; L91-I469 HydrophobicContact CD1-CG2 4.11Å; L91-I469 HydrophobicContact CD2-CG1 4.14Å; L91-I469 HydrophobicContact CG-CG1 4.25Å; L91-I469 HydrophobicContact CG-CG2 4.48Å; L91-F478 HydrophobicContact CG-CE1 4.3Å; L91-W498 HydrophobicContact CB-CZ2 3.93Å; L91-W498 HydrophobicContact CD1-CD2 4.34Å; L91-W498 HydrophobicContact CD1-CG 4.11Å
92	E	97.3	Very high	95.8	Very high	0 Å²	0	8.7 Å²	8.7	0%	0	5%	0.052	C	C	.	.	H	α-helix	trans	-63.9	-45	-177.1	-70.3	-171.8	-162.4	0	0	112.6	V88 A94 L95 G96 C295 L299	V88-E92 PolarHBondContact O-N 3.15Å; E92-A94 PolarHBondContact O-N 2.94Å; E92-L95 PolarHBondContact O-N 3.35Å; E92-G96 PolarHBondContact O-N 2.9Å; E92-C295 WeakPolarHBondContact OE1-CA 3.12Å; E92-C295 PolarHBondContact OE1-N 3.38Å; E92-L299 HydrophobicContact CB-CB 3.9Å
93	T	97.2	Very high	95.5	Very high	2 Å²	2	6 Å²	6	1%	0.012	4%	0.035	C	C	.	.	H	α-helix	trans	-63.2	-44.7	-179.9	-55.1	0	0	0	0	111.1	F44 F89 Q97 C312	F44-T93 HydrophobicContact CZ-CG2 4.11Å; F89-T93 WeakPolarHBondContact O-CB 3.3Å; F89-T93 PolarHBondContact O-N 3.22Å; F89-T93 VanDerWaalsContact O-N 3.16Å; F89-T93 PolarHBondContact O-OG1 3.29Å; T93-Q97 WeakPolarHBondContact O-CB 3.38Å; T93-Q97 PolarHBondContact O-N 3.27Å; T93-C312 HydrophobicContact CG2-CB 4.17Å
94	A	96.9	Very high	95.5	Very high	0 Å²	0	5.2 Å²	5.2	0%	0	3%	0.03	C	C	.	.	H	α-helix	trans	-68	-38.1	177.9	0	0	0	0	0	111.7	F90 L91 E92 Q97 F98 F478 I482 M485	F90-A94 HydrophobicContact CD2-CB 4.29Å; F90-A94 HydrophobicContact CE2-CB 3.99Å; F90-A94 HydrophobicContact CZ-CB 4.4Å; F90-A94 WeakPolarHBondContact O-CB 3.33Å; F90-A94 PolarHBondContact O-N 3Å; L91-A94 PolarHBondContact O-N 3.44Å; E92-A94 PolarHBondContact O-N 2.94Å; A94-Q97 PolarHBondContact O-N 2.89Å; A94-F98 WeakPolarHBondContact O-CB 3.27Å; A94-F98 PolarHBondContact O-N 3.48Å; A94-F478 HydrophobicContact CB-CZ 4.06Å; A94-I482 HydrophobicContact CB-CD1 4.34Å; A94-I482 HydrophobicContact CB-CG1 4.21Å; A94-M485 HydrophobicContact CB-CE 4.17Å
95	L	96.6	Very high	95.5	Very high	1 Å²	1	5.6 Å²	5.6	1%	0.005	3%	0.032	C	C	.	.	H	α-helix	trans	-64.1	-45.7	178.1	-174.9	69.7	0	0	0	111.2	L91 E92 F98 T99 C106 W107 V110 I469 F478	L91-L95 HydrophobicContact CD2-CD2 4.35Å; L91-L95 WeakPolarHBondContact O-CB 3.26Å; L91-L95 PolarHBondContact O-N 2.82Å; E92-L95 PolarHBondContact O-N 3.35Å; L95-F98 PolarHBondContact O-N 2.94Å; L95-T99 WeakPolarHBondContact O-CB 3.47Å; L95-T99 WeakPolarHBondContact O-CG2 3.43Å; L95-T99 PolarHBondContact O-N 3.23Å; L95-T99 PolarHBondContact O-OG1 2.85Å; L95-C106 VanDerWaalsContact CD2-SG 3.53Å; L95-C106 WeakPolarHBondContact CG-SG 3.38Å; L95-W107 HydrophobicContact CD2-CD2 4.46Å; L95-W107 HydrophobicContact CD2-CH2 3.82Å; L95-W107 HydrophobicContact CD2-CZ2 3.65Å; L95-W107 HydrophobicContact CD2-CZ3 4.29Å; L95-V110 HydrophobicContact CD1-CG1 4.36Å; L95-V110 HydrophobicContact CD1-CG2 3.74Å; L95-I469 HydrophobicContact CD1-CD1 4.1Å; L95-F478 HydrophobicContact CB-CE2 4.38Å; L95-F478 HydrophobicContact CB-CZ 4.14Å; L95-F478 HydrophobicContact CD1-CE2 3.92Å; L95-F478 HydrophobicContact CD1-CZ 4.39Å
96	G	96.1	Very high	95.5	Very high	0 Å²	0	5.6 Å²	5.6	0%	0	3%	0.032	C	C	.	.	H	α-helix	trans	-59.1	-51.2	172.5	0	0	0	0	0	112.1	E92 F98 T99 S100 T300 S304	E92-G96 PolarHBondContact O-N 2.9Å; G96-F98 VanDerWaalsContact C-N 3.34Å; G96-F98 PolarHBondContact O-N 3.48Å; G96-T99 PolarHBondContact O-N 3.45Å; G96-T99 PolarHBondContact O-OG1 3.39Å; G96-S100 WeakPolarHBondContact O-CA 3.38Å; G96-S100 PolarHBondContact O-N 3.47Å; G96-T300 WeakPolarHBondContact CA-O 3.43Å; G96-S304 VanDerWaalsContact O-CA 3.25Å; G96-S304 WeakPolarHBondContact O-CA 3.38Å
97	Q	96.5	Very high	95.5	Very high	0 Å²	0	4.5 Å²	4.5	0%	0	3%	0.026	C	C	.	.	H	α-helix	trans	-61.6	-40.6	179.8	-175.7	176.1	-57.4	0	0	112.6	T93 A94 S100 G303 N306 S307 Y308 N310 M485	T93-Q97 WeakPolarHBondContact O-CB 3.38Å; T93-Q97 PolarHBondContact O-N 3.27Å; A94-Q97 PolarHBondContact O-N 2.89Å; Q97-S100 PolarHBondContact O-OG 2.87Å; Q97-G303 VanDerWaalsContact CA-O 3.23Å; Q97-G303 WeakPolarHBondContact CA-O 3.34Å; Q97-G303 PolarHBondContact N-O 3.43Å; Q97-N306 HydrophobicContact CB-CB 4.47Å; Q97-N306 HydrophobicContact CG-CB 3.95Å; Q97-N306 PolarHBondContact OE1-ND2 3.22Å; Q97-S307 PolarHBondContact NE2-O 3.37Å; Q97-Y308 PolarHBondContact NE2-O 3.18Å; Q97-N310 PolarHBondContact NE2-O 3.5Å; Q97-M485 HydrophobicContact CB-SD 4.33Å; Q97-M485 HydrophobicContact CG-SD 4.11Å
98	F	95.9	Very high	95.4	Very high	2 Å²	2	8.6 Å²	8.6	1%	0.009	4%	0.042	C	C	.	.	H	α-helix	trans	-67.6	-46.5	-179.8	179.5	-118.1	0	0	0	112	A94 L95 G96 Y308 N481 M485 L576 M578 R579	A94-F98 WeakPolarHBondContact O-CB 3.27Å; A94-F98 PolarHBondContact O-N 3.48Å; L95-F98 PolarHBondContact O-N 2.94Å; G96-F98 VanDerWaalsContact C-N 3.34Å; G96-F98 PolarHBondContact O-N 3.48Å; F98-Y308 AromaticContact CD2-CE2 3.75Å; F98-Y308 HydrophobicContact CD2-CE2 3.75Å; F98-Y308 HydrophobicContact CE2-CE2 4.2Å; F98-Y308 WeakPolarHBondContact CE2-OH 3.37Å; F98-N481 HydrophobicContact CD1-CB 4.48Å; F98-N481 HydrophobicContact CD2-CB 4Å; F98-N481 HydrophobicContact CE1-CB 4.22Å; F98-N481 VanDerWaalsContact CE1-ND2 3.33Å; F98-N481 WeakPolarHBondContact CE1-ND2 3.32Å; F98-N481 HydrophobicContact CE2-CB 3.73Å; F98-N481 HydrophobicContact CG-CB 4.38Å; F98-N481 HydrophobicContact CZ-CB 3.86Å; F98-N481 VanDerWaalsContact CZ-CG 3.43Å; F98-N481 WeakPolarHBondContact CZ-ND2 3.42Å; F98-M485 VanDerWaalsContact CA-SD 3.53Å; F98-M485 HydrophobicContact CB-CE 3.88Å; F98-M485 HydrophobicContact CB-SD 3.6Å; F98-M485 VanDerWaalsContact CB-SD 3.6Å; F98-M485 HydrophobicContact CD2-CG 4.3Å; F98-M485 HydrophobicContact CD2-SD 4.08Å; F98-M485 HydrophobicContact CG-SD 4.33Å; F98-L576 HydrophobicContact CD1-CD1 4.02Å; F98-L576 HydrophobicContact CD1-CD2 4.46Å; F98-L576 HydrophobicContact CD1-CG 4.4Å; F98-L576 HydrophobicContact CE1-CD1 3.66Å; F98-L576 HydrophobicContact CE1-CD2 3.75Å; F98-L576 HydrophobicContact CE1-CG 3.58Å; F98-L576 HydrophobicContact CZ-CD1 4.23Å; F98-L576 HydrophobicContact CZ-CG 4.06Å; F98-M578 HydrophobicContact CE2-CG 4.4Å; F98-R579 PolarHBondContact O-NH2 3.42Å
99	T	94.5	Very high	95.2	Very high	4 Å²	4	11 Å²	11	3%	0.025	5%	0.052	C	C	.	.	H	α-helix	trans	-78.2	-30.4	-177.6	57.9	0	0	0	0	112.3	L95 G96 E101 C106 V110 L576	L95-T99 WeakPolarHBondContact O-CB 3.47Å; L95-T99 WeakPolarHBondContact O-CG2 3.43Å; L95-T99 PolarHBondContact O-N 3.23Å; L95-T99 PolarHBondContact O-OG1 2.85Å; G96-T99 PolarHBondContact O-N 3.45Å; G96-T99 PolarHBondContact O-OG1 3.39Å; T99-E101 WeakPolarHBondContact O-CG 3.33Å; T99-C106 HydrophobicContact CG2-CB 4.41Å; T99-V110 HydrophobicContact CG2-CG2 3.69Å; T99-L576 HydrophobicContact CG2-CD1 3.9Å
100	S	93.8	Very high	95.1	Very high	35 Å²	35	11 Å²	11	25%	0.245	5%	0.052	C	C	.	.	T	Hydrogen-bonded Turn	trans	54.4	43.1	-169.3	-51.3	0	0	0	0	111.5	R35 G96 Q97 R579	R35-S100 PolarHBondContact NH1-O 3.23Å; G96-S100 WeakPolarHBondContact O-CA 3.38Å; G96-S100 PolarHBondContact O-N 3.47Å; Q97-S100 PolarHBondContact O-OG 2.87Å; S100-R579 PolarHBondContact OG-NH2 2.9Å
101	E	91.9	Very high	95	Very high	30 Å²	30	11 Å²	11	14%	0.14	5%	0.052	C	C	.	.			trans	-138.9	154.7	-175	-71.8	-67.3	167	0	0	110.7	T99 T105 C106 K109 S304	T99-E101 WeakPolarHBondContact O-CG 3.33Å; E101-T105 WeakPolarHBondContact CB-OG1 3.32Å; E101-T105 WeakPolarHBondContact OE2-CB 3.43Å; E101-T105 PolarHBondContact OE2-OG1 2.99Å; E101-C106 HydrophobicContact CB-CB 4.24Å; E101-K109 HydrophobicContact CG-CD 4.12Å; E101-K109 WeakPolarHBondContact OE1-CE 3.44Å; E101-K109 IonicContact OE1-NZ 2.67Å; E101-K109 PolarHBondContact OE1-NZ 3.42Å; E101-S304 VanDerWaalsContact O-CB 3.28Å; E101-S304 WeakPolarHBondContact O-CB 3.29Å
102	G	91	Very high	94.8	Very high	0 Å²	0	12.1 Å²	12.1	0%	0	6%	0.059	C	C	.	.			trans	-70.8	178.2	175.4	0	0	0	0	0	114.2	I104 T105 C106 D406	G102-I104 VanDerWaalsContact C-N 3.29Å; G102-I104 PolarHBondContact O-N 3Å; G102-I104 VanDerWaalsContact O-N 3.11Å; G102-T105 PolarHBondContact N-OG1 3.34Å; G102-T105 PolarHBondContact O-N 3.12Å; G102-C106 WeakPolarHBondContact O-CB 3.31Å; G102-C106 PolarHBondContact O-N 3.01Å; G102-D406 PolarHBondContact N-OD2 3.23Å
103	G	89.4	Confident	94.8	Very high	1 Å²	1	12.5 Å²	12.5	1%	0.01	6%	0.061	C	C	.	.	H	α-helix	trans	-55.6	-32.7	-170.1	0	0	0	0	0	115.6	G118	G103-G118 WeakPolarHBondContact O-CA 3.39Å
104	I	95.6	Very high	94.7	Very high	8 Å²	8	13.2 Å²	13.2	4%	0.041	6%	0.064	C	C	.	.	H	α-helix	trans	-88.5	-51.7	-180	-61.6	169.5	0	0	0	111.9	G102 C106 W107 R108 E115 Y119 Q122 A403 M407	G102-I104 VanDerWaalsContact C-N 3.29Å; G102-I104 PolarHBondContact O-N 3Å; G102-I104 VanDerWaalsContact O-N 3.11Å; I104-C106 PolarHBondContact O-N 3.43Å; I104-W107 PolarHBondContact O-N 3.42Å; I104-R108 PolarHBondContact O-N 2.8Å; I104-R108 VanDerWaalsContact O-N 3.14Å; I104-E115 HydrophobicContact CG2-CG 4.3Å; I104-Y119 HydrophobicContact CD1-CD1 3.84Å; I104-Y119 HydrophobicContact CD1-CE1 3.82Å; I104-Y119 HydrophobicContact CD1-CG 4.46Å; I104-Y119 HydrophobicContact CG2-CD2 4.4Å; I104-Y119 HydrophobicContact CG2-CE1 4.35Å; I104-Y119 HydrophobicContact CG2-CE2 3.92Å; I104-Q122 HydrophobicContact CD1-CB 4.47Å; I104-Q122 HydrophobicContact CD1-CG 3.76Å; I104-Q122 HydrophobicContact CG1-CG 3.78Å; I104-A403 HydrophobicContact CD1-CB 4.26Å; I104-A403 HydrophobicContact CG1-CB 4.38Å; I104-M407 HydrophobicContact CB-CG 4.4Å; I104-M407 HydrophobicContact CB-SD 4.09Å; I104-M407 HydrophobicContact CD1-SD 3.48Å; I104-M407 WeakPolarHBondContact CD1-SD 3.29Å; I104-M407 HydrophobicContact CG1-SD 4.38Å; I104-M407 HydrophobicContact CG2-CG 4.32Å; I104-M407 HydrophobicContact CG2-SD 3.87Å
105	T	94.6	Very high	94.7	Very high	7 Å²	7	13.8 Å²	13.8	4%	0.043	7%	0.067	C	C	.	.	H	α-helix	trans	-66.6	-28.4	-174.4	48.2	0	0	0	0	112.4	E101 G102 R108 K109 D406 M407	E101-T105 WeakPolarHBondContact CB-OG1 3.32Å; E101-T105 WeakPolarHBondContact OE2-CB 3.43Å; E101-T105 PolarHBondContact OE2-OG1 2.99Å; G102-T105 PolarHBondContact N-OG1 3.34Å; G102-T105 PolarHBondContact O-N 3.12Å; T105-R108 PolarHBondContact O-N 3.06Å; T105-K109 WeakPolarHBondContact O-CG 3.26Å; T105-K109 PolarHBondContact O-N 3.43Å; T105-D406 HydrophobicContact CG2-CB 4.3Å; T105-M407 HydrophobicContact CG2-CG 3.92Å
106	C	95.3	Very high	94.7	Very high	0 Å²	0	13.9 Å²	13.9	0%	0	7%	0.068	C	C	.	.	H	α-helix	trans	-55.8	-56.3	170.3	171.3	0	0	0	0	112.3	L95 T99 E101 G102 I104 R108 K109 V110 T300	L95-C106 VanDerWaalsContact CD2-SG 3.53Å; L95-C106 WeakPolarHBondContact CG-SG 3.38Å; T99-C106 HydrophobicContact CG2-CB 4.41Å; E101-C106 HydrophobicContact CB-CB 4.24Å; G102-C106 WeakPolarHBondContact O-CB 3.31Å; G102-C106 PolarHBondContact O-N 3.01Å; I104-C106 PolarHBondContact O-N 3.43Å; C106-R108 VanDerWaalsContact C-N 3.32Å; C106-R108 PolarHBondContact O-N 3.42Å; C106-K109 PolarHBondContact O-N 3.43Å; C106-K109 VanDerWaalsContact O-N 3.13Å; C106-V110 VanDerWaalsContact O-CG2 3.29Å; C106-V110 WeakPolarHBondContact O-CG2 3.2Å; C106-V110 PolarHBondContact O-N 2.97Å; C106-T300 HydrophobicContact CB-CG2 4.17Å
107	W	96.3	Very high	94.8	Very high	1 Å²	1	13.9 Å²	13.9	0%	0.004	7%	0.068	C	C	.	.	H	α-helix	trans	-63.8	-37.6	179	-68.7	113.7	0	0	0	112.1	L95 I104 K109 V110 C111 I117 E465 C468 I469	L95-W107 HydrophobicContact CD2-CD2 4.46Å; L95-W107 HydrophobicContact CD2-CH2 3.82Å; L95-W107 HydrophobicContact CD2-CZ2 3.65Å; L95-W107 HydrophobicContact CD2-CZ3 4.29Å; I104-W107 PolarHBondContact O-N 3.42Å; W107-K109 VanDerWaalsContact C-N 3.27Å; W107-K109 PolarHBondContact O-N 3.09Å; W107-V110 PolarHBondContact O-N 2.85Å; W107-C111 CarbonylContact O-C 3.43Å; W107-C111 PolarHBondContact O-N 3.25Å; W107-C111 VanDerWaalsContact O-O 3.09Å; W107-I117 HydrophobicContact CD2-CB 4.23Å; W107-I117 HydrophobicContact CD2-CD1 4.48Å; W107-I117 HydrophobicContact CD2-CG2 4.15Å; W107-I117 HydrophobicContact CE3-CD1 4.29Å; W107-I117 HydrophobicContact CG-CB 4.27Å; W107-I117 HydrophobicContact CG-CG2 4.43Å; W107-I117 HydrophobicContact CH2-CD1 4.4Å; W107-I117 HydrophobicContact CZ2-CG2 3.88Å; W107-I117 HydrophobicContact CZ3-CD1 4.24Å; W107-E465 HydrophobicContact CH2-CB 4Å; W107-E465 HydrophobicContact CH2-CG 3.83Å; W107-E465 HydrophobicContact CZ2-CB 4.19Å; W107-E465 HydrophobicContact CZ2-CG 3.55Å; W107-C468 HydrophobicContact CZ3-CB 4.03Å; W107-I469 HydrophobicContact CH2-CD1 4.21Å; W107-I469 HydrophobicContact CH2-CG1 3.94Å; W107-I469 HydrophobicContact CZ3-CD1 3.86Å; W107-I469 HydrophobicContact CZ3-CG1 3.99Å
108	R	94.9	Very high	94.8	Very high	87 Å²	87	13.9 Å²	13.9	33%	0.328	7%	0.068	S	C	.	.	H	α-helix	trans	-56.4	-39.1	173.6	-174	-178.1	-65.3	154.8	5.5	112.5	I104 T105 C106 P112 E115	I104-R108 PolarHBondContact O-N 2.8Å; I104-R108 VanDerWaalsContact O-N 3.14Å; T105-R108 PolarHBondContact O-N 3.06Å; C106-R108 VanDerWaalsContact C-N 3.32Å; C106-R108 PolarHBondContact O-N 3.42Å; R108-P112 WeakPolarHBondContact O-CD 3.41Å; R108-P112 WeakPolarHBondContact O-CG 3.46Å; R108-E115 HydrophobicContact CB-CG 4.13Å; R108-E115 WeakPolarHBondContact CG-OE2 3.35Å; R108-E115 IonicContact CZ-OE1 3.3Å; R108-E115 VanDerWaalsContact CZ-OE1 3.3Å; R108-E115 VanDerWaalsContact NE-CD 3.3Å; R108-E115 IonicContact NE-OE1 3.06Å; R108-E115 PolarHBondContact NE-OE1 2.78Å; R108-E115 IonicContact NE-OE2 3.12Å; R108-E115 PolarHBondContact NE-OE2 3.32Å; R108-E115 VanDerWaalsContact NE-OE2 3.12Å; R108-E115 IonicContact NH2-OE1 2.69Å; R108-E115 PolarHBondContact NH2-OE1 3.34Å
109	K	93.8	Very high	94.8	Very high	52 Å²	52	18 Å²	18	23%	0.226	8%	0.084	C	C	.	.	H	α-helix	trans	-80.1	-33.8	178.4	-70.9	-171.5	-171.4	178.9	0	113.1	E101 T105 C106 W107 P572 S573	E101-K109 HydrophobicContact CG-CD 4.12Å; E101-K109 WeakPolarHBondContact OE1-CE 3.44Å; E101-K109 IonicContact OE1-NZ 2.67Å; E101-K109 PolarHBondContact OE1-NZ 3.42Å; T105-K109 WeakPolarHBondContact O-CG 3.26Å; T105-K109 PolarHBondContact O-N 3.43Å; C106-K109 PolarHBondContact O-N 3.43Å; C106-K109 VanDerWaalsContact O-N 3.13Å; W107-K109 VanDerWaalsContact C-N 3.27Å; W107-K109 PolarHBondContact O-N 3.09Å; K109-P572 CarbonylContact O-C 3.6Å; K109-P572 WeakPolarHBondContact O-CA 3.13Å; K109-S573 PolarHBondContact O-N 3.37Å
110	V	94.4	Very high	95	Very high	1 Å²	1	17.8 Å²	17.8	1%	0.006	8%	0.083	C	C	.	.	H	α-helix	trans	-80.7	-51.5	-174.8	170.1	0	0	0	0	110.8	L95 T99 C106 W107 I469 Y473 L576	L95-V110 HydrophobicContact CD1-CG1 4.36Å; L95-V110 HydrophobicContact CD1-CG2 3.74Å; T99-V110 HydrophobicContact CG2-CG2 3.69Å; C106-V110 VanDerWaalsContact O-CG2 3.29Å; C106-V110 WeakPolarHBondContact O-CG2 3.2Å; C106-V110 PolarHBondContact O-N 2.97Å; W107-V110 PolarHBondContact O-N 2.85Å; V110-I469 HydrophobicContact CG1-CD1 3.84Å; V110-Y473 HydrophobicContact CG1-CD1 4.46Å; V110-Y473 HydrophobicContact CG1-CD2 3.51Å; V110-Y473 HydrophobicContact CG1-CE2 3.81Å; V110-Y473 HydrophobicContact CG1-CG 3.86Å; V110-Y473 VanDerWaalsContact O-CD2 3.31Å; V110-Y473 WeakPolarHBondContact O-CD2 3.28Å; V110-L576 HydrophobicContact CG2-CD2 3.9Å
111	C	95.2	Very high	95.1	Very high	0 Å²	0	16.1 Å²	16.1	0%	0	7%	0.072	C	C	.	.			trans	-151.3	93.8	177.8	-166.3	0	0	0	0	109.9	W107 L113 F114 C468	W107-C111 CarbonylContact O-C 3.43Å; W107-C111 PolarHBondContact O-N 3.25Å; W107-C111 VanDerWaalsContact O-O 3.09Å; C111-L113 PolarHBondContact O-N 3.37Å; C111-F114 PolarHBondContact O-N 2.89Å; C111-C468 VanDerWaalsContact CB-SG 3.55Å
112	P	94.8	Very high	95.2	Very high	23 Å²	23	15.5 Å²	15.5	15%	0.149	7%	0.069	C	C	.	.	G	3₁₀ helix	trans	-50.7	-32.3	-179.5	-25.8	27.8	0	0	0	114.7	R108 F114 E115 M554 L569	R108-P112 WeakPolarHBondContact O-CD 3.41Å; R108-P112 WeakPolarHBondContact O-CG 3.46Å; P112-F114 PolarHBondContact O-N 3.48Å; P112-E115 WeakPolarHBondContact O-CB 3.43Å; P112-E115 PolarHBondContact O-N 2.78Å; P112-M554 HydrophobicContact CB-CE 3.8Å; P112-M554 VanDerWaalsContact O-CE 3.29Å; P112-M554 WeakPolarHBondContact O-CE 3.32Å; P112-L569 HydrophobicContact CB-CD2 4.04Å; P112-L569 VanDerWaalsContact CD-O 3.25Å; P112-L569 WeakPolarHBondContact CD-O 3.4Å
113	L	96.1	Very high	95.5	Very high	9 Å²	9	17.4 Å²	17.4	5%	0.047	8%	0.08	C	C	.	.	G	3₁₀ helix	trans	-56.4	-37.1	176.3	-171.3	63.5	0	0	0	112.8	C111 I551 I555 M566 L569 T570	C111-L113 PolarHBondContact O-N 3.37Å; L113-I551 HydrophobicContact CD1-CG2 4.02Å; L113-I551 HydrophobicContact CG-CG1 4.47Å; L113-I551 HydrophobicContact CG-CG2 4.5Å; L113-I551 WeakPolarHBondContact O-CG1 3.28Å; L113-I555 HydrophobicContact CD1-CD1 4.09Å; L113-I555 HydrophobicContact CD1-CG1 3.89Å; L113-M566 HydrophobicContact CD1-SD 4.49Å; L113-M566 HydrophobicContact CD2-CE 3.68Å; L113-M566 HydrophobicContact CD2-SD 4.47Å; L113-L569 HydrophobicContact CB-CB 3.94Å; L113-L569 HydrophobicContact CD1-CB 4.16Å; L113-L569 HydrophobicContact CD1-CD1 3.99Å; L113-L569 PolarHBondContact N-O 3.32Å; L113-T570 HydrophobicContact CD2-CG2 3.97Å
114	F	96.3	Very high	95.8	Very high	16 Å²	16	17.3 Å²	17.3	7%	0.07	8%	0.08	C	C	.	.	G	3₁₀ helix	trans	-102.1	20.1	-176.5	-72.6	-80.8	0	0	0	112.7	C111 P112 G116 I117 F464 C468 V472 I551	C111-F114 PolarHBondContact O-N 2.89Å; P112-F114 PolarHBondContact O-N 3.48Å; F114-G116 PolarHBondContact O-N 2.96Å; F114-I117 HydrophobicContact CB-CD1 3.78Å; F114-I117 HydrophobicContact CB-CG1 4.17Å; F114-I117 HydrophobicContact CD1-CD1 4.02Å; F114-I117 HydrophobicContact CD1-CG1 4.4Å; F114-I117 HydrophobicContact CG-CD1 4.23Å; F114-I117 WeakPolarHBondContact O-CB 3.27Å; F114-I117 WeakPolarHBondContact O-CG1 3.36Å; F114-I117 PolarHBondContact O-N 3.43Å; F114-F464 HydrophobicContact CD1-CD1 4.5Å; F114-F464 AromaticContact CE1-CD1 3.93Å; F114-F464 HydrophobicContact CE1-CD1 3.93Å; F114-C468 HydrophobicContact CB-CB 4.31Å; F114-C468 HydrophobicContact CD1-CB 4.44Å; F114-C468 HydrophobicContact CD2-CB 4.03Å; F114-C468 HydrophobicContact CG-CB 4Å; F114-V472 HydrophobicContact CE2-CB 4.27Å; F114-V472 HydrophobicContact CE2-CG1 4.13Å; F114-V472 HydrophobicContact CE2-CG2 3.83Å; F114-V472 HydrophobicContact CZ-CG2 4.37Å; F114-I551 HydrophobicContact CD1-CD1 4.13Å; F114-I551 HydrophobicContact CE1-CD1 3.77Å; F114-I551 HydrophobicContact CZ-CD1 4.45Å
115	E	95.8	Very high	95.7	Very high	13 Å²	13	17 Å²	17	6%	0.061	8%	0.078	C	C	.	.	H	α-helix	trans	-54.2	-29.2	173.9	-174	-179	154	0	0	112.3	I104 R108 P112 I117 G118 Y119	I104-E115 HydrophobicContact CG2-CG 4.3Å; R108-E115 HydrophobicContact CB-CG 4.13Å; R108-E115 WeakPolarHBondContact CG-OE2 3.35Å; R108-E115 IonicContact CZ-OE1 3.3Å; R108-E115 VanDerWaalsContact CZ-OE1 3.3Å; R108-E115 VanDerWaalsContact NE-CD 3.3Å; R108-E115 IonicContact NE-OE1 3.06Å; R108-E115 PolarHBondContact NE-OE1 2.78Å; R108-E115 IonicContact NE-OE2 3.12Å; R108-E115 PolarHBondContact NE-OE2 3.32Å; R108-E115 VanDerWaalsContact NE-OE2 3.12Å; R108-E115 IonicContact NH2-OE1 2.69Å; R108-E115 PolarHBondContact NH2-OE1 3.34Å; P112-E115 WeakPolarHBondContact O-CB 3.43Å; P112-E115 PolarHBondContact O-N 2.78Å; E115-I117 PolarHBondContact O-N 3.18Å; E115-I117 VanDerWaalsContact O-N 3.15Å; E115-G118 PolarHBondContact O-N 3.48Å; E115-Y119 HydrophobicContact CG-CD2 4.4Å; E115-Y119 HydrophobicContact CG-CE2 3.92Å; E115-Y119 WeakPolarHBondContact OE1-CE2 3.45Å; E115-Y119 PolarHBondContact OE1-OH 3.08Å
116	G	96.9	Very high	95.8	Very high	3 Å²	3	18.6 Å²	18.6	3%	0.031	9%	0.092	C	C	.	.	H	α-helix	trans	-57.6	-23.3	174.9	0	0	0	0	0	115	F114 G118 Y119 A120 C546	F114-G116 PolarHBondContact O-N 2.96Å; G116-G118 VanDerWaalsContact C-N 3.35Å; G116-Y119 PolarHBondContact O-N 3.39Å; G116-A120 WeakPolarHBondContact O-CB 3.39Å; G116-A120 PolarHBondContact O-N 3.23Å; G116-C546 WeakPolarHBondContact CA-O 3.43Å
117	I	97.4	Very high	95.8	Very high	0 Å²	0	20.4 Å²	20.4	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-60.9	-46.4	172.3	-64.5	179.5	0	0	0	110.1	W107 F114 E115 Y119 A120 T121 V461 F464 E465 C468 I547	W107-I117 HydrophobicContact CD2-CB 4.23Å; W107-I117 HydrophobicContact CD2-CD1 4.48Å; W107-I117 HydrophobicContact CD2-CG2 4.15Å; W107-I117 HydrophobicContact CE3-CD1 4.29Å; W107-I117 HydrophobicContact CG-CB 4.27Å; W107-I117 HydrophobicContact CG-CG2 4.43Å; W107-I117 HydrophobicContact CH2-CD1 4.4Å; W107-I117 HydrophobicContact CZ2-CG2 3.88Å; W107-I117 HydrophobicContact CZ3-CD1 4.24Å; F114-I117 HydrophobicContact CB-CD1 3.78Å; F114-I117 HydrophobicContact CB-CG1 4.17Å; F114-I117 HydrophobicContact CD1-CD1 4.02Å; F114-I117 HydrophobicContact CD1-CG1 4.4Å; F114-I117 HydrophobicContact CG-CD1 4.23Å; F114-I117 WeakPolarHBondContact O-CB 3.27Å; F114-I117 WeakPolarHBondContact O-CG1 3.36Å; F114-I117 PolarHBondContact O-N 3.43Å; E115-I117 PolarHBondContact O-N 3.18Å; E115-I117 VanDerWaalsContact O-N 3.15Å; I117-Y119 VanDerWaalsContact C-N 3.33Å; I117-Y119 PolarHBondContact O-N 3.21Å; I117-A120 WeakPolarHBondContact O-CB 3.37Å; I117-A120 PolarHBondContact O-N 3.4Å; I117-A120 VanDerWaalsContact O-N 3.15Å; I117-T121 WeakPolarHBondContact O-CG2 3.3Å; I117-T121 PolarHBondContact O-N 3.11Å; I117-V461 HydrophobicContact CG2-CG1 4.24Å; I117-F464 HydrophobicContact CD1-CB 4.01Å; I117-F464 HydrophobicContact CG1-CB 4.24Å; I117-E465 HydrophobicContact CD1-CG 4.09Å; I117-E465 HydrophobicContact CG2-CG 3.42Å; I117-E465 VanDerWaalsContact CG2-CG 3.42Å; I117-E465 WeakPolarHBondContact CG2-OE1 3.13Å; I117-C468 HydrophobicContact CD1-CB 4.21Å; I117-I547 HydrophobicContact CG1-CD1 4.22Å; I117-I547 HydrophobicContact CG1-CG1 4.15Å
118	G	96.6	Very high	95.6	Very high	0 Å²	0	21 Å²	21	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-60.6	-43	178.5	0	0	0	0	0	112	G103 E115 G116 T121 Q122	G103-G118 WeakPolarHBondContact O-CA 3.39Å; E115-G118 PolarHBondContact O-N 3.48Å; G116-G118 VanDerWaalsContact C-N 3.35Å; G118-T121 PolarHBondContact O-N 3.25Å; G118-T121 PolarHBondContact O-OG1 3.06Å; G118-Q122 VanDerWaalsContact O-CG 3.28Å; G118-Q122 WeakPolarHBondContact O-CG 3.38Å; G118-Q122 PolarHBondContact O-N 2.9Å; G118-Q122 VanDerWaalsContact O-N 3.11Å
119	Y	97.1	Very high	95.6	Very high	87 Å²	87	17 Å²	17	34%	0.341	9%	0.088	S	C	.	.	H	α-helix	trans	-65	-40	175.1	-70.1	-77.2	0	0	0	112.3	I104 E115 G116 I117 T121 Q122 V123 M407	I104-Y119 HydrophobicContact CD1-CD1 3.84Å; I104-Y119 HydrophobicContact CD1-CE1 3.82Å; I104-Y119 HydrophobicContact CD1-CG 4.46Å; I104-Y119 HydrophobicContact CG2-CD2 4.4Å; I104-Y119 HydrophobicContact CG2-CE1 4.35Å; I104-Y119 HydrophobicContact CG2-CE2 3.92Å; E115-Y119 HydrophobicContact CG-CD2 4.4Å; E115-Y119 HydrophobicContact CG-CE2 3.92Å; E115-Y119 WeakPolarHBondContact OE1-CE2 3.45Å; E115-Y119 PolarHBondContact OE1-OH 3.08Å; G116-Y119 PolarHBondContact O-N 3.39Å; I117-Y119 VanDerWaalsContact C-N 3.33Å; I117-Y119 PolarHBondContact O-N 3.21Å; Y119-T121 PolarHBondContact O-N 3.4Å; Y119-Q122 PolarHBondContact O-N 3.5Å; Y119-V123 VanDerWaalsContact O-CG2 3.3Å; Y119-V123 WeakPolarHBondContact O-CG2 3.3Å; Y119-V123 PolarHBondContact O-N 2.87Å; Y119-M407 HydrophobicContact CE1-CE 4.36Å; Y119-M407 HydrophobicContact CE1-SD 4.5Å; Y119-M407 WeakPolarHBondContact OH-CE 3.37Å
120	A	97.3	Very high	95.6	Very high	0 Å²	0	14.8 Å²	14.8	0%	0	8%	0.08	C	C	.	.	H	α-helix	trans	-59.1	-47.4	177.5	0	0	0	0	0	111.7	G116 I117 V123 I124 V461 S543 C546 I547	G116-A120 WeakPolarHBondContact O-CB 3.39Å; G116-A120 PolarHBondContact O-N 3.23Å; I117-A120 WeakPolarHBondContact O-CB 3.37Å; I117-A120 PolarHBondContact O-N 3.4Å; I117-A120 VanDerWaalsContact O-N 3.15Å; A120-V123 PolarHBondContact O-N 3.34Å; A120-I124 WeakPolarHBondContact O-CG1 3.15Å; A120-I124 PolarHBondContact O-N 3.34Å; A120-V461 HydrophobicContact CB-CG2 4.15Å; A120-S543 VanDerWaalsContact CB-O 3.27Å; A120-S543 WeakPolarHBondContact CB-O 3.45Å; A120-C546 HydrophobicContact CB-CB 4Å; A120-I547 HydrophobicContact CB-CD1 4.15Å; A120-I547 HydrophobicContact CB-CG1 3.9Å
121	T	95.8	Very high	95.6	Very high	1 Å²	1	15.2 Å²	15.2	1%	0.006	8%	0.081	C	C	.	.	H	α-helix	trans	-63.8	-42.5	178.6	59.3	0	0	0	0	111.9	I117 G118 Y119 V123 I124 E125 C295 V461	I117-T121 WeakPolarHBondContact O-CG2 3.3Å; I117-T121 PolarHBondContact O-N 3.11Å; G118-T121 PolarHBondContact O-N 3.25Å; G118-T121 PolarHBondContact O-OG1 3.06Å; Y119-T121 PolarHBondContact O-N 3.4Å; T121-V123 VanDerWaalsContact C-N 3.32Å; T121-V123 PolarHBondContact O-N 2.95Å; T121-I124 PolarHBondContact O-N 3.43Å; T121-E125 WeakPolarHBondContact O-CB 3.3Å; T121-E125 PolarHBondContact O-N 3.19Å; T121-C295 WeakPolarHBondContact CG2-O 3.47Å; T121-V461 HydrophobicContact CG2-CG1 3.81Å
122	Q	95.9	Very high	95.5	Very high	16 Å²	16	16.5 Å²	16.5	8%	0.075	9%	0.086	C	C	.	.	H	α-helix	trans	-65.8	-32.2	176.6	-62.7	-45.3	-73.8	0	0	113.1	I104 G118 Y119 A126 S399 L400 A403	I104-Q122 HydrophobicContact CD1-CB 4.47Å; I104-Q122 HydrophobicContact CD1-CG 3.76Å; I104-Q122 HydrophobicContact CG1-CG 3.78Å; G118-Q122 VanDerWaalsContact O-CG 3.28Å; G118-Q122 WeakPolarHBondContact O-CG 3.38Å; G118-Q122 PolarHBondContact O-N 2.9Å; G118-Q122 VanDerWaalsContact O-N 3.11Å; Y119-Q122 PolarHBondContact O-N 3.5Å; Q122-A126 WeakPolarHBondContact O-CB 3.28Å; Q122-A126 PolarHBondContact O-N 2.92Å; Q122-S399 PolarHBondContact OE1-O 3.42Å; Q122-L400 HydrophobicContact CB-CD2 4.2Å; Q122-L400 WeakPolarHBondContact O-CD2 3.48Å; Q122-A403 HydrophobicContact CG-CB 3.92Å; Q122-A403 VanDerWaalsContact OE1-CB 3.32Å
123	V	96.4	Very high	95.6	Very high	40 Å²	40	15.4 Å²	15.4	24%	0.242	8%	0.079	C	C	.	.	H	α-helix	trans	-68.4	-42.7	173.8	172.4	0	0	0	0	110.7	Y119 A120 T121 E125 A126 H127 S542	Y119-V123 VanDerWaalsContact O-CG2 3.3Å; Y119-V123 WeakPolarHBondContact O-CG2 3.3Å; Y119-V123 PolarHBondContact O-N 2.87Å; A120-V123 PolarHBondContact O-N 3.34Å; T121-V123 VanDerWaalsContact C-N 3.32Å; T121-V123 PolarHBondContact O-N 2.95Å; V123-E125 VanDerWaalsContact C-N 3.34Å; V123-A126 PolarHBondContact O-N 3.28Å; V123-H127 PolarHBondContact O-N 3.27Å; V123-H127 PolarHBondContact O-ND1 3.38Å; V123-S542 WeakPolarHBondContact CG1-OG 3.32Å
124	I	95.4	Very high	95.6	Very high	0 Å²	0	15 Å²	15	0%	0	8%	0.077	C	C	.	.	H	α-helix	trans	-60.1	-48	175.6	-62.9	167.9	0	0	0	109.9	A120 T121 A126 H127 L128 L296 A453 C457 L458 V461 S543	A120-I124 WeakPolarHBondContact O-CG1 3.15Å; A120-I124 PolarHBondContact O-N 3.34Å; T121-I124 PolarHBondContact O-N 3.43Å; I124-A126 VanDerWaalsContact C-N 3.34Å; I124-A126 PolarHBondContact O-N 3.21Å; I124-H127 PolarHBondContact O-N 3.24Å; I124-H127 VanDerWaalsContact O-N 3.16Å; I124-L128 PolarHBondContact O-N 3.46Å; I124-L296 HydrophobicContact CB-CD2 4.28Å; I124-L296 HydrophobicContact CG2-CD2 3.43Å; I124-L296 VanDerWaalsContact CG2-CD2 3.43Å; I124-A453 HydrophobicContact CG2-CB 4.01Å; I124-C457 HydrophobicContact CD1-CB 3.85Å; I124-C457 HydrophobicContact CG1-CB 4.3Å; I124-L458 HydrophobicContact CD1-CD2 4.29Å; I124-L458 HydrophobicContact CG2-CD2 4.31Å; I124-V461 HydrophobicContact CD1-CG2 4Å; I124-S543 VanDerWaalsContact CG1-CB 3.48Å
125	E	94.4	Very high	95.6	Very high	0 Å²	0	14.6 Å²	14.6	0%	0	8%	0.075	C	C	.	.	H	α-helix	trans	-57.5	-43.2	176.1	-83.6	-61.3	126.5	0	0	112.9	T121 V123 H127 L128 N129 L296 C298 C396 L400	T121-E125 WeakPolarHBondContact O-CB 3.3Å; T121-E125 PolarHBondContact O-N 3.19Å; V123-E125 VanDerWaalsContact C-N 3.34Å; E125-H127 VanDerWaalsContact C-N 3.29Å; E125-H127 PolarHBondContact O-N 3.42Å; E125-L128 PolarHBondContact O-N 2.86Å; E125-N129 WeakPolarHBondContact O-CB 3.49Å; E125-N129 PolarHBondContact O-N 3.32Å; E125-L296 HydrophobicContact CG-CB 4.37Å; E125-L296 WeakPolarHBondContact CG-O 3.36Å; E125-L296 VanDerWaalsContact OE1-CB 3.24Å; E125-L296 WeakPolarHBondContact OE1-CB 3.48Å; E125-L296 WeakPolarHBondContact OE1-CD1 3.43Å; E125-L296 WeakPolarHBondContact OE1-CD2 3.48Å; E125-C298 PolarHBondContact OE1-SG 3.23Å; E125-C298 VanDerWaalsContact OE1-SG 3.4Å; E125-C396 WeakPolarHBondContact OE2-CA 3.35Å; E125-C396 WeakPolarHBondContact OE2-CB 3.35Å; E125-L400 HydrophobicContact CB-CD2 3.88Å; E125-L400 HydrophobicContact CB-CG 4.09Å
126	A	95.3	Very high	95.6	Very high	42 Å²	42	14 Å²	14	35%	0.347	7%	0.073	S	C	.	.	H	α-helix	trans	-61.1	-38.3	177.9	0	0	0	0	0	112.3	Q122 V123 I124 V130 L400	Q122-A126 WeakPolarHBondContact O-CB 3.28Å; Q122-A126 PolarHBondContact O-N 2.92Å; V123-A126 PolarHBondContact O-N 3.28Å; I124-A126 VanDerWaalsContact C-N 3.34Å; I124-A126 PolarHBondContact O-N 3.21Å; A126-V130 WeakPolarHBondContact O-CG2 3.44Å; A126-L400 HydrophobicContact CB-CD2 4.29Å
127	H	94.9	Very high	95.7	Very high	37 Å²	37	14 Å²	14	17%	0.171	7%	0.072	C	C	.	.	H	α-helix	trans	-68.3	-45.8	173.5	-69.2	89.7	0	0	0	111.3	V123 I124 E125 N129 V130 Y131 F448 A452 S542	V123-H127 PolarHBondContact O-N 3.27Å; V123-H127 PolarHBondContact O-ND1 3.38Å; I124-H127 PolarHBondContact O-N 3.24Å; I124-H127 VanDerWaalsContact O-N 3.16Å; E125-H127 VanDerWaalsContact C-N 3.29Å; E125-H127 PolarHBondContact O-N 3.42Å; H127-N129 VanDerWaalsContact C-N 3.33Å; H127-N129 PolarHBondContact O-N 3.13Å; H127-V130 PolarHBondContact O-N 2.92Å; H127-V130 VanDerWaalsContact O-N 3.14Å; H127-Y131 WeakPolarHBondContact O-CD1 3.44Å; H127-Y131 PolarHBondContact O-N 2.79Å; H127-F448 HydrophobicContact CB-CD1 4.27Å; H127-F448 HydrophobicContact CB-CE1 4.35Å; H127-F448 AromaticContact CD2-CE1 3.89Å; H127-A452 HydrophobicContact CB-CB 3.74Å; H127-S542 PolarHBondContact CE1-OG 3.06Å; H127-S542 VanDerWaalsContact CE1-OG 3.27Å
128	L	93.4	Very high	95.7	Very high	14 Å²	14	14 Å²	14	7%	0.073	7%	0.072	C	C	.	.	H	α-helix	trans	-59.2	-44.7	-179.3	-169.4	135.5	0	0	0	112.1	I124 E125 V130 Y131 Y132 C396 A453	I124-L128 PolarHBondContact O-N 3.46Å; E125-L128 PolarHBondContact O-N 2.86Å; L128-V130 PolarHBondContact O-N 2.72Å; L128-V130 VanDerWaalsContact O-N 3.17Å; L128-Y131 HydrophobicContact CB-CE1 4.18Å; L128-Y131 HydrophobicContact CD1-CE1 4.46Å; L128-Y131 HydrophobicContact CG-CE1 4.07Å; L128-Y131 PolarHBondContact O-N 3.36Å; L128-Y132 WeakPolarHBondContact O-CB 3.09Å; L128-Y132 PolarHBondContact O-N 3.45Å; L128-C396 HydrophobicContact CD2-CB 4.18Å; L128-C396 WeakPolarHBondContact CD2-SG 3.02Å; L128-A453 HydrophobicContact CB-CB 4.22Å; L128-A453 HydrophobicContact CD1-CB 3.82Å
129	N	93.6	Very high	95.7	Very high	2 Å²	2	14 Å²	14	1%	0.011	7%	0.072	C	C	.	.	H	α-helix	trans	-56.7	-31.7	177	-168.1	35.3	0	0	0	113.5	E125 H127 W218 Q393 V397 L400 S429	E125-N129 WeakPolarHBondContact O-CB 3.49Å; E125-N129 PolarHBondContact O-N 3.32Å; H127-N129 VanDerWaalsContact C-N 3.33Å; H127-N129 PolarHBondContact O-N 3.13Å; N129-W218 WeakPolarHBondContact OD1-CH2 3.47Å; N129-Q393 PolarHBondContact O-NE2 3.46Å; N129-Q393 PolarHBondContact OD1-NE2 2.98Å; N129-V397 WeakPolarHBondContact OD1-CG2 3.27Å; N129-L400 HydrophobicContact CB-CD1 4.12Å; N129-S429 PolarHBondContact ND2-OG 3.43Å
130	V	94.3	Very high	95.8	Very high	7 Å²	7	10.3 Å²	10.3	4%	0.042	6%	0.058	C	C	.	.	H	α-helix	trans	-78.9	-45.5	-179.3	171.6	0	0	0	0	112.1	A126 H127 L128 I432 M436 F448	A126-V130 WeakPolarHBondContact O-CG2 3.44Å; H127-V130 PolarHBondContact O-N 2.92Å; H127-V130 VanDerWaalsContact O-N 3.14Å; L128-V130 PolarHBondContact O-N 2.72Å; L128-V130 VanDerWaalsContact O-N 3.17Å; V130-I432 HydrophobicContact CG1-CB 3.99Å; V130-I432 HydrophobicContact CG1-CG2 3.61Å; V130-I432 HydrophobicContact CG2-CB 4.38Å; V130-I432 HydrophobicContact CG2-CD1 4.48Å; V130-I432 HydrophobicContact CG2-CG2 4.36Å; V130-M436 HydrophobicContact CG1-CE 3.72Å; V130-F448 HydrophobicContact CB-CE1 4.33Å; V130-F448 HydrophobicContact CG1-CE1 4.19Å; V130-F448 HydrophobicContact CG1-CZ 4.49Å
131	Y	93.8	Very high	95.8	Very high	9 Å²	9	10.6 Å²	10.6	4%	0.035	6%	0.059	C	C	.	.	H	α-helix	trans	-90.7	-34.7	-172.6	89.4	-89.1	0	0	0	113.2	H127 L128 I133 V134 F445 F448 D449 A453	H127-Y131 WeakPolarHBondContact O-CD1 3.44Å; H127-Y131 PolarHBondContact O-N 2.79Å; L128-Y131 HydrophobicContact CB-CE1 4.18Å; L128-Y131 HydrophobicContact CD1-CE1 4.46Å; L128-Y131 HydrophobicContact CG-CE1 4.07Å; L128-Y131 PolarHBondContact O-N 3.36Å; Y131-I133 VanDerWaalsContact C-N 3.3Å; Y131-I133 PolarHBondContact O-N 3.3Å; Y131-V134 VanDerWaalsContact O-CB 3.26Å; Y131-V134 WeakPolarHBondContact O-CB 3.49Å; Y131-V134 PolarHBondContact O-N 3.32Å; Y131-V134 VanDerWaalsContact O-N 3.08Å; Y131-F445 HydrophobicContact CD2-CD2 4.06Å; Y131-F445 AromaticContact CD2-CE2 3.62Å; Y131-F445 HydrophobicContact CD2-CE2 3.62Å; Y131-F445 AromaticContact CD2-CZ 3.99Å; Y131-F445 HydrophobicContact CD2-CZ 3.99Å; Y131-F445 HydrophobicContact CE2-CE2 4.36Å; Y131-F445 HydrophobicContact CE2-CZ 4.3Å; Y131-F445 WeakPolarHBondContact O-CE2 3.14Å; Y131-F448 HydrophobicContact CD1-CB 3.9Å; Y131-F448 HydrophobicContact CD1-CD1 4.18Å; Y131-F448 HydrophobicContact CD2-CB 4.33Å; Y131-F448 HydrophobicContact CG-CB 3.72Å; Y131-F448 HydrophobicContact CG-CD1 4.4Å; Y131-F448 HydrophobicContact CG-CG 4.43Å; Y131-D449 HydrophobicContact CD2-CB 4.33Å; Y131-D449 HydrophobicContact CE2-CB 3.73Å; Y131-D449 WeakPolarHBondContact CE2-OD1 3.49Å; Y131-D449 PolarHBondContact OH-OD1 3.11Å; Y131-A453 HydrophobicContact CE1-CB 4.06Å
132	Y	94.2	Very high	95.9	Very high	27 Å²	27	10.5 Å²	10.5	11%	0.106	6%	0.059	C	C	.	.	H	α-helix	trans	-62.6	-39.5	-175.2	-170.8	-98.4	0	0	0	111.6	L55 L128 V134 I135 L136 G389 S392 Q393	L55-Y132 HydrophobicContact CD1-CE2 4.19Å; L128-Y132 WeakPolarHBondContact O-CB 3.09Å; L128-Y132 PolarHBondContact O-N 3.45Å; Y132-V134 PolarHBondContact O-N 2.99Å; Y132-I135 HydrophobicContact CD2-CD1 3.98Å; Y132-I135 HydrophobicContact CE2-CD1 4.24Å; Y132-I135 VanDerWaalsContact O-CB 3.29Å; Y132-I135 WeakPolarHBondContact O-CB 3.29Å; Y132-I135 WeakPolarHBondContact O-CG1 3.22Å; Y132-I135 PolarHBondContact O-N 2.7Å; Y132-L136 HydrophobicContact CD1-CD1 4.36Å; Y132-L136 HydrophobicContact CE1-CD1 4.29Å; Y132-G389 WeakPolarHBondContact CE1-O 3.46Å; Y132-S392 PolarHBondContact OH-OG 3.42Å; Y132-Q393 HydrophobicContact CD1-CB 4.35Å
133	I	96.3	Very high	95.9	Very high	0 Å²	0	11 Å²	11	0%	0	6%	0.062	C	C	.	.	H	α-helix	trans	-64.3	-21.2	177.9	-156.4	171.1	0	0	0	114	Y131 I135 L136 A137 L214 A217 W218 Q393	Y131-I133 VanDerWaalsContact C-N 3.3Å; Y131-I133 PolarHBondContact O-N 3.3Å; I133-I135 PolarHBondContact O-N 3.21Å; I133-L136 HydrophobicContact CG1-CD2 4.4Å; I133-L136 WeakPolarHBondContact O-CB 3.29Å; I133-L136 PolarHBondContact O-N 3.49Å; I133-L136 VanDerWaalsContact O-N 3.13Å; I133-A137 PolarHBondContact O-N 3.37Å; I133-A137 VanDerWaalsContact O-N 3.12Å; I133-L214 HydrophobicContact CG2-CD1 3.69Å; I133-A217 HydrophobicContact CD1-CB 4.07Å; I133-A217 HydrophobicContact CG1-CB 3.86Å; I133-W218 HydrophobicContact CB-CZ2 4.42Å; I133-W218 HydrophobicContact CD1-CB 4.38Å; I133-W218 HydrophobicContact CD1-CD2 3.38Å; I133-W218 VanDerWaalsContact CD1-CE2 3.42Å; I133-W218 HydrophobicContact CD1-CE3 3.77Å; I133-W218 HydrophobicContact CD1-CG 3.66Å; I133-W218 HydrophobicContact CD1-CH2 4.21Å; I133-W218 HydrophobicContact CD1-CZ2 3.84Å; I133-W218 HydrophobicContact CD1-CZ3 4.17Å; I133-W218 HydrophobicContact CG2-CZ2 3.77Å; I133-Q393 HydrophobicContact CB-CG 4.27Å; I133-Q393 HydrophobicContact CD1-CG 4.04Å; I133-Q393 HydrophobicContact CG1-CG 4.1Å
134	V	96.9	Very high	96	Very high	0 Å²	0	14.6 Å²	14.6	0%	0	8%	0.075	C	C	.	.	H	α-helix	trans	-64	-30.5	174.8	-177.7	0	0	0	0	110.5	Y131 Y132 L136 A137 W138 L214 M436 F445	Y131-V134 VanDerWaalsContact O-CB 3.26Å; Y131-V134 WeakPolarHBondContact O-CB 3.49Å; Y131-V134 PolarHBondContact O-N 3.32Å; Y131-V134 VanDerWaalsContact O-N 3.08Å; Y132-V134 PolarHBondContact O-N 2.99Å; V134-L136 VanDerWaalsContact C-N 3.33Å; V134-L136 PolarHBondContact O-N 3.35Å; V134-A137 VanDerWaalsContact O-CB 3.3Å; V134-A137 WeakPolarHBondContact O-CB 3.47Å; V134-A137 PolarHBondContact O-N 2.91Å; V134-A137 VanDerWaalsContact O-N 3.15Å; V134-W138 HydrophobicContact CG1-CD2 4.48Å; V134-W138 HydrophobicContact CG1-CH2 4.49Å; V134-W138 HydrophobicContact CG1-CZ2 3.78Å; V134-W138 PolarHBondContact O-N 3.31Å; V134-L214 HydrophobicContact CG2-CD1 4.32Å; V134-M436 HydrophobicContact CG1-CB 4.21Å; V134-M436 HydrophobicContact CG2-CB 4Å; V134-M436 HydrophobicContact CG2-SD 3.9Å; V134-F445 HydrophobicContact CB-CD2 4.31Å; V134-F445 HydrophobicContact CB-CE2 4.49Å; V134-F445 HydrophobicContact CG1-CD2 4.45Å
135	I	95.7	Very high	96	Very high	8 Å²	8	16.1 Å²	16.1	4%	0.041	8%	0.083	C	C	.	.	H	α-helix	trans	-64.9	-40.2	174.8	-53.6	167.7	0	0	0	111.1	L55 W59 Y132 I133 A137 W138 A139 F361 F445	L55-I135 HydrophobicContact CD1-CB 4.14Å; L55-I135 HydrophobicContact CD1-CD1 4.03Å; L55-I135 HydrophobicContact CD1-CG2 3.51Å; W59-I135 HydrophobicContact CH2-CD1 4.01Å; W59-I135 HydrophobicContact CH2-CG1 4.41Å; W59-I135 HydrophobicContact CH2-CG2 3.6Å; W59-I135 HydrophobicContact CZ2-CD1 4Å; W59-I135 HydrophobicContact CZ2-CG2 4.47Å; W59-I135 HydrophobicContact CZ3-CG2 4.32Å; Y132-I135 HydrophobicContact CD2-CD1 3.98Å; Y132-I135 HydrophobicContact CE2-CD1 4.24Å; Y132-I135 VanDerWaalsContact O-CB 3.29Å; Y132-I135 WeakPolarHBondContact O-CB 3.29Å; Y132-I135 WeakPolarHBondContact O-CG1 3.22Å; Y132-I135 PolarHBondContact O-N 2.7Å; I133-I135 PolarHBondContact O-N 3.21Å; I135-A137 VanDerWaalsContact C-N 3.27Å; I135-A137 PolarHBondContact O-N 3.41Å; I135-W138 HydrophobicContact CB-CE3 4.28Å; I135-W138 HydrophobicContact CG1-CE3 4.21Å; I135-W138 HydrophobicContact CG1-CZ3 4.01Å; I135-W138 HydrophobicContact CG2-CE3 4.3Å; I135-W138 WeakPolarHBondContact O-CB 3.31Å; I135-W138 PolarHBondContact O-N 3.44Å; I135-A139 PolarHBondContact O-N 3.38Å; I135-F361 HydrophobicContact CG2-CE2 4Å; I135-F361 HydrophobicContact CG2-CZ 4.06Å; I135-F445 HydrophobicContact CD1-CE2 4.24Å; I135-F445 HydrophobicContact CD1-CZ 3.94Å; I135-F445 HydrophobicContact CG1-CE2 3.7Å; I135-F445 HydrophobicContact CG1-CZ 3.71Å
136	L	96.5	Very high	96.1	Very high	2 Å²	2	16.3 Å²	16.3	1%	0.01	8%	0.084	C	C	.	.	H	α-helix	trans	-63.8	-37.5	174.4	-76.8	65	0	0	0	110.5	Y132 I133 V134 W138 A139 I140 A217 L390	Y132-L136 HydrophobicContact CD1-CD1 4.36Å; Y132-L136 HydrophobicContact CE1-CD1 4.29Å; I133-L136 HydrophobicContact CG1-CD2 4.4Å; I133-L136 WeakPolarHBondContact O-CB 3.29Å; I133-L136 PolarHBondContact O-N 3.49Å; I133-L136 VanDerWaalsContact O-N 3.13Å; V134-L136 VanDerWaalsContact C-N 3.33Å; V134-L136 PolarHBondContact O-N 3.35Å; L136-W138 VanDerWaalsContact C-N 3.32Å; L136-W138 PolarHBondContact O-N 3.47Å; L136-A139 PolarHBondContact O-N 3.16Å; L136-I140 WeakPolarHBondContact O-CB 3.37Å; L136-I140 VanDerWaalsContact O-CG1 3.23Å; L136-I140 WeakPolarHBondContact O-CG1 3.32Å; L136-I140 PolarHBondContact O-N 3.19Å; L136-A217 HydrophobicContact CB-CB 4.13Å; L136-L390 HydrophobicContact CD2-CB 4.38Å; L136-L390 HydrophobicContact CD2-CD2 3.51Å; L136-L390 HydrophobicContact CD2-CG 3.68Å
137	A	97.9	Very high	96	Very high	1 Å²	1	21.1 Å²	21.1	1%	0.008	10%	0.097	C	C	.	.	H	α-helix	trans	-60.6	-42.2	174.6	0	0	0	0	0	111.6	I133 V134 I135 F141 C213 L214	I133-A137 PolarHBondContact O-N 3.37Å; I133-A137 VanDerWaalsContact O-N 3.12Å; V134-A137 VanDerWaalsContact O-CB 3.3Å; V134-A137 WeakPolarHBondContact O-CB 3.47Å; V134-A137 PolarHBondContact O-N 2.91Å; V134-A137 VanDerWaalsContact O-N 3.15Å; I135-A137 VanDerWaalsContact C-N 3.27Å; I135-A137 PolarHBondContact O-N 3.41Å; A137-F141 WeakPolarHBondContact O-CB 3.29Å; A137-F141 PolarHBondContact O-N 3.37Å; A137-C213 HydrophobicContact CB-CB 4.06Å; A137-C213 WeakPolarHBondContact O-CB 3.42Å; A137-L214 HydrophobicContact CB-CB 3.95Å; A137-L214 HydrophobicContact CB-CD1 4.34Å
138	W	97.9	Very high	95.9	Very high	1 Å²	1	22.2 Å²	22.2	0%	0.004	11%	0.107	C	C	.	.	H	α-helix	trans	-63	-45.4	172.5	-58.4	-31.6	0	0	0	111.9	V134 I135 L136 I140 F141 Y142 W189 L194 P357 F361 M442 F445	V134-W138 HydrophobicContact CG1-CD2 4.48Å; V134-W138 HydrophobicContact CG1-CH2 4.49Å; V134-W138 HydrophobicContact CG1-CZ2 3.78Å; V134-W138 PolarHBondContact O-N 3.31Å; I135-W138 HydrophobicContact CB-CE3 4.28Å; I135-W138 HydrophobicContact CG1-CE3 4.21Å; I135-W138 HydrophobicContact CG1-CZ3 4.01Å; I135-W138 HydrophobicContact CG2-CE3 4.3Å; I135-W138 WeakPolarHBondContact O-CB 3.31Å; I135-W138 PolarHBondContact O-N 3.44Å; L136-W138 VanDerWaalsContact C-N 3.32Å; L136-W138 PolarHBondContact O-N 3.47Å; W138-I140 PolarHBondContact O-N 2.82Å; W138-F141 WeakPolarHBondContact O-CB 3.38Å; W138-F141 PolarHBondContact O-N 3.06Å; W138-Y142 WeakPolarHBondContact O-CD2 3.47Å; W138-Y142 PolarHBondContact O-N 3.02Å; W138-W189 HydrophobicContact CB-CH2 4.5Å; W138-W189 HydrophobicContact CB-CZ3 4.33Å; W138-W189 AromaticContact CD2-CH2 3.71Å; W138-W189 HydrophobicContact CD2-CH2 3.71Å; W138-W189 HydrophobicContact CD2-CZ3 4.36Å; W138-W189 AromaticContact CE3-CH2 3.76Å; W138-W189 HydrophobicContact CE3-CH2 3.76Å; W138-W189 HydrophobicContact CG-CH2 4.06Å; W138-W189 HydrophobicContact CG-CZ3 4.23Å; W138-W189 HydrophobicContact CZ3-CH2 4.22Å; W138-L194 HydrophobicContact CZ2-CD2 4.33Å; W138-P357 HydrophobicContact CZ3-CB 4.14Å; W138-P357 HydrophobicContact CZ3-CG 4.11Å; W138-F361 HydrophobicContact CB-CD1 4.46Å; W138-F361 HydrophobicContact CB-CE1 3.78Å; W138-F361 HydrophobicContact CB-CE2 4.21Å; W138-F361 HydrophobicContact CB-CZ 3.64Å; W138-F361 HydrophobicContact CE3-CD2 4.37Å; W138-F361 AromaticContact CE3-CE2 3.83Å; W138-F361 HydrophobicContact CE3-CE2 3.83Å; W138-F361 HydrophobicContact CE3-CZ 4.34Å; W138-M442 HydrophobicContact CH2-CE 4.45Å; W138-M442 HydrophobicContact CH2-SD 3.73Å; W138-M442 HydrophobicContact CZ2-SD 3.99Å; W138-F445 HydrophobicContact CH2-CB 4.5Å; W138-F445 AromaticContact CH2-CD1 3.78Å; W138-F445 HydrophobicContact CH2-CD1 3.78Å; W138-F445 AromaticContact CH2-CD2 3.59Å; W138-F445 HydrophobicContact CH2-CD2 3.59Å; W138-F445 AromaticContact CH2-CE1 3.81Å; W138-F445 HydrophobicContact CH2-CE1 3.81Å; W138-F445 AromaticContact CH2-CE2 3.59Å; W138-F445 HydrophobicContact CH2-CE2 3.59Å; W138-F445 AromaticContact CH2-CG 3.68Å; W138-F445 HydrophobicContact CH2-CG 3.68Å; W138-F445 AromaticContact CH2-CZ 3.72Å; W138-F445 HydrophobicContact CH2-CZ 3.72Å; W138-F445 HydrophobicContact CZ2-CD2 4.18Å; W138-F445 HydrophobicContact CZ2-CE2 4.48Å; W138-F445 HydrophobicContact CZ2-CG 4.31Å; W138-F445 HydrophobicContact CZ3-CD2 4.33Å; W138-F445 HydrophobicContact CZ3-CE1 4.1Å; W138-F445 AromaticContact CZ3-CE2 3.87Å; W138-F445 HydrophobicContact CZ3-CE2 3.87Å; W138-F445 AromaticContact CZ3-CZ 3.75Å; W138-F445 HydrophobicContact CZ3-CZ 3.75Å
139	A	97.1	Very high	95.6	Very high	1 Å²	1	28.1 Å²	28.1	1%	0.008	14%	0.144	C	C	.	.	H	α-helix	trans	-63.5	-40.4	179	0	0	0	0	0	112.6	I135 L136 Y142 L143 F361 F382 L385 I386	I135-A139 PolarHBondContact O-N 3.38Å; L136-A139 PolarHBondContact O-N 3.16Å; A139-Y142 PolarHBondContact O-N 2.75Å; A139-L143 WeakPolarHBondContact O-CB 3.12Å; A139-L143 PolarHBondContact O-N 3.23Å; A139-F361 HydrophobicContact CB-CE1 4.35Å; A139-F361 HydrophobicContact CB-CZ 4.36Å; A139-F382 HydrophobicContact CB-CD1 4.5Å; A139-L385 HydrophobicContact CB-CB 4.18Å; A139-I386 HydrophobicContact CB-CD1 4.44Å; A139-I386 HydrophobicContact CB-CG1 3.68Å
140	I	98.3	Very high	95.4	Very high	8 Å²	8	35.5 Å²	35.5	4%	0.041	18%	0.178	C	C	.	.	H	α-helix	trans	-62.3	-43.3	173	-71.7	168.6	0	0	0	110.6	L136 W138 Y142 L143 F144 C213 L216 A217 I386	L136-I140 WeakPolarHBondContact O-CB 3.37Å; L136-I140 VanDerWaalsContact O-CG1 3.23Å; L136-I140 WeakPolarHBondContact O-CG1 3.32Å; L136-I140 PolarHBondContact O-N 3.19Å; W138-I140 PolarHBondContact O-N 2.82Å; I140-Y142 PolarHBondContact O-N 3.03Å; I140-L143 PolarHBondContact O-N 3.11Å; I140-F144 HydrophobicContact CG2-CD2 3.83Å; I140-F144 HydrophobicContact CG2-CE2 3.38Å; I140-F144 HydrophobicContact CG2-CZ 4.09Å; I140-F144 WeakPolarHBondContact O-CD2 3.47Å; I140-F144 PolarHBondContact O-N 3.28Å; I140-C213 HydrophobicContact CB-CB 4.31Å; I140-C213 HydrophobicContact CG2-CB 3.98Å; I140-L216 HydrophobicContact CG2-CD2 3.98Å; I140-A217 HydrophobicContact CD1-CB 3.85Å; I140-I386 HydrophobicContact CG1-CD1 3.77Å; I140-I386 HydrophobicContact CG1-CG1 4.07Å
141	F	97.9	Very high	95.4	Very high	6 Å²	6	35.3 Å²	35.3	3%	0.026	18%	0.177	C	C	.	.	H	α-helix	trans	-58.4	-48.7	176.5	-176.4	-82.3	0	0	0	111.4	A137 W138 F144 N145 F188 V193 E209 L210	A137-F141 WeakPolarHBondContact O-CB 3.29Å; A137-F141 PolarHBondContact O-N 3.37Å; W138-F141 WeakPolarHBondContact O-CB 3.38Å; W138-F141 PolarHBondContact O-N 3.06Å; F141-F144 PolarHBondContact O-N 3.47Å; F141-N145 VanDerWaalsContact CE1-ND2 3.29Å; F141-N145 WeakPolarHBondContact CE1-ND2 3.37Å; F141-N145 PolarHBondContact O-N 2.68Å; F141-N145 PolarHBondContact O-ND2 3.11Å; F141-F188 HydrophobicContact CE1-CE1 4.49Å; F141-F188 HydrophobicContact CE1-CZ 4.04Å; F141-V193 HydrophobicContact CD1-CG1 4.18Å; F141-V193 HydrophobicContact CD1-CG2 3.91Å; F141-V193 HydrophobicContact CE1-CB 4.35Å; F141-V193 HydrophobicContact CE1-CG1 4.46Å; F141-V193 HydrophobicContact CE1-CG2 3.68Å; F141-E209 HydrophobicContact CD2-CB 4.36Å; F141-E209 HydrophobicContact CE2-CB 3.91Å; F141-E209 VanDerWaalsContact CE2-OE2 3.27Å; F141-E209 WeakPolarHBondContact CE2-OE2 3.44Å; F141-L210 HydrophobicContact CB-CD2 3.93Å; F141-L210 HydrophobicContact CD2-CD2 3.75Å; F141-L210 HydrophobicContact CG-CD2 3.91Å
142	Y	97.6	Very high	95.4	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-63.7	-40.9	176.3	-89.2	-100.5	0	0	0	112.2	W138 A139 I140 F144 N145 C146 W153 F188 W189 V193 F361 P365 F382	W138-Y142 WeakPolarHBondContact O-CD2 3.47Å; W138-Y142 PolarHBondContact O-N 3.02Å; A139-Y142 PolarHBondContact O-N 2.75Å; I140-Y142 PolarHBondContact O-N 3.03Å; Y142-F144 VanDerWaalsContact C-N 3.33Å; Y142-F144 PolarHBondContact O-N 3.07Å; Y142-N145 CarbonylContact O-C 3.53Å; Y142-N145 WeakPolarHBondContact O-CA 3.23Å; Y142-N145 PolarHBondContact O-N 3.4Å; Y142-C146 PolarHBondContact O-N 2.95Å; Y142-C146 VanDerWaalsContact O-N 3.11Å; Y142-C146 PolarHBondContact O-SG 2.93Å; Y142-W153 HydrophobicContact CD1-CE3 4.03Å; Y142-W153 AromaticContact CD1-CH2 3.73Å; Y142-W153 HydrophobicContact CD1-CH2 3.73Å; Y142-W153 HydrophobicContact CD1-CZ2 4.28Å; Y142-W153 AromaticContact CD1-CZ3 3.59Å; Y142-W153 HydrophobicContact CD1-CZ3 3.59Å; Y142-W153 HydrophobicContact CE1-CD2 4.37Å; Y142-W153 HydrophobicContact CE1-CE3 4.07Å; Y142-W153 HydrophobicContact CE1-CH2 4.46Å; Y142-W153 HydrophobicContact CE1-CZ3 4.11Å; Y142-W153 HydrophobicContact CG-CZ3 4.5Å; Y142-F188 HydrophobicContact CD1-CE1 4.03Å; Y142-F188 AromaticContact CE1-CD1 3.86Å; Y142-F188 HydrophobicContact CE1-CD1 3.86Å; Y142-F188 AromaticContact CE1-CE1 3.59Å; Y142-F188 HydrophobicContact CE1-CE1 3.59Å; Y142-F188 HydrophobicContact CE2-CE1 4.16Å; Y142-F188 AromaticContact CZ-CD1 3.81Å; Y142-F188 AromaticContact CZ-CE1 3.66Å; Y142-W189 AromaticContact CE2-CE3 3.79Å; Y142-W189 HydrophobicContact CE2-CE3 3.79Å; Y142-W189 AromaticContact CE2-CZ3 3.9Å; Y142-W189 HydrophobicContact CE2-CZ3 3.9Å; Y142-V193 HydrophobicContact CD2-CG2 4.43Å; Y142-V193 HydrophobicContact CE2-CG1 4.31Å; Y142-V193 HydrophobicContact CE2-CG2 3.66Å; Y142-F361 AromaticContact CD2-CD1 3.64Å; Y142-F361 HydrophobicContact CD2-CD1 3.64Å; Y142-F361 HydrophobicContact CD2-CE1 4.04Å; Y142-F361 HydrophobicContact CE2-CB 4.22Å; Y142-F361 AromaticContact CE2-CD1 3.53Å; Y142-F361 HydrophobicContact CE2-CD1 3.53Å; Y142-F361 HydrophobicContact CE2-CE1 4.32Å; Y142-F361 HydrophobicContact CE2-CG 4.24Å; Y142-F361 HydrophobicContact CG-CD1 4.25Å; Y142-F361 PolarHBondContact OH-O 2.74Å; Y142-P365 HydrophobicContact CE1-CB 4.47Å; Y142-P365 HydrophobicContact CE1-CG 4.23Å; Y142-F382 VanDerWaalsContact CB-CE1 3.45Å; Y142-F382 VanDerWaalsContact CB-CZ 3.49Å; Y142-F382 AromaticContact CD1-CE1 3.76Å; Y142-F382 HydrophobicContact CD1-CE1 3.76Å; Y142-F382 AromaticContact CD1-CE2 3.57Å; Y142-F382 HydrophobicContact CD1-CE2 3.57Å; Y142-F382 AromaticContact CD1-CZ 3.1Å; Y142-F382 HydrophobicContact CD1-CZ 3.1Å; Y142-F382 HydrophobicContact CD2-CE1 4.31Å; Y142-F382 HydrophobicContact CD2-CZ 4.44Å; Y142-F382 AromaticContact CE1-CZ 3.85Å; Y142-F382 HydrophobicContact CE1-CZ 3.85Å; Y142-F382 HydrophobicContact CG-CD1 4.22Å; Y142-F382 AromaticContact CG-CE1 3.59Å; Y142-F382 HydrophobicContact CG-CE1 3.59Å; Y142-F382 AromaticContact CG-CE2 3.97Å; Y142-F382 HydrophobicContact CG-CE2 3.97Å; Y142-F382 AromaticContact CG-CZ 3.44Å; Y142-F382 HydrophobicContact CG-CZ 3.44Å; Y142-F382 VanDerWaalsContact CG-CZ 3.44Å
143	L	97.2	Very high	95.4	Very high	27 Å²	27	34.3 Å²	34.3	14%	0.141	18%	0.175	C	C	.	.	H	α-helix	trans	-57.7	-45.1	177.1	-179.8	64.2	0	0	0	111.5	A139 I140 N145 C146 F147 C379 F382 I386	A139-L143 WeakPolarHBondContact O-CB 3.12Å; A139-L143 PolarHBondContact O-N 3.23Å; I140-L143 PolarHBondContact O-N 3.11Å; L143-N145 PolarHBondContact O-N 3.27Å; L143-C146 WeakPolarHBondContact O-CB 3.2Å; L143-C146 PolarHBondContact O-N 3.48Å; L143-F147 HydrophobicContact CD1-CZ 4.4Å; L143-F147 HydrophobicContact CG-CE2 4.28Å; L143-F147 HydrophobicContact CG-CZ 4.5Å; L143-F147 WeakPolarHBondContact O-CD2 3.49Å; L143-F147 VanDerWaalsContact O-CE2 3.27Å; L143-F147 WeakPolarHBondContact O-CE2 3.4Å; L143-C379 HydrophobicContact CD1-CB 4.38Å; L143-F382 HydrophobicContact CB-CB 4.18Å; L143-I386 HydrophobicContact CB-CD1 4.17Å; L143-I386 HydrophobicContact CD2-CD1 3.6Å; L143-I386 HydrophobicContact CG-CD1 4.48Å
144	F	97	Very high	95.1	Very high	115 Å²	115	35.8 Å²	35.8	50%	0.504	19%	0.187	S	C	.	.	H	α-helix	trans	-63	-29.6	176	-71.7	-43.9	0	0	0	113.2	I140 F141 Y142 C146 F147 L216	I140-F144 HydrophobicContact CG2-CD2 3.83Å; I140-F144 HydrophobicContact CG2-CE2 3.38Å; I140-F144 HydrophobicContact CG2-CZ 4.09Å; I140-F144 WeakPolarHBondContact O-CD2 3.47Å; I140-F144 PolarHBondContact O-N 3.28Å; F141-F144 PolarHBondContact O-N 3.47Å; Y142-F144 VanDerWaalsContact C-N 3.33Å; Y142-F144 PolarHBondContact O-N 3.07Å; F144-C146 VanDerWaalsContact C-N 3.3Å; F144-F147 HydrophobicContact CD1-CE2 4.43Å; F144-L216 HydrophobicContact CE2-CD2 3.91Å; F144-L216 HydrophobicContact CZ-CD2 3.65Å
145	N	95.9	Very high	94.8	Very high	32 Å²	32	36.6 Å²	36.6	17%	0.171	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.6	-0.3	175.7	-75.3	-86.5	0	0	0	113.5	F141 Y142 L143 P152 W153 F188	F141-N145 VanDerWaalsContact CE1-ND2 3.29Å; F141-N145 WeakPolarHBondContact CE1-ND2 3.37Å; F141-N145 PolarHBondContact O-N 2.68Å; F141-N145 PolarHBondContact O-ND2 3.11Å; Y142-N145 CarbonylContact O-C 3.53Å; Y142-N145 WeakPolarHBondContact O-CA 3.23Å; Y142-N145 PolarHBondContact O-N 3.4Å; L143-N145 PolarHBondContact O-N 3.27Å; N145-P152 HydrophobicContact CB-CG 4.17Å; N145-P152 WeakPolarHBondContact O-CD 3.33Å; N145-W153 HydrophobicContact CB-CZ3 3.96Å; N145-F188 HydrophobicContact CB-CZ 4.33Å
146	C	95.9	Very high	94.4	Very high	4 Å²	4	38.5 Å²	38.5	3%	0.027	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.8	-15.3	174.4	-64.7	0	0	0	0	113.4	Y142 L143 F144 T148 A378 C379	Y142-C146 PolarHBondContact O-N 2.95Å; Y142-C146 VanDerWaalsContact O-N 3.11Å; Y142-C146 PolarHBondContact O-SG 2.93Å; L143-C146 WeakPolarHBondContact O-CB 3.2Å; L143-C146 PolarHBondContact O-N 3.48Å; F144-C146 VanDerWaalsContact C-N 3.3Å; C146-T148 PolarHBondContact O-N 3Å; C146-A378 VanDerWaalsContact SG-CB 3.6Å; C146-C379 HydrophobicContact CB-CB 4.12Å
147	F	93.9	Very high	94	Very high	142 Å²	142	41.9 Å²	41.9	62%	0.623	24%	0.244	S	C	*	.	S	Bend	trans	-82.2	55.2	-177	-60	-72.4	0	0	0	111.9	L143 F144	L143-F147 HydrophobicContact CD1-CZ 4.4Å; L143-F147 HydrophobicContact CG-CE2 4.28Å; L143-F147 HydrophobicContact CG-CZ 4.5Å; L143-F147 WeakPolarHBondContact O-CD2 3.49Å; L143-F147 VanDerWaalsContact O-CE2 3.27Å; L143-F147 WeakPolarHBondContact O-CE2 3.4Å; F144-F147 HydrophobicContact CD1-CE2 4.43Å
148	T	92.1	Very high	93.7	Very high	61 Å²	61	45.4 Å²	45.4	37%	0.374	26%	0.261	S	S	.	.	S	Bend	trans	-136.2	165.9	-177.9	60.3	0	0	0	0	110.4	C146 E150 P375	C146-T148 PolarHBondContact O-N 3Å; T148-E150 VanDerWaalsContact CB-O 3.31Å; T148-E150 WeakPolarHBondContact CB-O 3.45Å; T148-E150 PolarHBondContact OG1-O 2.98Å; T148-P375 WeakPolarHBondContact O-CG 3.36Å
149	T	87.8	Confident	93.6	Very high	137 Å²	137	53.5 Å²	53.5	84%	0.84	29%	0.292	S	S	*	.	S	Bend	trans	-74.9	-40.5	173.2	48.6	0	0	0	0	111.7
150	E	89.8	Confident	93.5	Very high	158 Å²	158	55 Å²	55	74%	0.738	30%	0.298	S	S	*	.	S	Bend	trans	-121	136.1	174.7	-66.3	-177.8	176.7	0	0	108.9	T148	T148-E150 VanDerWaalsContact CB-O 3.31Å; T148-E150 WeakPolarHBondContact CB-O 3.45Å; T148-E150 PolarHBondContact OG1-O 2.98Å
151	L	93.8	Very high	93.3	Very high	3 Å²	3	55.9 Å²	55.9	2%	0.016	30%	0.303	C	S	.	.			trans	-69	135.9	-177.3	-70.3	173.4	0	0	0	110.4	W153 A154 V368 T369 P375 A378	L151-W153 HydrophobicContact CB-CD2 4.3Å; L151-W153 HydrophobicContact CB-CZ2 4.23Å; L151-W153 HydrophobicContact CD1-CZ2 3.91Å; L151-W153 HydrophobicContact CD2-CH2 3.94Å; L151-W153 HydrophobicContact CD2-CZ2 3.67Å; L151-W153 HydrophobicContact CG-CZ2 4.15Å; L151-W153 PolarHBondContact O-N 3.38Å; L151-A154 HydrophobicContact CB-CB 4.24Å; L151-A154 WeakPolarHBondContact O-CB 3.48Å; L151-A154 PolarHBondContact O-N 2.82Å; L151-V368 HydrophobicContact CD1-CG1 4.18Å; L151-T369 HydrophobicContact CD1-CG2 4.08Å; L151-P375 HydrophobicContact CD2-CB 4.31Å; L151-P375 HydrophobicContact CD2-CG 4.45Å; L151-P375 HydrophobicContact CG-CG 4.39Å; L151-A378 HydrophobicContact CD1-CB 3.96Å; L151-A378 HydrophobicContact CD2-CB 3.97Å
152	P	93.9	Very high	93	Very high	14 Å²	14	57.5 Å²	57.5	9%	0.091	31%	0.313	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-15.3	-176.5	-26.6	36.5	0	0	0	115.7	N145 H158 W160 F188	N145-P152 HydrophobicContact CB-CG 4.17Å; N145-P152 WeakPolarHBondContact O-CD 3.33Å; P152-H158 PolarHBondContact O-CD2 3.02Å; P152-H158 PolarHBondContact O-NE2 3.24Å; P152-W160 HydrophobicContact CB-CH2 4.28Å; P152-W160 HydrophobicContact CB-CZ2 4.12Å; P152-F188 HydrophobicContact CB-CD2 4.22Å; P152-F188 HydrophobicContact CB-CE2 3.73Å; P152-F188 HydrophobicContact CB-CZ 4.44Å
153	W	93.8	Very high	92.5	Very high	0 Å²	0	67.2 Å²	67.2	0%	0	36%	0.358	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.5	5.5	176.4	55.4	83	0	0	0	112.9	Y142 N145 L151 V185 F188 P365 A378 F382	Y142-W153 HydrophobicContact CD1-CE3 4.03Å; Y142-W153 AromaticContact CD1-CH2 3.73Å; Y142-W153 HydrophobicContact CD1-CH2 3.73Å; Y142-W153 HydrophobicContact CD1-CZ2 4.28Å; Y142-W153 AromaticContact CD1-CZ3 3.59Å; Y142-W153 HydrophobicContact CD1-CZ3 3.59Å; Y142-W153 HydrophobicContact CE1-CD2 4.37Å; Y142-W153 HydrophobicContact CE1-CE3 4.07Å; Y142-W153 HydrophobicContact CE1-CH2 4.46Å; Y142-W153 HydrophobicContact CE1-CZ3 4.11Å; Y142-W153 HydrophobicContact CG-CZ3 4.5Å; N145-W153 HydrophobicContact CB-CZ3 3.96Å; L151-W153 HydrophobicContact CB-CD2 4.3Å; L151-W153 HydrophobicContact CB-CZ2 4.23Å; L151-W153 HydrophobicContact CD1-CZ2 3.91Å; L151-W153 HydrophobicContact CD2-CH2 3.94Å; L151-W153 HydrophobicContact CD2-CZ2 3.67Å; L151-W153 HydrophobicContact CG-CZ2 4.15Å; L151-W153 PolarHBondContact O-N 3.38Å; W153-V185 HydrophobicContact CB-CB 4.45Å; W153-V185 HydrophobicContact CB-CG1 4.35Å; W153-V185 HydrophobicContact CB-CG2 4.17Å; W153-V185 VanDerWaalsContact O-CG2 3.28Å; W153-V185 WeakPolarHBondContact O-CG2 3.36Å; W153-F188 HydrophobicContact CB-CB 3.81Å; W153-F188 HydrophobicContact CB-CD1 4.06Å; W153-F188 HydrophobicContact CB-CD2 4.38Å; W153-F188 HydrophobicContact CB-CG 3.83Å; W153-F188 HydrophobicContact CD2-CD1 4.48Å; W153-F188 HydrophobicContact CD2-CE1 4.46Å; W153-F188 AromaticContact CE3-CD1 3.87Å; W153-F188 HydrophobicContact CE3-CD1 3.87Å; W153-F188 AromaticContact CE3-CE1 3.48Å; W153-F188 HydrophobicContact CE3-CE1 3.48Å; W153-F188 VanDerWaalsContact CE3-CE1 3.48Å; W153-F188 HydrophobicContact CE3-CE2 4.23Å; W153-F188 HydrophobicContact CE3-CG 4.39Å; W153-F188 AromaticContact CE3-CZ 3.69Å; W153-F188 HydrophobicContact CE3-CZ 3.69Å; W153-F188 AromaticContact CZ3-CE1 3.95Å; W153-F188 HydrophobicContact CZ3-CE1 3.95Å; W153-F188 HydrophobicContact CZ3-CZ 4.03Å; W153-P365 HydrophobicContact CG-CB 4.5Å; W153-P365 HydrophobicContact CZ2-CB 4.38Å; W153-P365 PolarHBondContact NE1-O 2.91Å; W153-A378 HydrophobicContact CZ2-CB 4.02Å; W153-F382 AromaticContact CH2-CE2 4Å; W153-F382 HydrophobicContact CH2-CE2 4Å; W153-F382 AromaticContact CZ2-CE2 3.98Å; W153-F382 HydrophobicContact CZ2-CE2 3.98Å
154	A	90.9	Very high	92	Very high	32 Å²	32	69 Å²	69	26%	0.264	37%	0.368	S	S	.	.	S	Bend	trans	-75.4	-33.9	-179.7	0	0	0	0	0	113.2	L151 T369	L151-A154 HydrophobicContact CB-CB 4.24Å; L151-A154 WeakPolarHBondContact O-CB 3.48Å; L151-A154 PolarHBondContact O-N 2.82Å; A154-T369 HydrophobicContact CB-CG2 3.96Å
155	G	88.9	Confident	91.5	Very high	17 Å²	17	64.3 Å²	64.3	18%	0.175	35%	0.35	C	S	.	.	S	Bend	trans	-136.7	171.1	-175.5	0	0	0	0	0	113.5	P184	G155-P184 WeakPolarHBondContact O-CB 3.43Å
156	C	88	Confident	90.9	Very high	47 Å²	47	64.7 Å²	64.7	32%	0.318	35%	0.353	S	S	.	.	S	Bend	trans	-92.4	159.3	171.5	-61	0	0	0	0	110.7	C165	C156-C165 HydrophobicContact CB-CB 3.82Å; C156-C165 WeakPolarHBondContact CB-SG 3.26Å; C156-C165 WeakPolarHBondContact SG-CB 3.34Å; C156-C165 PolarHBondContact SG-O 3.01Å; C156-C165 CovalentContact SG-SG 2.04Å; C156-C165 PolarHBondContact SG-SG 3.49Å
157	G	87.8	Confident	89.8	Confident	74 Å²	74	67.5 Å²	67.5	76%	0.763	37%	0.368	S	S	*	.			trans	116.8	8.6	176.7	0	0	0	0	0	114.6	N161	G157-N161 PolarHBondContact N-OD1 3.36Å; G157-N161 VanDerWaalsContact N-OD1 3.12Å
158	H	92.9	Very high	88.4	Confident	75 Å²	75	65 Å²	65	35%	0.347	36%	0.355	S	S	.	.	S	Bend	trans	-85	162.7	170.5	-60.8	-72	0	0	0	111.6	P152 W160 N161	P152-H158 PolarHBondContact O-CD2 3.02Å; P152-H158 PolarHBondContact O-NE2 3.24Å; H158-W160 HydrophobicContact CB-CD2 3.54Å; H158-W160 HydrophobicContact CB-CE3 3.79Å; H158-W160 HydrophobicContact CB-CG 4.25Å; H158-W160 HydrophobicContact CB-CH2 3.66Å; H158-W160 HydrophobicContact CB-CZ2 3.34Å; H158-W160 HydrophobicContact CB-CZ3 3.86Å; H158-W160 AromaticContact CD2-CZ2 3.52Å; H158-W160 AromaticContact CG-CE2 3.73Å; H158-W160 AromaticContact CG-CH2 3.61Å; H158-W160 AromaticContact CG-CZ2 3.28Å; H158-W160 AromaticContact ND1-CH2 3.75Å; H158-W160 AromaticContact ND1-CZ2 3.86Å; H158-W160 PolarHBondContact O-N 3.33Å; H158-N161 WeakPolarHBondContact CB-OD1 3.38Å; H158-N161 PolarHBondContact N-OD1 2.83Å; H158-N161 WeakPolarHBondContact O-CB 3.32Å; H158-N161 PolarHBondContact O-N 3.43Å
159	Y	94.9	Very high	86.7	Confident	171 Å²	171	67 Å²	67	67%	0.671	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.2	-16.9	-176.5	71.1	-101.2	0	0	0	114.5	R192	Y159-R192 WeakPolarHBondContact OH-CD 3.34Å; Y159-R192 PolarHBondContact OH-NE 3.19Å; Y159-R192 VanDerWaalsContact OH-NE 3.09Å
160	W	94.7	Very high	85	Confident	31 Å²	31	62.2 Å²	62.2	12%	0.117	33%	0.334	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.3	-10.6	176.9	55.2	82.3	0	0	0	113.1	P152 H158 F188 R191 R192	P152-W160 HydrophobicContact CB-CH2 4.28Å; P152-W160 HydrophobicContact CB-CZ2 4.12Å; H158-W160 HydrophobicContact CB-CD2 3.54Å; H158-W160 HydrophobicContact CB-CE3 3.79Å; H158-W160 HydrophobicContact CB-CG 4.25Å; H158-W160 HydrophobicContact CB-CH2 3.66Å; H158-W160 HydrophobicContact CB-CZ2 3.34Å; H158-W160 HydrophobicContact CB-CZ3 3.86Å; H158-W160 AromaticContact CD2-CZ2 3.52Å; H158-W160 AromaticContact CG-CE2 3.73Å; H158-W160 AromaticContact CG-CH2 3.61Å; H158-W160 AromaticContact CG-CZ2 3.28Å; H158-W160 AromaticContact ND1-CH2 3.75Å; H158-W160 AromaticContact ND1-CZ2 3.86Å; H158-W160 PolarHBondContact O-N 3.33Å; W160-F188 AromaticContact CE2-CD2 3.94Å; W160-F188 AromaticContact CZ2-CD2 3.78Å; W160-F188 HydrophobicContact CZ2-CD2 3.78Å; W160-F188 HydrophobicContact CZ2-CE2 4.08Å; W160-F188 AromaticContact NE1-CD2 3.99Å; W160-R191 HydrophobicContact CB-CB 4.36Å; W160-R191 WeakPolarHBondContact O-CD 3.49Å; W160-R192 HydrophobicContact CB-CB 4.06Å; W160-R192 HydrophobicContact CD2-CB 3.72Å; W160-R192 HydrophobicContact CD2-CG 3.81Å; W160-R192 HydrophobicContact CE3-CB 4.25Å; W160-R192 VanDerWaalsContact CE3-CD 3.45Å; W160-R192 HydrophobicContact CE3-CG 3.89Å; W160-R192 HydrophobicContact CG-CB 3.65Å; W160-R192 HydrophobicContact CG-CG 4.28Å; W160-R192 HydrophobicContact CH2-CG 4.38Å; W160-R192 HydrophobicContact CZ2-CG 4.35Å; W160-R192 HydrophobicContact CZ3-CG 4.16Å
161	N	94.4	Very high	82.9	Confident	28 Å²	28	64.5 Å²	64.5	15%	0.15	35%	0.345	C	S	.	.			trans	-78.8	149.6	-177.1	-67.9	128	0	0	0	112.2	G157 H158 C165 E187	G157-N161 PolarHBondContact N-OD1 3.36Å; G157-N161 VanDerWaalsContact N-OD1 3.12Å; H158-N161 WeakPolarHBondContact CB-OD1 3.38Å; H158-N161 PolarHBondContact N-OD1 2.83Å; H158-N161 WeakPolarHBondContact O-CB 3.32Å; H158-N161 PolarHBondContact O-N 3.43Å; N161-C165 HydrophobicContact CB-CB 4.17Å; N161-C165 PolarHBondContact ND2-SG 3.38Å; N161-C165 VanDerWaalsContact ND2-SG 3.45Å; N161-E187 WeakPolarHBondContact CA-OE2 3.21Å; N161-E187 WeakPolarHBondContact CB-OE2 3.46Å; N161-E187 PolarHBondContact ND2-OE2 2.8Å
162	T	91.6	Very high	80.6	Confident	39 Å²	39	71.6 Å²	71.6	24%	0.239	38%	0.383	C	S	.	.			trans	-97.6	168.6	171.5	73.8	0	0	0	0	111.8	N164 C165 E187	T162-N164 PolarHBondContact O-N 2.67Å; T162-N164 PolarHBondContact OG1-N 3.32Å; T162-C165 VanDerWaalsContact O-CB 3.24Å; T162-C165 WeakPolarHBondContact O-CB 3.43Å; T162-C165 PolarHBondContact O-N 2.88Å; T162-E187 PolarHBondContact N-OE2 2.92Å; T162-E187 PolarHBondContact OG1-OE1 2.81Å
163	E	87.3	Confident	78.6	Confident	204 Å²	204	73.3 Å²	73.3	95%	0.953	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	-18.1	171.6	-61.7	-179.1	179.4	0	0	112.9	C165	E163-C165 VanDerWaalsContact C-N 3.33Å
164	N	86.3	Confident	76.4	Confident	65 Å²	65	79.5 Å²	79.5	35%	0.348	44%	0.436	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.5	-4	176.6	-62.3	-47.3	0	0	0	113.2	T162 V166 N178 T182	T162-N164 PolarHBondContact O-N 2.67Å; T162-N164 PolarHBondContact OG1-N 3.32Å; N164-V166 PolarHBondContact O-N 2.94Å; N164-N178 PolarHBondContact OD1-ND2 3.45Å; N164-N178 VanDerWaalsContact OD1-ND2 3.12Å; N164-T182 PolarHBondContact O-N 3.37Å; N164-T182 PolarHBondContact O-OG1 3.34Å
165	C	87.3	Confident	74.3	Confident	17 Å²	17	84.4 Å²	84.4	12%	0.115	46%	0.458	C	S	.	.	B	Isolated β-bridge	trans	-67.2	121.6	175.8	-170.1	0	0	0	0	109.7	C156 N161 T162 E163 T182 E187	C156-C165 HydrophobicContact CB-CB 3.82Å; C156-C165 WeakPolarHBondContact CB-SG 3.26Å; C156-C165 WeakPolarHBondContact SG-CB 3.34Å; C156-C165 PolarHBondContact SG-O 3.01Å; C156-C165 CovalentContact SG-SG 2.04Å; C156-C165 PolarHBondContact SG-SG 3.49Å; N161-C165 HydrophobicContact CB-CB 4.17Å; N161-C165 PolarHBondContact ND2-SG 3.38Å; N161-C165 VanDerWaalsContact ND2-SG 3.45Å; T162-C165 VanDerWaalsContact O-CB 3.24Å; T162-C165 WeakPolarHBondContact O-CB 3.43Å; T162-C165 PolarHBondContact O-N 2.88Å; E163-C165 VanDerWaalsContact C-N 3.33Å; C165-T182 WeakPolarHBondContact CA-O 3.46Å; C165-E187 VanDerWaalsContact CB-OE2 3.32Å; C165-E187 WeakPolarHBondContact CB-OE2 3.28Å
166	V	83.1	Confident	72.7	Confident	40 Å²	40	87.1 Å²	87.1	24%	0.242	47%	0.467	C	S	.	.			trans	-118	124.3	177	-172.7	0	0	0	0	110	N164 Y168 I176 A181 T182 P184	N164-V166 PolarHBondContact O-N 2.94Å; V166-Y168 PolarHBondContact O-N 3.42Å; V166-I176 HydrophobicContact CG1-CD1 3.7Å; V166-I176 HydrophobicContact CG1-CG1 4.1Å; V166-A181 HydrophobicContact CG2-CB 3.86Å; V166-T182 PolarHBondContact N-O 3.16Å; V166-P184 WeakPolarHBondContact O-CD 3.47Å
167	D	73.3	Confident	71.2	Confident	63 Å²	63	90.7 Å²	90.7	34%	0.337	49%	0.488	S	S	.	.			trans	-80.1	114	166.1	-168.2	-13.7	0	0	0	108.7	Y169	D167-Y169 PolarHBondContact O-N 3.45Å; D167-Y169 PolarHBondContact OD1-N 2.9Å
168	Y	64.1	Low	70.1	Confident	89 Å²	89	90.5 Å²	90.5	35%	0.349	47%	0.469	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.5	-7.2	-179.1	-71.1	-90.1	0	0	0	112.7	V166 I176	V166-Y168 PolarHBondContact O-N 3.42Å; Y168-I176 HydrophobicContact CD1-CD1 3.95Å; Y168-I176 HydrophobicContact CE1-CD1 3.75Å
169	Y	56	Low	68.8	Low	103 Å²	103	92.7 Å²	92.7	40%	0.404	49%	0.49	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111.5	5.6	-171.6	-62.7	-77.2	0	0	0	115.4	D167 Q345 M370	D167-Y169 PolarHBondContact O-N 3.45Å; D167-Y169 PolarHBondContact OD1-N 2.9Å; Y169-Q345 VanDerWaalsContact OH-CG 3.27Å; Y169-Q345 WeakPolarHBondContact OH-CG 3.44Å; Y169-Q345 PolarHBondContact OH-NE2 3.23Å; Y169-M370 HydrophobicContact CE1-CG 4.4Å; Y169-M370 HydrophobicContact CE1-SD 4.5Å; Y169-M370 HydrophobicContact CE2-CE 4.05Å; Y169-M370 HydrophobicContact CE2-CG 4.36Å; Y169-M370 WeakPolarHBondContact OH-CE 3.4Å; Y169-M370 PolarHBondContact OH-SD 2.88Å
170	G	51.2	Low	67.7	Low	36 Å²	36	89.9 Å²	89.9	37%	0.371	49%	0.487	S	S	.	.	S	Bend	trans	-83.8	147.6	172.9	0	0	0	0	0	113.2	N172 A173	G170-N172 PolarHBondContact O-N 3.03Å; G170-A173 WeakPolarHBondContact O-CB 3.33Å; G170-A173 PolarHBondContact O-N 3.35Å
171	E	46	Very low	66.9	Low	207 Å²	207	89.5 Å²	89.5	97%	0.967	49%	0.49	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.8	-4.4	177.5	-69.4	-175.8	152.3	0	0	115.3
172	N	45.8	Very low	66.4	Low	152 Å²	152	90 Å²	90	81%	0.813	49%	0.494	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.6	21.6	176.2	-74	-27	0	0	0	113.9	G170 T174	G170-N172 PolarHBondContact O-N 3.03Å; N172-T174 PolarHBondContact O-N 3.3Å
173	A	52.1	Low	66.2	Low	49 Å²	49	88.2 Å²	88.2	41%	0.405	48%	0.484	S	S	.	.	G	3₁₀ helix	trans	-66.9	4.3	-178.3	0	0	0	0	0	115.6	G170 N175	G170-A173 WeakPolarHBondContact O-CB 3.33Å; G170-A173 PolarHBondContact O-N 3.35Å; A173-N175 PolarHBondContact O-N 3.49Å
174	T	47.2	Very low	66.4	Low	131 Å²	131	79 Å²	79	80%	0.804	44%	0.441	S	S	*	.	G	3₁₀ helix	trans	-89.9	12.3	-169.3	47.2	0	0	0	0	115.8	N172	N172-T174 PolarHBondContact O-N 3.3Å
175	N	48.3	Very low	66.6	Low	135 Å²	135	76 Å²	76	72%	0.722	43%	0.425	S	S	*	.	G	3₁₀ helix	trans	-145.8	43.6	-179.7	-120.7	-7.3	0	0	0	115.2	A173 T177	A173-N175 PolarHBondContact O-N 3.49Å; N175-T177 VanDerWaalsContact C-N 3.27Å; N175-T177 PolarHBondContact O-N 3.03Å
176	I	55.6	Low	66.7	Low	74 Å²	74	77.3 Å²	77.3	38%	0.379	43%	0.431	S	S	.	.			trans	-78.7	81.1	172	-49.3	177	0	0	0	108.9	V166 Y168 A181	V166-I176 HydrophobicContact CG1-CD1 3.7Å; V166-I176 HydrophobicContact CG1-CG1 4.1Å; Y168-I176 HydrophobicContact CD1-CD1 3.95Å; Y168-I176 HydrophobicContact CE1-CD1 3.75Å; I176-A181 HydrophobicContact CG2-CB 3.87Å
177	T	56.2	Low	67.2	Low	122 Å²	122	75.5 Å²	75.5	75%	0.748	42%	0.42	S	S	*	.			trans	-93.5	-2.1	170.6	31.3	0	0	0	0	112.7	N175 P179	N175-T177 VanDerWaalsContact C-N 3.27Å; N175-T177 PolarHBondContact O-N 3.03Å; T177-P179 VanDerWaalsContact O-CD 3.29Å; T177-P179 WeakPolarHBondContact O-CD 3.25Å
178	N	64	Low	68.2	Low	69 Å²	69	72.5 Å²	72.5	37%	0.369	40%	0.404	S	S	.	.			trans	-86.1	113.3	-179.3	-171.1	-2.6	0	0	0	110.7	N164 N180 A181	N164-N178 PolarHBondContact OD1-ND2 3.45Å; N164-N178 VanDerWaalsContact OD1-ND2 3.12Å; N178-N180 PolarHBondContact O-N 2.77Å; N178-N180 WeakPolarHBondContact OD1-CB 3.09Å; N178-N180 PolarHBondContact OD1-N 2.84Å; N178-A181 WeakPolarHBondContact O-CB 3.16Å; N178-A181 PolarHBondContact O-N 2.98Å
179	P	65	Low	69.7	Low	122 Å²	122	68.5 Å²	68.5	79%	0.792	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.2	-14.1	175.8	28	-34.8	0	0	0	113.4	T177	T177-P179 VanDerWaalsContact O-CD 3.29Å; T177-P179 WeakPolarHBondContact O-CD 3.25Å
180	N	73.3	Confident	71.5	Confident	111 Å²	111	66.1 Å²	66.1	59%	0.594	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.5	12.8	179.4	-62.8	-10.2	0	0	0	113.3	N178	N178-N180 PolarHBondContact O-N 2.77Å; N178-N180 WeakPolarHBondContact OD1-CB 3.09Å; N178-N180 PolarHBondContact OD1-N 2.84Å
181	A	77.4	Confident	73.5	Confident	23 Å²	23	70.5 Å²	70.5	19%	0.19	39%	0.386	C	S	.	.			trans	-63.9	134.7	178.4	0	0	0	0	0	111.6	V166 I176 N178	V166-A181 HydrophobicContact CG2-CB 3.86Å; I176-A181 HydrophobicContact CG2-CB 3.87Å; N178-A181 WeakPolarHBondContact O-CB 3.16Å; N178-A181 PolarHBondContact O-N 2.98Å
182	T	83.8	Confident	75.9	Confident	38 Å²	38	61.7 Å²	61.7	23%	0.233	34%	0.344	C	S	.	.	B	Isolated β-bridge	trans	-118.9	149.4	-179.8	46	0	0	0	0	110.5	N164 C165 V166 E187	N164-T182 PolarHBondContact O-N 3.37Å; N164-T182 PolarHBondContact O-OG1 3.34Å; C165-T182 WeakPolarHBondContact CA-O 3.46Å; V166-T182 PolarHBondContact N-O 3.16Å; T182-E187 PolarHBondContact OG1-OE1 3.19Å
183	S	86.9	Confident	78.3	Confident	3 Å²	3	54.4 Å²	54.4	2%	0.021	31%	0.305	C	S	.	.			trans	-85.6	151	176.4	77.6	0	0	0	0	111.5	V185 I186 E187	S183-V185 PolarHBondContact O-N 2.94Å; S183-V185 VanDerWaalsContact O-N 3.16Å; S183-I186 PolarHBondContact O-N 3.46Å; S183-I186 VanDerWaalsContact O-N 3.14Å; S183-I186 WeakPolarHBondContact OG-CD1 3.33Å; S183-I186 VanDerWaalsContact OG-CG1 3.31Å; S183-I186 WeakPolarHBondContact OG-CG1 3.19Å; S183-I186 PolarHBondContact OG-N 3.36Å; S183-E187 PolarHBondContact O-N 3.45Å; S183-E187 VanDerWaalsContact O-N 3.08Å
184	P	91	Very high	80.4	Confident	9 Å²	9	52.4 Å²	52.4	6%	0.058	29%	0.287	C	S	.	.	H	α-helix	trans	-58.5	-30.7	-180	21.9	-33.9	0	0	0	113	G155 V166 F188	G155-P184 WeakPolarHBondContact O-CB 3.43Å; V166-P184 WeakPolarHBondContact O-CD 3.47Å; P184-F188 VanDerWaalsContact O-CB 3.32Å; P184-F188 WeakPolarHBondContact O-CB 3.34Å; P184-F188 PolarHBondContact O-N 2.94Å
185	V	90.9	Very high	82.7	Confident	2 Å²	2	50 Å²	50	1%	0.012	27%	0.266	C	S	.	.	H	α-helix	trans	-72.4	-40.5	178.8	-167.8	0	0	0	0	112.2	W153 S183 F188 W189 I362 P365 K366	W153-V185 HydrophobicContact CB-CB 4.45Å; W153-V185 HydrophobicContact CB-CG1 4.35Å; W153-V185 HydrophobicContact CB-CG2 4.17Å; W153-V185 VanDerWaalsContact O-CG2 3.28Å; W153-V185 WeakPolarHBondContact O-CG2 3.36Å; S183-V185 PolarHBondContact O-N 2.94Å; S183-V185 VanDerWaalsContact O-N 3.16Å; V185-F188 PolarHBondContact O-N 2.96Å; V185-W189 PolarHBondContact O-N 3.42Å; V185-I362 HydrophobicContact CG1-CG2 4.23Å; V185-I362 WeakPolarHBondContact CG1-O 3.27Å; V185-P365 HydrophobicContact CG1-CB 4.3Å; V185-K366 HydrophobicContact CB-CB 4.42Å; V185-K366 HydrophobicContact CG2-CB 3.82Å; V185-K366 HydrophobicContact CG2-CG 3.98Å
186	I	89.3	Confident	84.8	Confident	45 Å²	45	45.5 Å²	45.5	23%	0.231	24%	0.241	C	C	.	.	H	α-helix	trans	-63.2	-46.4	174.7	-67.9	168.2	0	0	0	109.3	S183 F188 W189 E190 I362	S183-I186 PolarHBondContact O-N 3.46Å; S183-I186 VanDerWaalsContact O-N 3.14Å; S183-I186 WeakPolarHBondContact OG-CD1 3.33Å; S183-I186 VanDerWaalsContact OG-CG1 3.31Å; S183-I186 WeakPolarHBondContact OG-CG1 3.19Å; S183-I186 PolarHBondContact OG-N 3.36Å; I186-F188 VanDerWaalsContact C-N 3.33Å; I186-F188 PolarHBondContact O-N 2.79Å; I186-W189 PolarHBondContact O-N 3.09Å; I186-E190 HydrophobicContact CG2-CG 4.26Å; I186-E190 WeakPolarHBondContact O-CB 3.12Å; I186-E190 PolarHBondContact O-N 3.02Å; I186-I362 HydrophobicContact CG1-CG2 3.74Å
187	E	93.1	Very high	86.7	Confident	3 Å²	3	42.7 Å²	42.7	1%	0.014	23%	0.228	C	C	.	.	H	α-helix	trans	-66.2	-34.6	177.8	-67.3	-160	160.5	0	0	112.7	N161 T162 C165 T182 S183 R191 R192	N161-E187 WeakPolarHBondContact CA-OE2 3.21Å; N161-E187 WeakPolarHBondContact CB-OE2 3.46Å; N161-E187 PolarHBondContact ND2-OE2 2.8Å; T162-E187 PolarHBondContact N-OE2 2.92Å; T162-E187 PolarHBondContact OG1-OE1 2.81Å; C165-E187 VanDerWaalsContact CB-OE2 3.32Å; C165-E187 WeakPolarHBondContact CB-OE2 3.28Å; T182-E187 PolarHBondContact OG1-OE1 3.19Å; S183-E187 PolarHBondContact O-N 3.45Å; S183-E187 VanDerWaalsContact O-N 3.08Å; E187-R191 WeakPolarHBondContact O-CA 3.22Å; E187-R191 WeakPolarHBondContact O-CB 3.47Å; E187-R191 PolarHBondContact O-N 3.17Å; E187-R192 PolarHBondContact O-N 3.24Å
188	F	95.4	Very high	88.4	Confident	0 Å²	0	43.7 Å²	43.7	0%	0	23%	0.229	C	C	.	.	I	π-helix	trans	-61.1	-47.5	172	-176.4	-97.8	0	0	0	111	F141 Y142 N145 P152 W153 W160 P184 V185 I186 R192 V193	F141-F188 HydrophobicContact CE1-CE1 4.49Å; F141-F188 HydrophobicContact CE1-CZ 4.04Å; Y142-F188 HydrophobicContact CD1-CE1 4.03Å; Y142-F188 AromaticContact CE1-CD1 3.86Å; Y142-F188 HydrophobicContact CE1-CD1 3.86Å; Y142-F188 AromaticContact CE1-CE1 3.59Å; Y142-F188 HydrophobicContact CE1-CE1 3.59Å; Y142-F188 HydrophobicContact CE2-CE1 4.16Å; Y142-F188 AromaticContact CZ-CD1 3.81Å; Y142-F188 AromaticContact CZ-CE1 3.66Å; N145-F188 HydrophobicContact CB-CZ 4.33Å; P152-F188 HydrophobicContact CB-CD2 4.22Å; P152-F188 HydrophobicContact CB-CE2 3.73Å; P152-F188 HydrophobicContact CB-CZ 4.44Å; W153-F188 HydrophobicContact CB-CB 3.81Å; W153-F188 HydrophobicContact CB-CD1 4.06Å; W153-F188 HydrophobicContact CB-CD2 4.38Å; W153-F188 HydrophobicContact CB-CG 3.83Å; W153-F188 HydrophobicContact CD2-CD1 4.48Å; W153-F188 HydrophobicContact CD2-CE1 4.46Å; W153-F188 AromaticContact CE3-CD1 3.87Å; W153-F188 HydrophobicContact CE3-CD1 3.87Å; W153-F188 AromaticContact CE3-CE1 3.48Å; W153-F188 HydrophobicContact CE3-CE1 3.48Å; W153-F188 VanDerWaalsContact CE3-CE1 3.48Å; W153-F188 HydrophobicContact CE3-CE2 4.23Å; W153-F188 HydrophobicContact CE3-CG 4.39Å; W153-F188 AromaticContact CE3-CZ 3.69Å; W153-F188 HydrophobicContact CE3-CZ 3.69Å; W153-F188 AromaticContact CZ3-CE1 3.95Å; W153-F188 HydrophobicContact CZ3-CE1 3.95Å; W153-F188 HydrophobicContact CZ3-CZ 4.03Å; W160-F188 AromaticContact CE2-CD2 3.94Å; W160-F188 AromaticContact CZ2-CD2 3.78Å; W160-F188 HydrophobicContact CZ2-CD2 3.78Å; W160-F188 HydrophobicContact CZ2-CE2 4.08Å; W160-F188 AromaticContact NE1-CD2 3.99Å; P184-F188 VanDerWaalsContact O-CB 3.32Å; P184-F188 WeakPolarHBondContact O-CB 3.34Å; P184-F188 PolarHBondContact O-N 2.94Å; V185-F188 PolarHBondContact O-N 2.96Å; I186-F188 VanDerWaalsContact C-N 3.33Å; I186-F188 PolarHBondContact O-N 2.79Å; F188-R192 HydrophobicContact CD2-CB 3.92Å; F188-R192 HydrophobicContact CD2-CG 3.83Å; F188-R192 HydrophobicContact CE2-CB 4.25Å; F188-R192 HydrophobicContact CE2-CG 3.65Å; F188-R192 HydrophobicContact CG-CB 4.43Å; F188-R192 HydrophobicContact CZ-CG 4.39Å; F188-R192 CarbonylContact O-C 3.45Å; F188-R192 WeakPolarHBondContact O-CA 3.36Å; F188-R192 VanDerWaalsContact O-CB 3.22Å; F188-R192 WeakPolarHBondContact O-CB 3.39Å; F188-R192 PolarHBondContact O-N 3.08Å; F188-V193 HydrophobicContact CD1-CG2 3.75Å; F188-V193 HydrophobicContact CE1-CG2 3.47Å; F188-V193 VanDerWaalsContact CE1-CG2 3.47Å; F188-V193 HydrophobicContact CZ-CG2 4.09Å; F188-V193 WeakPolarHBondContact O-CG2 3.14Å; F188-V193 PolarHBondContact O-N 2.87Å
189	W	95	Very high	89.7	Confident	5 Å²	5	40.4 Å²	40.4	2%	0.019	21%	0.212	C	C	.	.	I	π-helix	trans	-63.3	-56	177.6	176.7	-108.9	0	0	0	112.5	W138 Y142 V185 I186 V193 L194 P357 F361 I362 M442	W138-W189 HydrophobicContact CB-CH2 4.5Å; W138-W189 HydrophobicContact CB-CZ3 4.33Å; W138-W189 AromaticContact CD2-CH2 3.71Å; W138-W189 HydrophobicContact CD2-CH2 3.71Å; W138-W189 HydrophobicContact CD2-CZ3 4.36Å; W138-W189 AromaticContact CE3-CH2 3.76Å; W138-W189 HydrophobicContact CE3-CH2 3.76Å; W138-W189 HydrophobicContact CG-CH2 4.06Å; W138-W189 HydrophobicContact CG-CZ3 4.23Å; W138-W189 HydrophobicContact CZ3-CH2 4.22Å; Y142-W189 AromaticContact CE2-CE3 3.79Å; Y142-W189 HydrophobicContact CE2-CE3 3.79Å; Y142-W189 AromaticContact CE2-CZ3 3.9Å; Y142-W189 HydrophobicContact CE2-CZ3 3.9Å; V185-W189 PolarHBondContact O-N 3.42Å; I186-W189 PolarHBondContact O-N 3.09Å; W189-V193 HydrophobicContact CE3-CB 4.16Å; W189-V193 HydrophobicContact CE3-CG1 4.05Å; W189-V193 HydrophobicContact CE3-CG2 4.36Å; W189-V193 HydrophobicContact CZ3-CG1 4.02Å; W189-V193 WeakPolarHBondContact O-CB 3.49Å; W189-L194 HydrophobicContact CD2-CD1 4.13Å; W189-L194 HydrophobicContact CD2-CG 4.3Å; W189-L194 VanDerWaalsContact CE2-CD1 3.47Å; W189-L194 HydrophobicContact CG-CD1 4.49Å; W189-L194 HydrophobicContact CH2-CD2 4.35Å; W189-L194 HydrophobicContact CZ2-CD1 3.71Å; W189-L194 HydrophobicContact CZ2-CD2 4.3Å; W189-L194 HydrophobicContact CZ2-CG 4.2Å; W189-L194 WeakPolarHBondContact O-CB 3.42Å; W189-L194 PolarHBondContact O-N 3.17Å; W189-P357 HydrophobicContact CZ2-CB 4.36Å; W189-F361 HydrophobicContact CD2-CB 4.11Å; W189-F361 HydrophobicContact CE3-CB 3.56Å; W189-F361 HydrophobicContact CE3-CG 4.13Å; W189-F361 HydrophobicContact CH2-CB 3.96Å; W189-F361 AromaticContact CH2-CD2 3.77Å; W189-F361 HydrophobicContact CH2-CD2 3.77Å; W189-F361 HydrophobicContact CH2-CE2 4.45Å; W189-F361 AromaticContact CH2-CG 3.88Å; W189-F361 HydrophobicContact CH2-CG 3.88Å; W189-F361 HydrophobicContact CZ2-CB 4.49Å; W189-F361 HydrophobicContact CZ3-CB 3.47Å; W189-F361 VanDerWaalsContact CZ3-CB 3.47Å; W189-F361 AromaticContact CZ3-CD1 3.97Å; W189-F361 HydrophobicContact CZ3-CD1 3.97Å; W189-F361 AromaticContact CZ3-CD2 3.91Å; W189-F361 HydrophobicContact CZ3-CD2 3.91Å; W189-F361 AromaticContact CZ3-CG 3.51Å; W189-F361 HydrophobicContact CZ3-CG 3.51Å; W189-I362 HydrophobicContact CB-CD1 4.27Å; W189-I362 HydrophobicContact CB-CG1 3.91Å; W189-I362 HydrophobicContact CG-CD1 4Å; W189-I362 HydrophobicContact CG-CG1 3.93Å; W189-M442 HydrophobicContact CZ2-SD 4.43Å
190	E	93.7	Very high	91.1	Very high	52 Å²	52	35 Å²	35	24%	0.243	18%	0.176	C	C	.	.	I	π-helix	trans	-74.4	-39.5	-172.2	-66.7	-173.4	160.9	0	0	112.4	I186 K195 I196	I186-E190 HydrophobicContact CG2-CG 4.26Å; I186-E190 WeakPolarHBondContact O-CB 3.12Å; I186-E190 PolarHBondContact O-N 3.02Å; E190-K195 CarbonylContact O-C 3.5Å; E190-K195 WeakPolarHBondContact O-CA 3.26Å; E190-K195 PolarHBondContact O-N 3.04Å; E190-I196 HydrophobicContact CB-CG2 3.91Å; E190-I196 HydrophobicContact CG-CG2 4.31Å; E190-I196 PolarHBondContact O-N 3.29Å
191	R	94.8	Very high	92.1	Very high	128 Å²	128	34 Å²	34	48%	0.483	17%	0.168	S	C	.	.	I	π-helix	trans	-104.1	-23.5	-172.1	-56.1	178.9	169.4	-90.5	-5.3	114.5	W160 E187 K195	W160-R191 HydrophobicContact CB-CB 4.36Å; W160-R191 WeakPolarHBondContact O-CD 3.49Å; E187-R191 WeakPolarHBondContact O-CA 3.22Å; E187-R191 WeakPolarHBondContact O-CB 3.47Å; E187-R191 PolarHBondContact O-N 3.17Å; R191-K195 WeakPolarHBondContact O-CG 3.42Å
192	R	95.6	Very high	92.9	Very high	22 Å²	22	38.4 Å²	38.4	8%	0.083	18%	0.184	C	C	.	.	I	π-helix	trans	-104.1	-47.1	-179.9	176.5	58.4	-174.4	103.7	-9.1	113.3	Y159 W160 E187 F188 R207 E209	Y159-R192 WeakPolarHBondContact OH-CD 3.34Å; Y159-R192 PolarHBondContact OH-NE 3.19Å; Y159-R192 VanDerWaalsContact OH-NE 3.09Å; W160-R192 HydrophobicContact CB-CB 4.06Å; W160-R192 HydrophobicContact CD2-CB 3.72Å; W160-R192 HydrophobicContact CD2-CG 3.81Å; W160-R192 HydrophobicContact CE3-CB 4.25Å; W160-R192 VanDerWaalsContact CE3-CD 3.45Å; W160-R192 HydrophobicContact CE3-CG 3.89Å; W160-R192 HydrophobicContact CG-CB 3.65Å; W160-R192 HydrophobicContact CG-CG 4.28Å; W160-R192 HydrophobicContact CH2-CG 4.38Å; W160-R192 HydrophobicContact CZ2-CG 4.35Å; W160-R192 HydrophobicContact CZ3-CG 4.16Å; E187-R192 PolarHBondContact O-N 3.24Å; F188-R192 HydrophobicContact CD2-CB 3.92Å; F188-R192 HydrophobicContact CD2-CG 3.83Å; F188-R192 HydrophobicContact CE2-CB 4.25Å; F188-R192 HydrophobicContact CE2-CG 3.65Å; F188-R192 HydrophobicContact CG-CB 4.43Å; F188-R192 HydrophobicContact CZ-CG 4.39Å; F188-R192 CarbonylContact O-C 3.45Å; F188-R192 WeakPolarHBondContact O-CA 3.36Å; F188-R192 VanDerWaalsContact O-CB 3.22Å; F188-R192 WeakPolarHBondContact O-CB 3.39Å; F188-R192 PolarHBondContact O-N 3.08Å; R192-R207 PolarHBondContact O-NH2 2.99Å; R192-E209 IonicContact CZ-OE2 2.75Å; R192-E209 IonicContact NH1-OE1 2.72Å; R192-E209 IonicContact NH1-OE2 3.16Å; R192-E209 PolarHBondContact NH1-OE2 2.71Å; R192-E209 IonicContact NH2-OE1 2.71Å; R192-E209 PolarHBondContact NH2-OE1 2.85Å; R192-E209 IonicContact NH2-OE2 2.94Å; R192-E209 PolarHBondContact NH2-OE2 2.66Å
193	V	96.3	Very high	93.3	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	19%	0.187	C	C	.	.	I	π-helix	trans	-74.8	-68.2	179.3	-178.3	0	0	0	0	108.1	F141 Y142 F188 W189 R207 L210	F141-V193 HydrophobicContact CD1-CG1 4.18Å; F141-V193 HydrophobicContact CD1-CG2 3.91Å; F141-V193 HydrophobicContact CE1-CB 4.35Å; F141-V193 HydrophobicContact CE1-CG1 4.46Å; F141-V193 HydrophobicContact CE1-CG2 3.68Å; Y142-V193 HydrophobicContact CD2-CG2 4.43Å; Y142-V193 HydrophobicContact CE2-CG1 4.31Å; Y142-V193 HydrophobicContact CE2-CG2 3.66Å; F188-V193 HydrophobicContact CD1-CG2 3.75Å; F188-V193 HydrophobicContact CE1-CG2 3.47Å; F188-V193 VanDerWaalsContact CE1-CG2 3.47Å; F188-V193 HydrophobicContact CZ-CG2 4.09Å; F188-V193 WeakPolarHBondContact O-CG2 3.14Å; F188-V193 PolarHBondContact O-N 2.87Å; W189-V193 HydrophobicContact CE3-CB 4.16Å; W189-V193 HydrophobicContact CE3-CG1 4.05Å; W189-V193 HydrophobicContact CE3-CG2 4.36Å; W189-V193 HydrophobicContact CZ3-CG1 4.02Å; W189-V193 WeakPolarHBondContact O-CB 3.49Å; V193-R207 PolarHBondContact O-NE 3.04Å; V193-L210 HydrophobicContact CG1-CD1 4.45Å; V193-L210 HydrophobicContact CG1-CD2 4.14Å; V193-L210 WeakPolarHBondContact O-CD1 3.4Å
194	L	95.1	Very high	93.7	Very high	7 Å²	7	41.8 Å²	41.8	4%	0.037	21%	0.212	C	C	.	.	I	π-helix	trans	-78	-40.8	-173.6	-60.9	-178.7	0	0	0	113.2	W138 W189 I196 R207 M442	W138-L194 HydrophobicContact CZ2-CD2 4.33Å; W189-L194 HydrophobicContact CD2-CD1 4.13Å; W189-L194 HydrophobicContact CD2-CG 4.3Å; W189-L194 VanDerWaalsContact CE2-CD1 3.47Å; W189-L194 HydrophobicContact CG-CD1 4.49Å; W189-L194 HydrophobicContact CH2-CD2 4.35Å; W189-L194 HydrophobicContact CZ2-CD1 3.71Å; W189-L194 HydrophobicContact CZ2-CD2 4.3Å; W189-L194 HydrophobicContact CZ2-CG 4.2Å; W189-L194 WeakPolarHBondContact O-CB 3.42Å; W189-L194 PolarHBondContact O-N 3.17Å; L194-I196 VanDerWaalsContact C-N 3.29Å; L194-I196 HydrophobicContact CB-CB 4.24Å; L194-I196 HydrophobicContact CD1-CD1 4.48Å; L194-R207 WeakPolarHBondContact O-CD 3.24Å; L194-R207 WeakPolarHBondContact O-CG 3.03Å; L194-R207 PolarHBondContact O-NE 3.09Å; L194-M442 HydrophobicContact CD1-CB 4.13Å; L194-M442 HydrophobicContact CD1-CG 4.11Å; L194-M442 HydrophobicContact CD1-SD 4.26Å
195	K	95.1	Very high	93.9	Very high	81 Å²	81	48.2 Å²	48.2	35%	0.352	24%	0.241	S	C	.	.			trans	48.5	56	-159.1	-69.3	-174.5	-177.8	-177.1	0	110.2	E190 R191 S197 R207 E439	E190-K195 CarbonylContact O-C 3.5Å; E190-K195 WeakPolarHBondContact O-CA 3.26Å; E190-K195 PolarHBondContact O-N 3.04Å; R191-K195 WeakPolarHBondContact O-CG 3.42Å; K195-S197 PolarHBondContact O-N 3.44Å; K195-R207 VanDerWaalsContact CE-CZ 3.42Å; K195-E439 HydrophobicContact CB-CG 3.96Å; K195-E439 WeakPolarHBondContact O-CA 3.45Å; K195-E439 WeakPolarHBondContact O-CB 3.3Å; K195-E439 WeakPolarHBondContact O-CG 3.45Å
196	I	93.6	Very high	94.2	Very high	39 Å²	39	50.6 Å²	50.6	20%	0.2	25%	0.253	C	S	.	.			trans	-59.9	132.4	-170.9	-164.5	164.1	0	0	0	110.7	E190 L194 E439 M442 Y443 Y522	E190-I196 HydrophobicContact CB-CG2 3.91Å; E190-I196 HydrophobicContact CG-CG2 4.31Å; E190-I196 PolarHBondContact O-N 3.29Å; L194-I196 VanDerWaalsContact C-N 3.29Å; L194-I196 HydrophobicContact CB-CB 4.24Å; L194-I196 HydrophobicContact CD1-CD1 4.48Å; I196-E439 WeakPolarHBondContact CA-O 3.48Å; I196-M442 HydrophobicContact CD1-CB 3.93Å; I196-M442 HydrophobicContact CD1-CG 4.15Å; I196-Y443 HydrophobicContact CD1-CE2 4.4Å; I196-Y443 HydrophobicContact CG1-CE2 4.07Å; I196-Y522 HydrophobicContact CD1-CD1 4.43Å; I196-Y522 HydrophobicContact CD1-CE1 3.43Å; I196-Y522 VanDerWaalsContact CD1-CE1 3.43Å; I196-Y522 WeakPolarHBondContact CD1-OH 3.28Å
197	S	94.6	Very high	94.5	Very high	16 Å²	16	49.4 Å²	49.4	11%	0.112	25%	0.245	C	C	.	.			trans	-79.7	176.2	175.1	69.4	0	0	0	0	111.8	K195 G199 H202 E439 G440 Y443	K195-S197 PolarHBondContact O-N 3.44Å; S197-G199 PolarHBondContact O-N 2.97Å; S197-G199 PolarHBondContact OG-O 2.94Å; S197-G199 VanDerWaalsContact OG-O 3.1Å; S197-H202 WeakPolarHBondContact CB-O 3.41Å; S197-H202 PolarHBondContact OG-O 2.93Å; S197-E439 PolarHBondContact N-O 3.16Å; S197-E439 VanDerWaalsContact N-O 3.08Å; S197-G440 VanDerWaalsContact OG-CA 3.24Å; S197-G440 WeakPolarHBondContact OG-CA 3.43Å; S197-Y443 WeakPolarHBondContact O-CE2 3.13Å; S197-Y443 PolarHBondContact O-OH 3.48Å; S197-Y443 VanDerWaalsContact O-OH 3.07Å
198	D	91.6	Very high	94.7	Very high	142 Å²	142	58.5 Å²	58.5	76%	0.759	28%	0.28	S	S	*	.	S	Bend	trans	-69.7	-19.3	-179.9	-63.3	-34.3	0	0	0	113.9	Y443 Y526	D198-Y443 PolarHBondContact O-OH 2.99Å; D198-Y526 WeakPolarHBondContact O-CD2 3.1Å
199	G	92.5	Very high	94.8	Very high	1 Å²	1	62 Å²	62	1%	0.01	30%	0.296	C	S	.	.			trans	177.6	171.2	-175.1	0	0	0	0	0	114.4	S197 E201 H202 Y443 Y526	S197-G199 PolarHBondContact O-N 2.97Å; S197-G199 PolarHBondContact OG-O 2.94Å; S197-G199 VanDerWaalsContact OG-O 3.1Å; G199-E201 PolarHBondContact O-N 3.45Å; G199-H202 CarbonylContact O-C 3.54Å; G199-H202 PolarHBondContact O-N 3.31Å; G199-Y443 VanDerWaalsContact CA-CE2 3.43Å; G199-Y526 VanDerWaalsContact CA-CE2 3.41Å
200	I	94.5	Very high	94.9	Very high	9 Å²	9	61.9 Å²	61.9	5%	0.046	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-21.3	179	-159.7	175.2	0	0	0	112.8	H202 M203 Y443 V444 L447 Y526 Y528 P529 W531	I200-H202 PolarHBondContact O-N 3Å; I200-M203 HydrophobicContact CG1-SD 4.38Å; I200-Y443 HydrophobicContact CB-CG 4.34Å; I200-V444 HydrophobicContact CD1-CG2 4.15Å; I200-V444 HydrophobicContact CG1-CG2 4.16Å; I200-L447 HydrophobicContact CD1-CD1 3.41Å; I200-L447 VanDerWaalsContact CD1-CD1 3.41Å; I200-L447 HydrophobicContact CD1-CG 4.49Å; I200-Y526 VanDerWaalsContact CG2-OH 3.29Å; I200-Y526 WeakPolarHBondContact CG2-OH 3.46Å; I200-Y526 PolarHBondContact N-OH 3.48Å; I200-Y528 HydrophobicContact CD1-CD1 4.41Å; I200-Y528 HydrophobicContact CD1-CE1 4.34Å; I200-Y528 HydrophobicContact CG2-CD1 4.38Å; I200-P529 HydrophobicContact CG2-CG 3.81Å; I200-W531 HydrophobicContact CB-CH2 4.41Å; I200-W531 HydrophobicContact CD1-CH2 4.22Å; I200-W531 HydrophobicContact CD1-CZ3 4.37Å; I200-W531 HydrophobicContact CG1-CH2 4.07Å; I200-W531 HydrophobicContact CG2-CH2 3.63Å; I200-W531 HydrophobicContact CG2-CZ2 3.75Å; I200-W531 HydrophobicContact CG2-CZ3 4.49Å
201	E	94.1	Very high	95.1	Very high	90 Å²	90	59.7 Å²	59.7	42%	0.421	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-24.6	172.5	-58.5	86.7	167.7	0	0	112.3	G199 Y526 P529 W531	G199-E201 PolarHBondContact O-N 3.45Å; E201-Y526 PolarHBondContact OE2-OH 2.96Å; E201-P529 HydrophobicContact CG-CG 4.37Å; E201-P529 WeakPolarHBondContact OE1-CB 3.42Å; E201-P529 VanDerWaalsContact OE1-CD 3.29Å; E201-P529 WeakPolarHBondContact OE1-CD 3.16Å; E201-P529 WeakPolarHBondContact OE1-CG 3.34Å; E201-W531 HydrophobicContact CG-CZ2 4.2Å
202	H	94.1	Very high	95.3	Very high	115 Å²	115	59.6 Å²	59.6	53%	0.532	29%	0.293	S	S	.	.			trans	-117.5	79.6	-175.8	-60.4	-62	0	0	0	109.5	S197 G199 I200 G204	S197-H202 WeakPolarHBondContact CB-O 3.41Å; S197-H202 PolarHBondContact OG-O 2.93Å; G199-H202 CarbonylContact O-C 3.54Å; G199-H202 PolarHBondContact O-N 3.31Å; I200-H202 PolarHBondContact O-N 3Å; H202-G204 PolarHBondContact O-N 3.16Å
203	M	92.6	Very high	95.4	Very high	58 Å²	58	58.9 Å²	58.9	29%	0.286	29%	0.292	S	S	.	.			trans	-64.3	-23.3	-178.6	-68.9	-59.6	-71.8	0	0	113.9	I200 I435 T438 E439 G440 V444	I200-M203 HydrophobicContact CG1-SD 4.38Å; M203-I435 HydrophobicContact CE-CG2 3.58Å; M203-T438 WeakPolarHBondContact CE-OG1 3.2Å; M203-T438 WeakPolarHBondContact O-CB 3.48Å; M203-T438 PolarHBondContact O-OG1 3.48Å; M203-E439 PolarHBondContact O-N 2.75Å; M203-G440 PolarHBondContact O-N 2.84Å; M203-V444 HydrophobicContact CE-CG2 3.68Å; M203-V444 HydrophobicContact SD-CG2 4.01Å
204	G	94.1	Very high	95.5	Very high	53 Å²	53	58.9 Å²	58.9	55%	0.546	29%	0.292	S	S	.	.			trans	63.5	-153.5	176.3	0	0	0	0	0	113.6	H202 E439	H202-G204 PolarHBondContact O-N 3.16Å; G204-E439 WeakPolarHBondContact CA-OE2 3.46Å
205	E	95.4	Very high	95.7	Very high	145 Å²	145	60.5 Å²	60.5	68%	0.678	31%	0.306	S	S	*	.			trans	-88.8	163.8	-177.9	-65.4	-170.2	170.5	0	0	113.5	T438 E439	E205-T438 WeakPolarHBondContact O-CA 3.45Å; E205-E439 PolarHBondContact N-OE2 3.37Å; E205-E439 VanDerWaalsContact N-OE2 3.07Å; E205-E439 PolarHBondContact O-N 3.4Å; E205-E439 VanDerWaalsContact O-N 3.09Å
206	M	97	Very high	95.8	Very high	52 Å²	52	59.6 Å²	59.6	26%	0.256	31%	0.305	S	S	.	.	B	Isolated β-bridge	trans	-75.8	127.8	173.5	-174.1	63.1	64.2	0	0	110.7	W208 A211 L434 C437 T438	M206-W208 HydrophobicContact CB-CZ2 4.45Å; M206-W208 HydrophobicContact CG-CD2 4.24Å; M206-W208 HydrophobicContact CG-CE3 4.37Å; M206-W208 PolarHBondContact O-N 2.92Å; M206-A211 HydrophobicContact SD-CB 4.43Å; M206-L434 HydrophobicContact CE-CB 3.99Å; M206-L434 WeakPolarHBondContact CE-O 3.05Å; M206-L434 HydrophobicContact SD-CB 4.5Å; M206-L434 HydrophobicContact SD-CD2 4.37Å; M206-C437 HydrophobicContact SD-CB 3.93Å; M206-T438 HydrophobicContact CE-CG2 3.81Å; M206-T438 HydrophobicContact SD-CG2 4.2Å
207	R	97.3	Very high	96	Very high	20 Å²	20	57.8 Å²	57.8	8%	0.075	30%	0.295	C	S	.	.			trans	-80.3	85.4	171.2	-54.9	-65.7	-67.8	129.3	3.5	109.4	R192 V193 L194 K195 E209 L210 A211 C437	R192-R207 PolarHBondContact O-NH2 2.99Å; V193-R207 PolarHBondContact O-NE 3.04Å; L194-R207 WeakPolarHBondContact O-CD 3.24Å; L194-R207 WeakPolarHBondContact O-CG 3.03Å; L194-R207 PolarHBondContact O-NE 3.09Å; K195-R207 VanDerWaalsContact CE-CZ 3.42Å; R207-E209 PolarHBondContact O-N 2.83Å; R207-E209 VanDerWaalsContact O-N 3.14Å; R207-L210 HydrophobicContact CB-CB 4.01Å; R207-L210 HydrophobicContact CB-CD1 3.96Å; R207-L210 HydrophobicContact CB-CG 4.12Å; R207-L210 HydrophobicContact CG-CD1 4.29Å; R207-L210 WeakPolarHBondContact O-CA 3.43Å; R207-L210 WeakPolarHBondContact O-CB 3.24Å; R207-L210 PolarHBondContact O-N 3.34Å; R207-A211 PolarHBondContact O-N 3.01Å; R207-C437 WeakPolarHBondContact CA-O 3.42Å; R207-C437 WeakPolarHBondContact CB-O 3.34Å; R207-C437 WeakPolarHBondContact CG-O 3.46Å; R207-C437 PolarHBondContact N-O 2.95Å
208	W	96.9	Very high	96.1	Very high	193 Å²	193	57.5 Å²	57.5	73%	0.731	29%	0.292	S	S	*	.	H	α-helix	trans	-53.7	-36.2	-175.7	-68.8	106.6	0	0	0	114.7	M206 A211 M212	M206-W208 HydrophobicContact CB-CZ2 4.45Å; M206-W208 HydrophobicContact CG-CD2 4.24Å; M206-W208 HydrophobicContact CG-CE3 4.37Å; M206-W208 PolarHBondContact O-N 2.92Å; W208-A211 PolarHBondContact O-N 3.14Å; W208-M212 WeakPolarHBondContact O-CG 3.2Å; W208-M212 PolarHBondContact O-N 3.07Å
209	E	97.1	Very high	96.4	Very high	73 Å²	73	56.7 Å²	56.7	34%	0.341	28%	0.282	S	S	.	.	H	α-helix	trans	-64.6	-40.9	175.7	-64.1	175.5	-175.3	0	0	112.3	F141 R192 R207 M212 C213	F141-E209 HydrophobicContact CD2-CB 4.36Å; F141-E209 HydrophobicContact CE2-CB 3.91Å; F141-E209 VanDerWaalsContact CE2-OE2 3.27Å; F141-E209 WeakPolarHBondContact CE2-OE2 3.44Å; R192-E209 IonicContact CZ-OE2 2.75Å; R192-E209 IonicContact NH1-OE1 2.72Å; R192-E209 IonicContact NH1-OE2 3.16Å; R192-E209 PolarHBondContact NH1-OE2 2.71Å; R192-E209 IonicContact NH2-OE1 2.71Å; R192-E209 PolarHBondContact NH2-OE1 2.85Å; R192-E209 IonicContact NH2-OE2 2.94Å; R192-E209 PolarHBondContact NH2-OE2 2.66Å; R207-E209 PolarHBondContact O-N 2.83Å; R207-E209 VanDerWaalsContact O-N 3.14Å; E209-M212 HydrophobicContact CG-CE 4.32Å; E209-M212 PolarHBondContact O-N 2.93Å; E209-C213 PolarHBondContact O-N 3.16Å; E209-C213 PolarHBondContact O-SG 2.91Å
210	L	97.3	Very high	96.6	Very high	3 Å²	3	59.2 Å²	59.2	2%	0.016	29%	0.294	C	S	.	.	H	α-helix	trans	-69.1	-39.5	173.6	-70.6	-178.2	0	0	0	111.4	F141 V193 R207 M212 C213 L214 C437	F141-L210 HydrophobicContact CB-CD2 3.93Å; F141-L210 HydrophobicContact CD2-CD2 3.75Å; F141-L210 HydrophobicContact CG-CD2 3.91Å; V193-L210 HydrophobicContact CG1-CD1 4.45Å; V193-L210 HydrophobicContact CG1-CD2 4.14Å; V193-L210 WeakPolarHBondContact O-CD1 3.4Å; R207-L210 HydrophobicContact CB-CB 4.01Å; R207-L210 HydrophobicContact CB-CD1 3.96Å; R207-L210 HydrophobicContact CB-CG 4.12Å; R207-L210 HydrophobicContact CG-CD1 4.29Å; R207-L210 WeakPolarHBondContact O-CA 3.43Å; R207-L210 WeakPolarHBondContact O-CB 3.24Å; R207-L210 PolarHBondContact O-N 3.34Å; L210-M212 VanDerWaalsContact C-N 3.29Å; L210-M212 PolarHBondContact O-N 3.29Å; L210-C213 CarbonylContact O-C 3.15Å; L210-C213 PolarHBondContact O-N 3.26Å; L210-C213 VanDerWaalsContact O-N 3.14Å; L210-L214 WeakPolarHBondContact O-CB 3.17Å; L210-L214 PolarHBondContact O-N 3.28Å; L210-C437 HydrophobicContact CB-CB 4.34Å
211	A	97.9	Very high	96.6	Very high	6 Å²	6	58.8 Å²	58.8	5%	0.05	29%	0.292	C	S	.	.	H	α-helix	trans	-60.6	-38.1	174.8	0	0	0	0	0	112	M206 R207 W208 L214 A215 L434	M206-A211 HydrophobicContact SD-CB 4.43Å; R207-A211 PolarHBondContact O-N 3.01Å; W208-A211 PolarHBondContact O-N 3.14Å; A211-L214 PolarHBondContact O-N 3.41Å; A211-A215 WeakPolarHBondContact O-CB 3.13Å; A211-A215 PolarHBondContact O-N 2.97Å; A211-L434 HydrophobicContact CB-CD2 3.69Å
212	M	98.1	Very high	96.7	Very high	126 Å²	126	56.3 Å²	56.3	62%	0.621	28%	0.279	S	S	*	.	H	α-helix	trans	-67.4	-40.9	172.4	-72.4	-173.1	-65.1	0	0	112.2	W208 E209 L210 L214 A215 L216	W208-M212 WeakPolarHBondContact O-CG 3.2Å; W208-M212 PolarHBondContact O-N 3.07Å; E209-M212 HydrophobicContact CG-CE 4.32Å; E209-M212 PolarHBondContact O-N 2.93Å; L210-M212 VanDerWaalsContact C-N 3.29Å; L210-M212 PolarHBondContact O-N 3.29Å; M212-L214 VanDerWaalsContact C-N 3.3Å; M212-L214 PolarHBondContact O-N 3.49Å; M212-A215 PolarHBondContact O-N 3.27Å; M212-L216 WeakPolarHBondContact O-CB 3.12Å; M212-L216 PolarHBondContact O-N 2.93Å
213	C	98.4	Very high	96.7	Very high	8 Å²	8	54.7 Å²	54.7	5%	0.054	27%	0.271	C	S	.	.	H	α-helix	trans	-63.4	-37.8	174.4	-64.8	0	0	0	0	111.6	A137 I140 E209 L210 L216 A217	A137-C213 HydrophobicContact CB-CB 4.06Å; A137-C213 WeakPolarHBondContact O-CB 3.42Å; I140-C213 HydrophobicContact CB-CB 4.31Å; I140-C213 HydrophobicContact CG2-CB 3.98Å; E209-C213 PolarHBondContact O-N 3.16Å; E209-C213 PolarHBondContact O-SG 2.91Å; L210-C213 CarbonylContact O-C 3.15Å; L210-C213 PolarHBondContact O-N 3.26Å; L210-C213 VanDerWaalsContact O-N 3.14Å; C213-L216 PolarHBondContact O-N 3.13Å; C213-A217 WeakPolarHBondContact O-CB 3.43Å; C213-A217 PolarHBondContact O-N 2.72Å
214	L	98.4	Very high	96.7	Very high	0 Å²	0	52.6 Å²	52.6	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-65	-44	174.2	-179.3	66.4	0	0	0	111.3	I133 V134 A137 L210 A211 M212 L216 A217 W218 F430 L434	I133-L214 HydrophobicContact CG2-CD1 3.69Å; V134-L214 HydrophobicContact CG2-CD1 4.32Å; A137-L214 HydrophobicContact CB-CB 3.95Å; A137-L214 HydrophobicContact CB-CD1 4.34Å; L210-L214 WeakPolarHBondContact O-CB 3.17Å; L210-L214 PolarHBondContact O-N 3.28Å; A211-L214 PolarHBondContact O-N 3.41Å; M212-L214 VanDerWaalsContact C-N 3.3Å; M212-L214 PolarHBondContact O-N 3.49Å; L214-L216 VanDerWaalsContact C-N 3.31Å; L214-L216 PolarHBondContact O-N 2.87Å; L214-A217 PolarHBondContact O-N 3.41Å; L214-W218 PolarHBondContact O-N 3.46Å; L214-F430 HydrophobicContact CB-CE2 4.38Å; L214-F430 HydrophobicContact CD2-CD2 3.94Å; L214-F430 HydrophobicContact CD2-CE2 4.13Å; L214-F430 HydrophobicContact CG-CD2 3.9Å; L214-F430 HydrophobicContact CG-CE2 4.13Å; L214-L434 HydrophobicContact CD2-CD2 4.38Å
215	A	98.3	Very high	96.6	Very high	41 Å²	41	50.1 Å²	50.1	34%	0.339	24%	0.236	S	C	.	.	H	α-helix	trans	-61.1	-41.4	174.7	0	0	0	0	0	111.4	A211 M212 W218 F219 F430	A211-A215 WeakPolarHBondContact O-CB 3.13Å; A211-A215 PolarHBondContact O-N 2.97Å; M212-A215 PolarHBondContact O-N 3.27Å; A215-W218 PolarHBondContact O-N 3.29Å; A215-F219 WeakPolarHBondContact O-CB 3.28Å; A215-F219 PolarHBondContact O-N 3.47Å; A215-F430 HydrophobicContact CB-CD2 4.41Å; A215-F430 HydrophobicContact CB-CE2 3.68Å; A215-F430 HydrophobicContact CB-CZ 4.1Å
216	L	98.3	Very high	96.3	Very high	62 Å²	62	47.3 Å²	47.3	33%	0.325	22%	0.219	S	C	.	.	H	α-helix	trans	-65.1	-41.2	175.4	-179.2	59	0	0	0	112	I140 F144 M212 C213 L214 F219 I220	I140-L216 HydrophobicContact CG2-CD2 3.98Å; F144-L216 HydrophobicContact CE2-CD2 3.91Å; F144-L216 HydrophobicContact CZ-CD2 3.65Å; M212-L216 WeakPolarHBondContact O-CB 3.12Å; M212-L216 PolarHBondContact O-N 2.93Å; C213-L216 PolarHBondContact O-N 3.13Å; L214-L216 VanDerWaalsContact C-N 3.31Å; L214-L216 PolarHBondContact O-N 2.87Å; L216-F219 HydrophobicContact CD1-CD1 4.43Å; L216-F219 WeakPolarHBondContact O-CB 3.39Å; L216-F219 PolarHBondContact O-N 3.45Å; L216-I220 HydrophobicContact CD1-CD1 4.16Å; L216-I220 HydrophobicContact CD1-CG1 4.26Å; L216-I220 HydrophobicContact CG-CD1 4.04Å; L216-I220 VanDerWaalsContact O-CG1 3.31Å; L216-I220 WeakPolarHBondContact O-CG1 3.25Å; L216-I220 PolarHBondContact O-N 3.06Å
217	A	97.8	Very high	95.9	Very high	0 Å²	0	51 Å²	51	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-59.9	-46.6	175.6	0	0	0	0	0	111.5	I133 L136 I140 C213 L214 I220 C221	I133-A217 HydrophobicContact CD1-CB 4.07Å; I133-A217 HydrophobicContact CG1-CB 3.86Å; L136-A217 HydrophobicContact CB-CB 4.13Å; I140-A217 HydrophobicContact CD1-CB 3.85Å; C213-A217 WeakPolarHBondContact O-CB 3.43Å; C213-A217 PolarHBondContact O-N 2.72Å; L214-A217 PolarHBondContact O-N 3.41Å; A217-I220 PolarHBondContact O-N 3.48Å; A217-C221 WeakPolarHBondContact O-CB 3.39Å; A217-C221 PolarHBondContact O-N 2.71Å
218	W	97.6	Very high	95.4	Very high	11 Å²	11	50.1 Å²	50.1	4%	0.042	23%	0.231	C	C	.	.	H	α-helix	trans	-63.5	-40.4	175.1	-85.3	110.4	0	0	0	112.9	N129 I133 L214 A215 C221 Y222 V397 S426 F430	N129-W218 WeakPolarHBondContact OD1-CH2 3.47Å; I133-W218 HydrophobicContact CB-CZ2 4.42Å; I133-W218 HydrophobicContact CD1-CB 4.38Å; I133-W218 HydrophobicContact CD1-CD2 3.38Å; I133-W218 VanDerWaalsContact CD1-CE2 3.42Å; I133-W218 HydrophobicContact CD1-CE3 3.77Å; I133-W218 HydrophobicContact CD1-CG 3.66Å; I133-W218 HydrophobicContact CD1-CH2 4.21Å; I133-W218 HydrophobicContact CD1-CZ2 3.84Å; I133-W218 HydrophobicContact CD1-CZ3 4.17Å; I133-W218 HydrophobicContact CG2-CZ2 3.77Å; L214-W218 PolarHBondContact O-N 3.46Å; A215-W218 PolarHBondContact O-N 3.29Å; W218-C221 PolarHBondContact O-N 2.97Å; W218-Y222 WeakPolarHBondContact O-CB 3.47Å; W218-Y222 PolarHBondContact O-N 3.49Å; W218-V397 HydrophobicContact CH2-CG2 4.3Å; W218-V397 HydrophobicContact CZ3-CG2 3.95Å; W218-S426 VanDerWaalsContact CE3-CB 3.41Å; W218-S426 VanDerWaalsContact CE3-OG 3.29Å; W218-S426 WeakPolarHBondContact CZ3-OG 3.42Å; W218-F430 AromaticContact CD1-CD2 3.86Å; W218-F430 HydrophobicContact CG-CB 4.26Å
219	F	96.8	Very high	94.8	Very high	124 Å²	124	41.3 Å²	41.3	54%	0.544	20%	0.198	S	C	.	.	H	α-helix	trans	-59	-49.4	175.5	177.3	-87.8	0	0	0	111	A215 L216 Y222 F223	A215-F219 WeakPolarHBondContact O-CB 3.28Å; A215-F219 PolarHBondContact O-N 3.47Å; L216-F219 HydrophobicContact CD1-CD1 4.43Å; L216-F219 WeakPolarHBondContact O-CB 3.39Å; L216-F219 PolarHBondContact O-N 3.45Å; F219-Y222 PolarHBondContact O-N 2.9Å; F219-F223 HydrophobicContact CD1-CD2 4.16Å; F219-F223 HydrophobicContact CD1-CE2 4.31Å; F219-F223 HydrophobicContact CD2-CD2 4.38Å; F219-F223 AromaticContact CD2-CE2 3.82Å; F219-F223 HydrophobicContact CD2-CE2 3.82Å; F219-F223 AromaticContact CE1-CD2 3.89Å; F219-F223 HydrophobicContact CE1-CD2 3.89Å; F219-F223 AromaticContact CE1-CE2 3.88Å; F219-F223 HydrophobicContact CE1-CE2 3.88Å; F219-F223 HydrophobicContact CE2-CD2 4.16Å; F219-F223 AromaticContact CE2-CE2 3.37Å; F219-F223 HydrophobicContact CE2-CE2 3.37Å; F219-F223 HydrophobicContact CE2-CZ 4.25Å; F219-F223 HydrophobicContact CG-CD2 4.39Å; F219-F223 HydrophobicContact CG-CE2 4.28Å; F219-F223 AromaticContact CZ-CD2 3.89Å; F219-F223 HydrophobicContact CZ-CD2 3.89Å; F219-F223 AromaticContact CZ-CE2 3.38Å; F219-F223 HydrophobicContact CZ-CE2 3.38Å; F219-F223 HydrophobicContact CZ-CZ 4.29Å; F219-F223 VanDerWaalsContact O-CD2 3.25Å; F219-F223 WeakPolarHBondContact O-CD2 3.33Å; F219-F223 PolarHBondContact O-N 3.2Å
220	I	96	Very high	94.3	Very high	55 Å²	55	44 Å²	44	28%	0.282	21%	0.209	S	C	.	.	H	α-helix	trans	-60.3	-50	176.7	-66	165.9	0	0	0	110	L216 A217 Y222 F223 C224 L390	L216-I220 HydrophobicContact CD1-CD1 4.16Å; L216-I220 HydrophobicContact CD1-CG1 4.26Å; L216-I220 HydrophobicContact CG-CD1 4.04Å; L216-I220 VanDerWaalsContact O-CG1 3.31Å; L216-I220 WeakPolarHBondContact O-CG1 3.25Å; L216-I220 PolarHBondContact O-N 3.06Å; A217-I220 PolarHBondContact O-N 3.48Å; I220-Y222 VanDerWaalsContact C-N 3.31Å; I220-Y222 PolarHBondContact O-N 3.17Å; I220-F223 PolarHBondContact O-N 2.82Å; I220-C224 PolarHBondContact O-N 3.34Å; I220-C224 VanDerWaalsContact O-N 3.08Å; I220-C224 PolarHBondContact O-SG 3.39Å; I220-L390 HydrophobicContact CB-CD2 4.47Å; I220-L390 HydrophobicContact CG2-CD1 3.85Å; I220-L390 HydrophobicContact CG2-CD2 3.82Å
221	C	95.6	Very high	93.9	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-55.4	-45.2	-179.9	-173.8	0	0	0	0	112.1	A217 W218 F223 C224 I225	A217-C221 WeakPolarHBondContact O-CB 3.39Å; A217-C221 PolarHBondContact O-N 2.71Å; W218-C221 PolarHBondContact O-N 2.97Å; C221-F223 PolarHBondContact O-N 3.3Å; C221-C224 WeakPolarHBondContact O-CB 3.47Å; C221-C224 PolarHBondContact O-N 3.5Å; C221-I225 WeakPolarHBondContact O-CG1 3.47Å; C221-I225 PolarHBondContact O-N 3.24Å
222	Y	95.6	Very high	93.5	Very high	37 Å²	37	44.6 Å²	44.6	15%	0.145	21%	0.213	C	C	.	.	H	α-helix	trans	-57.1	-49.9	179.2	172.2	-100.7	0	0	0	112.2	W218 F219 I220 C224 I225 W226 I422 L423	W218-Y222 WeakPolarHBondContact O-CB 3.47Å; W218-Y222 PolarHBondContact O-N 3.49Å; F219-Y222 PolarHBondContact O-N 2.9Å; I220-Y222 VanDerWaalsContact C-N 3.31Å; I220-Y222 PolarHBondContact O-N 3.17Å; Y222-C224 VanDerWaalsContact C-N 3.28Å; Y222-C224 PolarHBondContact O-N 2.63Å; Y222-I225 PolarHBondContact O-N 2.86Å; Y222-W226 WeakPolarHBondContact O-CB 3.43Å; Y222-W226 PolarHBondContact O-N 3.45Å; Y222-I422 HydrophobicContact CD2-CB 4.42Å; Y222-I422 HydrophobicContact CD2-CG2 3.76Å; Y222-I422 HydrophobicContact CE2-CB 4.36Å; Y222-I422 HydrophobicContact CE2-CG2 4.18Å; Y222-L423 HydrophobicContact CD2-CB 4.22Å; Y222-L423 HydrophobicContact CD2-CD1 4.25Å; Y222-L423 HydrophobicContact CE2-CB 3.65Å; Y222-L423 HydrophobicContact CE2-CD1 4.16Å; Y222-L423 HydrophobicContact CE2-CG 4.44Å
223	F	94	Very high	93	Very high	81 Å²	81	38.6 Å²	38.6	36%	0.355	18%	0.183	S	C	.	.	H	α-helix	trans	-70.5	-23.7	-180	-74.9	-72.4	0	0	0	113.4	F219 I220 C221 I225 W226 S231	F219-F223 HydrophobicContact CD1-CD2 4.16Å; F219-F223 HydrophobicContact CD1-CE2 4.31Å; F219-F223 HydrophobicContact CD2-CD2 4.38Å; F219-F223 AromaticContact CD2-CE2 3.82Å; F219-F223 HydrophobicContact CD2-CE2 3.82Å; F219-F223 AromaticContact CE1-CD2 3.89Å; F219-F223 HydrophobicContact CE1-CD2 3.89Å; F219-F223 AromaticContact CE1-CE2 3.88Å; F219-F223 HydrophobicContact CE1-CE2 3.88Å; F219-F223 HydrophobicContact CE2-CD2 4.16Å; F219-F223 AromaticContact CE2-CE2 3.37Å; F219-F223 HydrophobicContact CE2-CE2 3.37Å; F219-F223 HydrophobicContact CE2-CZ 4.25Å; F219-F223 HydrophobicContact CG-CD2 4.39Å; F219-F223 HydrophobicContact CG-CE2 4.28Å; F219-F223 AromaticContact CZ-CD2 3.89Å; F219-F223 HydrophobicContact CZ-CD2 3.89Å; F219-F223 AromaticContact CZ-CE2 3.38Å; F219-F223 HydrophobicContact CZ-CE2 3.38Å; F219-F223 HydrophobicContact CZ-CZ 4.29Å; F219-F223 VanDerWaalsContact O-CD2 3.25Å; F219-F223 WeakPolarHBondContact O-CD2 3.33Å; F219-F223 PolarHBondContact O-N 3.2Å; I220-F223 PolarHBondContact O-N 2.82Å; C221-F223 PolarHBondContact O-N 3.3Å; F223-I225 VanDerWaalsContact C-N 3.33Å; F223-W226 HydrophobicContact CD1-CD2 4.04Å; F223-W226 AromaticContact CD1-CE3 3.79Å; F223-W226 HydrophobicContact CD1-CE3 3.79Å; F223-W226 HydrophobicContact CD1-CH2 4.09Å; F223-W226 HydrophobicContact CD1-CZ2 4.31Å; F223-W226 AromaticContact CD1-CZ3 3.82Å; F223-W226 HydrophobicContact CD1-CZ3 3.82Å; F223-W226 AromaticContact CE1-CE3 3.89Å; F223-W226 HydrophobicContact CE1-CE3 3.89Å; F223-W226 HydrophobicContact CE1-CH2 4.17Å; F223-W226 AromaticContact CE1-CZ3 3.66Å; F223-W226 HydrophobicContact CE1-CZ3 3.66Å; F223-W226 PolarHBondContact O-NE1 3.18Å; F223-S231 PolarHBondContact O-OG 2.66Å
224	C	92.8	Very high	92.7	Very high	15 Å²	15	43.8 Å²	43.8	10%	0.101	21%	0.205	C	C	.	.	H	α-helix	trans	-65.9	-35.6	172.7	-68.2	0	0	0	0	112.1	I220 C221 Y222 S231 T232 V235	I220-C224 PolarHBondContact O-N 3.34Å; I220-C224 VanDerWaalsContact O-N 3.08Å; I220-C224 PolarHBondContact O-SG 3.39Å; C221-C224 WeakPolarHBondContact O-CB 3.47Å; C221-C224 PolarHBondContact O-N 3.5Å; Y222-C224 VanDerWaalsContact C-N 3.28Å; Y222-C224 PolarHBondContact O-N 2.63Å; C224-S231 CarbonylContact O-C 3.58Å; C224-S231 VanDerWaalsContact O-CB 3.23Å; C224-S231 WeakPolarHBondContact O-CB 3.34Å; C224-S231 PolarHBondContact O-OG 2.94Å; C224-T232 PolarHBondContact O-N 3.1Å; C224-V235 HydrophobicContact CB-CG1 4.46Å; C224-V235 HydrophobicContact CB-CG2 4.31Å
225	I	92.1	Very high	92.5	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-111.8	-8.4	-171.2	63.7	-175.6	0	0	0	116.2	C221 Y222 F223 K227 G228 F394 V397 R418 I422	C221-I225 WeakPolarHBondContact O-CG1 3.47Å; C221-I225 PolarHBondContact O-N 3.24Å; Y222-I225 PolarHBondContact O-N 2.86Å; F223-I225 VanDerWaalsContact C-N 3.33Å; I225-K227 PolarHBondContact O-N 3.2Å; I225-G228 WeakPolarHBondContact O-CA 3.46Å; I225-G228 PolarHBondContact O-N 2.88Å; I225-F394 HydrophobicContact CG2-CB 3.44Å; I225-F394 VanDerWaalsContact CG2-CB 3.44Å; I225-F394 HydrophobicContact CG2-CD2 4.26Å; I225-F394 HydrophobicContact CG2-CG 4.05Å; I225-V397 HydrophobicContact CD1-CB 3.67Å; I225-V397 HydrophobicContact CD1-CG1 3.3Å; I225-V397 HydrophobicContact CD1-CG2 4.38Å; I225-R418 PolarHBondContact O-NH1 3.47Å; I225-I422 HydrophobicContact CD1-CG2 3.42Å; I225-I422 VanDerWaalsContact CD1-CG2 3.42Å; I225-I422 HydrophobicContact CG1-CD1 4.26Å; I225-I422 HydrophobicContact CG1-CG2 3.73Å
226	W	90.3	Very high	92.3	Very high	86 Å²	86	43.6 Å²	43.6	33%	0.326	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-49.3	-40.4	-172.6	66.6	-26.6	0	0	0	114.1	Y222 F223 R418 E419	Y222-W226 WeakPolarHBondContact O-CB 3.43Å; Y222-W226 PolarHBondContact O-N 3.45Å; F223-W226 HydrophobicContact CD1-CD2 4.04Å; F223-W226 AromaticContact CD1-CE3 3.79Å; F223-W226 HydrophobicContact CD1-CE3 3.79Å; F223-W226 HydrophobicContact CD1-CH2 4.09Å; F223-W226 HydrophobicContact CD1-CZ2 4.31Å; F223-W226 AromaticContact CD1-CZ3 3.82Å; F223-W226 HydrophobicContact CD1-CZ3 3.82Å; F223-W226 AromaticContact CE1-CE3 3.89Å; F223-W226 HydrophobicContact CE1-CE3 3.89Å; F223-W226 HydrophobicContact CE1-CH2 4.17Å; F223-W226 AromaticContact CE1-CZ3 3.66Å; F223-W226 HydrophobicContact CE1-CZ3 3.66Å; F223-W226 PolarHBondContact O-NE1 3.18Å; W226-R418 PolarHBondContact O-NH1 3.24Å; W226-R418 VanDerWaalsContact O-NH1 3.08Å; W226-E419 WeakPolarHBondContact O-CG 3.21Å
227	K	88.4	Confident	92.1	Very high	131 Å²	131	44.7 Å²	44.7	57%	0.57	20%	0.2	S	C	*	.	T	Hydrogen-bonded Turn	trans	-94.8	18.7	176.2	-54.5	179.8	178	-178.6	0	114.3	I225	I225-K227 PolarHBondContact O-N 3.2Å
228	G	86.3	Confident	91.9	Very high	1 Å²	1	48.8 Å²	48.8	1%	0.01	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	61.7	-144.2	178.7	0	0	0	0	0	112.9	I225 K230 S231 T232	I225-G228 WeakPolarHBondContact O-CA 3.46Å; I225-G228 PolarHBondContact O-N 2.88Å; G228-K230 PolarHBondContact O-N 3.44Å; G228-S231 PolarHBondContact O-N 3.27Å; G228-T232 PolarHBondContact O-N 3.41Å; G228-T232 PolarHBondContact O-OG1 3.31Å
229	P	84.3	Confident	91.8	Very high	7 Å²	7	48.7 Å²	48.7	5%	0.045	23%	0.225	C	C	.	.	H	α-helix	trans	-52	-27.3	-176.5	-30.1	36.1	0	0	0	114.6	W38 G233 Y305	W38-P229 HydrophobicContact CD2-CB 4.23Å; W38-P229 HydrophobicContact CE3-CB 3.75Å; W38-P229 HydrophobicContact CH2-CB 4.17Å; W38-P229 HydrophobicContact CZ3-CB 3.73Å; P229-G233 PolarHBondContact O-N 3.34Å; P229-Y305 HydrophobicContact CG-CD1 4.19Å; P229-Y305 HydrophobicContact CG-CD2 3.62Å; P229-Y305 HydrophobicContact CG-CE1 4.2Å; P229-Y305 HydrophobicContact CG-CE2 3.62Å; P229-Y305 HydrophobicContact CG-CG 3.9Å
230	K	86.6	Confident	91.6	Very high	131 Å²	131	43.1 Å²	43.1	57%	0.57	20%	0.203	S	C	*	.	H	α-helix	trans	-71.3	-32.3	178.5	-66.2	-175.8	179.3	176.2	0	113.8	G228 K234	G228-K230 PolarHBondContact O-N 3.44Å; K230-K234 WeakPolarHBondContact O-CG 3.02Å
231	S	89.5	Confident	91.5	Very high	19 Å²	19	43.4 Å²	43.4	13%	0.133	21%	0.207	C	C	.	.	H	α-helix	trans	-85.3	-50.1	175	-176.7	0	0	0	0	109.8	F223 C224 G228 G233 K234 V235	F223-S231 PolarHBondContact O-OG 2.66Å; C224-S231 CarbonylContact O-C 3.58Å; C224-S231 VanDerWaalsContact O-CB 3.23Å; C224-S231 WeakPolarHBondContact O-CB 3.34Å; C224-S231 PolarHBondContact O-OG 2.94Å; G228-S231 PolarHBondContact O-N 3.27Å; S231-G233 VanDerWaalsContact C-N 3.33Å; S231-G233 PolarHBondContact O-N 3.17Å; S231-K234 PolarHBondContact O-N 3.14Å; S231-V235 PolarHBondContact O-N 2.93Å
232	T	88.8	Confident	91.4	Very high	2 Å²	2	45.5 Å²	45.5	1%	0.012	22%	0.216	C	C	.	.	H	α-helix	trans	-52.9	-50.1	179.5	-57	0	0	0	0	111.7	C224 G228 K234 V235 V236 F394	C224-T232 PolarHBondContact O-N 3.1Å; G228-T232 PolarHBondContact O-N 3.41Å; G228-T232 PolarHBondContact O-OG1 3.31Å; T232-K234 PolarHBondContact O-N 3.17Å; T232-V235 PolarHBondContact O-N 3.25Å; T232-V235 VanDerWaalsContact O-N 3.14Å; T232-V236 HydrophobicContact CG2-CG1 4.45Å; T232-V236 WeakPolarHBondContact O-CG1 3.46Å; T232-V236 PolarHBondContact O-N 2.95Å; T232-F394 HydrophobicContact CG2-CD2 3.4Å; T232-F394 HydrophobicContact CG2-CE1 4.27Å; T232-F394 HydrophobicContact CG2-CE2 3.01Å; T232-F394 HydrophobicContact CG2-CG 4.32Å; T232-F394 HydrophobicContact CG2-CZ 3.57Å
233	G	88.1	Confident	91.2	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-59	-22.2	178.6	0	0	0	0	0	114.6	E43 P229 S231 V236 Y237	E43-G233 WeakPolarHBondContact CG-O 3.24Å; P229-G233 PolarHBondContact O-N 3.34Å; S231-G233 VanDerWaalsContact C-N 3.33Å; S231-G233 PolarHBondContact O-N 3.17Å; G233-V236 VanDerWaalsContact O-CG2 3.27Å; G233-V236 WeakPolarHBondContact O-CG2 3.42Å; G233-Y237 WeakPolarHBondContact O-CD2 3.47Å; G233-Y237 WeakPolarHBondContact O-CE2 3.45Å
234	K	92	Very high	91.1	Very high	116 Å²	116	43.4 Å²	43.4	50%	0.504	21%	0.206	S	C	.	.	H	α-helix	trans	-86.2	-39.6	175.9	-62.7	-53.5	-174.6	-161.2	0	112.8	E43 K230 S231 T232 V236 Y237	E43-K234 WeakPolarHBondContact OE1-CE 3.32Å; E43-K234 IonicContact OE1-NZ 3.79Å; E43-K234 PolarHBondContact OE1-NZ 2.83Å; K230-K234 WeakPolarHBondContact O-CG 3.02Å; S231-K234 PolarHBondContact O-N 3.14Å; T232-K234 PolarHBondContact O-N 3.17Å; K234-V236 VanDerWaalsContact C-N 3.34Å; K234-Y237 PolarHBondContact O-N 3.43Å
235	V	93.2	Very high	91.1	Very high	38 Å²	38	46.4 Å²	46.4	23%	0.23	22%	0.224	C	C	.	.	H	α-helix	trans	-63.3	-42.9	-179.7	176	0	0	0	0	110.7	C224 S231 T232 Y237 V238 T239	C224-V235 HydrophobicContact CB-CG1 4.46Å; C224-V235 HydrophobicContact CB-CG2 4.31Å; S231-V235 PolarHBondContact O-N 2.93Å; T232-V235 PolarHBondContact O-N 3.25Å; T232-V235 VanDerWaalsContact O-N 3.14Å; V235-Y237 PolarHBondContact O-N 3.48Å; V235-V238 PolarHBondContact O-N 3.32Å; V235-T239 HydrophobicContact CG1-CG2 3.73Å; V235-T239 PolarHBondContact O-N 2.81Å; V235-T239 PolarHBondContact O-OG1 3.17Å
236	V	93.6	Very high	91	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-60.7	-19.5	-177.1	-63.2	0	0	0	0	115.1	L46 T232 G233 K234 V238 T239 A240 F394	L46-V236 HydrophobicContact CB-CB 4.16Å; L46-V236 HydrophobicContact CB-CG2 3.8Å; T232-V236 HydrophobicContact CG2-CG1 4.45Å; T232-V236 WeakPolarHBondContact O-CG1 3.46Å; T232-V236 PolarHBondContact O-N 2.95Å; G233-V236 VanDerWaalsContact O-CG2 3.27Å; G233-V236 WeakPolarHBondContact O-CG2 3.42Å; K234-V236 VanDerWaalsContact C-N 3.34Å; V236-V238 PolarHBondContact O-N 2.61Å; V236-T239 WeakPolarHBondContact CA-OG1 3.04Å; V236-A240 HydrophobicContact CB-CB 4.39Å; V236-A240 WeakPolarHBondContact O-CB 3.18Å; V236-A240 PolarHBondContact O-N 2.91Å; V236-F394 HydrophobicContact CG1-CE1 3.68Å; V236-F394 HydrophobicContact CG1-CE2 4.27Å; V236-F394 HydrophobicContact CG1-CZ 3.24Å
237	Y	94.3	Very high	91	Very high	84 Å²	84	42.9 Å²	42.9	33%	0.329	21%	0.212	S	C	.	.	H	α-helix	trans	-61.7	-31.2	173.5	-81.6	-81.5	0	0	0	112.5	I42 E43 L46 G233 K234 V235 T241	I42-Y237 HydrophobicContact CG2-CE1 3.76Å; E43-Y237 HydrophobicContact CG-CE2 3.83Å; L46-Y237 HydrophobicContact CD1-CD1 3.74Å; L46-Y237 HydrophobicContact CD1-CE1 3.9Å; L46-Y237 HydrophobicContact CD1-CG 4.18Å; G233-Y237 WeakPolarHBondContact O-CD2 3.47Å; G233-Y237 WeakPolarHBondContact O-CE2 3.45Å; K234-Y237 PolarHBondContact O-N 3.43Å; V235-Y237 PolarHBondContact O-N 3.48Å; Y237-T241 WeakPolarHBondContact O-CB 3.45Å; Y237-T241 WeakPolarHBondContact O-CG2 3.49Å; Y237-T241 PolarHBondContact O-OG1 2.76Å
238	V	94.5	Very high	91.2	Very high	87 Å²	87	41.5 Å²	41.5	53%	0.527	21%	0.21	S	C	.	.	H	α-helix	trans	-95.8	-52.2	177.8	178.9	0	0	0	0	109.9	V235 V236 A240 T241 F242 F387	V235-V238 PolarHBondContact O-N 3.32Å; V236-V238 PolarHBondContact O-N 2.61Å; V238-A240 PolarHBondContact O-N 2.82Å; V238-T241 PolarHBondContact O-N 3.36Å; V238-T241 PolarHBondContact O-OG1 2.8Å; V238-F242 VanDerWaalsContact O-CB 3.29Å; V238-F242 WeakPolarHBondContact O-CB 3.38Å; V238-F242 PolarHBondContact O-N 3.37Å; V238-F387 HydrophobicContact CG1-CE2 4.37Å
239	T	94.6	Very high	91.4	Very high	8 Å²	8	44.5 Å²	44.5	5%	0.049	23%	0.225	C	C	.	.	H	α-helix	trans	-67.7	-35.7	-170.8	52.3	0	0	0	0	112.6	V235 V236 P243 F387 D391	V235-T239 HydrophobicContact CG1-CG2 3.73Å; V235-T239 PolarHBondContact O-N 2.81Å; V235-T239 PolarHBondContact O-OG1 3.17Å; V236-T239 WeakPolarHBondContact CA-OG1 3.04Å; T239-P243 WeakPolarHBondContact O-CD 3.11Å; T239-P243 VanDerWaalsContact O-CG 3.29Å; T239-P243 WeakPolarHBondContact O-CG 3.49Å; T239-F387 HydrophobicContact CG2-CB 4.43Å; T239-F387 HydrophobicContact CG2-CD1 3.87Å; T239-F387 HydrophobicContact CG2-CE1 4.32Å; T239-F387 HydrophobicContact CG2-CG 4.13Å; T239-D391 WeakPolarHBondContact CB-OD1 3.27Å; T239-D391 PolarHBondContact OG1-OD1 2.96Å
240	A	92.8	Very high	91.5	Very high	8 Å²	8	44.5 Å²	44.5	7%	0.066	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83	-22.6	178.6	0	0	0	0	0	113.4	V236 V238 Y244 D391	V236-A240 HydrophobicContact CB-CB 4.39Å; V236-A240 WeakPolarHBondContact O-CB 3.18Å; V236-A240 PolarHBondContact O-N 2.91Å; V238-A240 PolarHBondContact O-N 2.82Å; A240-Y244 VanDerWaalsContact O-CD2 3.24Å; A240-Y244 WeakPolarHBondContact O-CD2 2.85Å; A240-D391 WeakPolarHBondContact CA-OD2 3.07Å; A240-D391 WeakPolarHBondContact CB-OD2 3.32Å; A240-D391 PolarHBondContact N-OD2 3.21Å
241	T	93.4	Very high	91.8	Very high	61 Å²	61	40.1 Å²	40.1	37%	0.374	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.1	-35.3	-175.6	65.5	0	0	0	0	113.1	L46 Y237 V238 Y244 V245	L46-T241 HydrophobicContact CD2-CG2 4.38Å; Y237-T241 WeakPolarHBondContact O-CB 3.45Å; Y237-T241 WeakPolarHBondContact O-CG2 3.49Å; Y237-T241 PolarHBondContact O-OG1 2.76Å; V238-T241 PolarHBondContact O-N 3.36Å; V238-T241 PolarHBondContact O-OG1 2.8Å; T241-Y244 WeakPolarHBondContact O-CB 3.04Å; T241-Y244 PolarHBondContact O-N 3.08Å; T241-Y244 VanDerWaalsContact O-N 3.12Å; T241-V245 PolarHBondContact O-N 3.38Å
242	F	93.9	Very high	92	Very high	43 Å²	43	43.9 Å²	43.9	19%	0.189	23%	0.225	C	C	.	.	H	α-helix	trans	-58.1	-41.6	-179.9	177.1	-88.2	0	0	0	113.3	V238 Y244 V245 M246 L380 M383 M384 F387	V238-F242 VanDerWaalsContact O-CB 3.29Å; V238-F242 WeakPolarHBondContact O-CB 3.38Å; V238-F242 PolarHBondContact O-N 3.37Å; F242-Y244 PolarHBondContact O-N 3.15Å; F242-V245 WeakPolarHBondContact O-CB 3.46Å; F242-V245 PolarHBondContact O-N 3.03Å; F242-V245 VanDerWaalsContact O-N 3.11Å; F242-M246 HydrophobicContact CD1-CG 3.88Å; F242-M246 HydrophobicContact CE1-CG 3.33Å; F242-M246 HydrophobicContact CE1-SD 4.35Å; F242-M246 HydrophobicContact CE2-CG 4.21Å; F242-M246 HydrophobicContact CZ-CG 3.52Å; F242-M246 HydrophobicContact CZ-SD 3.96Å; F242-M246 PolarHBondContact O-N 2.99Å; F242-L380 HydrophobicContact CZ-CD2 4.13Å; F242-M383 HydrophobicContact CE1-CB 4.23Å; F242-M383 HydrophobicContact CE1-CG 3.98Å; F242-M383 HydrophobicContact CE1-SD 4.14Å; F242-M383 HydrophobicContact CE2-SD 4.19Å; F242-M383 HydrophobicContact CZ-CB 4.47Å; F242-M383 HydrophobicContact CZ-CG 4.16Å; F242-M383 HydrophobicContact CZ-SD 3.71Å; F242-M384 HydrophobicContact CE1-CB 4.19Å; F242-F387 HydrophobicContact CB-CD2 3.79Å; F242-F387 HydrophobicContact CB-CE2 4.05Å; F242-F387 AromaticContact CD1-CD2 3.45Å; F242-F387 HydrophobicContact CD1-CD2 3.45Å; F242-F387 VanDerWaalsContact CD1-CD2 3.45Å; F242-F387 AromaticContact CD1-CE2 3.77Å; F242-F387 HydrophobicContact CD1-CE2 3.77Å; F242-F387 HydrophobicContact CD2-CE2 4.37Å; F242-F387 HydrophobicContact CE1-CD2 4.19Å; F242-F387 HydrophobicContact CE1-CE2 4.28Å; F242-F387 AromaticContact CG-CD2 3.75Å; F242-F387 HydrophobicContact CG-CD2 3.75Å; F242-F387 AromaticContact CG-CE2 3.81Å; F242-F387 HydrophobicContact CG-CE2 3.81Å
243	P	91.9	Very high	92	Very high	2 Å²	2	47.1 Å²	47.1	1%	0.013	24%	0.237	C	C	.	.	H	α-helix	trans	-58.2	-33.2	175.4	-27.6	36.6	0	0	0	114.1	T239 M246 L247 M384 F387 L388	T239-P243 WeakPolarHBondContact O-CD 3.11Å; T239-P243 VanDerWaalsContact O-CG 3.29Å; T239-P243 WeakPolarHBondContact O-CG 3.49Å; P243-M246 PolarHBondContact O-N 3.48Å; P243-L247 VanDerWaalsContact O-CB 3.31Å; P243-L247 WeakPolarHBondContact O-CB 3.03Å; P243-L247 VanDerWaalsContact O-CG 3.24Å; P243-L247 WeakPolarHBondContact O-CG 3.19Å; P243-L247 PolarHBondContact O-N 3.47Å; P243-M384 HydrophobicContact CB-CG 3.92Å; P243-M384 HydrophobicContact CG-CG 4.35Å; P243-F387 HydrophobicContact CG-CB 4.22Å; P243-L388 HydrophobicContact CB-CD1 4.29Å; P243-L388 HydrophobicContact CB-CD2 3.55Å; P243-L388 HydrophobicContact CB-CG 3.77Å; P243-L388 HydrophobicContact CG-CD2 3.7Å; P243-L388 HydrophobicContact CG-CG 3.74Å
244	Y	91.9	Very high	92	Very high	72 Å²	72	47.1 Å²	47.1	28%	0.282	24%	0.237	S	C	.	.	H	α-helix	trans	-68.4	-41.1	175	-76	-83.8	0	0	0	112.7	I53 A240 T241 F242 M246 L247 L248 L322 T326	I53-Y244 WeakPolarHBondContact CD1-OH 3.41Å; A240-Y244 VanDerWaalsContact O-CD2 3.24Å; A240-Y244 WeakPolarHBondContact O-CD2 2.85Å; T241-Y244 WeakPolarHBondContact O-CB 3.04Å; T241-Y244 PolarHBondContact O-N 3.08Å; T241-Y244 VanDerWaalsContact O-N 3.12Å; F242-Y244 PolarHBondContact O-N 3.15Å; Y244-M246 VanDerWaalsContact C-N 3.29Å; Y244-M246 PolarHBondContact O-N 3.46Å; Y244-L247 PolarHBondContact O-N 3.01Å; Y244-L248 WeakPolarHBondContact O-CB 3.18Å; Y244-L248 PolarHBondContact O-N 3.47Å; Y244-L322 HydrophobicContact CE1-CD1 4.29Å; Y244-L322 WeakPolarHBondContact OH-CG 3.48Å; Y244-T326 HydrophobicContact CE1-CG2 3.99Å; Y244-T326 VanDerWaalsContact CE1-OG1 3.24Å; Y244-T326 WeakPolarHBondContact CE1-OG1 3.43Å; Y244-T326 PolarHBondContact OH-OG1 3.3Å
245	V	92.9	Very high	92.2	Very high	79 Å²	79	44.9 Å²	44.9	48%	0.479	23%	0.233	S	C	.	.	H	α-helix	trans	-60.7	-45.6	174.4	178.3	0	0	0	0	109.4	T241 F242 L248 I249	T241-V245 PolarHBondContact O-N 3.38Å; F242-V245 WeakPolarHBondContact O-CB 3.46Å; F242-V245 PolarHBondContact O-N 3.03Å; F242-V245 VanDerWaalsContact O-N 3.11Å; V245-L248 PolarHBondContact O-N 3.13Å; V245-I249 HydrophobicContact CG1-CD1 3.96Å; V245-I249 VanDerWaalsContact O-CG1 3.3Å; V245-I249 WeakPolarHBondContact O-CG1 3.11Å; V245-I249 PolarHBondContact O-N 3.24Å
246	M	90.1	Very high	92.1	Very high	3 Å²	3	47.4 Å²	47.4	2%	0.015	25%	0.248	C	C	.	.	H	α-helix	trans	-66	-44.9	178	-76.2	-51.6	-49.8	0	0	113.1	F242 P243 Y244 L248 I249 L250 L380 M384	F242-M246 HydrophobicContact CD1-CG 3.88Å; F242-M246 HydrophobicContact CE1-CG 3.33Å; F242-M246 HydrophobicContact CE1-SD 4.35Å; F242-M246 HydrophobicContact CE2-CG 4.21Å; F242-M246 HydrophobicContact CZ-CG 3.52Å; F242-M246 HydrophobicContact CZ-SD 3.96Å; F242-M246 PolarHBondContact O-N 2.99Å; P243-M246 PolarHBondContact O-N 3.48Å; Y244-M246 VanDerWaalsContact C-N 3.29Å; Y244-M246 PolarHBondContact O-N 3.46Å; M246-L248 VanDerWaalsContact C-N 3.27Å; M246-L248 PolarHBondContact O-N 3.01Å; M246-I249 PolarHBondContact O-N 3.42Å; M246-I249 VanDerWaalsContact O-N 3.16Å; M246-I249 HydrophobicContact SD-CD1 4.17Å; M246-L250 HydrophobicContact CE-CD2 4.45Å; M246-L250 HydrophobicContact CE-CG 4.27Å; M246-L250 WeakPolarHBondContact O-CB 3.31Å; M246-L250 VanDerWaalsContact O-CG 3.28Å; M246-L250 WeakPolarHBondContact O-CG 3.37Å; M246-L250 PolarHBondContact O-N 3.26Å; M246-L380 HydrophobicContact CE-CB 3.47Å; M246-L380 VanDerWaalsContact CE-CB 3.47Å; M246-L380 HydrophobicContact CE-CD1 4.1Å; M246-L380 HydrophobicContact CE-CG 4.32Å; M246-L380 HydrophobicContact SD-CB 3.81Å; M246-L380 HydrophobicContact SD-CD1 4.15Å; M246-L380 HydrophobicContact SD-CD2 4.1Å; M246-L380 HydrophobicContact SD-CG 4.25Å; M246-M384 HydrophobicContact CB-CB 4.2Å; M246-M384 HydrophobicContact CB-CG 4.17Å; M246-M384 HydrophobicContact CB-SD 3.68Å; M246-M384 HydrophobicContact CG-CB 4.27Å
247	L	90.2	Very high	92	Very high	9 Å²	9	48 Å²	48	5%	0.047	25%	0.251	C	S	.	.	H	α-helix	trans	-58.9	-39.2	175.6	-77.8	173.8	0	0	0	111.8	V58 P243 Y244 L251 T326 A330 M384	V58-L247 HydrophobicContact CG2-CD2 4.38Å; P243-L247 VanDerWaalsContact O-CB 3.31Å; P243-L247 WeakPolarHBondContact O-CB 3.03Å; P243-L247 VanDerWaalsContact O-CG 3.24Å; P243-L247 WeakPolarHBondContact O-CG 3.19Å; P243-L247 PolarHBondContact O-N 3.47Å; Y244-L247 PolarHBondContact O-N 3.01Å; L247-L251 WeakPolarHBondContact O-CB 3.47Å; L247-L251 PolarHBondContact O-N 3.34Å; L247-T326 HydrophobicContact CD1-CG2 3.91Å; L247-A330 HydrophobicContact CD2-CB 4.01Å; L247-M384 HydrophobicContact CD2-SD 4.39Å; L247-M384 HydrophobicContact CG-SD 4.27Å
248	L	92.6	Very high	91.9	Very high	101 Å²	101	46.8 Å²	46.8	53%	0.529	25%	0.254	S	S	.	.	H	α-helix	trans	-64.2	-46.1	175	179.3	63.4	0	0	0	111.7	Y244 V245 M246 L251 I252	Y244-L248 WeakPolarHBondContact O-CB 3.18Å; Y244-L248 PolarHBondContact O-N 3.47Å; V245-L248 PolarHBondContact O-N 3.13Å; M246-L248 VanDerWaalsContact C-N 3.27Å; M246-L248 PolarHBondContact O-N 3.01Å; L248-L251 PolarHBondContact O-N 3.24Å; L248-I252 HydrophobicContact CD1-CD1 4.04Å; L248-I252 HydrophobicContact CD1-CG1 4.4Å; L248-I252 HydrophobicContact CG-CD1 4.05Å; L248-I252 VanDerWaalsContact O-CG1 3.3Å; L248-I252 WeakPolarHBondContact O-CG1 3.47Å; L248-I252 PolarHBondContact O-N 3.48Å
249	I	90.8	Very high	91.7	Very high	65 Å²	65	43.4 Å²	43.4	33%	0.333	24%	0.237	S	C	.	.	H	α-helix	trans	-61.7	-47.3	177.6	-68.5	166.5	0	0	0	110.5	V245 M246 L251 I252 R253 W377	V245-I249 HydrophobicContact CG1-CD1 3.96Å; V245-I249 VanDerWaalsContact O-CG1 3.3Å; V245-I249 WeakPolarHBondContact O-CG1 3.11Å; V245-I249 PolarHBondContact O-N 3.24Å; M246-I249 PolarHBondContact O-N 3.42Å; M246-I249 VanDerWaalsContact O-N 3.16Å; M246-I249 HydrophobicContact SD-CD1 4.17Å; I249-L251 VanDerWaalsContact C-N 3.33Å; I249-L251 PolarHBondContact O-N 3.39Å; I249-I252 PolarHBondContact O-N 2.88Å; I249-R253 WeakPolarHBondContact O-CB 3.37Å; I249-R253 PolarHBondContact O-N 3.4Å; I249-W377 HydrophobicContact CG2-CH2 4.19Å; I249-W377 HydrophobicContact CG2-CZ3 3.66Å
250	L	86.7	Confident	91.7	Very high	7 Å²	7	43.2 Å²	43.2	4%	0.037	24%	0.236	C	C	.	.	H	α-helix	trans	-65.9	-35.3	179	-68.9	-177.4	0	0	0	112.3	M246 G254 A333 Y364 F381 M384	M246-L250 HydrophobicContact CE-CD2 4.45Å; M246-L250 HydrophobicContact CE-CG 4.27Å; M246-L250 WeakPolarHBondContact O-CB 3.31Å; M246-L250 VanDerWaalsContact O-CG 3.28Å; M246-L250 WeakPolarHBondContact O-CG 3.37Å; M246-L250 PolarHBondContact O-N 3.26Å; L250-G254 WeakPolarHBondContact O-CA 3.33Å; L250-G254 PolarHBondContact O-N 3.44Å; L250-A333 HydrophobicContact CB-CB 4.41Å; L250-Y364 HydrophobicContact CD1-CE2 4.45Å; L250-Y364 WeakPolarHBondContact CD1-OH 3.04Å; L250-Y364 WeakPolarHBondContact CD2-OH 3.35Å; L250-F381 HydrophobicContact CD1-CD2 4.33Å; L250-M384 HydrophobicContact CD1-CE 4.24Å; L250-M384 HydrophobicContact CD1-SD 4.41Å
251	L	92.1	Very high	91.7	Very high	39 Å²	39	50.1 Å²	50.1	20%	0.204	27%	0.265	C	S	.	.	H	α-helix	trans	-63.1	-53.6	173.5	177.9	65.8	0	0	0	110.5	L247 L248 I249 R253 G254 V255 V329 F332 A333	L247-L251 WeakPolarHBondContact O-CB 3.47Å; L247-L251 PolarHBondContact O-N 3.34Å; L248-L251 PolarHBondContact O-N 3.24Å; I249-L251 VanDerWaalsContact C-N 3.33Å; I249-L251 PolarHBondContact O-N 3.39Å; L251-R253 VanDerWaalsContact C-N 3.31Å; L251-R253 PolarHBondContact O-N 3.01Å; L251-G254 PolarHBondContact O-N 3.01Å; L251-V255 HydrophobicContact CD1-CG1 4Å; L251-V255 WeakPolarHBondContact O-CG1 3.48Å; L251-V255 VanDerWaalsContact O-CG2 3.31Å; L251-V255 WeakPolarHBondContact O-CG2 3.48Å; L251-V255 PolarHBondContact O-N 3.31Å; L251-V329 HydrophobicContact CD2-CG1 3.98Å; L251-F332 HydrophobicContact CD1-CB 3.48Å; L251-F332 VanDerWaalsContact CD1-CB 3.48Å; L251-A333 HydrophobicContact CB-CB 4.19Å; L251-A333 HydrophobicContact CD1-CB 4.45Å
252	I	92.9	Very high	91.6	Very high	98 Å²	98	50.8 Å²	50.8	50%	0.503	27%	0.266	S	S	.	.	H	α-helix	trans	-59	-46.3	179.7	-66.6	167	0	0	0	110	L248 I249 T256	L248-I252 HydrophobicContact CD1-CD1 4.04Å; L248-I252 HydrophobicContact CD1-CG1 4.4Å; L248-I252 HydrophobicContact CG-CD1 4.05Å; L248-I252 VanDerWaalsContact O-CG1 3.3Å; L248-I252 WeakPolarHBondContact O-CG1 3.47Å; L248-I252 PolarHBondContact O-N 3.48Å; I249-I252 PolarHBondContact O-N 2.88Å; I252-T256 WeakPolarHBondContact O-CG2 3.41Å; I252-T256 PolarHBondContact O-N 3.44Å; I252-T256 PolarHBondContact O-OG1 3.09Å
253	R	88.5	Confident	91.5	Very high	69 Å²	69	48.8 Å²	48.8	26%	0.26	26%	0.257	S	S	.	.	H	α-helix	trans	-64.2	-49.5	178.3	179.8	54.5	-178.4	155.2	-0.7	111.1	I249 L251 V255 T256 L257 M371	I249-R253 WeakPolarHBondContact O-CB 3.37Å; I249-R253 PolarHBondContact O-N 3.4Å; L251-R253 VanDerWaalsContact C-N 3.31Å; L251-R253 PolarHBondContact O-N 3.01Å; R253-V255 PolarHBondContact O-N 3.4Å; R253-T256 PolarHBondContact O-N 3.48Å; R253-T256 VanDerWaalsContact O-N 3.15Å; R253-T256 PolarHBondContact O-OG1 3.2Å; R253-L257 VanDerWaalsContact CZ-CD2 3.49Å; R253-L257 WeakPolarHBondContact O-CG 3.47Å; R253-L257 PolarHBondContact O-N 2.85Å; R253-M371 HydrophobicContact CG-SD 4.31Å
254	G	90	Very high	91.6	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-56.9	-48.7	-178.1	0	0	0	0	0	112.7	L250 L251 T256 L257 A260 S336	L250-G254 WeakPolarHBondContact O-CA 3.33Å; L250-G254 PolarHBondContact O-N 3.44Å; L251-G254 PolarHBondContact O-N 3.01Å; G254-T256 PolarHBondContact O-N 2.76Å; G254-L257 WeakPolarHBondContact O-CB 3.34Å; G254-L257 PolarHBondContact O-N 2.8Å; G254-A260 VanDerWaalsContact O-CB 3.29Å; G254-A260 WeakPolarHBondContact O-CB 3.49Å; G254-S336 VanDerWaalsContact C-CB 3.46Å; G254-S336 VanDerWaalsContact C-OG 3.32Å; G254-S336 VanDerWaalsContact CA-OG 3.31Å; G254-S336 WeakPolarHBondContact CA-OG 3.31Å
255	V	94.5	Very high	91.6	Very high	69 Å²	69	52 Å²	52	42%	0.418	27%	0.273	S	S	.	.	H	α-helix	trans	-71.4	-14.5	-179.2	-56.7	0	0	0	0	114.1	L251 R253 I264	L251-V255 HydrophobicContact CD1-CG1 4Å; L251-V255 WeakPolarHBondContact O-CG1 3.48Å; L251-V255 VanDerWaalsContact O-CG2 3.31Å; L251-V255 WeakPolarHBondContact O-CG2 3.48Å; L251-V255 PolarHBondContact O-N 3.31Å; R253-V255 PolarHBondContact O-N 3.4Å; V255-I264 HydrophobicContact CG1-CD1 4.23Å
256	T	92.8	Very high	91.4	Very high	91 Å²	91	51.7 Å²	51.7	56%	0.558	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.9	-6.8	175.6	58.6	0	0	0	0	113.3	I252 R253 G254	I252-T256 WeakPolarHBondContact O-CG2 3.41Å; I252-T256 PolarHBondContact O-N 3.44Å; I252-T256 PolarHBondContact O-OG1 3.09Å; R253-T256 PolarHBondContact O-N 3.48Å; R253-T256 VanDerWaalsContact O-N 3.15Å; R253-T256 PolarHBondContact O-OG1 3.2Å; G254-T256 PolarHBondContact O-N 2.76Å
257	L	90.5	Very high	91.5	Very high	12 Å²	12	51.5 Å²	51.5	6%	0.063	27%	0.265	C	S	.	.	S	Bend	trans	-77.3	149.8	176.6	-69.4	167.7	0	0	0	111.5	R253 G254 A260 V337 F340 M371	R253-L257 VanDerWaalsContact CZ-CD2 3.49Å; R253-L257 WeakPolarHBondContact O-CG 3.47Å; R253-L257 PolarHBondContact O-N 2.85Å; G254-L257 WeakPolarHBondContact O-CB 3.34Å; G254-L257 PolarHBondContact O-N 2.8Å; L257-A260 VanDerWaalsContact O-CB 3.26Å; L257-A260 WeakPolarHBondContact O-CB 3.31Å; L257-A260 PolarHBondContact O-N 2.57Å; L257-V337 HydrophobicContact CD1-CG2 4.45Å; L257-F340 HydrophobicContact CB-CB 3.74Å; L257-F340 HydrophobicContact CB-CD2 3.79Å; L257-F340 HydrophobicContact CB-CG 3.78Å; L257-F340 HydrophobicContact CD1-CB 3.96Å; L257-F340 HydrophobicContact CD1-CD1 3.77Å; L257-F340 HydrophobicContact CD1-CD2 4.41Å; L257-F340 HydrophobicContact CD1-CE1 4.36Å; L257-F340 HydrophobicContact CD1-CG 3.78Å; L257-F340 HydrophobicContact CD2-CD1 4.41Å; L257-F340 HydrophobicContact CD2-CD2 4.08Å; L257-F340 HydrophobicContact CD2-CE1 4.38Å; L257-F340 HydrophobicContact CD2-CE2 4.05Å; L257-F340 HydrophobicContact CD2-CG 4.25Å; L257-F340 HydrophobicContact CD2-CZ 4.2Å; L257-F340 HydrophobicContact CG-CB 4.42Å; L257-F340 HydrophobicContact CG-CD1 4.48Å; L257-F340 HydrophobicContact CG-CD2 4.31Å; L257-F340 HydrophobicContact CG-CG 4.15Å; L257-M371 HydrophobicContact CD1-CE 3.77Å
258	P	91.8	Very high	91.7	Very high	59 Å²	59	53.4 Å²	53.4	38%	0.383	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.9	149.3	172	27.9	-32.3	0	0	0	110.5	A260 F340 Y343	P258-A260 PolarHBondContact O-N 3.04Å; P258-A260 VanDerWaalsContact O-N 3.12Å; P258-F340 HydrophobicContact CG-CD2 3.74Å; P258-F340 HydrophobicContact CG-CE2 3.84Å; P258-F340 WeakPolarHBondContact O-CA 3.49Å; P258-F340 WeakPolarHBondContact O-CB 3.2Å; P258-F340 WeakPolarHBondContact O-CD2 3.37Å; P258-Y343 HydrophobicContact CB-CD1 3.95Å; P258-Y343 HydrophobicContact CB-CE1 3.75Å; P258-Y343 HydrophobicContact CG-CD1 4.22Å; P258-Y343 HydrophobicContact CG-CE1 4.2Å
259	G	91.3	Very high	91.7	Very high	16 Å²	16	56.3 Å²	56.3	17%	0.165	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	73.2	-5.4	-178.1	0	0	0	0	0	116	F261 D262 G263 G339	G259-F261 PolarHBondContact O-N 3.09Å; G259-D262 PolarHBondContact O-N 2.87Å; G259-D262 VanDerWaalsContact O-N 3.1Å; G259-G263 PolarHBondContact O-N 3Å; G259-G339 CarbonylContact O-C 3.39Å
260	A	93.1	Very high	91.9	Very high	4 Å²	4	56.4 Å²	56.4	3%	0.033	29%	0.285	C	S	.	.	H	α-helix	trans	-57.7	-34.2	-179.4	0	0	0	0	0	113.7	G254 L257 P258 D262 G263 I264	G254-A260 VanDerWaalsContact O-CB 3.29Å; G254-A260 WeakPolarHBondContact O-CB 3.49Å; L257-A260 VanDerWaalsContact O-CB 3.26Å; L257-A260 WeakPolarHBondContact O-CB 3.31Å; L257-A260 PolarHBondContact O-N 2.57Å; P258-A260 PolarHBondContact O-N 3.04Å; P258-A260 VanDerWaalsContact O-N 3.12Å; A260-D262 VanDerWaalsContact C-N 3.33Å; A260-D262 PolarHBondContact O-N 3.03Å; A260-G263 PolarHBondContact O-N 3.45Å; A260-I264 WeakPolarHBondContact O-CG1 3.34Å; A260-I264 PolarHBondContact O-N 3.3Å
261	F	93.3	Very high	92.2	Very high	154 Å²	154	59.4 Å²	59.4	68%	0.675	30%	0.301	S	S	*	.	H	α-helix	trans	-63.1	-38.5	178.2	-178.2	-100.6	0	0	0	112.5	G259 I264 K265	G259-F261 PolarHBondContact O-N 3.09Å; F261-I264 PolarHBondContact O-N 3.47Å; F261-K265 WeakPolarHBondContact O-CB 3.41Å; F261-K265 PolarHBondContact O-N 3Å
262	D	91.5	Very high	92.3	Very high	75 Å²	75	63.6 Å²	63.6	40%	0.401	32%	0.322	S	S	.	.	H	α-helix	trans	-63.9	-45.7	177.8	-65	-44.1	0	0	0	109.8	G259 A260 I264 K265 F266 I349	G259-D262 PolarHBondContact O-N 2.87Å; G259-D262 VanDerWaalsContact O-N 3.1Å; A260-D262 VanDerWaalsContact C-N 3.33Å; A260-D262 PolarHBondContact O-N 3.03Å; D262-I264 PolarHBondContact O-N 3.3Å; D262-K265 WeakPolarHBondContact O-CB 3.32Å; D262-K265 PolarHBondContact O-N 3.27Å; D262-K265 VanDerWaalsContact O-N 3.13Å; D262-F266 VanDerWaalsContact O-CD2 3.26Å; D262-F266 WeakPolarHBondContact O-CD2 3.49Å; D262-F266 PolarHBondContact O-N 2.85Å; D262-I349 HydrophobicContact CB-CD1 4.03Å
263	G	92.1	Very high	92.3	Very high	0 Å²	0	62.4 Å²	62.4	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-54.4	-48	173.2	0	0	0	0	0	113.8	G259 A260 K265 F266 Y267 F335	G259-G263 PolarHBondContact O-N 3Å; A260-G263 PolarHBondContact O-N 3.45Å; G263-K265 VanDerWaalsContact C-N 3.32Å; G263-K265 PolarHBondContact O-N 2.64Å; G263-F266 WeakPolarHBondContact O-CB 3.32Å; G263-F266 PolarHBondContact O-N 3.06Å; G263-Y267 PolarHBondContact O-N 3.37Å; G263-F335 VanDerWaalsContact CA-O 3.26Å; G263-F335 WeakPolarHBondContact CA-O 3.43Å; G263-F335 WeakPolarHBondContact O-CD1 3.33Å
264	I	93.9	Very high	92.5	Very high	33 Å²	33	62.2 Å²	62.2	17%	0.169	32%	0.322	C	S	.	.	H	α-helix	trans	-64.7	-37.9	178	-65.7	167.5	0	0	0	111.4	V255 A260 F261 D262 F266 Y267 L268 F332	V255-I264 HydrophobicContact CG1-CD1 4.23Å; A260-I264 WeakPolarHBondContact O-CG1 3.34Å; A260-I264 PolarHBondContact O-N 3.3Å; F261-I264 PolarHBondContact O-N 3.47Å; D262-I264 PolarHBondContact O-N 3.3Å; I264-F266 VanDerWaalsContact C-N 3.34Å; I264-Y267 WeakPolarHBondContact O-CB 3.44Å; I264-Y267 PolarHBondContact O-N 2.93Å; I264-L268 HydrophobicContact CG2-CD1 4.3Å; I264-L268 PolarHBondContact O-N 3.35Å; I264-F332 HydrophobicContact CD1-CD1 4.17Å; I264-F332 HydrophobicContact CG1-CD1 4.13Å; I264-F332 HydrophobicContact CG2-CD1 3.99Å; I264-F332 HydrophobicContact CG2-CE1 3.8Å
265	K	92.8	Very high	92.6	Very high	108 Å²	108	64.1 Å²	64.1	47%	0.47	33%	0.332	S	S	.	.	H	α-helix	trans	-62.1	-43.7	174.1	-175.1	-178.2	175.6	-172.5	0	110.5	F261 D262 G263 Y267 L268 Y269	F261-K265 WeakPolarHBondContact O-CB 3.41Å; F261-K265 PolarHBondContact O-N 3Å; D262-K265 WeakPolarHBondContact O-CB 3.32Å; D262-K265 PolarHBondContact O-N 3.27Å; D262-K265 VanDerWaalsContact O-N 3.13Å; G263-K265 VanDerWaalsContact C-N 3.32Å; G263-K265 PolarHBondContact O-N 2.64Å; K265-Y267 VanDerWaalsContact C-N 3.28Å; K265-Y267 PolarHBondContact O-N 3.25Å; K265-L268 PolarHBondContact O-N 3.15Å; K265-Y269 HydrophobicContact CG-CD2 4.39Å; K265-Y269 WeakPolarHBondContact O-CB 3.3Å; K265-Y269 PolarHBondContact O-N 3.43Å
266	F	88.3	Confident	92.5	Very high	73 Å²	73	65.8 Å²	65.8	32%	0.32	35%	0.347	S	S	.	.	H	α-helix	trans	-61.6	-34.8	174.7	-89.8	-81.8	0	0	0	113.2	Y66 D262 G263 I264 I349 E350	Y66-F266 HydrophobicContact CD2-CD1 4.39Å; Y66-F266 AromaticContact CE2-CD1 3.83Å; Y66-F266 HydrophobicContact CE2-CD1 3.83Å; D262-F266 VanDerWaalsContact O-CD2 3.26Å; D262-F266 WeakPolarHBondContact O-CD2 3.49Å; D262-F266 PolarHBondContact O-N 2.85Å; G263-F266 WeakPolarHBondContact O-CB 3.32Å; G263-F266 PolarHBondContact O-N 3.06Å; I264-F266 VanDerWaalsContact C-N 3.34Å; F266-I349 HydrophobicContact CB-CD1 4.39Å; F266-I349 HydrophobicContact CB-CG2 4.21Å; F266-I349 HydrophobicContact CD1-CB 4.4Å; F266-I349 HydrophobicContact CD1-CG2 4.44Å; F266-I349 HydrophobicContact CD2-CB 3.98Å; F266-I349 HydrophobicContact CD2-CD1 3.16Å; F266-I349 HydrophobicContact CD2-CG1 4.06Å; F266-I349 HydrophobicContact CD2-CG2 4.35Å; F266-I349 HydrophobicContact CE2-CB 4.09Å; F266-I349 HydrophobicContact CE2-CD1 3.54Å; F266-I349 HydrophobicContact CE2-CG1 4.19Å; F266-I349 HydrophobicContact CG-CB 4.11Å; F266-I349 HydrophobicContact CG-CD1 3.94Å; F266-I349 HydrophobicContact CG-CG2 4.07Å; F266-I349 HydrophobicContact CZ-CB 4.35Å; F266-E350 WeakPolarHBondContact CE1-OE1 3.48Å
267	Y	92.6	Very high	92.3	Very high	0 Å²	0	63.9 Å²	63.9	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-68.6	-43.2	176.3	174.8	-140.2	0	0	0	113.3	F61 C65 G70 G263 I264 K265 F328 F332 F335	F61-Y267 WeakPolarHBondContact CE1-OH 3.17Å; C65-Y267 HydrophobicContact CB-CD2 4Å; C65-Y267 HydrophobicContact CB-CE2 3.62Å; C65-Y267 VanDerWaalsContact SG-CE2 3.52Å; G70-Y267 CarbonylContact C-O 3.51Å; G70-Y267 WeakPolarHBondContact CA-O 3.5Å; G263-Y267 PolarHBondContact O-N 3.37Å; I264-Y267 WeakPolarHBondContact O-CB 3.44Å; I264-Y267 PolarHBondContact O-N 2.93Å; K265-Y267 VanDerWaalsContact C-N 3.28Å; K265-Y267 PolarHBondContact O-N 3.25Å; Y267-F328 WeakPolarHBondContact OH-CD2 3.24Å; Y267-F328 PolarHBondContact OH-O 3.03Å; Y267-F328 VanDerWaalsContact OH-O 3.07Å; Y267-F332 HydrophobicContact CE1-CD2 4.02Å; Y267-F332 HydrophobicContact CE1-CE2 4.15Å; Y267-F332 HydrophobicContact CE1-CG 4.41Å; Y267-F335 HydrophobicContact CD2-CD2 4.13Å; Y267-F335 HydrophobicContact CD2-CE2 4.28Å; Y267-F335 HydrophobicContact CG-CB 4.43Å; Y267-F335 HydrophobicContact CG-CD2 4.12Å; Y267-F335 HydrophobicContact CG-CG 4.19Å
268	L	93.6	Very high	92	Very high	48 Å²	48	66 Å²	66	25%	0.251	35%	0.347	S	S	.	.	H	α-helix	trans	-111.3	-14.6	-166.8	-65.9	179.7	0	0	0	115.7	G71 F74 I264 K265 P270 F328 F332	G71-L268 VanDerWaalsContact CA-O 3.23Å; G71-L268 WeakPolarHBondContact CA-O 2.93Å; G71-L268 PolarHBondContact N-O 3.27Å; F74-L268 HydrophobicContact CE2-CD2 3.99Å; I264-L268 HydrophobicContact CG2-CD1 4.3Å; I264-L268 PolarHBondContact O-N 3.35Å; K265-L268 PolarHBondContact O-N 3.15Å; L268-P270 WeakPolarHBondContact O-CD 3.36Å; L268-P270 VanDerWaalsContact O-N 3.16Å; L268-F328 HydrophobicContact CD2-CE2 4.02Å; L268-F332 HydrophobicContact CD1-CE1 3.78Å; L268-F332 HydrophobicContact CD1-CE2 4.38Å; L268-F332 HydrophobicContact CD1-CZ 3.51Å
269	Y	93.2	Very high	91.8	Very high	162 Å²	162	65.5 Å²	65.5	64%	0.635	34%	0.34	S	S	*	.			trans	-63.8	120.6	-177.8	-164.7	-93.4	0	0	0	109.9	K265 D271	K265-Y269 HydrophobicContact CG-CD2 4.39Å; K265-Y269 WeakPolarHBondContact O-CB 3.3Å; K265-Y269 PolarHBondContact O-N 3.43Å; Y269-D271 PolarHBondContact O-N 3.27Å
270	P	94.4	Very high	91.7	Very high	68 Å²	68	64.8 Å²	64.8	44%	0.442	33%	0.332	S	S	.	.			trans	-81.9	123.4	-169.6	30.4	-33.3	0	0	0	111.6	A72 L268	A72-P270 HydrophobicContact CB-CB 4.38Å; L268-P270 WeakPolarHBondContact O-CD 3.36Å; L268-P270 VanDerWaalsContact O-N 3.16Å
271	D	92.8	Very high	91.6	Very high	70 Å²	70	68.5 Å²	68.5	37%	0.374	35%	0.346	S	S	.	.			trans	-104.1	95.9	165	-178.6	4	0	0	0	110	G69 A72 Y269 S273 R274	G69-D271 PolarHBondContact O-N 3.06Å; A72-D271 WeakPolarHBondContact CB-O 3.49Å; Y269-D271 PolarHBondContact O-N 3.27Å; D271-S273 VanDerWaalsContact CG-OG 3.26Å; D271-S273 PolarHBondContact O-N 3.25Å; D271-S273 VanDerWaalsContact OD1-CB 3.3Å; D271-S273 WeakPolarHBondContact OD1-CB 3.36Å; D271-S273 PolarHBondContact OD1-N 3.28Å; D271-S273 PolarHBondContact OD1-OG 3.34Å; D271-S273 PolarHBondContact OD2-OG 3.24Å; D271-R274 HydrophobicContact CB-CG 4.17Å; D271-R274 WeakPolarHBondContact O-CB 3.46Å; D271-R274 PolarHBondContact O-N 3.4Å; D271-R274 WeakPolarHBondContact OD2-CG 3.5Å
272	I	93.9	Very high	91.2	Very high	126 Å²	126	61.3 Å²	61.3	65%	0.646	32%	0.315	S	S	*	.	G	3₁₀ helix	trans	-64.4	-25.6	-176.7	-57.9	175.1	0	0	0	111.4	R274 L275	I272-R274 PolarHBondContact O-N 3.24Å; I272-L275 HydrophobicContact CG2-CD1 4.36Å; I272-L275 WeakPolarHBondContact O-CB 3.38Å; I272-L275 PolarHBondContact O-N 3.01Å; I272-L275 VanDerWaalsContact O-N 3.08Å
273	S	94.6	Very high	91.1	Very high	74 Å²	74	58.4 Å²	58.4	52%	0.517	30%	0.299	S	S	.	.	G	3₁₀ helix	trans	-61.5	-30.5	-179.1	75.8	0	0	0	0	112	D271 L275 S276	D271-S273 VanDerWaalsContact CG-OG 3.26Å; D271-S273 PolarHBondContact O-N 3.25Å; D271-S273 VanDerWaalsContact OD1-CB 3.3Å; D271-S273 WeakPolarHBondContact OD1-CB 3.36Å; D271-S273 PolarHBondContact OD1-N 3.28Å; D271-S273 PolarHBondContact OD1-OG 3.34Å; D271-S273 PolarHBondContact OD2-OG 3.24Å; S273-L275 PolarHBondContact O-N 2.91Å; S273-S276 WeakPolarHBondContact O-CB 3.33Å; S273-S276 PolarHBondContact O-N 3.49Å; S273-S276 PolarHBondContact O-OG 2.98Å
274	R	92.1	Very high	91.1	Very high	65 Å²	65	58.4 Å²	58.4	25%	0.245	30%	0.299	C	S	.	.	G	3₁₀ helix	trans	-63.6	-25	177.7	-64.1	-67.9	-65.8	131.9	7.6	113	K67 N68 D271 I272 S276 D277 V280	K67-R274 PolarHBondContact O-NE 3.43Å; N68-R274 PolarHBondContact OD1-NH2 3.35Å; D271-R274 HydrophobicContact CB-CG 4.17Å; D271-R274 WeakPolarHBondContact O-CB 3.46Å; D271-R274 PolarHBondContact O-N 3.4Å; D271-R274 WeakPolarHBondContact OD2-CG 3.5Å; I272-R274 PolarHBondContact O-N 3.24Å; R274-S276 PolarHBondContact O-N 2.99Å; R274-S276 VanDerWaalsContact O-N 3.16Å; R274-D277 IonicContact CZ-OD2 3.28Å; R274-D277 IonicContact NH1-OD2 3.3Å; R274-D277 PolarHBondContact NH1-OD2 3.23Å; R274-D277 IonicContact NH2-OD2 2.71Å; R274-D277 PolarHBondContact NH2-OD2 2.93Å; R274-D277 WeakPolarHBondContact O-CB 3.25Å; R274-D277 PolarHBondContact O-N 3.38Å; R274-V280 HydrophobicContact CB-CG2 4.24Å; R274-V280 VanDerWaalsContact O-CG2 3.23Å; R274-V280 WeakPolarHBondContact O-CG2 3.48Å
275	L	92.3	Very high	90.9	Very high	39 Å²	39	56.9 Å²	56.9	20%	0.204	29%	0.291	C	S	.	.	G	3₁₀ helix	trans	-64.8	-19.7	178.1	-66.7	-179.3	0	0	0	113.8	A72 V75 P76 I272 S273 D277 V280 W281	A72-L275 HydrophobicContact CB-CD1 4.49Å; A72-L275 HydrophobicContact CB-CD2 4.42Å; A72-L275 HydrophobicContact CB-CG 4.23Å; A72-L275 WeakPolarHBondContact O-CD2 3.14Å; V75-L275 HydrophobicContact CB-CD1 4.42Å; V75-L275 HydrophobicContact CB-CD2 4.45Å; V75-L275 HydrophobicContact CG2-CD1 4.46Å; P76-L275 HydrophobicContact CG-CD2 4.1Å; I272-L275 HydrophobicContact CG2-CD1 4.36Å; I272-L275 WeakPolarHBondContact O-CB 3.38Å; I272-L275 PolarHBondContact O-N 3.01Å; I272-L275 VanDerWaalsContact O-N 3.08Å; S273-L275 PolarHBondContact O-N 2.91Å; L275-D277 VanDerWaalsContact C-N 3.3Å; L275-V280 HydrophobicContact CD2-CG1 4.39Å; L275-W281 PolarHBondContact O-NE1 3.5Å; L275-W281 VanDerWaalsContact O-NE1 3.12Å
276	S	91.1	Very high	90.6	Very high	104 Å²	104	52.2 Å²	52.2	73%	0.727	27%	0.272	S	S	*	.	G	3₁₀ helix	trans	-74.5	-20.3	173.2	69.8	0	0	0	0	113.2	S273 R274 P278	S273-S276 WeakPolarHBondContact O-CB 3.33Å; S273-S276 PolarHBondContact O-N 3.49Å; S273-S276 PolarHBondContact O-OG 2.98Å; R274-S276 PolarHBondContact O-N 2.99Å; R274-S276 VanDerWaalsContact O-N 3.16Å; S276-P278 WeakPolarHBondContact O-CD 3.42Å
277	D	88.6	Confident	90.8	Very high	51 Å²	51	48.8 Å²	48.8	27%	0.273	26%	0.257	S	S	.	.	S	Bend	trans	-80.2	113.6	176.3	-178.6	-1.6	0	0	0	109.3	R274 L275 Q279 V280	R274-D277 IonicContact CZ-OD2 3.28Å; R274-D277 IonicContact NH1-OD2 3.3Å; R274-D277 PolarHBondContact NH1-OD2 3.23Å; R274-D277 IonicContact NH2-OD2 2.71Å; R274-D277 PolarHBondContact NH2-OD2 2.93Å; R274-D277 WeakPolarHBondContact O-CB 3.25Å; R274-D277 PolarHBondContact O-N 3.38Å; L275-D277 VanDerWaalsContact C-N 3.3Å; D277-Q279 PolarHBondContact O-N 3.26Å; D277-Q279 VanDerWaalsContact O-N 3.15Å; D277-Q279 VanDerWaalsContact OD1-CB 3.26Å; D277-Q279 WeakPolarHBondContact OD1-CB 3.34Å; D277-Q279 PolarHBondContact OD1-N 3.29Å; D277-V280 HydrophobicContact CB-CG2 4.14Å; D277-V280 VanDerWaalsContact O-CB 3.29Å; D277-V280 WeakPolarHBondContact O-CB 3.47Å; D277-V280 PolarHBondContact O-N 3.42Å
278	P	85.4	Confident	90.9	Very high	56 Å²	56	48.8 Å²	48.8	36%	0.364	26%	0.257	S	S	.	.	H	α-helix	trans	-69.4	-14.6	-177.1	-5	19.1	0	0	0	112.9	S276 V280 W281 V282 F512	S276-P278 WeakPolarHBondContact O-CD 3.42Å; P278-V280 PolarHBondContact O-N 3.47Å; P278-W281 WeakPolarHBondContact O-CB 3.15Å; P278-W281 PolarHBondContact O-N 3.06Å; P278-W281 VanDerWaalsContact O-N 3.11Å; P278-V282 PolarHBondContact O-N 3.1Å; P278-F512 HydrophobicContact CB-CD1 4.34Å; P278-F512 HydrophobicContact CB-CD2 4.22Å; P278-F512 HydrophobicContact CB-CE1 3.74Å; P278-F512 HydrophobicContact CB-CE2 3.59Å; P278-F512 HydrophobicContact CB-CZ 3.33Å; P278-F512 HydrophobicContact CG-CE1 4.46Å; P278-F512 HydrophobicContact CG-CE2 3.66Å; P278-F512 HydrophobicContact CG-CZ 3.58Å
279	Q	86.6	Confident	90.8	Very high	50 Å²	50	46.5 Å²	46.5	23%	0.234	25%	0.245	C	C	.	.	H	α-helix	trans	-60	-31.5	170.3	-172	63.2	46.5	0	0	111.7	D277 W281 V282 D283	D277-Q279 PolarHBondContact O-N 3.26Å; D277-Q279 VanDerWaalsContact O-N 3.15Å; D277-Q279 VanDerWaalsContact OD1-CB 3.26Å; D277-Q279 WeakPolarHBondContact OD1-CB 3.34Å; D277-Q279 PolarHBondContact OD1-N 3.29Å; Q279-W281 PolarHBondContact O-N 2.89Å; Q279-V282 PolarHBondContact O-N 2.92Å; Q279-D283 PolarHBondContact NE2-OD1 2.83Å; Q279-D283 WeakPolarHBondContact O-CB 3.41Å; Q279-D283 PolarHBondContact O-N 3.3Å
280	V	90.9	Very high	90.5	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-61.2	-37.1	176.4	171.3	0	0	0	0	111.3	N68 F73 P76 R274 L275 D277 P278 A284	N68-V280 HydrophobicContact CB-CB 4.34Å; N68-V280 HydrophobicContact CB-CG1 4Å; N68-V280 HydrophobicContact CB-CG2 3.85Å; F73-V280 HydrophobicContact CD2-CG1 4.09Å; P76-V280 HydrophobicContact CG-CG1 3.92Å; R274-V280 HydrophobicContact CB-CG2 4.24Å; R274-V280 VanDerWaalsContact O-CG2 3.23Å; R274-V280 WeakPolarHBondContact O-CG2 3.48Å; L275-V280 HydrophobicContact CD2-CG1 4.39Å; D277-V280 HydrophobicContact CB-CG2 4.14Å; D277-V280 VanDerWaalsContact O-CB 3.29Å; D277-V280 WeakPolarHBondContact O-CB 3.47Å; D277-V280 PolarHBondContact O-N 3.42Å; P278-V280 PolarHBondContact O-N 3.47Å; V280-A284 VanDerWaalsContact O-CB 3.32Å; V280-A284 WeakPolarHBondContact O-CB 3.35Å; V280-A284 PolarHBondContact O-N 3.45Å
281	W	89.9	Confident	90.4	Very high	82 Å²	82	37.8 Å²	37.8	31%	0.311	20%	0.204	S	C	.	.	H	α-helix	trans	-74.7	-37.6	178.2	-64.8	80.5	0	0	0	112.2	P76 I79 F80 L275 P278 Q279 A284 G285	P76-W281 HydrophobicContact CB-CD2 3.77Å; P76-W281 HydrophobicContact CB-CE3 3.55Å; P76-W281 HydrophobicContact CB-CG 4.38Å; P76-W281 HydrophobicContact CB-CH2 4.17Å; P76-W281 HydrophobicContact CB-CZ2 4.37Å; P76-W281 HydrophobicContact CB-CZ3 3.76Å; I79-W281 HydrophobicContact CD1-CH2 3.72Å; I79-W281 HydrophobicContact CD1-CZ3 3.77Å; F80-W281 HydrophobicContact CE2-CE3 4.05Å; F80-W281 VanDerWaalsContact CE2-O 3.25Å; F80-W281 WeakPolarHBondContact CE2-O 3.49Å; L275-W281 PolarHBondContact O-NE1 3.5Å; L275-W281 VanDerWaalsContact O-NE1 3.12Å; P278-W281 WeakPolarHBondContact O-CB 3.15Å; P278-W281 PolarHBondContact O-N 3.06Å; P278-W281 VanDerWaalsContact O-N 3.11Å; Q279-W281 PolarHBondContact O-N 2.89Å; W281-A284 PolarHBondContact O-N 3.03Å; W281-G285 PolarHBondContact O-N 2.83Å
282	V	85.9	Confident	90.4	Very high	4 Å²	4	34.4 Å²	34.4	2%	0.024	19%	0.186	C	C	.	.	H	α-helix	trans	-61.6	-50.1	172.1	176.2	0	0	0	0	110.1	P278 Q279 A284 G285 T286 I509 F512 F513	P278-V282 PolarHBondContact O-N 3.1Å; Q279-V282 PolarHBondContact O-N 2.92Å; V282-A284 VanDerWaalsContact C-N 3.32Å; V282-A284 PolarHBondContact O-N 3.45Å; V282-G285 PolarHBondContact O-N 3.37Å; V282-T286 HydrophobicContact CG1-CG2 4.25Å; V282-T286 WeakPolarHBondContact O-CB 3.45Å; V282-T286 VanDerWaalsContact O-CG2 3.27Å; V282-T286 WeakPolarHBondContact O-CG2 3.37Å; V282-T286 PolarHBondContact O-N 3.09Å; V282-T286 PolarHBondContact O-OG1 3.34Å; V282-I509 HydrophobicContact CB-CG2 4.39Å; V282-I509 HydrophobicContact CG2-CG2 3.96Å; V282-F512 HydrophobicContact CG2-CD1 3.56Å; V282-F512 HydrophobicContact CG2-CE1 3.92Å; V282-F513 HydrophobicContact CG1-CD2 3.93Å
283	D	89.1	Confident	90.4	Very high	14 Å²	14	28.6 Å²	28.6	8%	0.075	16%	0.157	C	C	.	.	H	α-helix	trans	-61.5	-41.4	-180	-75.3	7.8	0	0	0	110.7	L64 K67 N68 F73 Q279 T286 Q287	L64-D283 HydrophobicContact CD2-CB 4.21Å; K67-D283 IonicContact NZ-OD2 3.45Å; K67-D283 PolarHBondContact NZ-OD2 3.09Å; N68-D283 VanDerWaalsContact ND2-CB 3.3Å; N68-D283 WeakPolarHBondContact ND2-CB 3.15Å; N68-D283 PolarHBondContact ND2-OD2 2.87Å; F73-D283 HydrophobicContact CE2-CB 4.41Å; Q279-D283 PolarHBondContact NE2-OD1 2.83Å; Q279-D283 WeakPolarHBondContact O-CB 3.41Å; Q279-D283 PolarHBondContact O-N 3.3Å; D283-T286 PolarHBondContact O-OG1 2.94Å; D283-Q287 WeakPolarHBondContact O-CB 3.21Å; D283-Q287 PolarHBondContact O-N 3.04Å
284	A	92.2	Very high	90.4	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-65.1	-47.5	176.5	0	0	0	0	0	113	F73 P76 F80 V280 W281 V282 Q287 I288	F73-A284 HydrophobicContact CD2-CB 4.41Å; F73-A284 HydrophobicContact CE2-CB 3.63Å; F73-A284 HydrophobicContact CZ-CB 3.92Å; P76-A284 HydrophobicContact CB-CB 3.81Å; P76-A284 HydrophobicContact CG-CB 4.1Å; F80-A284 HydrophobicContact CD2-CB 3.88Å; F80-A284 HydrophobicContact CE2-CB 4.13Å; V280-A284 VanDerWaalsContact O-CB 3.32Å; V280-A284 WeakPolarHBondContact O-CB 3.35Å; V280-A284 PolarHBondContact O-N 3.45Å; W281-A284 PolarHBondContact O-N 3.03Å; V282-A284 VanDerWaalsContact C-N 3.32Å; V282-A284 PolarHBondContact O-N 3.45Å; A284-Q287 PolarHBondContact O-N 3.43Å; A284-I288 PolarHBondContact O-N 2.59Å; A284-I288 VanDerWaalsContact O-N 3.13Å
285	G	89.6	Confident	90.5	Very high	0 Å²	0	22 Å²	22	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-62.3	-53.6	178.5	0	0	0	0	0	111.2	W281 V282 Q287 I288 F289	W281-G285 PolarHBondContact O-N 2.83Å; V282-G285 PolarHBondContact O-N 3.37Å; G285-Q287 VanDerWaalsContact C-N 3.27Å; G285-Q287 PolarHBondContact O-N 3.22Å; G285-I288 PolarHBondContact O-N 3.26Å; G285-I288 VanDerWaalsContact O-N 3.08Å; G285-F289 VanDerWaalsContact O-CD2 3.27Å; G285-F289 WeakPolarHBondContact O-CD2 3.41Å; G285-F289 PolarHBondContact O-N 2.68Å
286	T	86.7	Confident	90.5	Very high	11 Å²	11	20.4 Å²	20.4	7%	0.067	11%	0.112	C	C	.	.	H	α-helix	trans	-59.7	-38.3	179.2	57.8	0	0	0	0	112.1	V282 D283 I288 F289 F290 L459	V282-T286 HydrophobicContact CG1-CG2 4.25Å; V282-T286 WeakPolarHBondContact O-CB 3.45Å; V282-T286 VanDerWaalsContact O-CG2 3.27Å; V282-T286 WeakPolarHBondContact O-CG2 3.37Å; V282-T286 PolarHBondContact O-N 3.09Å; V282-T286 PolarHBondContact O-OG1 3.34Å; D283-T286 PolarHBondContact O-OG1 2.94Å; T286-I288 PolarHBondContact O-N 3.49Å; T286-F289 PolarHBondContact O-N 3.14Å; T286-F290 WeakPolarHBondContact O-CD2 3.41Å; T286-F290 PolarHBondContact O-N 2.9Å; T286-L459 HydrophobicContact CG2-CD1 4.35Å
287	Q	92	Very high	90.4	Very high	1 Å²	1	15.5 Å²	15.5	1%	0.005	8%	0.078	C	C	.	.	H	α-helix	trans	-60.1	-43.4	174.6	-179.7	58.9	30.4	0	0	112.5	F61 L64 Y77 D283 A284 G285 S291	F61-Q287 HydrophobicContact CD2-CG 4.07Å; L64-Q287 HydrophobicContact CD1-CB 3.86Å; L64-Q287 HydrophobicContact CD1-CG 4.12Å; Y77-Q287 HydrophobicContact CE2-CG 4.05Å; D283-Q287 WeakPolarHBondContact O-CB 3.21Å; D283-Q287 PolarHBondContact O-N 3.04Å; A284-Q287 PolarHBondContact O-N 3.43Å; G285-Q287 VanDerWaalsContact C-N 3.27Å; G285-Q287 PolarHBondContact O-N 3.22Å; Q287-S291 WeakPolarHBondContact O-CB 3.41Å; Q287-S291 PolarHBondContact O-N 3.33Å
288	I	93.5	Very high	90.7	Very high	0 Å²	0	13 Å²	13	0%	0	7%	0.065	C	C	.	.	H	α-helix	trans	-63.1	-45.7	175.8	-72.5	-70.1	0	0	0	110.6	Y77 F80 F81 A284 G285 T286 F290 S291 Y292	Y77-I288 HydrophobicContact CD1-CD1 4.31Å; Y77-I288 HydrophobicContact CD2-CD1 3.9Å; Y77-I288 HydrophobicContact CD2-CG1 3.99Å; Y77-I288 HydrophobicContact CE1-CD1 3.82Å; Y77-I288 HydrophobicContact CE2-CD1 3.36Å; Y77-I288 HydrophobicContact CE2-CG1 3.81Å; Y77-I288 HydrophobicContact CG-CD1 4.34Å; F80-I288 HydrophobicContact CB-CB 4.16Å; F80-I288 HydrophobicContact CB-CG1 3.74Å; F80-I288 HydrophobicContact CB-CG2 4.45Å; F81-I288 HydrophobicContact CB-CD1 4.06Å; A284-I288 PolarHBondContact O-N 2.59Å; A284-I288 VanDerWaalsContact O-N 3.13Å; G285-I288 PolarHBondContact O-N 3.26Å; G285-I288 VanDerWaalsContact O-N 3.08Å; T286-I288 PolarHBondContact O-N 3.49Å; I288-F290 PolarHBondContact O-N 3.43Å; I288-S291 PolarHBondContact O-N 2.9Å; I288-Y292 HydrophobicContact CD1-CD1 4.38Å; I288-Y292 HydrophobicContact CD1-CE1 3.78Å; I288-Y292 HydrophobicContact CG2-CD1 4.29Å; I288-Y292 VanDerWaalsContact O-CB 3.28Å; I288-Y292 WeakPolarHBondContact O-CB 3.26Å; I288-Y292 WeakPolarHBondContact O-CD1 3.48Å; I288-Y292 PolarHBondContact O-N 3.44Å; I288-Y292 VanDerWaalsContact O-N 3.09Å
289	F	91.7	Very high	91.2	Very high	0 Å²	0	10.4 Å²	10.4	0%	0	5%	0.048	C	C	.	.	H	α-helix	trans	-62	-47.3	-178.4	-84.9	-102.6	0	0	0	112.4	C84 G285 T286 A293 I294 L458 L459 A462 C506	C84-F289 HydrophobicContact CB-CE2 3.74Å; C84-F289 HydrophobicContact CB-CZ 4.01Å; G285-F289 VanDerWaalsContact O-CD2 3.27Å; G285-F289 WeakPolarHBondContact O-CD2 3.41Å; G285-F289 PolarHBondContact O-N 2.68Å; T286-F289 PolarHBondContact O-N 3.14Å; F289-A293 PolarHBondContact O-N 3.34Å; F289-I294 HydrophobicContact CB-CD1 4.32Å; F289-I294 HydrophobicContact CB-CG1 4.15Å; F289-I294 HydrophobicContact CD1-CD1 3.4Å; F289-I294 HydrophobicContact CD1-CG1 3.63Å; F289-I294 HydrophobicContact CD2-CD1 4.06Å; F289-I294 HydrophobicContact CE1-CD1 3.47Å; F289-I294 VanDerWaalsContact CE1-CD1 3.47Å; F289-I294 HydrophobicContact CE1-CG1 4.12Å; F289-I294 HydrophobicContact CE2-CD1 4.19Å; F289-I294 HydrophobicContact CG-CD1 3.7Å; F289-I294 HydrophobicContact CG-CG1 3.99Å; F289-I294 HydrophobicContact CZ-CD1 3.91Å; F289-I294 WeakPolarHBondContact O-CG1 3.09Å; F289-I294 PolarHBondContact O-N 3.47Å; F289-L458 HydrophobicContact CB-CB 4.3Å; F289-L458 HydrophobicContact CB-CD1 4.06Å; F289-L458 HydrophobicContact CD1-CB 4.14Å; F289-L459 HydrophobicContact CD2-CD2 4.17Å; F289-L459 HydrophobicContact CE2-CD2 3.93Å; F289-L459 HydrophobicContact CZ-CD2 4.14Å; F289-A462 HydrophobicContact CD1-CB 4.41Å; F289-A462 HydrophobicContact CE1-CB 3.4Å; F289-A462 HydrophobicContact CZ-CB 3.92Å; F289-C506 WeakPolarHBondContact CZ-SG 3.36Å
290	F	87.5	Confident	91.6	Very high	38 Å²	38	8.1 Å²	8.1	17%	0.167	4%	0.037	C	C	.	.	H	α-helix	trans	-66.6	-48.3	176.1	-82.7	-65.7	0	0	0	113.3	T286 I288 Y292 A293 A453 G455 L458	T286-F290 WeakPolarHBondContact O-CD2 3.41Å; T286-F290 PolarHBondContact O-N 2.9Å; I288-F290 PolarHBondContact O-N 3.43Å; F290-Y292 PolarHBondContact O-N 3.39Å; F290-A293 PolarHBondContact O-N 2.93Å; F290-A293 VanDerWaalsContact O-N 3.14Å; F290-A453 HydrophobicContact CE1-CB 4.39Å; F290-A453 WeakPolarHBondContact CE1-O 3.29Å; F290-A453 WeakPolarHBondContact CZ-O 3.46Å; F290-G455 VanDerWaalsContact CE2-CA 3.41Å; F290-G455 VanDerWaalsContact CZ-N 3.33Å; F290-L458 HydrophobicContact CD1-CD1 3.72Å; F290-L458 HydrophobicContact CD2-CD1 4.23Å; F290-L458 HydrophobicContact CE1-CD1 3.47Å; F290-L458 VanDerWaalsContact CE1-CD1 3.47Å; F290-L458 HydrophobicContact CE1-CG 4.35Å; F290-L458 HydrophobicContact CE2-CD1 4.02Å; F290-L458 HydrophobicContact CG-CD1 4.04Å; F290-L458 HydrophobicContact CZ-CD1 3.57Å; F290-L458 HydrophobicContact CZ-CG 4.24Å
291	S	92.6	Very high	91.8	Very high	8 Å²	8	8.1 Å²	8.1	6%	0.056	4%	0.038	C	C	.	.	H	α-helix	trans	-65.9	-22.4	-174.8	-173.7	0	0	0	0	112.2	N57 Q287 I288 N323	N57-S291 PolarHBondContact ND2-OG 3.45Å; Q287-S291 WeakPolarHBondContact O-CB 3.41Å; Q287-S291 PolarHBondContact O-N 3.33Å; I288-S291 PolarHBondContact O-N 2.9Å; S291-N323 PolarHBondContact O-ND2 3.36Å; S291-N323 PolarHBondContact OG-ND2 2.9Å; S291-N323 PolarHBondContact OG-OD1 3.28Å
292	Y	93.3	Very high	92	Very high	0 Å²	0	4.4 Å²	4.4	0%	0	2%	0.024	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.7	-1.6	-178.4	-75.4	55	0	0	0	112	F81 F89 I288 F290 I294 C320 N323 S324	F81-Y292 HydrophobicContact CD2-CE2 4.17Å; F81-Y292 AromaticContact CD2-CZ 3.82Å; F81-Y292 WeakPolarHBondContact CD2-OH 3.23Å; F81-Y292 HydrophobicContact CE2-CE2 4.22Å; F81-Y292 WeakPolarHBondContact CE2-OH 3.3Å; F89-Y292 AromaticContact CD2-CD2 3.98Å; F89-Y292 HydrophobicContact CD2-CD2 3.98Å; F89-Y292 WeakPolarHBondContact CE2-O 3.42Å; I288-Y292 HydrophobicContact CD1-CD1 4.38Å; I288-Y292 HydrophobicContact CD1-CE1 3.78Å; I288-Y292 HydrophobicContact CG2-CD1 4.29Å; I288-Y292 VanDerWaalsContact O-CB 3.28Å; I288-Y292 WeakPolarHBondContact O-CB 3.26Å; I288-Y292 WeakPolarHBondContact O-CD1 3.48Å; I288-Y292 PolarHBondContact O-N 3.44Å; I288-Y292 VanDerWaalsContact O-N 3.09Å; F290-Y292 PolarHBondContact O-N 3.39Å; Y292-I294 PolarHBondContact O-N 3.25Å; Y292-C320 HydrophobicContact CD2-CB 4.46Å; Y292-C320 HydrophobicContact CE2-CB 3.63Å; Y292-C320 VanDerWaalsContact CE2-SG 3.53Å; Y292-C320 PolarHBondContact OH-O 3.41Å; Y292-N323 WeakPolarHBondContact CD1-ND2 3.38Å; Y292-N323 HydrophobicContact CE1-CB 4.42Å; Y292-N323 WeakPolarHBondContact CE1-ND2 3.41Å; Y292-S324 WeakPolarHBondContact OH-CB 3.29Å; Y292-S324 PolarHBondContact OH-OG 3.37Å
293	A	92.4	Very high	92.5	Very high	4 Å²	4	4.2 Å²	4.2	3%	0.033	2%	0.023	C	C	.	.	T	Hydrogen-bonded Turn	trans	50.7	36.6	-173.9	0	0	0	0	0	113.1	E51 F289 F290 L296	E51-A293 HydrophobicContact CG-CB 3.76Å; E51-A293 WeakPolarHBondContact OE1-CB 3.44Å; F289-A293 PolarHBondContact O-N 3.34Å; F290-A293 PolarHBondContact O-N 2.93Å; F290-A293 VanDerWaalsContact O-N 3.14Å; A293-L296 HydrophobicContact CB-CD1 3.98Å
294	I	94.5	Very high	92.8	Very high	0 Å²	0	3.7 Å²	3.7	0%	0	2%	0.02	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.5	149.8	178	55.4	168.5	0	0	0	110.5	V88 F89 F289 Y292 L296 L299	V88-I294 HydrophobicContact CB-CB 4.48Å; V88-I294 HydrophobicContact CB-CD1 3.91Å; V88-I294 HydrophobicContact CB-CG2 4.46Å; V88-I294 HydrophobicContact CG1-CB 3.86Å; V88-I294 HydrophobicContact CG1-CD1 4.01Å; V88-I294 HydrophobicContact CG1-CG1 4.48Å; V88-I294 HydrophobicContact CG1-CG2 4.19Å; F89-I294 HydrophobicContact CB-CG2 3.95Å; F89-I294 HydrophobicContact CD2-CG2 3.96Å; F89-I294 HydrophobicContact CG-CG2 4.43Å; F289-I294 HydrophobicContact CB-CD1 4.32Å; F289-I294 HydrophobicContact CB-CG1 4.15Å; F289-I294 HydrophobicContact CD1-CD1 3.4Å; F289-I294 HydrophobicContact CD1-CG1 3.63Å; F289-I294 HydrophobicContact CD2-CD1 4.06Å; F289-I294 HydrophobicContact CE1-CD1 3.47Å; F289-I294 VanDerWaalsContact CE1-CD1 3.47Å; F289-I294 HydrophobicContact CE1-CG1 4.12Å; F289-I294 HydrophobicContact CE2-CD1 4.19Å; F289-I294 HydrophobicContact CG-CD1 3.7Å; F289-I294 HydrophobicContact CG-CG1 3.99Å; F289-I294 HydrophobicContact CZ-CD1 3.91Å; F289-I294 WeakPolarHBondContact O-CG1 3.09Å; F289-I294 PolarHBondContact O-N 3.47Å; Y292-I294 PolarHBondContact O-N 3.25Å; I294-L296 PolarHBondContact O-N 3.23Å; I294-L299 HydrophobicContact CG2-CD1 3.72Å
295	C	94.3	Very high	92.8	Very high	0 Å²	0	4.3 Å²	4.3	0%	0	2%	0.022	C	C	.	.	T	Hydrogen-bonded Turn	trans	63.8	25.9	-173.9	-57	0	0	0	0	113.6	E92 T121 L458 V461 A462 E465	E92-C295 WeakPolarHBondContact OE1-CA 3.12Å; E92-C295 PolarHBondContact OE1-N 3.38Å; T121-C295 WeakPolarHBondContact CG2-O 3.47Å; C295-L458 HydrophobicContact CB-CB 4.46Å; C295-L458 HydrophobicContact CB-CD2 4.23Å; C295-V461 HydrophobicContact CB-CB 3.94Å; C295-V461 HydrophobicContact CB-CG1 3.7Å; C295-A462 VanDerWaalsContact SG-CA 3.53Å; C295-A462 VanDerWaalsContact SG-CB 3.55Å; C295-E465 PolarHBondContact SG-OE2 3.06Å
296	L	91.9	Very high	93.1	Very high	5 Å²	5	4.9 Å²	4.9	3%	0.026	3%	0.026	C	C	.	.	S	Bend	trans	-109.7	-17.4	176.6	-73.7	-175.8	0	0	0	112.2	I124 E125 A293 I294 C298 L458	I124-L296 HydrophobicContact CB-CD2 4.28Å; I124-L296 HydrophobicContact CG2-CD2 3.43Å; I124-L296 VanDerWaalsContact CG2-CD2 3.43Å; E125-L296 HydrophobicContact CG-CB 4.37Å; E125-L296 WeakPolarHBondContact CG-O 3.36Å; E125-L296 VanDerWaalsContact OE1-CB 3.24Å; E125-L296 WeakPolarHBondContact OE1-CB 3.48Å; E125-L296 WeakPolarHBondContact OE1-CD1 3.43Å; E125-L296 WeakPolarHBondContact OE1-CD2 3.48Å; A293-L296 HydrophobicContact CB-CD1 3.98Å; I294-L296 PolarHBondContact O-N 3.23Å; L296-C298 PolarHBondContact O-N 3.05Å; L296-L458 HydrophobicContact CD2-CD2 3.59Å; L296-L458 HydrophobicContact CG-CD2 4.07Å
297	G	90.8	Very high	93.4	Very high	1 Å²	1	7.8 Å²	7.8	1%	0.01	5%	0.047	C	C	.	.	S	Bend	trans	81.2	-8.6	-177.7	0	0	0	0	0	114.3	L299 T300 A301	G297-L299 PolarHBondContact O-N 3.08Å; G297-T300 WeakPolarHBondContact O-CB 3.48Å; G297-T300 PolarHBondContact O-N 3.47Å; G297-A301 PolarHBondContact O-N 2.95Å
298	C	93.9	Very high	93.4	Very high	0 Å²	0	9 Å²	9	0%	0	5%	0.051	C	C	.	.	H	α-helix	trans	-55.2	-49.5	172.8	-69.1	0	0	0	0	112.2	E51 E125 L296 T300 A301 L302 V395 S399	E51-C298 PolarHBondContact OE1-SG 3.28Å; E125-C298 PolarHBondContact OE1-SG 3.23Å; E125-C298 VanDerWaalsContact OE1-SG 3.4Å; L296-C298 PolarHBondContact O-N 3.05Å; C298-T300 VanDerWaalsContact C-N 3.3Å; C298-T300 PolarHBondContact O-N 2.91Å; C298-A301 PolarHBondContact O-N 2.86Å; C298-A301 VanDerWaalsContact O-N 3.17Å; C298-L302 WeakPolarHBondContact O-CG 3.29Å; C298-L302 PolarHBondContact O-N 2.8Å; C298-V395 HydrophobicContact CB-CG1 3.73Å; C298-S399 PolarHBondContact N-OG 2.97Å
299	L	95.9	Very high	93.3	Very high	1 Å²	1	14.1 Å²	14.1	1%	0.005	8%	0.078	C	C	.	.	H	α-helix	trans	-66.2	-34.2	179.8	-58.3	175.8	0	0	0	112.3	V48 F89 E92 I294 G297 G303	V48-L299 HydrophobicContact CG1-CD2 4Å; F89-L299 HydrophobicContact CB-CD1 4.37Å; F89-L299 HydrophobicContact CD1-CD1 4.3Å; F89-L299 HydrophobicContact CD2-CD1 3.29Å; F89-L299 HydrophobicContact CD2-CD2 4.3Å; F89-L299 HydrophobicContact CD2-CG 4.42Å; F89-L299 HydrophobicContact CE1-CD1 4.41Å; F89-L299 HydrophobicContact CE1-CD2 4.33Å; F89-L299 HydrophobicContact CE2-CD1 3.41Å; F89-L299 VanDerWaalsContact CE2-CD1 3.41Å; F89-L299 HydrophobicContact CE2-CD2 3.53Å; F89-L299 HydrophobicContact CE2-CG 4.11Å; F89-L299 HydrophobicContact CG-CD1 3.77Å; F89-L299 HydrophobicContact CZ-CD1 4.01Å; F89-L299 HydrophobicContact CZ-CD2 3.56Å; F89-L299 HydrophobicContact CZ-CG 4.43Å; E92-L299 HydrophobicContact CB-CB 3.9Å; I294-L299 HydrophobicContact CG2-CD1 3.72Å; G297-L299 PolarHBondContact O-N 3.08Å; L299-G303 WeakPolarHBondContact O-CA 3.24Å; L299-G303 PolarHBondContact O-N 3.01Å
300	T	95.8	Very high	93.5	Very high	1 Å²	1	15 Å²	15	1%	0.006	8%	0.083	C	C	.	.	H	α-helix	trans	-63.2	-46.3	173	-57.5	0	0	0	0	110.3	G96 C106 G297 C298 S304	G96-T300 WeakPolarHBondContact CA-O 3.43Å; C106-T300 HydrophobicContact CB-CG2 4.17Å; G297-T300 WeakPolarHBondContact O-CB 3.48Å; G297-T300 PolarHBondContact O-N 3.47Å; C298-T300 VanDerWaalsContact C-N 3.3Å; C298-T300 PolarHBondContact O-N 2.91Å; T300-S304 WeakPolarHBondContact O-CB 3.23Å; T300-S304 PolarHBondContact O-N 2.88Å
301	A	94.3	Very high	93.9	Very high	1 Å²	1	15.2 Å²	15.2	1%	0.008	9%	0.086	C	C	.	.	H	α-helix	trans	-63.3	-51.5	177.3	0	0	0	0	0	112.1	G297 C298 G303 S304 Y305 T402	G297-A301 PolarHBondContact O-N 2.95Å; C298-A301 PolarHBondContact O-N 2.86Å; C298-A301 VanDerWaalsContact O-N 3.17Å; A301-G303 PolarHBondContact O-N 3.14Å; A301-S304 WeakPolarHBondContact O-CB 3.36Å; A301-S304 PolarHBondContact O-N 3.31Å; A301-S304 VanDerWaalsContact O-N 3.13Å; A301-S304 PolarHBondContact O-OG 3.05Å; A301-Y305 WeakPolarHBondContact O-CD2 3.41Å; A301-T402 HydrophobicContact CB-CG2 4.27Å
302	L	94.6	Very high	94	Very high	3 Å²	3	14.8 Å²	14.8	2%	0.016	8%	0.083	C	C	.	.	H	α-helix	trans	-62.6	-41.4	179.5	-64.6	179.2	0	0	0	112.3	W38 F44 V48 C298 S304 Y305 V395	W38-L302 HydrophobicContact CH2-CD2 3.91Å; W38-L302 HydrophobicContact CZ2-CB 4.37Å; W38-L302 HydrophobicContact CZ2-CD2 3.62Å; W38-L302 PolarHBondContact NE1-O 2.93Å; F44-L302 HydrophobicContact CE2-CB 4.4Å; V48-L302 HydrophobicContact CB-CD1 4.46Å; V48-L302 HydrophobicContact CG2-CB 4.27Å; V48-L302 HydrophobicContact CG2-CD1 3.76Å; C298-L302 WeakPolarHBondContact O-CG 3.29Å; C298-L302 PolarHBondContact O-N 2.8Å; L302-S304 VanDerWaalsContact C-N 3.27Å; L302-S304 PolarHBondContact O-N 3.36Å; L302-Y305 PolarHBondContact O-N 3.26Å; L302-V395 HydrophobicContact CD1-CG1 3.72Å; L302-V395 HydrophobicContact CD1-CG2 4.19Å; L302-V395 HydrophobicContact CD2-CG1 4.2Å; L302-V395 HydrophobicContact CD2-CG2 4.28Å; L302-V395 HydrophobicContact CG-CG1 4.02Å
303	G	95.3	Very high	94.2	Very high	0 Å²	0	16.4 Å²	16.4	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-64.2	-31.8	176	0	0	0	0	0	112.5	Q97 L299 A301 Y305 N306	Q97-G303 VanDerWaalsContact CA-O 3.23Å; Q97-G303 WeakPolarHBondContact CA-O 3.34Å; Q97-G303 PolarHBondContact N-O 3.43Å; L299-G303 WeakPolarHBondContact O-CA 3.24Å; L299-G303 PolarHBondContact O-N 3.01Å; A301-G303 PolarHBondContact O-N 3.14Å; G303-Y305 PolarHBondContact O-N 2.92Å; G303-N306 VanDerWaalsContact O-CB 3.29Å; G303-N306 WeakPolarHBondContact O-CB 3.21Å; G303-N306 PolarHBondContact O-N 2.76Å
304	S	95.6	Very high	94.3	Very high	3 Å²	3	24.7 Å²	24.7	2%	0.021	12%	0.12	C	C	.	.	H	α-helix	trans	-66.4	-19.2	179.9	82.1	0	0	0	0	114.8	R35 G96 E101 T300 A301 L302	R35-S304 PolarHBondContact NH1-O 3.34Å; R35-S304 PolarHBondContact NH1-OG 3.21Å; R35-S304 PolarHBondContact NH2-OG 3.17Å; G96-S304 VanDerWaalsContact O-CA 3.25Å; G96-S304 WeakPolarHBondContact O-CA 3.38Å; E101-S304 VanDerWaalsContact O-CB 3.28Å; E101-S304 WeakPolarHBondContact O-CB 3.29Å; T300-S304 WeakPolarHBondContact O-CB 3.23Å; T300-S304 PolarHBondContact O-N 2.88Å; A301-S304 WeakPolarHBondContact O-CB 3.36Å; A301-S304 PolarHBondContact O-N 3.31Å; A301-S304 VanDerWaalsContact O-N 3.13Å; A301-S304 PolarHBondContact O-OG 3.05Å; L302-S304 VanDerWaalsContact C-N 3.27Å; L302-S304 PolarHBondContact O-N 3.36Å
305	Y	93.6	Very high	94.4	Very high	13 Å²	13	25 Å²	25	5%	0.051	12%	0.121	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.8	-3.3	175.7	-63.7	-49.8	0	0	0	113.4	R35 G36 W38 P229 A301 L302 G303 E398 T402	R35-Y305 HydrophobicContact CG-CE1 4.32Å; G36-Y305 WeakPolarHBondContact O-CD1 3.4Å; W38-Y305 HydrophobicContact CZ2-CD2 4.22Å; W38-Y305 PolarHBondContact N-O 2.91Å; P229-Y305 HydrophobicContact CG-CD1 4.19Å; P229-Y305 HydrophobicContact CG-CD2 3.62Å; P229-Y305 HydrophobicContact CG-CE1 4.2Å; P229-Y305 HydrophobicContact CG-CE2 3.62Å; P229-Y305 HydrophobicContact CG-CG 3.9Å; A301-Y305 WeakPolarHBondContact O-CD2 3.41Å; L302-Y305 PolarHBondContact O-N 3.26Å; G303-Y305 PolarHBondContact O-N 2.92Å; Y305-E398 HydrophobicContact CE2-CG 4.41Å; Y305-E398 PolarHBondContact OH-OE1 2.92Å; Y305-T402 PolarHBondContact OH-OG1 3.48Å
306	N	94.9	Very high	94.5	Very high	13 Å²	13	25 Å²	25	7%	0.07	12%	0.122	C	C	.	.	S	Bend	trans	-73.7	154.2	174.9	-74.9	-23.4	0	0	0	111.9	F44 Q97 G303 N310	F44-N306 VanDerWaalsContact CD2-OD1 3.28Å; F44-N306 WeakPolarHBondContact CD2-OD1 3.5Å; F44-N306 WeakPolarHBondContact CE1-ND2 3.3Å; F44-N306 VanDerWaalsContact CE2-ND2 3.31Å; F44-N306 WeakPolarHBondContact CE2-ND2 3.27Å; F44-N306 VanDerWaalsContact CG-OD1 3.26Å; F44-N306 WeakPolarHBondContact CG-OD1 3.24Å; F44-N306 WeakPolarHBondContact CZ-ND2 3.21Å; Q97-N306 HydrophobicContact CB-CB 4.47Å; Q97-N306 HydrophobicContact CG-CB 3.95Å; Q97-N306 PolarHBondContact OE1-ND2 3.22Å; G303-N306 VanDerWaalsContact O-CB 3.29Å; G303-N306 WeakPolarHBondContact O-CB 3.21Å; G303-N306 PolarHBondContact O-N 2.76Å; N306-N310 HydrophobicContact CB-CB 4.35Å
307	S	92.4	Very high	94.8	Very high	72 Å²	72	27.5 Å²	27.5	50%	0.503	14%	0.135	S	C	.	.			trans	-64.9	144.5	165.3	63.7	0	0	0	0	110.2	Q97 N309 N310	Q97-S307 PolarHBondContact NE2-O 3.37Å; S307-N309 PolarHBondContact O-N 3.13Å; S307-N309 VanDerWaalsContact O-N 3.14Å; S307-N310 WeakPolarHBondContact O-CB 3.47Å; S307-N310 PolarHBondContact O-N 3.08Å
308	Y	91.8	Very high	95.1	Very high	25 Å²	25	31.8 Å²	31.8	10%	0.098	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.3	-36.3	-176.5	-172.6	-96.1	0	0	0	113.3	Q97 F98 D484 M485 M578 R579 G580	Q97-Y308 PolarHBondContact NE2-O 3.18Å; F98-Y308 AromaticContact CD2-CE2 3.75Å; F98-Y308 HydrophobicContact CD2-CE2 3.75Å; F98-Y308 HydrophobicContact CE2-CE2 4.2Å; F98-Y308 WeakPolarHBondContact CE2-OH 3.37Å; Y308-D484 VanDerWaalsContact CE1-OD2 3.29Å; Y308-D484 WeakPolarHBondContact CE1-OD2 3.43Å; Y308-D484 PolarHBondContact OH-OD2 3.12Å; Y308-M485 HydrophobicContact CD1-CG 4.19Å; Y308-M485 HydrophobicContact CD2-CG 4.2Å; Y308-M485 HydrophobicContact CE1-CB 4.39Å; Y308-M485 HydrophobicContact CE1-CG 3.72Å; Y308-M485 HydrophobicContact CE2-CG 3.81Å; Y308-M485 HydrophobicContact CE2-SD 4.35Å; Y308-M485 HydrophobicContact CG-CG 4.41Å; Y308-M485 WeakPolarHBondContact O-CB 3.42Å; Y308-M578 WeakPolarHBondContact OH-CA 3.31Å; Y308-R579 HydrophobicContact CD1-CB 3.98Å; Y308-R579 HydrophobicContact CD2-CB 4.27Å; Y308-R579 VanDerWaalsContact CD2-NH2 3.28Å; Y308-R579 HydrophobicContact CE1-CB 3.82Å; Y308-R579 HydrophobicContact CE2-CB 4.05Å; Y308-R579 HydrophobicContact CE2-CG 4.44Å; Y308-R579 HydrophobicContact CG-CB 4.19Å; Y308-R579 PolarHBondContact OH-N 3.37Å; Y308-R579 VanDerWaalsContact OH-N 3.09Å; Y308-G580 VanDerWaalsContact CE1-N 3.3Å
309	N	93	Very high	95.2	Very high	108 Å²	108	31.9 Å²	31.9	58%	0.578	16%	0.156	S	C	*	.	T	Hydrogen-bonded Turn	trans	-90.3	8.1	-178	-60.7	-37.1	0	0	0	113.8	S307 M485	S307-N309 PolarHBondContact O-N 3.13Å; S307-N309 VanDerWaalsContact O-N 3.14Å; N309-M485 WeakPolarHBondContact CA-O 3.18Å
310	N	94.3	Very high	95.3	Very high	19 Å²	19	31.8 Å²	31.8	10%	0.102	16%	0.156	C	C	.	.	S	Bend	trans	-66	140.2	176.9	179.1	54.6	0	0	0	110.3	K41 Q97 N306 S307 C312 D315	K41-N310 PolarHBondContact NZ-OD1 3.25Å; Q97-N310 PolarHBondContact NE2-O 3.5Å; N306-N310 HydrophobicContact CB-CB 4.35Å; S307-N310 WeakPolarHBondContact O-CB 3.47Å; S307-N310 PolarHBondContact O-N 3.08Å; N310-C312 PolarHBondContact O-N 3.33Å; N310-D315 PolarHBondContact ND2-OD2 3.01Å; N310-D315 PolarHBondContact OD1-OD2 3.4Å
311	N	95.8	Very high	95.3	Very high	42 Å²	42	34.8 Å²	34.8	23%	0.225	18%	0.176	C	C	.	.			trans	-78.4	75	177.2	-170.6	-19.7	0	0	0	111	Y313 R314 D315 Y488	N311-Y313 PolarHBondContact O-N 2.82Å; N311-Y313 PolarHBondContact OD1-N 3.34Å; N311-R314 PolarHBondContact O-N 3.49Å; N311-R314 PolarHBondContact OD1-N 3.03Å; N311-D315 PolarHBondContact O-N 3.18Å; N311-Y488 PolarHBondContact ND2-OH 3.07Å; N311-Y488 PolarHBondContact OD1-OH 3.33Å; N311-Y488 VanDerWaalsContact OD1-OH 3.06Å
312	C	95.7	Very high	95.4	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-62.3	-28.9	178.7	54.4	0	0	0	0	112.7	T93 N310 D315 C316	T93-C312 HydrophobicContact CG2-CB 4.17Å; N310-C312 PolarHBondContact O-N 3.33Å; C312-D315 PolarHBondContact O-N 3.08Å; C312-C316 WeakPolarHBondContact O-CB 3.44Å; C312-C316 PolarHBondContact O-N 3.13Å; C312-C316 PolarHBondContact O-SG 3.38Å
313	Y	96.6	Very high	95.5	Very high	34 Å²	34	37.7 Å²	37.7	13%	0.133	19%	0.191	C	C	.	.	H	α-helix	trans	-63	-50.1	179	177.4	-117.6	0	0	0	112.5	F90 N311 D315 C316 I317 I486 Y488 P490 F491 I494	F90-Y313 HydrophobicContact CD1-CD2 4.1Å; F90-Y313 HydrophobicContact CD2-CD2 4.31Å; F90-Y313 AromaticContact CE1-CD2 3.8Å; F90-Y313 HydrophobicContact CE1-CD2 3.8Å; F90-Y313 VanDerWaalsContact CE2-CA 3.4Å; F90-Y313 HydrophobicContact CE2-CD2 4.05Å; F90-Y313 HydrophobicContact CE2-CG 4.36Å; F90-Y313 HydrophobicContact CG-CD2 4.34Å; F90-Y313 AromaticContact CZ-CD2 3.77Å; F90-Y313 HydrophobicContact CZ-CD2 3.77Å; F90-Y313 HydrophobicContact CZ-CG 4.17Å; N311-Y313 PolarHBondContact O-N 2.82Å; N311-Y313 PolarHBondContact OD1-N 3.34Å; Y313-D315 VanDerWaalsContact C-N 3.32Å; Y313-D315 PolarHBondContact O-N 3.07Å; Y313-C316 PolarHBondContact O-N 2.99Å; Y313-I317 HydrophobicContact CD1-CD1 4.43Å; Y313-I317 HydrophobicContact CD2-CD1 4.24Å; Y313-I317 HydrophobicContact CE1-CD1 3.83Å; Y313-I317 HydrophobicContact CE2-CD1 3.55Å; Y313-I317 HydrophobicContact CE2-CG1 4.24Å; Y313-I317 PolarHBondContact O-N 2.86Å; Y313-I317 WeakPolarHBondContact OH-CD1 3.12Å; Y313-I486 HydrophobicContact CG-CD1 4.46Å; Y313-Y488 AromaticContact CD1-CE2 3.81Å; Y313-Y488 HydrophobicContact CD1-CE2 3.81Å; Y313-Y488 HydrophobicContact CE1-CE2 4.28Å; Y313-P490 HydrophobicContact CD2-CB 4.03Å; Y313-P490 HydrophobicContact CE1-CB 4.49Å; Y313-P490 HydrophobicContact CE2-CB 3.94Å; Y313-P490 HydrophobicContact CG-CB 4.35Å; Y313-F491 WeakPolarHBondContact OH-CB 3.48Å; Y313-I494 HydrophobicContact CD2-CD1 4.24Å; Y313-I494 HydrophobicContact CE2-CD1 3.36Å
314	R	95.6	Very high	95.5	Very high	178 Å²	178	38.5 Å²	38.5	67%	0.672	20%	0.197	S	C	*	.	H	α-helix	trans	-63.5	-41.4	176.8	-177.4	179.5	177.3	-173.6	-1.1	111.3	N311 I317 M318	N311-R314 PolarHBondContact O-N 3.49Å; N311-R314 PolarHBondContact OD1-N 3.03Å; R314-I317 PolarHBondContact O-N 3.42Å; R314-M318 WeakPolarHBondContact O-CB 3.29Å; R314-M318 PolarHBondContact O-N 3.39Å; R314-M318 VanDerWaalsContact O-N 3.08Å
315	D	96.6	Very high	95.5	Very high	5 Å²	5	40 Å²	40	3%	0.027	21%	0.212	C	C	.	.	H	α-helix	trans	-61.6	-47	-179.8	-63.1	-13.7	0	0	0	110.5	K41 F44 I45 N310 N311 C312 Y313 I317 M318 L319	K41-D315 WeakPolarHBondContact CE-OD1 3.2Å; K41-D315 WeakPolarHBondContact CE-OD2 3.43Å; K41-D315 IonicContact NZ-OD1 2.71Å; K41-D315 PolarHBondContact NZ-OD1 3.09Å; K41-D315 IonicContact NZ-OD2 2.86Å; K41-D315 PolarHBondContact NZ-OD2 3.42Å; F44-D315 HydrophobicContact CE1-CB 4.23Å; I45-D315 HydrophobicContact CD1-CB 3.76Å; N310-D315 PolarHBondContact ND2-OD2 3.01Å; N310-D315 PolarHBondContact OD1-OD2 3.4Å; N311-D315 PolarHBondContact O-N 3.18Å; C312-D315 PolarHBondContact O-N 3.08Å; Y313-D315 VanDerWaalsContact C-N 3.32Å; Y313-D315 PolarHBondContact O-N 3.07Å; D315-I317 PolarHBondContact O-N 3.07Å; D315-M318 PolarHBondContact O-N 3.01Å; D315-L319 WeakPolarHBondContact O-CB 3.44Å; D315-L319 WeakPolarHBondContact O-CD1 3.27Å; D315-L319 VanDerWaalsContact O-CG 3.27Å; D315-L319 WeakPolarHBondContact O-CG 3.4Å; D315-L319 PolarHBondContact O-N 3.45Å
316	C	96.9	Very high	95.6	Very high	1 Å²	1	39.9 Å²	39.9	1%	0.007	21%	0.213	C	C	.	.	H	α-helix	trans	-60.3	-46.8	178.6	-69.3	0	0	0	0	112.4	F89 F90 C312 Y313 M318 L319 C320	F89-C316 HydrophobicContact CD1-CB 3.79Å; F89-C316 HydrophobicContact CE1-CB 4.15Å; F90-C316 HydrophobicContact CB-CB 4.17Å; F90-C316 HydrophobicContact CD2-CB 4.16Å; C312-C316 WeakPolarHBondContact O-CB 3.44Å; C312-C316 PolarHBondContact O-N 3.13Å; C312-C316 PolarHBondContact O-SG 3.38Å; Y313-C316 PolarHBondContact O-N 2.99Å; C316-M318 VanDerWaalsContact C-N 3.35Å; C316-M318 PolarHBondContact O-N 3.47Å; C316-L319 PolarHBondContact O-N 3.14Å; C316-C320 WeakPolarHBondContact O-CB 3.12Å; C316-C320 PolarHBondContact O-N 2.83Å; C316-C320 PolarHBondContact O-SG 3.04Å
317	I	96.8	Very high	95.6	Very high	58 Å²	58	39.2 Å²	39.2	30%	0.297	21%	0.209	S	C	.	.	H	α-helix	trans	-60.9	-46.6	178	-69.1	174.3	0	0	0	110.7	I86 Y313 R314 D315 L319 C320 C321	I86-I317 HydrophobicContact CG2-CG1 4.44Å; Y313-I317 HydrophobicContact CD1-CD1 4.43Å; Y313-I317 HydrophobicContact CD2-CD1 4.24Å; Y313-I317 HydrophobicContact CE1-CD1 3.83Å; Y313-I317 HydrophobicContact CE2-CD1 3.55Å; Y313-I317 HydrophobicContact CE2-CG1 4.24Å; Y313-I317 PolarHBondContact O-N 2.86Å; Y313-I317 WeakPolarHBondContact OH-CD1 3.12Å; R314-I317 PolarHBondContact O-N 3.42Å; D315-I317 PolarHBondContact O-N 3.07Å; I317-L319 PolarHBondContact O-N 2.94Å; I317-C320 PolarHBondContact O-N 3.28Å; I317-C321 WeakPolarHBondContact O-CB 3.44Å; I317-C321 PolarHBondContact O-N 3.48Å; I317-C321 PolarHBondContact O-SG 3.22Å
318	M	97.1	Very high	95.7	Very high	91 Å²	91	39.5 Å²	39.5	45%	0.448	20%	0.202	S	C	.	.	H	α-helix	trans	-61.4	-46.3	-179.8	-175.4	-172.8	74.6	0	0	111.5	I45 R314 D315 C316 C321 L322	I45-M318 HydrophobicContact CD1-CE 3.93Å; I45-M318 HydrophobicContact CG1-CE 4.34Å; I45-M318 HydrophobicContact CG2-CE 3.71Å; R314-M318 WeakPolarHBondContact O-CB 3.29Å; R314-M318 PolarHBondContact O-N 3.39Å; R314-M318 VanDerWaalsContact O-N 3.08Å; D315-M318 PolarHBondContact O-N 3.01Å; C316-M318 VanDerWaalsContact C-N 3.35Å; C316-M318 PolarHBondContact O-N 3.47Å; M318-C321 PolarHBondContact O-N 2.86Å; M318-L322 WeakPolarHBondContact O-CB 3.48Å; M318-L322 PolarHBondContact O-N 2.99Å
319	L	97.4	Very high	95.8	Very high	1 Å²	1	41.1 Å²	41.1	1%	0.005	21%	0.214	C	C	.	.	H	α-helix	trans	-65.4	-42.5	179.3	-74.7	163.6	0	0	0	112	I45 V48 A49 I52 F89 D315 C316 I317 C321 L322 N323	I45-L319 HydrophobicContact CD1-CD1 3.98Å; I45-L319 HydrophobicContact CD1-CG 4.37Å; I45-L319 HydrophobicContact CG2-CD2 4.15Å; V48-L319 HydrophobicContact CB-CD1 3.89Å; V48-L319 HydrophobicContact CB-CD2 4.33Å; V48-L319 HydrophobicContact CG1-CD1 3.62Å; V48-L319 HydrophobicContact CG1-CD2 4.31Å; V48-L319 HydrophobicContact CG1-CG 4.45Å; A49-L319 HydrophobicContact CB-CD2 4.02Å; I52-L319 HydrophobicContact CD1-CB 3.96Å; I52-L319 HydrophobicContact CD1-CD2 4.23Å; I52-L319 WeakPolarHBondContact CD1-O 3.27Å; F89-L319 HydrophobicContact CE1-CB 4.45Å; F89-L319 HydrophobicContact CE1-CD1 4.5Å; F89-L319 HydrophobicContact CZ-CB 4.38Å; D315-L319 WeakPolarHBondContact O-CB 3.44Å; D315-L319 WeakPolarHBondContact O-CD1 3.27Å; D315-L319 VanDerWaalsContact O-CG 3.27Å; D315-L319 WeakPolarHBondContact O-CG 3.4Å; D315-L319 PolarHBondContact O-N 3.45Å; C316-L319 PolarHBondContact O-N 3.14Å; I317-L319 PolarHBondContact O-N 2.94Å; L319-C321 PolarHBondContact O-N 3.45Å; L319-L322 PolarHBondContact O-N 3Å; L319-N323 WeakPolarHBondContact O-CB 3.26Å; L319-N323 PolarHBondContact O-N 2.95Å
320	C	97.1	Very high	95.8	Very high	0 Å²	0	36 Å²	36	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-60.6	-43.9	175.3	-74.1	0	0	0	0	111.8	F81 I86 Y292 C316 I317 S324	F81-C320 HydrophobicContact CE2-CB 3.96Å; I86-C320 HydrophobicContact CG1-CB 3.72Å; Y292-C320 HydrophobicContact CD2-CB 4.46Å; Y292-C320 HydrophobicContact CE2-CB 3.63Å; Y292-C320 VanDerWaalsContact CE2-SG 3.53Å; Y292-C320 PolarHBondContact OH-O 3.41Å; C316-C320 WeakPolarHBondContact O-CB 3.12Å; C316-C320 PolarHBondContact O-N 2.83Å; C316-C320 PolarHBondContact O-SG 3.04Å; I317-C320 PolarHBondContact O-N 3.28Å; C320-S324 PolarHBondContact O-N 3.2Å
321	C	96.9	Very high	95.8	Very high	63 Å²	63	35.1 Å²	35.1	43%	0.426	18%	0.182	S	C	.	.	H	α-helix	trans	-67.4	-41.3	176	-71.1	0	0	0	0	111.9	I317 M318 L319 G325	I317-C321 WeakPolarHBondContact O-CB 3.44Å; I317-C321 PolarHBondContact O-N 3.48Å; I317-C321 PolarHBondContact O-SG 3.22Å; M318-C321 PolarHBondContact O-N 2.86Å; L319-C321 PolarHBondContact O-N 3.45Å; C321-G325 PolarHBondContact O-N 3.14Å
322	L	96.3	Very high	95.7	Very high	65 Å²	65	35.4 Å²	35.4	34%	0.34	18%	0.181	S	C	.	.	H	α-helix	trans	-58.6	-49.1	176.6	-179	66.6	0	0	0	110.4	A49 I53 Y244 M318 L319 G325 T326	A49-L322 HydrophobicContact CB-CD2 4.17Å; I53-L322 HydrophobicContact CD1-CD2 4.02Å; I53-L322 HydrophobicContact CD1-CG 4.08Å; Y244-L322 HydrophobicContact CE1-CD1 4.29Å; Y244-L322 WeakPolarHBondContact OH-CG 3.48Å; M318-L322 WeakPolarHBondContact O-CB 3.48Å; M318-L322 PolarHBondContact O-N 2.99Å; L319-L322 PolarHBondContact O-N 3Å; L322-G325 PolarHBondContact O-N 3.1Å; L322-T326 WeakPolarHBondContact O-CB 3.41Å; L322-T326 PolarHBondContact O-N 3.16Å; L322-T326 PolarHBondContact O-OG1 2.91Å
323	N	96.3	Very high	95.5	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-55.5	-56.2	179.8	-171.4	28.6	0	0	0	113.2	I52 N57 S291 Y292 L319 G325 T326 S327	I52-N323 HydrophobicContact CD1-CB 3.85Å; I52-N323 HydrophobicContact CG1-CB 4.01Å; I52-N323 PolarHBondContact O-OD1 3.44Å; N57-N323 PolarHBondContact ND2-OD1 3.12Å; S291-N323 PolarHBondContact O-ND2 3.36Å; S291-N323 PolarHBondContact OG-ND2 2.9Å; S291-N323 PolarHBondContact OG-OD1 3.28Å; Y292-N323 WeakPolarHBondContact CD1-ND2 3.38Å; Y292-N323 HydrophobicContact CE1-CB 4.42Å; Y292-N323 WeakPolarHBondContact CE1-ND2 3.41Å; L319-N323 WeakPolarHBondContact O-CB 3.26Å; L319-N323 PolarHBondContact O-N 2.95Å; N323-G325 VanDerWaalsContact C-N 3.33Å; N323-G325 PolarHBondContact O-N 2.94Å; N323-T326 PolarHBondContact O-N 3.49Å; N323-S327 PolarHBondContact O-N 3.29Å; N323-S327 PolarHBondContact O-OG 3.21Å
324	S	95.8	Very high	95.2	Very high	18 Å²	18	34.4 Å²	34.4	13%	0.126	18%	0.178	C	C	.	.	H	α-helix	trans	-64.8	-36.5	178.4	-82	0	0	0	0	112.7	Y77 Y292 C320 S327 F328	Y77-S324 VanDerWaalsContact CE1-OG 3.32Å; Y77-S324 WeakPolarHBondContact CE1-OG 3.5Å; Y77-S324 PolarHBondContact OH-OG 3.27Å; Y292-S324 WeakPolarHBondContact OH-CB 3.29Å; Y292-S324 PolarHBondContact OH-OG 3.37Å; C320-S324 PolarHBondContact O-N 3.2Å; S324-S327 PolarHBondContact O-N 2.83Å; S324-F328 WeakPolarHBondContact O-CB 3.33Å; S324-F328 PolarHBondContact O-N 2.83Å
325	G	95.6	Very high	95	Very high	34 Å²	34	26 Å²	26	35%	0.351	15%	0.147	S	C	.	.	H	α-helix	trans	-62.4	-43.2	174.5	0	0	0	0	0	112.1	C321 L322 N323 F328 V329	C321-G325 PolarHBondContact O-N 3.14Å; L322-G325 PolarHBondContact O-N 3.1Å; N323-G325 VanDerWaalsContact C-N 3.33Å; N323-G325 PolarHBondContact O-N 2.94Å; G325-F328 WeakPolarHBondContact O-CB 2.79Å; G325-F328 PolarHBondContact O-N 2.91Å; G325-V329 WeakPolarHBondContact O-CG2 3.27Å; G325-V329 PolarHBondContact O-N 2.86Å
326	T	94.7	Very high	94.9	Very high	10 Å²	10	25.8 Å²	25.8	6%	0.061	15%	0.145	C	C	.	.	H	α-helix	trans	-64.1	-44.6	176.8	-60.1	0	0	0	0	111.4	I53 Y244 L247 L322 N323 F328 V329 A330	I53-T326 HydrophobicContact CG1-CG2 4.47Å; I53-T326 HydrophobicContact CG2-CG2 3.72Å; Y244-T326 HydrophobicContact CE1-CG2 3.99Å; Y244-T326 VanDerWaalsContact CE1-OG1 3.24Å; Y244-T326 WeakPolarHBondContact CE1-OG1 3.43Å; Y244-T326 PolarHBondContact OH-OG1 3.3Å; L247-T326 HydrophobicContact CD1-CG2 3.91Å; L322-T326 WeakPolarHBondContact O-CB 3.41Å; L322-T326 PolarHBondContact O-N 3.16Å; L322-T326 PolarHBondContact O-OG1 2.91Å; N323-T326 PolarHBondContact O-N 3.49Å; T326-F328 VanDerWaalsContact C-N 3.31Å; T326-F328 PolarHBondContact O-N 2.9Å; T326-V329 PolarHBondContact O-N 3.09Å; T326-A330 VanDerWaalsContact O-CB 3.27Å; T326-A330 WeakPolarHBondContact O-CB 3.39Å; T326-A330 PolarHBondContact O-N 3.33Å
327	S	94.9	Very high	94.5	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-57.6	-43.7	174	-62.7	0	0	0	0	112.5	N57 F61 N323 S324 A330 G331	N57-S327 PolarHBondContact ND2-OG 2.92Å; F61-S327 WeakPolarHBondContact CD1-O 3.41Å; N323-S327 PolarHBondContact O-N 3.29Å; N323-S327 PolarHBondContact O-OG 3.21Å; S324-S327 PolarHBondContact O-N 2.83Å; S327-A330 PolarHBondContact O-N 3.04Å; S327-G331 PolarHBondContact O-N 3.08Å
328	F	94.8	Very high	94.1	Very high	77 Å²	77	23.3 Å²	23.3	34%	0.338	13%	0.133	S	C	.	.	H	α-helix	trans	-61.3	-47.8	178.2	-178.9	-116.3	0	0	0	112.1	F74 Y267 L268 S324 G325 T326 G331 F332	F74-F328 AromaticContact CE1-CD2 3.71Å; F74-F328 HydrophobicContact CE1-CD2 3.71Å; F74-F328 HydrophobicContact CE1-CE2 4.16Å; F74-F328 HydrophobicContact CE2-CE2 4.38Å; F74-F328 AromaticContact CZ-CD2 3.49Å; F74-F328 HydrophobicContact CZ-CD2 3.49Å; F74-F328 VanDerWaalsContact CZ-CD2 3.49Å; F74-F328 AromaticContact CZ-CE2 3.74Å; F74-F328 HydrophobicContact CZ-CE2 3.74Å; Y267-F328 WeakPolarHBondContact OH-CD2 3.24Å; Y267-F328 PolarHBondContact OH-O 3.03Å; Y267-F328 VanDerWaalsContact OH-O 3.07Å; L268-F328 HydrophobicContact CD2-CE2 4.02Å; S324-F328 WeakPolarHBondContact O-CB 3.33Å; S324-F328 PolarHBondContact O-N 2.83Å; G325-F328 WeakPolarHBondContact O-CB 2.79Å; G325-F328 PolarHBondContact O-N 2.91Å; T326-F328 VanDerWaalsContact C-N 3.31Å; T326-F328 PolarHBondContact O-N 2.9Å; F328-G331 PolarHBondContact O-N 3.29Å; F328-F332 HydrophobicContact CD1-CE2 4.05Å; F328-F332 HydrophobicContact CD2-CE2 4.36Å; F328-F332 AromaticContact CE1-CE2 3.55Å; F328-F332 HydrophobicContact CE1-CE2 3.55Å; F328-F332 HydrophobicContact CE1-CZ 4.26Å; F328-F332 AromaticContact CE2-CE2 3.9Å; F328-F332 HydrophobicContact CE2-CE2 3.9Å; F328-F332 HydrophobicContact CE2-CZ 4.48Å; F328-F332 HydrophobicContact CG-CE2 4.45Å; F328-F332 AromaticContact CZ-CE2 3.47Å; F328-F332 HydrophobicContact CZ-CE2 3.47Å; F328-F332 VanDerWaalsContact CZ-CE2 3.47Å; F328-F332 AromaticContact CZ-CZ 3.91Å; F328-F332 HydrophobicContact CZ-CZ 3.91Å; F328-F332 WeakPolarHBondContact O-CD2 3.26Å
329	V	94.6	Very high	93.9	Very high	60 Å²	60	19 Å²	19	36%	0.364	11%	0.112	S	C	.	.	H	α-helix	trans	-67.3	-42.2	179.1	173.9	0	0	0	0	111.8	L251 G325 T326 G331 F332 A333	L251-V329 HydrophobicContact CD2-CG1 3.98Å; G325-V329 WeakPolarHBondContact O-CG2 3.27Å; G325-V329 PolarHBondContact O-N 2.86Å; T326-V329 PolarHBondContact O-N 3.09Å; V329-G331 PolarHBondContact O-N 2.96Å; V329-F332 WeakPolarHBondContact O-CB 3.38Å; V329-F332 PolarHBondContact O-N 3.27Å; V329-F332 VanDerWaalsContact O-N 3.07Å; V329-A333 PolarHBondContact O-N 3.34Å
330	A	92.8	Very high	93.5	Very high	0 Å²	0	19.5 Å²	19.5	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-59.2	-35.2	175.2	0	0	0	0	0	111.3	V58 L247 T326 S327 F332 A333 I334	V58-A330 HydrophobicContact CG2-CB 4.45Å; L247-A330 HydrophobicContact CD2-CB 4.01Å; T326-A330 VanDerWaalsContact O-CB 3.27Å; T326-A330 WeakPolarHBondContact O-CB 3.39Å; T326-A330 PolarHBondContact O-N 3.33Å; S327-A330 PolarHBondContact O-N 3.04Å; A330-F332 VanDerWaalsContact C-N 3.35Å; A330-F332 PolarHBondContact O-N 3.46Å; A330-A333 PolarHBondContact O-N 2.94Å; A330-A333 VanDerWaalsContact O-N 3.15Å; A330-I334 WeakPolarHBondContact O-CG1 3.25Å; A330-I334 PolarHBondContact O-N 2.76Å
331	G	93.3	Very high	92.9	Very high	0 Å²	0	19.7 Å²	19.7	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-57	-42.6	172.5	0	0	0	0	0	113.8	P62 S327 F328 V329 F335	P62-G331 VanDerWaalsContact CG-CA 3.5Å; S327-G331 PolarHBondContact O-N 3.08Å; F328-G331 PolarHBondContact O-N 3.29Å; V329-G331 PolarHBondContact O-N 2.96Å; G331-F335 WeakPolarHBondContact O-CB 3.22Å; G331-F335 PolarHBondContact O-N 2.98Å
332	F	94.1	Very high	92.5	Very high	48 Å²	48	17 Å²	17	21%	0.211	10%	0.097	C	C	.	.	H	α-helix	trans	-64.2	-43.9	173.3	-73.9	-90.2	0	0	0	112.2	L251 I264 Y267 L268 F328 V329 A330 I334 S336	L251-F332 HydrophobicContact CD1-CB 3.48Å; L251-F332 VanDerWaalsContact CD1-CB 3.48Å; I264-F332 HydrophobicContact CD1-CD1 4.17Å; I264-F332 HydrophobicContact CG1-CD1 4.13Å; I264-F332 HydrophobicContact CG2-CD1 3.99Å; I264-F332 HydrophobicContact CG2-CE1 3.8Å; Y267-F332 HydrophobicContact CE1-CD2 4.02Å; Y267-F332 HydrophobicContact CE1-CE2 4.15Å; Y267-F332 HydrophobicContact CE1-CG 4.41Å; L268-F332 HydrophobicContact CD1-CE1 3.78Å; L268-F332 HydrophobicContact CD1-CE2 4.38Å; L268-F332 HydrophobicContact CD1-CZ 3.51Å; F328-F332 HydrophobicContact CD1-CE2 4.05Å; F328-F332 HydrophobicContact CD2-CE2 4.36Å; F328-F332 AromaticContact CE1-CE2 3.55Å; F328-F332 HydrophobicContact CE1-CE2 3.55Å; F328-F332 HydrophobicContact CE1-CZ 4.26Å; F328-F332 AromaticContact CE2-CE2 3.9Å; F328-F332 HydrophobicContact CE2-CE2 3.9Å; F328-F332 HydrophobicContact CE2-CZ 4.48Å; F328-F332 HydrophobicContact CG-CE2 4.45Å; F328-F332 AromaticContact CZ-CE2 3.47Å; F328-F332 HydrophobicContact CZ-CE2 3.47Å; F328-F332 VanDerWaalsContact CZ-CE2 3.47Å; F328-F332 AromaticContact CZ-CZ 3.91Å; F328-F332 HydrophobicContact CZ-CZ 3.91Å; F328-F332 WeakPolarHBondContact O-CD2 3.26Å; V329-F332 WeakPolarHBondContact O-CB 3.38Å; V329-F332 PolarHBondContact O-N 3.27Å; V329-F332 VanDerWaalsContact O-N 3.07Å; A330-F332 VanDerWaalsContact C-N 3.35Å; A330-F332 PolarHBondContact O-N 3.46Å; F332-I334 VanDerWaalsContact C-N 3.34Å; F332-I334 PolarHBondContact O-N 2.88Å; F332-S336 WeakPolarHBondContact O-CB 3.37Å; F332-S336 PolarHBondContact O-N 2.91Å; F332-S336 PolarHBondContact O-OG 3.11Å
333	A	92.2	Very high	92	Very high	2 Å²	2	20.4 Å²	20.4	2%	0.017	11%	0.107	C	C	.	.	H	α-helix	trans	-61.4	-42.7	179.9	0	0	0	0	0	111.6	L250 L251 V329 A330 S336 V337	L250-A333 HydrophobicContact CB-CB 4.41Å; L251-A333 HydrophobicContact CB-CB 4.19Å; L251-A333 HydrophobicContact CD1-CB 4.45Å; V329-A333 PolarHBondContact O-N 3.34Å; A330-A333 PolarHBondContact O-N 2.94Å; A330-A333 VanDerWaalsContact O-N 3.15Å; A333-S336 PolarHBondContact O-OG 3.43Å; A333-S336 VanDerWaalsContact O-OG 3.05Å; A333-V337 WeakPolarHBondContact O-CG2 3.48Å
334	I	90.3	Very high	91.4	Very high	11 Å²	11	24.6 Å²	24.6	6%	0.056	13%	0.126	C	C	.	.	H	α-helix	trans	-73.8	-51.2	-179.7	-64.7	-58.7	0	0	0	111.9	V58 A330 F332 S336 V337 L338 L359 Y364	V58-I334 HydrophobicContact CG1-CD1 3.79Å; V58-I334 HydrophobicContact CG1-CG1 3.99Å; V58-I334 WeakPolarHBondContact O-CG1 3.48Å; A330-I334 WeakPolarHBondContact O-CG1 3.25Å; A330-I334 PolarHBondContact O-N 2.76Å; F332-I334 VanDerWaalsContact C-N 3.34Å; F332-I334 PolarHBondContact O-N 2.88Å; I334-S336 VanDerWaalsContact C-N 3.32Å; I334-S336 PolarHBondContact O-N 2.8Å; I334-V337 PolarHBondContact O-N 3.36Å; I334-L338 HydrophobicContact CG2-CD1 4Å; I334-L338 HydrophobicContact CG2-CG 4.32Å; I334-L338 WeakPolarHBondContact O-CG 3.23Å; I334-L338 PolarHBondContact O-N 3.37Å; I334-L359 HydrophobicContact CG2-CD2 4.08Å; I334-Y364 HydrophobicContact CD1-CD2 4.08Å; I334-Y364 HydrophobicContact CD1-CE2 4.23Å
335	F	91.6	Very high	90.5	Very high	2 Å²	2	25.3 Å²	25.3	1%	0.009	13%	0.128	C	C	.	.	H	α-helix	trans	-69.8	-28.6	-175.8	-87.6	-97.1	0	0	0	113.2	P62 Y66 G263 Y267 G331 V337 L338 G339	P62-F335 HydrophobicContact CB-CD2 3.8Å; P62-F335 HydrophobicContact CB-CE2 3.47Å; P62-F335 VanDerWaalsContact CB-CE2 3.47Å; P62-F335 VanDerWaalsContact O-CE2 3.3Å; P62-F335 WeakPolarHBondContact O-CE2 3.46Å; Y66-F335 VanDerWaalsContact CB-CZ 3.42Å; Y66-F335 HydrophobicContact CD1-CZ 4.4Å; Y66-F335 HydrophobicContact CD2-CE1 4.49Å; Y66-F335 HydrophobicContact CG-CE1 4.03Å; Y66-F335 HydrophobicContact CG-CZ 4.02Å; G263-F335 VanDerWaalsContact CA-O 3.26Å; G263-F335 WeakPolarHBondContact CA-O 3.43Å; G263-F335 WeakPolarHBondContact O-CD1 3.33Å; Y267-F335 HydrophobicContact CD2-CD2 4.13Å; Y267-F335 HydrophobicContact CD2-CE2 4.28Å; Y267-F335 HydrophobicContact CG-CB 4.43Å; Y267-F335 HydrophobicContact CG-CD2 4.12Å; Y267-F335 HydrophobicContact CG-CG 4.19Å; G331-F335 WeakPolarHBondContact O-CB 3.22Å; G331-F335 PolarHBondContact O-N 2.98Å; F335-V337 VanDerWaalsContact C-N 3.34Å; F335-L338 HydrophobicContact CD1-CD1 4.45Å; F335-L338 HydrophobicContact CE1-CD1 4.48Å; F335-L338 PolarHBondContact O-N 2.93Å; F335-G339 PolarHBondContact O-N 3.09Å
336	S	93.4	Very high	89.9	Confident	0 Å²	0	31 Å²	31	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-63.2	-40.9	172	57.7	0	0	0	0	112.1	G254 F332 A333 I334 G339 F340	G254-S336 VanDerWaalsContact C-CB 3.46Å; G254-S336 VanDerWaalsContact C-OG 3.32Å; G254-S336 VanDerWaalsContact CA-OG 3.31Å; G254-S336 WeakPolarHBondContact CA-OG 3.31Å; F332-S336 WeakPolarHBondContact O-CB 3.37Å; F332-S336 PolarHBondContact O-N 2.91Å; F332-S336 PolarHBondContact O-OG 3.11Å; A333-S336 PolarHBondContact O-OG 3.43Å; A333-S336 VanDerWaalsContact O-OG 3.05Å; I334-S336 VanDerWaalsContact C-N 3.32Å; I334-S336 PolarHBondContact O-N 2.8Å; S336-G339 PolarHBondContact O-N 2.86Å; S336-F340 PolarHBondContact O-N 2.81Å; S336-F340 VanDerWaalsContact O-N 3.1Å
337	V	89.3	Confident	89.3	Confident	3 Å²	3	33 Å²	33	2%	0.018	16%	0.162	C	C	.	.	H	α-helix	trans	-69.8	-40	175.3	175.4	0	0	0	0	111.9	L257 A333 I334 F335 G339 F340 M341 Y364 A367 M371	L257-V337 HydrophobicContact CD1-CG2 4.45Å; A333-V337 WeakPolarHBondContact O-CG2 3.48Å; I334-V337 PolarHBondContact O-N 3.36Å; F335-V337 VanDerWaalsContact C-N 3.34Å; V337-G339 VanDerWaalsContact C-N 3.34Å; V337-F340 WeakPolarHBondContact O-CB 3.27Å; V337-F340 PolarHBondContact O-N 3.41Å; V337-M341 PolarHBondContact O-N 2.88Å; V337-Y364 HydrophobicContact CG1-CE2 4.49Å; V337-A367 HydrophobicContact CG1-CB 3.33Å; V337-M371 HydrophobicContact CG1-CE 3.88Å; V337-M371 HydrophobicContact CG2-CE 4.22Å
338	L	88.8	Confident	88.7	Confident	5 Å²	5	37 Å²	37	3%	0.026	19%	0.188	C	C	.	.	H	α-helix	trans	-64.4	-38.6	174	-68.3	176.5	0	0	0	112.3	I334 F335 M341 A342 L359 A363	I334-L338 HydrophobicContact CG2-CD1 4Å; I334-L338 HydrophobicContact CG2-CG 4.32Å; I334-L338 WeakPolarHBondContact O-CG 3.23Å; I334-L338 PolarHBondContact O-N 3.37Å; F335-L338 HydrophobicContact CD1-CD1 4.45Å; F335-L338 HydrophobicContact CE1-CD1 4.48Å; F335-L338 PolarHBondContact O-N 2.93Å; L338-M341 WeakPolarHBondContact O-CB 3.35Å; L338-M341 PolarHBondContact O-N 2.74Å; L338-A342 WeakPolarHBondContact O-CB 3.36Å; L338-A342 PolarHBondContact O-N 3.19Å; L338-L359 HydrophobicContact CD1-CD1 4.04Å; L338-L359 HydrophobicContact CD2-CD1 4.26Å; L338-A363 HydrophobicContact CD2-CB 4.01Å
339	G	91.2	Very high	88.2	Confident	1 Å²	1	33.7 Å²	33.7	1%	0.01	17%	0.174	C	C	.	.	H	α-helix	trans	-62.5	-42.5	175.7	0	0	0	0	0	112.1	G259 F335 S336 V337 M341 A342 Y343	G259-G339 CarbonylContact O-C 3.39Å; F335-G339 PolarHBondContact O-N 3.09Å; S336-G339 PolarHBondContact O-N 2.86Å; V337-G339 VanDerWaalsContact C-N 3.34Å; G339-M341 VanDerWaalsContact C-N 3.35Å; G339-A342 PolarHBondContact O-N 3.44Å; G339-Y343 WeakPolarHBondContact O-CB 3.46Å; G339-Y343 PolarHBondContact O-N 3.17Å
340	F	89	Confident	87.5	Confident	11 Å²	11	35.3 Å²	35.3	5%	0.048	18%	0.177	C	C	.	.	H	α-helix	trans	-58.1	-46.4	169.6	166	-108.6	0	0	0	112.3	L257 P258 S336 V337 A342 Y343 E344 M370	L257-F340 HydrophobicContact CB-CB 3.74Å; L257-F340 HydrophobicContact CB-CD2 3.79Å; L257-F340 HydrophobicContact CB-CG 3.78Å; L257-F340 HydrophobicContact CD1-CB 3.96Å; L257-F340 HydrophobicContact CD1-CD1 3.77Å; L257-F340 HydrophobicContact CD1-CD2 4.41Å; L257-F340 HydrophobicContact CD1-CE1 4.36Å; L257-F340 HydrophobicContact CD1-CG 3.78Å; L257-F340 HydrophobicContact CD2-CD1 4.41Å; L257-F340 HydrophobicContact CD2-CD2 4.08Å; L257-F340 HydrophobicContact CD2-CE1 4.38Å; L257-F340 HydrophobicContact CD2-CE2 4.05Å; L257-F340 HydrophobicContact CD2-CG 4.25Å; L257-F340 HydrophobicContact CD2-CZ 4.2Å; L257-F340 HydrophobicContact CG-CB 4.42Å; L257-F340 HydrophobicContact CG-CD1 4.48Å; L257-F340 HydrophobicContact CG-CD2 4.31Å; L257-F340 HydrophobicContact CG-CG 4.15Å; P258-F340 HydrophobicContact CG-CD2 3.74Å; P258-F340 HydrophobicContact CG-CE2 3.84Å; P258-F340 WeakPolarHBondContact O-CA 3.49Å; P258-F340 WeakPolarHBondContact O-CB 3.2Å; P258-F340 WeakPolarHBondContact O-CD2 3.37Å; S336-F340 PolarHBondContact O-N 2.81Å; S336-F340 VanDerWaalsContact O-N 3.1Å; V337-F340 WeakPolarHBondContact O-CB 3.27Å; V337-F340 PolarHBondContact O-N 3.41Å; F340-A342 VanDerWaalsContact C-N 3.33Å; F340-A342 PolarHBondContact O-N 3.18Å; F340-Y343 WeakPolarHBondContact O-CB 3.12Å; F340-Y343 PolarHBondContact O-N 2.86Å; F340-E344 HydrophobicContact CD2-CG 3.76Å; F340-E344 HydrophobicContact CE1-CG 4.27Å; F340-E344 HydrophobicContact CE2-CG 3.27Å; F340-E344 WeakPolarHBondContact CE2-OE1 3.3Å; F340-E344 HydrophobicContact CG-CG 4.45Å; F340-E344 HydrophobicContact CZ-CG 3.57Å; F340-E344 WeakPolarHBondContact O-CG 3.49Å; F340-E344 PolarHBondContact O-N 3.4Å; F340-M370 HydrophobicContact CE1-CB 3.82Å; F340-M370 HydrophobicContact CE1-SD 4.15Å; F340-M370 HydrophobicContact CZ-CB 4.07Å
341	M	85.9	Confident	86.7	Confident	3 Å²	3	38.8 Å²	38.8	2%	0.015	21%	0.206	C	C	.	.	H	α-helix	trans	-61.4	-42.4	-179.9	-156.5	-178.3	87.6	0	0	112.3	V337 L338 G339 Q345 V352 K366 A367 M370	V337-M341 PolarHBondContact O-N 2.88Å; L338-M341 WeakPolarHBondContact O-CB 3.35Å; L338-M341 PolarHBondContact O-N 2.74Å; G339-M341 VanDerWaalsContact C-N 3.35Å; M341-Q345 VanDerWaalsContact O-CB 3.32Å; M341-Q345 WeakPolarHBondContact O-CB 3.21Å; M341-Q345 WeakPolarHBondContact O-CG 3.1Å; M341-Q345 PolarHBondContact O-N 3.12Å; M341-V352 HydrophobicContact CE-CB 3.26Å; M341-V352 HydrophobicContact CE-CG1 3.14Å; M341-V352 HydrophobicContact CE-CG2 4.24Å; M341-K366 HydrophobicContact CE-CD 3.81Å; M341-K366 HydrophobicContact SD-CB 3.89Å; M341-K366 HydrophobicContact SD-CD 3.75Å; M341-K366 HydrophobicContact SD-CG 3.85Å; M341-A367 HydrophobicContact CB-CB 4.4Å; M341-A367 HydrophobicContact CG-CB 4.35Å; M341-A367 HydrophobicContact SD-CB 4.09Å; M341-M370 HydrophobicContact CG-CE 3.44Å; M341-M370 VanDerWaalsContact CG-CE 3.44Å; M341-M370 HydrophobicContact CG-SD 4.06Å; M341-M370 HydrophobicContact SD-CE 4.08Å
342	A	87.1	Confident	85.9	Confident	6 Å²	6	39 Å²	39	5%	0.05	21%	0.208	C	C	.	.	H	α-helix	trans	-65.6	-39.4	176.3	0	0	0	0	0	112.3	L338 G339 F340 N346 V347 I349 V352	L338-A342 WeakPolarHBondContact O-CB 3.36Å; L338-A342 PolarHBondContact O-N 3.19Å; G339-A342 PolarHBondContact O-N 3.44Å; F340-A342 VanDerWaalsContact C-N 3.33Å; F340-A342 PolarHBondContact O-N 3.18Å; A342-N346 WeakPolarHBondContact O-CA 3.49Å; A342-N346 PolarHBondContact O-N 2.72Å; A342-V347 WeakPolarHBondContact CB-O 3.28Å; A342-V347 PolarHBondContact O-N 3.15Å; A342-V347 VanDerWaalsContact O-N 3.12Å; A342-I349 HydrophobicContact CB-CB 4.38Å; A342-I349 HydrophobicContact CB-CD1 4.26Å; A342-I349 HydrophobicContact CB-CG1 3.32Å; A342-V352 HydrophobicContact CB-CG2 4.2Å
343	Y	87.3	Confident	85	Confident	138 Å²	138	37.5 Å²	37.5	54%	0.541	20%	0.204	S	C	.	.	H	α-helix	trans	-63.6	-49.6	175.9	177	-94.5	0	0	0	112.1	P258 G339 F340 Q345 N346	P258-Y343 HydrophobicContact CB-CD1 3.95Å; P258-Y343 HydrophobicContact CB-CE1 3.75Å; P258-Y343 HydrophobicContact CG-CD1 4.22Å; P258-Y343 HydrophobicContact CG-CE1 4.2Å; G339-Y343 WeakPolarHBondContact O-CB 3.46Å; G339-Y343 PolarHBondContact O-N 3.17Å; F340-Y343 WeakPolarHBondContact O-CB 3.12Å; F340-Y343 PolarHBondContact O-N 2.86Å; Y343-Q345 VanDerWaalsContact C-N 3.32Å; Y343-Q345 PolarHBondContact O-N 3.22Å; Y343-N346 PolarHBondContact O-N 2.98Å
344	E	82.9	Confident	84	Confident	88 Å²	88	40.3 Å²	40.3	41%	0.411	22%	0.217	S	C	.	.	H	α-helix	trans	-64.9	-35.3	179	-71.1	-64.2	144.3	0	0	112.5	F340 M370	F340-E344 HydrophobicContact CD2-CG 3.76Å; F340-E344 HydrophobicContact CE1-CG 4.27Å; F340-E344 HydrophobicContact CE2-CG 3.27Å; F340-E344 WeakPolarHBondContact CE2-OE1 3.3Å; F340-E344 HydrophobicContact CG-CG 4.45Å; F340-E344 HydrophobicContact CZ-CG 3.57Å; F340-E344 WeakPolarHBondContact O-CG 3.49Å; F340-E344 PolarHBondContact O-N 3.4Å; E344-M370 HydrophobicContact CB-SD 4.29Å
345	Q	77.9	Confident	83	Confident	33 Å²	33	43.1 Å²	43.1	15%	0.154	24%	0.237	C	C	.	.	H	α-helix	trans	-86.6	-8.4	179.5	-71.9	175.4	3.7	0	0	113.6	Y169 M341 Y343 V347	Y169-Q345 VanDerWaalsContact OH-CG 3.27Å; Y169-Q345 WeakPolarHBondContact OH-CG 3.44Å; Y169-Q345 PolarHBondContact OH-NE2 3.23Å; M341-Q345 VanDerWaalsContact O-CB 3.32Å; M341-Q345 WeakPolarHBondContact O-CB 3.21Å; M341-Q345 WeakPolarHBondContact O-CG 3.1Å; M341-Q345 PolarHBondContact O-N 3.12Å; Y343-Q345 VanDerWaalsContact C-N 3.32Å; Y343-Q345 PolarHBondContact O-N 3.22Å; Q345-V347 HydrophobicContact CB-CG1 4.27Å; Q345-V347 HydrophobicContact CB-CG2 3.76Å; Q345-V347 PolarHBondContact O-N 3.27Å
346	N	81.9	Confident	82.3	Confident	152 Å²	152	44.1 Å²	44.1	81%	0.813	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.3	42.4	-173.5	-163	29.7	0	0	0	112.7	A342 Y343	A342-N346 WeakPolarHBondContact O-CA 3.49Å; A342-N346 PolarHBondContact O-N 2.72Å; Y343-N346 PolarHBondContact O-N 2.98Å
347	V	81.9	Confident	81.7	Confident	54 Å²	54	44.9 Å²	44.9	33%	0.327	25%	0.253	S	S	.	.			trans	-120	155.3	178.2	-63.8	0	0	0	0	110.9	A342 Q345 V352	A342-V347 WeakPolarHBondContact CB-O 3.28Å; A342-V347 PolarHBondContact O-N 3.15Å; A342-V347 VanDerWaalsContact O-N 3.12Å; Q345-V347 HydrophobicContact CB-CG1 4.27Å; Q345-V347 HydrophobicContact CB-CG2 3.76Å; Q345-V347 PolarHBondContact O-N 3.27Å; V347-V352 HydrophobicContact CG2-CG1 3.73Å
348	P	83.4	Confident	81.5	Confident	84 Å²	84	45.2 Å²	45.2	55%	0.545	26%	0.257	S	S	.	.			trans	-60	147.3	171.9	-20.8	32.6	0	0	0	112.1	E350 A351	P348-E350 VanDerWaalsContact CB-OE2 3.24Å; P348-E350 WeakPolarHBondContact CB-OE2 3.46Å; P348-E350 PolarHBondContact O-N 3.18Å; P348-A351 WeakPolarHBondContact O-CB 3.48Å; P348-A351 PolarHBondContact O-N 3.11Å
349	I	82.8	Confident	81.2	Confident	6 Å²	6	45.3 Å²	45.3	3%	0.031	26%	0.258	C	S	.	.	G	3₁₀ helix	trans	-64.3	-28.2	-178.8	-74.3	164.6	0	0	0	111.6	D262 F266 A342 A351 V352 A353	D262-I349 HydrophobicContact CB-CD1 4.03Å; F266-I349 HydrophobicContact CB-CD1 4.39Å; F266-I349 HydrophobicContact CB-CG2 4.21Å; F266-I349 HydrophobicContact CD1-CB 4.4Å; F266-I349 HydrophobicContact CD1-CG2 4.44Å; F266-I349 HydrophobicContact CD2-CB 3.98Å; F266-I349 HydrophobicContact CD2-CD1 3.16Å; F266-I349 HydrophobicContact CD2-CG1 4.06Å; F266-I349 HydrophobicContact CD2-CG2 4.35Å; F266-I349 HydrophobicContact CE2-CB 4.09Å; F266-I349 HydrophobicContact CE2-CD1 3.54Å; F266-I349 HydrophobicContact CE2-CG1 4.19Å; F266-I349 HydrophobicContact CG-CB 4.11Å; F266-I349 HydrophobicContact CG-CD1 3.94Å; F266-I349 HydrophobicContact CG-CG2 4.07Å; F266-I349 HydrophobicContact CZ-CB 4.35Å; A342-I349 HydrophobicContact CB-CB 4.38Å; A342-I349 HydrophobicContact CB-CD1 4.26Å; A342-I349 HydrophobicContact CB-CG1 3.32Å; I349-A351 PolarHBondContact O-N 3.3Å; I349-V352 HydrophobicContact CG2-CG2 4.44Å; I349-V352 WeakPolarHBondContact O-CG2 3.47Å; I349-V352 PolarHBondContact O-N 3.24Å; I349-V352 VanDerWaalsContact O-N 3.13Å; I349-A353 WeakPolarHBondContact O-CB 3.25Å; I349-A353 PolarHBondContact O-N 3.09Å; I349-A353 VanDerWaalsContact O-N 3.1Å
350	E	80.9	Confident	81	Confident	94 Å²	94	45.5 Å²	45.5	44%	0.439	26%	0.259	S	S	.	.	G	3₁₀ helix	trans	-52.1	-39	172	-67.7	56	-137	0	0	112.4	Y66 F266 P348 V352	Y66-E350 WeakPolarHBondContact OH-CG 3.41Å; Y66-E350 PolarHBondContact OH-OE1 3.35Å; F266-E350 WeakPolarHBondContact CE1-OE1 3.48Å; P348-E350 VanDerWaalsContact CB-OE2 3.24Å; P348-E350 WeakPolarHBondContact CB-OE2 3.46Å; P348-E350 PolarHBondContact O-N 3.18Å; E350-V352 PolarHBondContact O-N 2.84Å
351	A	75.9	Confident	81.2	Confident	73 Å²	73	45 Å²	45	60%	0.603	26%	0.257	S	S	*	.	G	3₁₀ helix	trans	-75.5	-12.8	-173.4	0	0	0	0	0	112.6	P348 I349	P348-A351 WeakPolarHBondContact O-CB 3.48Å; P348-A351 PolarHBondContact O-N 3.11Å; I349-A351 PolarHBondContact O-N 3.3Å
352	V	77.1	Confident	81.4	Confident	6 Å²	6	45.4 Å²	45.4	4%	0.036	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-115.3	-14	-176.3	-60.5	0	0	0	0	113.4	M341 A342 V347 I349 E350 E354	M341-V352 HydrophobicContact CE-CB 3.26Å; M341-V352 HydrophobicContact CE-CG1 3.14Å; M341-V352 HydrophobicContact CE-CG2 4.24Å; A342-V352 HydrophobicContact CB-CG2 4.2Å; V347-V352 HydrophobicContact CG2-CG1 3.73Å; I349-V352 HydrophobicContact CG2-CG2 4.44Å; I349-V352 WeakPolarHBondContact O-CG2 3.47Å; I349-V352 PolarHBondContact O-N 3.24Å; I349-V352 VanDerWaalsContact O-N 3.13Å; E350-V352 PolarHBondContact O-N 2.84Å; V352-E354 PolarHBondContact O-N 3.4Å; V352-E354 VanDerWaalsContact O-N 3.16Å
353	A	74.3	Confident	81.4	Confident	16 Å²	16	45.3 Å²	45.3	13%	0.132	26%	0.258	C	S	.	.			trans	-84.3	82.7	178.4	0	0	0	0	0	111	Y66 I349	Y66-A353 HydrophobicContact CD1-CB 4.46Å; Y66-A353 HydrophobicContact CE1-CB 4.18Å; I349-A353 WeakPolarHBondContact O-CB 3.25Å; I349-A353 PolarHBondContact O-N 3.09Å; I349-A353 VanDerWaalsContact O-N 3.1Å
354	E	71.1	Confident	81.4	Confident	60 Å²	60	39.3 Å²	39.3	28%	0.28	24%	0.235	S	C	.	.			trans	-76.7	157.8	173.5	-68.3	-169	-170.1	0	0	112.9	Y63 V352 G358 L359 I362	Y63-E354 WeakPolarHBondContact CD2-O 3.38Å; V352-E354 PolarHBondContact O-N 3.4Å; V352-E354 VanDerWaalsContact O-N 3.16Å; E354-G358 WeakPolarHBondContact OE2-CA 3.25Å; E354-L359 WeakPolarHBondContact O-CD1 3.14Å; E354-I362 WeakPolarHBondContact OE1-CG2 3.31Å; E354-I362 WeakPolarHBondContact OE2-CB 3.38Å; E354-I362 VanDerWaalsContact OE2-CD1 3.25Å; E354-I362 WeakPolarHBondContact OE2-CD1 3.43Å
355	S	70.2	Confident	81.7	Confident	70 Å²	70	35.2 Å²	35.2	49%	0.49	22%	0.215	S	C	.	.			trans	-101.3	146.4	179.5	72.7	0	0	0	0	112.4
356	G	75.6	Confident	82.2	Confident	24 Å²	24	35 Å²	35	25%	0.247	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	67.1	-139.8	171.1	0	0	0	0	0	112.7	G358 L359	G356-G358 PolarHBondContact O-N 3.29Å; G356-L359 PolarHBondContact O-N 3.47Å; G356-L359 VanDerWaalsContact O-N 3.13Å
357	P	81.8	Confident	82.4	Confident	16 Å²	16	27.8 Å²	27.8	10%	0.104	18%	0.176	C	C	.	.	H	α-helix	trans	-56.6	-31.3	-179.3	-27.7	36.6	0	0	0	114.4	W59 W138 W189 L359 A360 F361 M442 F445	W59-P357 HydrophobicContact CH2-CG 4.4Å; W59-P357 HydrophobicContact CZ3-CB 4.34Å; W138-P357 HydrophobicContact CZ3-CB 4.14Å; W138-P357 HydrophobicContact CZ3-CG 4.11Å; W189-P357 HydrophobicContact CZ2-CB 4.36Å; P357-L359 PolarHBondContact O-N 2.93Å; P357-A360 PolarHBondContact O-N 3.38Å; P357-A360 VanDerWaalsContact O-N 3.14Å; P357-F361 HydrophobicContact CB-CD2 4.02Å; P357-F361 HydrophobicContact CB-CE2 4.47Å; P357-F361 VanDerWaalsContact O-CD2 3.29Å; P357-F361 WeakPolarHBondContact O-CD2 3.26Å; P357-F361 PolarHBondContact O-N 3.25Å; P357-M442 HydrophobicContact CG-CE 4.26Å; P357-F445 HydrophobicContact CG-CE1 4.06Å; P357-F445 HydrophobicContact CG-CZ 4.49Å
358	G	84.1	Confident	82.7	Confident	9 Å²	9	25.2 Å²	25.2	9%	0.093	16%	0.16	C	C	.	.	H	α-helix	trans	-57.2	-33.5	178	0	0	0	0	0	113	E354 G356 A360 I362 A363	E354-G358 WeakPolarHBondContact OE2-CA 3.25Å; G356-G358 PolarHBondContact O-N 3.29Å; G358-A360 PolarHBondContact O-N 3.37Å; G358-I362 CarbonylContact O-C 3.47Å; G358-I362 VanDerWaalsContact O-CA 3.29Å; G358-I362 WeakPolarHBondContact O-CA 3.36Å; G358-I362 WeakPolarHBondContact O-CB 3.34Å; G358-I362 PolarHBondContact O-N 2.71Å; G358-A363 PolarHBondContact O-N 3.3Å
359	L	82.8	Confident	83	Confident	8 Å²	8	22.7 Å²	22.7	4%	0.042	14%	0.143	C	C	.	.	I	π-helix	trans	-64.8	-41.3	178.3	-165.7	70	0	0	0	112.8	W59 I334 L338 E354 G356 P357 A363 Y364	W59-L359 HydrophobicContact CB-CB 4.38Å; W59-L359 HydrophobicContact CB-CD2 4.02Å; W59-L359 VanDerWaalsContact O-CD2 3.27Å; W59-L359 WeakPolarHBondContact O-CD2 3.44Å; I334-L359 HydrophobicContact CG2-CD2 4.08Å; L338-L359 HydrophobicContact CD1-CD1 4.04Å; L338-L359 HydrophobicContact CD2-CD1 4.26Å; E354-L359 WeakPolarHBondContact O-CD1 3.14Å; G356-L359 PolarHBondContact O-N 3.47Å; G356-L359 VanDerWaalsContact O-N 3.13Å; P357-L359 PolarHBondContact O-N 2.93Å; L359-A363 HydrophobicContact CD1-CB 3.95Å; L359-Y364 WeakPolarHBondContact O-CB 3.34Å; L359-Y364 PolarHBondContact O-N 2.87Å
360	A	87.8	Confident	83	Confident	5 Å²	5	24.3 Å²	24.3	4%	0.041	15%	0.151	C	C	.	.	I	π-helix	trans	-87.5	-27.3	-179.5	0	0	0	0	0	114.1	W59 P357 G358 P365 F381 L385	W59-A360 HydrophobicContact CE3-CB 3.38Å; W59-A360 HydrophobicContact CZ3-CB 3.75Å; P357-A360 PolarHBondContact O-N 3.38Å; P357-A360 VanDerWaalsContact O-N 3.14Å; G358-A360 PolarHBondContact O-N 3.37Å; A360-P365 WeakPolarHBondContact O-CD 3.28Å; A360-P365 WeakPolarHBondContact O-CG 3.47Å; A360-F381 HydrophobicContact CB-CE1 4.46Å; A360-F381 HydrophobicContact CB-CZ 4.09Å; A360-F381 WeakPolarHBondContact O-CE1 3.28Å; A360-L385 HydrophobicContact CB-CD1 4Å
361	F	92.3	Very high	83.2	Confident	0 Å²	0	20.3 Å²	20.3	0%	0	13%	0.132	C	C	.	.	I	π-helix	trans	-105.3	-11.2	-175.4	-63.9	-70.4	0	0	0	114	W59 I135 W138 A139 Y142 W189 P357 F382	W59-F361 HydrophobicContact CH2-CE2 4.36Å; W59-F361 HydrophobicContact CZ3-CD2 4.28Å; W59-F361 AromaticContact CZ3-CE2 3.83Å; W59-F361 HydrophobicContact CZ3-CE2 3.83Å; I135-F361 HydrophobicContact CG2-CE2 4Å; I135-F361 HydrophobicContact CG2-CZ 4.06Å; W138-F361 HydrophobicContact CB-CD1 4.46Å; W138-F361 HydrophobicContact CB-CE1 3.78Å; W138-F361 HydrophobicContact CB-CE2 4.21Å; W138-F361 HydrophobicContact CB-CZ 3.64Å; W138-F361 HydrophobicContact CE3-CD2 4.37Å; W138-F361 AromaticContact CE3-CE2 3.83Å; W138-F361 HydrophobicContact CE3-CE2 3.83Å; W138-F361 HydrophobicContact CE3-CZ 4.34Å; A139-F361 HydrophobicContact CB-CE1 4.35Å; A139-F361 HydrophobicContact CB-CZ 4.36Å; Y142-F361 AromaticContact CD2-CD1 3.64Å; Y142-F361 HydrophobicContact CD2-CD1 3.64Å; Y142-F361 HydrophobicContact CD2-CE1 4.04Å; Y142-F361 HydrophobicContact CE2-CB 4.22Å; Y142-F361 AromaticContact CE2-CD1 3.53Å; Y142-F361 HydrophobicContact CE2-CD1 3.53Å; Y142-F361 HydrophobicContact CE2-CE1 4.32Å; Y142-F361 HydrophobicContact CE2-CG 4.24Å; Y142-F361 HydrophobicContact CG-CD1 4.25Å; Y142-F361 PolarHBondContact OH-O 2.74Å; W189-F361 HydrophobicContact CD2-CB 4.11Å; W189-F361 HydrophobicContact CE3-CB 3.56Å; W189-F361 HydrophobicContact CE3-CG 4.13Å; W189-F361 HydrophobicContact CH2-CB 3.96Å; W189-F361 AromaticContact CH2-CD2 3.77Å; W189-F361 HydrophobicContact CH2-CD2 3.77Å; W189-F361 HydrophobicContact CH2-CE2 4.45Å; W189-F361 AromaticContact CH2-CG 3.88Å; W189-F361 HydrophobicContact CH2-CG 3.88Å; W189-F361 HydrophobicContact CZ2-CB 4.49Å; W189-F361 HydrophobicContact CZ3-CB 3.47Å; W189-F361 VanDerWaalsContact CZ3-CB 3.47Å; W189-F361 AromaticContact CZ3-CD1 3.97Å; W189-F361 HydrophobicContact CZ3-CD1 3.97Å; W189-F361 AromaticContact CZ3-CD2 3.91Å; W189-F361 HydrophobicContact CZ3-CD2 3.91Å; W189-F361 AromaticContact CZ3-CG 3.51Å; W189-F361 HydrophobicContact CZ3-CG 3.51Å; P357-F361 HydrophobicContact CB-CD2 4.02Å; P357-F361 HydrophobicContact CB-CE2 4.47Å; P357-F361 VanDerWaalsContact O-CD2 3.29Å; P357-F361 WeakPolarHBondContact O-CD2 3.26Å; P357-F361 PolarHBondContact O-N 3.25Å; F361-F382 AromaticContact CD1-CE1 3.83Å; F361-F382 HydrophobicContact CD1-CE1 3.83Å; F361-F382 HydrophobicContact CE1-CD1 4.34Å; F361-F382 AromaticContact CE1-CE1 3.87Å; F361-F382 HydrophobicContact CE1-CE1 3.87Å
362	I	89.5	Confident	83.6	Confident	12 Å²	12	21 Å²	21	6%	0.062	13%	0.131	C	C	.	.	I	π-helix	trans	-121.6	-63.8	176.2	-56.7	169	0	0	0	111.1	V185 I186 W189 E354 G358 Y364 P365 K366	V185-I362 HydrophobicContact CG1-CG2 4.23Å; V185-I362 WeakPolarHBondContact CG1-O 3.27Å; I186-I362 HydrophobicContact CG1-CG2 3.74Å; W189-I362 HydrophobicContact CB-CD1 4.27Å; W189-I362 HydrophobicContact CB-CG1 3.91Å; W189-I362 HydrophobicContact CG-CD1 4Å; W189-I362 HydrophobicContact CG-CG1 3.93Å; E354-I362 WeakPolarHBondContact OE1-CG2 3.31Å; E354-I362 WeakPolarHBondContact OE2-CB 3.38Å; E354-I362 VanDerWaalsContact OE2-CD1 3.25Å; E354-I362 WeakPolarHBondContact OE2-CD1 3.43Å; G358-I362 CarbonylContact O-C 3.47Å; G358-I362 VanDerWaalsContact O-CA 3.29Å; G358-I362 WeakPolarHBondContact O-CA 3.36Å; G358-I362 WeakPolarHBondContact O-CB 3.34Å; G358-I362 PolarHBondContact O-N 2.71Å; I362-Y364 PolarHBondContact O-N 2.71Å; I362-P365 WeakPolarHBondContact O-CD 3.12Å; I362-K366 VanDerWaalsContact O-CB 3.26Å; I362-K366 WeakPolarHBondContact O-CB 3.14Å; I362-K366 PolarHBondContact O-N 2.72Å; I362-K366 VanDerWaalsContact O-N 3.13Å
363	A	87.4	Confident	84.2	Confident	3 Å²	3	27 Å²	27	3%	0.025	16%	0.162	C	C	.	.	I	π-helix	trans	-64.9	-46.9	-172.4	0	0	0	0	0	112.5	L338 G358 L359 K366 A367	L338-A363 HydrophobicContact CD2-CB 4.01Å; G358-A363 PolarHBondContact O-N 3.3Å; L359-A363 HydrophobicContact CD1-CB 3.95Å; A363-K366 WeakPolarHBondContact O-CB 3.35Å; A363-K366 PolarHBondContact O-N 3.16Å; A363-A367 PolarHBondContact O-N 3.02Å
364	Y	86.8	Confident	85	Confident	13 Å²	13	27.2 Å²	27.2	5%	0.051	16%	0.162	C	C	.	.	H	α-helix	trans	-68.2	-47.5	-178.9	-166.5	-83.8	0	0	0	113.5	L250 I334 V337 L359 I362 K366 A367 V368 F381	L250-Y364 HydrophobicContact CD1-CE2 4.45Å; L250-Y364 WeakPolarHBondContact CD1-OH 3.04Å; L250-Y364 WeakPolarHBondContact CD2-OH 3.35Å; I334-Y364 HydrophobicContact CD1-CD2 4.08Å; I334-Y364 HydrophobicContact CD1-CE2 4.23Å; V337-Y364 HydrophobicContact CG1-CE2 4.49Å; L359-Y364 WeakPolarHBondContact O-CB 3.34Å; L359-Y364 PolarHBondContact O-N 2.87Å; I362-Y364 PolarHBondContact O-N 2.71Å; Y364-K366 PolarHBondContact O-N 3.08Å; Y364-A367 PolarHBondContact O-N 3.31Å; Y364-V368 HydrophobicContact CD1-CG2 3.66Å; Y364-V368 HydrophobicContact CE1-CG2 3.26Å; Y364-V368 WeakPolarHBondContact O-CG2 3.34Å; Y364-V368 PolarHBondContact O-N 3.19Å; Y364-F381 HydrophobicContact CD1-CB 4.32Å; Y364-F381 AromaticContact CD1-CD1 3.39Å; Y364-F381 HydrophobicContact CD1-CD1 3.39Å; Y364-F381 AromaticContact CD1-CD2 3.55Å; Y364-F381 HydrophobicContact CD1-CD2 3.55Å; Y364-F381 AromaticContact CD1-CE1 3.35Å; Y364-F381 HydrophobicContact CD1-CE1 3.35Å; Y364-F381 AromaticContact CD1-CE2 3.52Å; Y364-F381 HydrophobicContact CD1-CE2 3.52Å; Y364-F381 AromaticContact CD1-CG 3.48Å; Y364-F381 HydrophobicContact CD1-CG 3.48Å; Y364-F381 VanDerWaalsContact CD1-CG 3.48Å; Y364-F381 AromaticContact CD1-CZ 3.41Å; Y364-F381 HydrophobicContact CD1-CZ 3.41Å; Y364-F381 VanDerWaalsContact CD1-CZ 3.41Å; Y364-F381 HydrophobicContact CD2-CD2 4.37Å; Y364-F381 AromaticContact CD2-CE2 3.88Å; Y364-F381 HydrophobicContact CD2-CE2 3.88Å; Y364-F381 HydrophobicContact CD2-CZ 4.14Å; Y364-F381 HydrophobicContact CE1-CB 3.59Å; Y364-F381 AromaticContact CE1-CD1 3.57Å; Y364-F381 HydrophobicContact CE1-CD1 3.57Å; Y364-F381 AromaticContact CE1-CD2 3.14Å; Y364-F381 HydrophobicContact CE1-CD2 3.14Å; Y364-F381 AromaticContact CE1-CE1 3.95Å; Y364-F381 HydrophobicContact CE1-CE1 3.95Å; Y364-F381 AromaticContact CE1-CE2 3.57Å; Y364-F381 HydrophobicContact CE1-CE2 3.57Å; Y364-F381 AromaticContact CE1-CG 3.12Å; Y364-F381 HydrophobicContact CE1-CG 3.12Å; Y364-F381 AromaticContact CE1-CZ 3.95Å; Y364-F381 HydrophobicContact CE1-CZ 3.95Å; Y364-F381 HydrophobicContact CE2-CD2 4.04Å; Y364-F381 AromaticContact CE2-CE2 3.92Å; Y364-F381 HydrophobicContact CE2-CE2 3.92Å; Y364-F381 HydrophobicContact CG-CD1 4.34Å; Y364-F381 HydrophobicContact CG-CD2 4.15Å; Y364-F381 AromaticContact CG-CE1 3.88Å; Y364-F381 HydrophobicContact CG-CE1 3.88Å; Y364-F381 AromaticContact CG-CE2 3.67Å; Y364-F381 HydrophobicContact CG-CE2 3.67Å; Y364-F381 HydrophobicContact CG-CG 4.45Å; Y364-F381 AromaticContact CG-CZ 3.51Å; Y364-F381 HydrophobicContact CG-CZ 3.51Å; Y364-F381 AromaticContact CZ-CD2 3.4Å; Y364-F381 VanDerWaalsContact CZ-CD2 3.4Å; Y364-F381 AromaticContact CZ-CE2 3.76Å; Y364-F381 AromaticContact CZ-CG 3.87Å
365	P	90.6	Very high	86	Confident	1 Å²	1	25.7 Å²	25.7	1%	0.006	16%	0.158	C	C	.	.	H	α-helix	trans	-61.3	-32.9	177.5	-26.7	40	0	0	0	112.1	Y142 W153 V185 A360 I362 V368 T369 F382	Y142-P365 HydrophobicContact CE1-CB 4.47Å; Y142-P365 HydrophobicContact CE1-CG 4.23Å; W153-P365 HydrophobicContact CG-CB 4.5Å; W153-P365 HydrophobicContact CZ2-CB 4.38Å; W153-P365 PolarHBondContact NE1-O 2.91Å; V185-P365 HydrophobicContact CG1-CB 4.3Å; A360-P365 WeakPolarHBondContact O-CD 3.28Å; A360-P365 WeakPolarHBondContact O-CG 3.47Å; I362-P365 WeakPolarHBondContact O-CD 3.12Å; P365-V368 PolarHBondContact O-N 3.24Å; P365-T369 WeakPolarHBondContact O-CG2 3.29Å; P365-T369 PolarHBondContact O-N 3.33Å; P365-F382 HydrophobicContact CB-CZ 4.45Å; P365-F382 HydrophobicContact CG-CE2 4.42Å; P365-F382 HydrophobicContact CG-CZ 3.69Å
366	K	88.1	Confident	87	Confident	30 Å²	30	26.9 Å²	26.9	13%	0.13	16%	0.158	C	C	.	.	H	α-helix	trans	-61.1	-49.5	170.8	-165.5	-179.6	-168.3	-157.2	0	111.7	V185 M341 I362 A363 Y364 V368 T369 M370	V185-K366 HydrophobicContact CB-CB 4.42Å; V185-K366 HydrophobicContact CG2-CB 3.82Å; V185-K366 HydrophobicContact CG2-CG 3.98Å; M341-K366 HydrophobicContact CE-CD 3.81Å; M341-K366 HydrophobicContact SD-CB 3.89Å; M341-K366 HydrophobicContact SD-CD 3.75Å; M341-K366 HydrophobicContact SD-CG 3.85Å; I362-K366 VanDerWaalsContact O-CB 3.26Å; I362-K366 WeakPolarHBondContact O-CB 3.14Å; I362-K366 PolarHBondContact O-N 2.72Å; I362-K366 VanDerWaalsContact O-N 3.13Å; A363-K366 WeakPolarHBondContact O-CB 3.35Å; A363-K366 PolarHBondContact O-N 3.16Å; Y364-K366 PolarHBondContact O-N 3.08Å; K366-V368 VanDerWaalsContact C-N 3.28Å; K366-V368 PolarHBondContact O-N 2.95Å; K366-T369 PolarHBondContact O-N 2.92Å; K366-T369 PolarHBondContact O-OG1 2.91Å; K366-M370 HydrophobicContact CG-CE 3.96Å; K366-M370 WeakPolarHBondContact O-CE 3.33Å
367	A	86.2	Confident	87.7	Confident	0 Å²	0	28 Å²	28	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-63.9	-34.2	178.6	0	0	0	0	0	112.8	V337 M341 A363 Y364 T369 M370	V337-A367 HydrophobicContact CG1-CB 3.33Å; M341-A367 HydrophobicContact CB-CB 4.4Å; M341-A367 HydrophobicContact CG-CB 4.35Å; M341-A367 HydrophobicContact SD-CB 4.09Å; A363-A367 PolarHBondContact O-N 3.02Å; Y364-A367 PolarHBondContact O-N 3.31Å; A367-T369 PolarHBondContact O-N 2.86Å; A367-M370 PolarHBondContact O-N 3.05Å
368	V	88.6	Confident	88.3	Confident	0 Å²	0	27.2 Å²	27.2	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-66.5	-33.9	177.8	168.6	0	0	0	0	112.6	L151 Y364 P365 K366 M370 M371 S374 W377 A378	L151-V368 HydrophobicContact CD1-CG1 4.18Å; Y364-V368 HydrophobicContact CD1-CG2 3.66Å; Y364-V368 HydrophobicContact CE1-CG2 3.26Å; Y364-V368 WeakPolarHBondContact O-CG2 3.34Å; Y364-V368 PolarHBondContact O-N 3.19Å; P365-V368 PolarHBondContact O-N 3.24Å; K366-V368 VanDerWaalsContact C-N 3.28Å; K366-V368 PolarHBondContact O-N 2.95Å; V368-M370 PolarHBondContact O-N 3.38Å; V368-M371 PolarHBondContact O-N 2.96Å; V368-S374 WeakPolarHBondContact CG1-O 3.3Å; V368-S374 WeakPolarHBondContact O-CB 3.1Å; V368-W377 HydrophobicContact CG1-CB 3.79Å; V368-W377 HydrophobicContact CG2-CB 4.47Å; V368-A378 HydrophobicContact CG1-CB 3.94Å
369	T	89.4	Confident	88.8	Confident	31 Å²	31	27.9 Å²	27.9	19%	0.19	15%	0.153	C	C	.	.	H	α-helix	trans	-64.6	-22.1	179.7	67.8	0	0	0	0	112.7	L151 A154 P365 K366 A367 M371	L151-T369 HydrophobicContact CD1-CG2 4.08Å; A154-T369 HydrophobicContact CB-CG2 3.96Å; P365-T369 WeakPolarHBondContact O-CG2 3.29Å; P365-T369 PolarHBondContact O-N 3.33Å; K366-T369 PolarHBondContact O-N 2.92Å; K366-T369 PolarHBondContact O-OG1 2.91Å; A367-T369 PolarHBondContact O-N 2.86Å; T369-M371 VanDerWaalsContact C-N 3.33Å
370	M	83.4	Confident	89.2	Confident	40 Å²	40	29.5 Å²	29.5	20%	0.197	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84	-7.5	177.2	-54.7	172	-152.2	0	0	113.3	Y169 F340 M341 E344 K366 A367 V368	Y169-M370 HydrophobicContact CE1-CG 4.4Å; Y169-M370 HydrophobicContact CE1-SD 4.5Å; Y169-M370 HydrophobicContact CE2-CE 4.05Å; Y169-M370 HydrophobicContact CE2-CG 4.36Å; Y169-M370 WeakPolarHBondContact OH-CE 3.4Å; Y169-M370 PolarHBondContact OH-SD 2.88Å; F340-M370 HydrophobicContact CE1-CB 3.82Å; F340-M370 HydrophobicContact CE1-SD 4.15Å; F340-M370 HydrophobicContact CZ-CB 4.07Å; M341-M370 HydrophobicContact CG-CE 3.44Å; M341-M370 VanDerWaalsContact CG-CE 3.44Å; M341-M370 HydrophobicContact CG-SD 4.06Å; M341-M370 HydrophobicContact SD-CE 4.08Å; E344-M370 HydrophobicContact CB-SD 4.29Å; K366-M370 HydrophobicContact CG-CE 3.96Å; K366-M370 WeakPolarHBondContact O-CE 3.33Å; A367-M370 PolarHBondContact O-N 3.05Å; V368-M370 PolarHBondContact O-N 3.38Å
371	M	83.7	Confident	89.4	Confident	10 Å²	10	29.3 Å²	29.3	5%	0.049	16%	0.16	C	C	.	.	S	Bend	trans	-92.7	145.6	-179.5	-58.2	-167.4	-163.5	0	0	111.2	R253 L257 V337 V368 T369 S374	R253-M371 HydrophobicContact CG-SD 4.31Å; L257-M371 HydrophobicContact CD1-CE 3.77Å; V337-M371 HydrophobicContact CG1-CE 3.88Å; V337-M371 HydrophobicContact CG2-CE 4.22Å; V368-M371 PolarHBondContact O-N 2.96Å; T369-M371 VanDerWaalsContact C-N 3.33Å; M371-S374 WeakPolarHBondContact O-CB 3.5Å; M371-S374 PolarHBondContact O-N 2.86Å
372	P	85.4	Confident	89.6	Confident	88 Å²	88	29.3 Å²	29.3	57%	0.571	16%	0.16	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.8	143.8	172	28	-34.7	0	0	0	110.2	S374 W377	P372-S374 VanDerWaalsContact C-N 3.33Å; P372-W377 PolarHBondContact O-NE1 3.15Å
373	L	88.8	Confident	89.8	Confident	131 Å²	131	31.5 Å²	31.5	69%	0.686	17%	0.17	S	C	*	.	T	Hydrogen-bonded Turn	trans	58.8	41.5	-173.8	-55.1	170.6	0	0	0	112.6	P375 L376 W377	L373-P375 VanDerWaalsContact C-N 3.31Å; L373-P375 VanDerWaalsContact O-N 3.16Å; L373-L376 HydrophobicContact CB-CB 4.46Å; L373-L376 WeakPolarHBondContact O-CB 3.16Å; L373-L376 PolarHBondContact O-N 3.04Å; L373-W377 VanDerWaalsContact O-CD1 3.29Å
374	S	90.8	Very high	90.1	Very high	21 Å²	21	31.4 Å²	31.4	15%	0.147	17%	0.169	C	C	.	.	H	α-helix	trans	-50	-37.4	-176.1	59.2	0	0	0	0	115.3	V368 M371 P372 L376 W377 A378	V368-S374 WeakPolarHBondContact CG1-O 3.3Å; V368-S374 WeakPolarHBondContact O-CB 3.1Å; M371-S374 WeakPolarHBondContact O-CB 3.5Å; M371-S374 PolarHBondContact O-N 2.86Å; P372-S374 VanDerWaalsContact C-N 3.33Å; S374-L376 VanDerWaalsContact C-N 3.31Å; S374-L376 PolarHBondContact O-N 3.45Å; S374-W377 PolarHBondContact O-N 3.46Å; S374-A378 WeakPolarHBondContact O-CB 3.1Å; S374-A378 PolarHBondContact O-N 2.82Å
375	P	93.6	Very high	90.5	Very high	28 Å²	28	31 Å²	31	18%	0.182	17%	0.168	C	C	.	.	H	α-helix	trans	-62.8	-34.4	177.5	-23.4	36	0	0	0	114	T148 L151 L373 C379	T148-P375 WeakPolarHBondContact O-CG 3.36Å; L151-P375 HydrophobicContact CD2-CB 4.31Å; L151-P375 HydrophobicContact CD2-CG 4.45Å; L151-P375 HydrophobicContact CG-CG 4.39Å; L373-P375 VanDerWaalsContact C-N 3.31Å; L373-P375 VanDerWaalsContact O-N 3.16Å; P375-C379 VanDerWaalsContact O-CB 3.28Å; P375-C379 WeakPolarHBondContact O-CB 3.33Å; P375-C379 PolarHBondContact O-N 3.22Å
376	L	91.1	Very high	90.7	Very high	94 Å²	94	31.6 Å²	31.6	49%	0.492	17%	0.171	S	C	.	.	H	α-helix	trans	-65.8	-48.4	177.6	176.6	63.8	0	0	0	110.8	L373 S374 A378 C379 L380	L373-L376 HydrophobicContact CB-CB 4.46Å; L373-L376 WeakPolarHBondContact O-CB 3.16Å; L373-L376 PolarHBondContact O-N 3.04Å; S374-L376 VanDerWaalsContact C-N 3.31Å; S374-L376 PolarHBondContact O-N 3.45Å; L376-A378 VanDerWaalsContact C-N 3.34Å; L376-A378 PolarHBondContact O-N 3.22Å; L376-C379 PolarHBondContact O-N 3.48Å; L376-L380 HydrophobicContact CD1-CD1 4.13Å; L376-L380 HydrophobicContact CD1-CG 4.28Å; L376-L380 HydrophobicContact CG-CD1 4.13Å; L376-L380 WeakPolarHBondContact O-CG 3.43Å; L376-L380 PolarHBondContact O-N 2.92Å
377	W	90.3	Very high	91.1	Very high	47 Å²	47	32 Å²	32	18%	0.178	17%	0.173	C	C	.	.	H	α-helix	trans	-63	-41.6	179.2	-62.7	113.1	0	0	0	111.9	I249 V368 P372 L373 S374 F381	I249-W377 HydrophobicContact CG2-CH2 4.19Å; I249-W377 HydrophobicContact CG2-CZ3 3.66Å; V368-W377 HydrophobicContact CG1-CB 3.79Å; V368-W377 HydrophobicContact CG2-CB 4.47Å; P372-W377 PolarHBondContact O-NE1 3.15Å; L373-W377 VanDerWaalsContact O-CD1 3.29Å; S374-W377 PolarHBondContact O-N 3.46Å; W377-F381 VanDerWaalsContact O-CB 3.31Å; W377-F381 WeakPolarHBondContact O-CB 3.32Å; W377-F381 PolarHBondContact O-N 3.45Å
378	A	93.4	Very high	91.4	Very high	1 Å²	1	32.2 Å²	32.2	1%	0.008	17%	0.174	C	C	.	.	H	α-helix	trans	-62.2	-48.4	176.1	0	0	0	0	0	111.2	C146 L151 W153 V368 S374 L376 L380 F381 F382	C146-A378 VanDerWaalsContact SG-CB 3.6Å; L151-A378 HydrophobicContact CD1-CB 3.96Å; L151-A378 HydrophobicContact CD2-CB 3.97Å; W153-A378 HydrophobicContact CZ2-CB 4.02Å; V368-A378 HydrophobicContact CG1-CB 3.94Å; S374-A378 WeakPolarHBondContact O-CB 3.1Å; S374-A378 PolarHBondContact O-N 2.82Å; L376-A378 VanDerWaalsContact C-N 3.34Å; L376-A378 PolarHBondContact O-N 3.22Å; A378-L380 PolarHBondContact O-N 3.08Å; A378-F381 PolarHBondContact O-N 3.39Å; A378-F382 HydrophobicContact CB-CD2 4.46Å; A378-F382 HydrophobicContact CB-CE2 4.45Å; A378-F382 WeakPolarHBondContact O-CD2 3.45Å; A378-F382 PolarHBondContact O-N 2.79Å
379	C	94.3	Very high	91.7	Very high	23 Å²	23	32.2 Å²	32.2	16%	0.155	17%	0.174	C	C	.	.	H	α-helix	trans	-58	-47.7	178.6	-178.3	0	0	0	0	111.9	L143 C146 P375 L376 F381 F382 M383	L143-C379 HydrophobicContact CD1-CB 4.38Å; C146-C379 HydrophobicContact CB-CB 4.12Å; P375-C379 VanDerWaalsContact O-CB 3.28Å; P375-C379 WeakPolarHBondContact O-CB 3.33Å; P375-C379 PolarHBondContact O-N 3.22Å; L376-C379 PolarHBondContact O-N 3.48Å; C379-F381 PolarHBondContact O-N 3.29Å; C379-F382 PolarHBondContact O-N 2.65Å; C379-M383 VanDerWaalsContact O-CB 3.24Å; C379-M383 WeakPolarHBondContact O-CB 3.23Å; C379-M383 PolarHBondContact O-N 3.46Å
380	L	92.6	Very high	92	Very high	41 Å²	41	31.2 Å²	31.2	22%	0.215	17%	0.167	C	C	.	.	H	α-helix	trans	-64.4	-38.7	178.5	-69.1	174	0	0	0	112.6	F242 M246 L376 A378 M384	F242-L380 HydrophobicContact CZ-CD2 4.13Å; M246-L380 HydrophobicContact CE-CB 3.47Å; M246-L380 VanDerWaalsContact CE-CB 3.47Å; M246-L380 HydrophobicContact CE-CD1 4.1Å; M246-L380 HydrophobicContact CE-CG 4.32Å; M246-L380 HydrophobicContact SD-CB 3.81Å; M246-L380 HydrophobicContact SD-CD1 4.15Å; M246-L380 HydrophobicContact SD-CD2 4.1Å; M246-L380 HydrophobicContact SD-CG 4.25Å; L376-L380 HydrophobicContact CD1-CD1 4.13Å; L376-L380 HydrophobicContact CD1-CG 4.28Å; L376-L380 HydrophobicContact CG-CD1 4.13Å; L376-L380 WeakPolarHBondContact O-CG 3.43Å; L376-L380 PolarHBondContact O-N 2.92Å; A378-L380 PolarHBondContact O-N 3.08Å; L380-M384 WeakPolarHBondContact O-CB 3.28Å; L380-M384 PolarHBondContact O-N 2.83Å
381	F	92.1	Very high	92.5	Very high	2 Å²	2	29.3 Å²	29.3	1%	0.009	16%	0.158	C	C	.	.	H	α-helix	trans	-66.6	-49	176.9	174.5	-104.5	0	0	0	112.3	L250 A360 Y364 W377 A378 C379 M383 M384 L385	L250-F381 HydrophobicContact CD1-CD2 4.33Å; A360-F381 HydrophobicContact CB-CE1 4.46Å; A360-F381 HydrophobicContact CB-CZ 4.09Å; A360-F381 WeakPolarHBondContact O-CE1 3.28Å; Y364-F381 HydrophobicContact CD1-CB 4.32Å; Y364-F381 AromaticContact CD1-CD1 3.39Å; Y364-F381 HydrophobicContact CD1-CD1 3.39Å; Y364-F381 AromaticContact CD1-CD2 3.55Å; Y364-F381 HydrophobicContact CD1-CD2 3.55Å; Y364-F381 AromaticContact CD1-CE1 3.35Å; Y364-F381 HydrophobicContact CD1-CE1 3.35Å; Y364-F381 AromaticContact CD1-CE2 3.52Å; Y364-F381 HydrophobicContact CD1-CE2 3.52Å; Y364-F381 AromaticContact CD1-CG 3.48Å; Y364-F381 HydrophobicContact CD1-CG 3.48Å; Y364-F381 VanDerWaalsContact CD1-CG 3.48Å; Y364-F381 AromaticContact CD1-CZ 3.41Å; Y364-F381 HydrophobicContact CD1-CZ 3.41Å; Y364-F381 VanDerWaalsContact CD1-CZ 3.41Å; Y364-F381 HydrophobicContact CD2-CD2 4.37Å; Y364-F381 AromaticContact CD2-CE2 3.88Å; Y364-F381 HydrophobicContact CD2-CE2 3.88Å; Y364-F381 HydrophobicContact CD2-CZ 4.14Å; Y364-F381 HydrophobicContact CE1-CB 3.59Å; Y364-F381 AromaticContact CE1-CD1 3.57Å; Y364-F381 HydrophobicContact CE1-CD1 3.57Å; Y364-F381 AromaticContact CE1-CD2 3.14Å; Y364-F381 HydrophobicContact CE1-CD2 3.14Å; Y364-F381 AromaticContact CE1-CE1 3.95Å; Y364-F381 HydrophobicContact CE1-CE1 3.95Å; Y364-F381 AromaticContact CE1-CE2 3.57Å; Y364-F381 HydrophobicContact CE1-CE2 3.57Å; Y364-F381 AromaticContact CE1-CG 3.12Å; Y364-F381 HydrophobicContact CE1-CG 3.12Å; Y364-F381 AromaticContact CE1-CZ 3.95Å; Y364-F381 HydrophobicContact CE1-CZ 3.95Å; Y364-F381 HydrophobicContact CE2-CD2 4.04Å; Y364-F381 AromaticContact CE2-CE2 3.92Å; Y364-F381 HydrophobicContact CE2-CE2 3.92Å; Y364-F381 HydrophobicContact CG-CD1 4.34Å; Y364-F381 HydrophobicContact CG-CD2 4.15Å; Y364-F381 AromaticContact CG-CE1 3.88Å; Y364-F381 HydrophobicContact CG-CE1 3.88Å; Y364-F381 AromaticContact CG-CE2 3.67Å; Y364-F381 HydrophobicContact CG-CE2 3.67Å; Y364-F381 HydrophobicContact CG-CG 4.45Å; Y364-F381 AromaticContact CG-CZ 3.51Å; Y364-F381 HydrophobicContact CG-CZ 3.51Å; Y364-F381 AromaticContact CZ-CD2 3.4Å; Y364-F381 VanDerWaalsContact CZ-CD2 3.4Å; Y364-F381 AromaticContact CZ-CE2 3.76Å; Y364-F381 AromaticContact CZ-CG 3.87Å; W377-F381 VanDerWaalsContact O-CB 3.31Å; W377-F381 WeakPolarHBondContact O-CB 3.32Å; W377-F381 PolarHBondContact O-N 3.45Å; A378-F381 PolarHBondContact O-N 3.39Å; C379-F381 PolarHBondContact O-N 3.29Å; F381-M383 VanDerWaalsContact C-N 3.31Å; F381-M383 PolarHBondContact O-N 3.37Å; F381-M384 HydrophobicContact CD2-CE 3.65Å; F381-M384 HydrophobicContact CE2-CE 3.79Å; F381-M384 WeakPolarHBondContact O-CB 3.27Å; F381-M384 PolarHBondContact O-N 2.84Å; F381-M384 VanDerWaalsContact O-N 3.13Å; F381-L385 HydrophobicContact CD1-CD1 4.09Å; F381-L385 HydrophobicContact CD1-CG 4.42Å; F381-L385 HydrophobicContact CE1-CD1 3.45Å; F381-L385 VanDerWaalsContact CE1-CD1 3.45Å; F381-L385 HydrophobicContact CE1-CG 4.04Å; F381-L385 HydrophobicContact CE2-CD2 4.22Å; F381-L385 HydrophobicContact CE2-CG 4.36Å; F381-L385 HydrophobicContact CZ-CD1 3.71Å; F381-L385 HydrophobicContact CZ-CD2 4.02Å; F381-L385 HydrophobicContact CZ-CG 4.01Å; F381-L385 WeakPolarHBondContact O-CG 3.47Å; F381-L385 PolarHBondContact O-N 3.46Å
382	F	95	Very high	92.9	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-68.3	-31.4	178.6	-71.5	-65.2	0	0	0	112.4	A139 Y142 L143 W153 F361 P365 A378 C379 L385 I386	A139-F382 HydrophobicContact CB-CD1 4.5Å; Y142-F382 VanDerWaalsContact CB-CE1 3.45Å; Y142-F382 VanDerWaalsContact CB-CZ 3.49Å; Y142-F382 AromaticContact CD1-CE1 3.76Å; Y142-F382 HydrophobicContact CD1-CE1 3.76Å; Y142-F382 AromaticContact CD1-CE2 3.57Å; Y142-F382 HydrophobicContact CD1-CE2 3.57Å; Y142-F382 AromaticContact CD1-CZ 3.1Å; Y142-F382 HydrophobicContact CD1-CZ 3.1Å; Y142-F382 HydrophobicContact CD2-CE1 4.31Å; Y142-F382 HydrophobicContact CD2-CZ 4.44Å; Y142-F382 AromaticContact CE1-CZ 3.85Å; Y142-F382 HydrophobicContact CE1-CZ 3.85Å; Y142-F382 HydrophobicContact CG-CD1 4.22Å; Y142-F382 AromaticContact CG-CE1 3.59Å; Y142-F382 HydrophobicContact CG-CE1 3.59Å; Y142-F382 AromaticContact CG-CE2 3.97Å; Y142-F382 HydrophobicContact CG-CE2 3.97Å; Y142-F382 AromaticContact CG-CZ 3.44Å; Y142-F382 HydrophobicContact CG-CZ 3.44Å; Y142-F382 VanDerWaalsContact CG-CZ 3.44Å; L143-F382 HydrophobicContact CB-CB 4.18Å; W153-F382 AromaticContact CH2-CE2 4Å; W153-F382 HydrophobicContact CH2-CE2 4Å; W153-F382 AromaticContact CZ2-CE2 3.98Å; W153-F382 HydrophobicContact CZ2-CE2 3.98Å; F361-F382 AromaticContact CD1-CE1 3.83Å; F361-F382 HydrophobicContact CD1-CE1 3.83Å; F361-F382 HydrophobicContact CE1-CD1 4.34Å; F361-F382 AromaticContact CE1-CE1 3.87Å; F361-F382 HydrophobicContact CE1-CE1 3.87Å; P365-F382 HydrophobicContact CB-CZ 4.45Å; P365-F382 HydrophobicContact CG-CE2 4.42Å; P365-F382 HydrophobicContact CG-CZ 3.69Å; A378-F382 HydrophobicContact CB-CD2 4.46Å; A378-F382 HydrophobicContact CB-CE2 4.45Å; A378-F382 WeakPolarHBondContact O-CD2 3.45Å; A378-F382 PolarHBondContact O-N 2.79Å; C379-F382 PolarHBondContact O-N 2.65Å; F382-L385 HydrophobicContact CD1-CD1 3.88Å; F382-L385 HydrophobicContact CE1-CD1 4.12Å; F382-L385 PolarHBondContact O-N 3.35Å; F382-I386 WeakPolarHBondContact O-CD1 3.34Å; F382-I386 VanDerWaalsContact O-CG1 3.25Å; F382-I386 WeakPolarHBondContact O-CG1 3.36Å; F382-I386 PolarHBondContact O-N 3.48Å
383	M	94.9	Very high	93.4	Very high	57 Å²	57	25.1 Å²	25.1	28%	0.281	13%	0.132	S	C	.	.	H	α-helix	trans	-62.9	-42.6	169.2	-172.1	-179.6	-59.4	0	0	111.8	F242 C379 F381 I386 F387	F242-M383 HydrophobicContact CE1-CB 4.23Å; F242-M383 HydrophobicContact CE1-CG 3.98Å; F242-M383 HydrophobicContact CE1-SD 4.14Å; F242-M383 HydrophobicContact CE2-SD 4.19Å; F242-M383 HydrophobicContact CZ-CB 4.47Å; F242-M383 HydrophobicContact CZ-CG 4.16Å; F242-M383 HydrophobicContact CZ-SD 3.71Å; C379-M383 VanDerWaalsContact O-CB 3.24Å; C379-M383 WeakPolarHBondContact O-CB 3.23Å; C379-M383 PolarHBondContact O-N 3.46Å; F381-M383 VanDerWaalsContact C-N 3.31Å; F381-M383 PolarHBondContact O-N 3.37Å; M383-I386 PolarHBondContact O-N 3.21Å; M383-F387 HydrophobicContact CG-CD2 4.29Å; M383-F387 HydrophobicContact CG-CE1 4.37Å; M383-F387 HydrophobicContact CG-CE2 3.76Å; M383-F387 HydrophobicContact CG-CZ 3.81Å; M383-F387 WeakPolarHBondContact O-CG 3.29Å; M383-F387 PolarHBondContact O-N 3.1Å; M383-F387 HydrophobicContact SD-CE2 4.11Å; M383-F387 HydrophobicContact SD-CZ 4.18Å
384	M	93.9	Very high	93.5	Very high	1 Å²	1	19 Å²	19	1%	0.005	10%	0.099	C	C	.	.	H	α-helix	trans	-59.9	-45.5	173.2	175.5	-173.2	80	0	0	111.5	V58 F242 P243 M246 L247 L250 L380 F381 I386 F387 L388	V58-M384 HydrophobicContact CG1-CE 4.5Å; F242-M384 HydrophobicContact CE1-CB 4.19Å; P243-M384 HydrophobicContact CB-CG 3.92Å; P243-M384 HydrophobicContact CG-CG 4.35Å; M246-M384 HydrophobicContact CB-CB 4.2Å; M246-M384 HydrophobicContact CB-CG 4.17Å; M246-M384 HydrophobicContact CB-SD 3.68Å; M246-M384 HydrophobicContact CG-CB 4.27Å; L247-M384 HydrophobicContact CD2-SD 4.39Å; L247-M384 HydrophobicContact CG-SD 4.27Å; L250-M384 HydrophobicContact CD1-CE 4.24Å; L250-M384 HydrophobicContact CD1-SD 4.41Å; L380-M384 WeakPolarHBondContact O-CB 3.28Å; L380-M384 PolarHBondContact O-N 2.83Å; F381-M384 HydrophobicContact CD2-CE 3.65Å; F381-M384 HydrophobicContact CE2-CE 3.79Å; F381-M384 WeakPolarHBondContact O-CB 3.27Å; F381-M384 PolarHBondContact O-N 2.84Å; F381-M384 VanDerWaalsContact O-N 3.13Å; M384-I386 VanDerWaalsContact C-N 3.34Å; M384-I386 PolarHBondContact O-N 3.47Å; M384-F387 PolarHBondContact O-N 2.93Å; M384-L388 HydrophobicContact CG-CD1 3.92Å; M384-L388 HydrophobicContact CG-CG 4.37Å; M384-L388 WeakPolarHBondContact O-CB 3.37Å; M384-L388 WeakPolarHBondContact O-CG 3.39Å; M384-L388 PolarHBondContact O-N 3.23Å
385	L	93.6	Very high	93.6	Very high	5 Å²	5	18 Å²	18	3%	0.026	9%	0.093	C	C	.	.	H	α-helix	trans	-62.4	-40.2	177.4	-65.4	-175.9	0	0	0	112.2	L55 A139 A360 F381 F382 G389	L55-L385 HydrophobicContact CD2-CB 4.06Å; L55-L385 HydrophobicContact CD2-CD2 3.57Å; L55-L385 HydrophobicContact CD2-CG 4.35Å; A139-L385 HydrophobicContact CB-CB 4.18Å; A360-L385 HydrophobicContact CB-CD1 4Å; F381-L385 HydrophobicContact CD1-CD1 4.09Å; F381-L385 HydrophobicContact CD1-CG 4.42Å; F381-L385 HydrophobicContact CE1-CD1 3.45Å; F381-L385 VanDerWaalsContact CE1-CD1 3.45Å; F381-L385 HydrophobicContact CE1-CG 4.04Å; F381-L385 HydrophobicContact CE2-CD2 4.22Å; F381-L385 HydrophobicContact CE2-CG 4.36Å; F381-L385 HydrophobicContact CZ-CD1 3.71Å; F381-L385 HydrophobicContact CZ-CD2 4.02Å; F381-L385 HydrophobicContact CZ-CG 4.01Å; F381-L385 WeakPolarHBondContact O-CG 3.47Å; F381-L385 PolarHBondContact O-N 3.46Å; F382-L385 HydrophobicContact CD1-CD1 3.88Å; F382-L385 HydrophobicContact CE1-CD1 4.12Å; F382-L385 PolarHBondContact O-N 3.35Å; L385-G389 PolarHBondContact O-N 3Å
386	I	95.9	Very high	93.6	Very high	13 Å²	13	16.7 Å²	16.7	7%	0.067	8%	0.084	C	C	.	.	H	α-helix	trans	-62.3	-45.6	175.9	-70.3	162.8	0	0	0	110.4	A139 I140 L143 F382 M383 M384 G389 L390	A139-I386 HydrophobicContact CB-CD1 4.44Å; A139-I386 HydrophobicContact CB-CG1 3.68Å; I140-I386 HydrophobicContact CG1-CD1 3.77Å; I140-I386 HydrophobicContact CG1-CG1 4.07Å; L143-I386 HydrophobicContact CB-CD1 4.17Å; L143-I386 HydrophobicContact CD2-CD1 3.6Å; L143-I386 HydrophobicContact CG-CD1 4.48Å; F382-I386 WeakPolarHBondContact O-CD1 3.34Å; F382-I386 VanDerWaalsContact O-CG1 3.25Å; F382-I386 WeakPolarHBondContact O-CG1 3.36Å; F382-I386 PolarHBondContact O-N 3.48Å; M383-I386 PolarHBondContact O-N 3.21Å; M384-I386 VanDerWaalsContact C-N 3.34Å; M384-I386 PolarHBondContact O-N 3.47Å; I386-G389 PolarHBondContact O-N 3.36Å; I386-L390 HydrophobicContact CG2-CD1 3.59Å; I386-L390 HydrophobicContact CG2-CG 4.09Å; I386-L390 VanDerWaalsContact O-CB 3.28Å; I386-L390 WeakPolarHBondContact O-CB 3.36Å; I386-L390 WeakPolarHBondContact O-CG 3.37Å; I386-L390 PolarHBondContact O-N 3.4Å
387	F	95.6	Very high	93.8	Very high	40 Å²	40	12.2 Å²	12.2	18%	0.175	6%	0.061	C	C	.	.	H	α-helix	trans	-68.1	-43.8	-179.9	-67.5	-14.6	0	0	0	113	V238 T239 F242 P243 M383 M384 G389 L390 D391	V238-F387 HydrophobicContact CG1-CE2 4.37Å; T239-F387 HydrophobicContact CG2-CB 4.43Å; T239-F387 HydrophobicContact CG2-CD1 3.87Å; T239-F387 HydrophobicContact CG2-CE1 4.32Å; T239-F387 HydrophobicContact CG2-CG 4.13Å; F242-F387 HydrophobicContact CB-CD2 3.79Å; F242-F387 HydrophobicContact CB-CE2 4.05Å; F242-F387 AromaticContact CD1-CD2 3.45Å; F242-F387 HydrophobicContact CD1-CD2 3.45Å; F242-F387 VanDerWaalsContact CD1-CD2 3.45Å; F242-F387 AromaticContact CD1-CE2 3.77Å; F242-F387 HydrophobicContact CD1-CE2 3.77Å; F242-F387 HydrophobicContact CD2-CE2 4.37Å; F242-F387 HydrophobicContact CE1-CD2 4.19Å; F242-F387 HydrophobicContact CE1-CE2 4.28Å; F242-F387 AromaticContact CG-CD2 3.75Å; F242-F387 HydrophobicContact CG-CD2 3.75Å; F242-F387 AromaticContact CG-CE2 3.81Å; F242-F387 HydrophobicContact CG-CE2 3.81Å; P243-F387 HydrophobicContact CG-CB 4.22Å; M383-F387 HydrophobicContact CG-CD2 4.29Å; M383-F387 HydrophobicContact CG-CE1 4.37Å; M383-F387 HydrophobicContact CG-CE2 3.76Å; M383-F387 HydrophobicContact CG-CZ 3.81Å; M383-F387 WeakPolarHBondContact O-CG 3.29Å; M383-F387 PolarHBondContact O-N 3.1Å; M383-F387 HydrophobicContact SD-CE2 4.11Å; M383-F387 HydrophobicContact SD-CZ 4.18Å; M384-F387 PolarHBondContact O-N 2.93Å; F387-G389 VanDerWaalsContact C-N 3.27Å; F387-G389 PolarHBondContact O-N 3.46Å; F387-L390 HydrophobicContact CD1-CD1 4.35Å; F387-L390 PolarHBondContact O-N 3.32Å; F387-D391 PolarHBondContact O-N 3.11Å; F387-D391 VanDerWaalsContact O-N 3.08Å
388	L	93.4	Very high	93.9	Very high	3 Å²	3	10.2 Å²	10.2	2%	0.016	5%	0.053	C	C	.	.	H	α-helix	trans	-59.2	-38.8	173	-73.1	172.5	0	0	0	112.1	I53 L55 V58 P243 M384 S392	I53-L388 HydrophobicContact CG2-CD2 4.08Å; I53-L388 VanDerWaalsContact O-CD2 3.29Å; I53-L388 WeakPolarHBondContact O-CD2 3.29Å; L55-L388 HydrophobicContact CD2-CB 4.3Å; V58-L388 HydrophobicContact CG2-CD1 3.78Å; P243-L388 HydrophobicContact CB-CD1 4.29Å; P243-L388 HydrophobicContact CB-CD2 3.55Å; P243-L388 HydrophobicContact CB-CG 3.77Å; P243-L388 HydrophobicContact CG-CD2 3.7Å; P243-L388 HydrophobicContact CG-CG 3.74Å; M384-L388 HydrophobicContact CG-CD1 3.92Å; M384-L388 HydrophobicContact CG-CG 4.37Å; M384-L388 WeakPolarHBondContact O-CB 3.37Å; M384-L388 WeakPolarHBondContact O-CG 3.39Å; M384-L388 PolarHBondContact O-N 3.23Å; L388-S392 PolarHBondContact O-OG 3.45Å
389	G	94.6	Very high	93.9	Very high	0 Å²	0	10.2 Å²	10.2	0%	0	5%	0.053	C	C	.	.	H	α-helix	trans	-72.6	-41	176.8	0	0	0	0	0	113.1	Y132 L385 I386 F387 D391 Q393	Y132-G389 WeakPolarHBondContact CE1-O 3.46Å; L385-G389 PolarHBondContact O-N 3Å; I386-G389 PolarHBondContact O-N 3.36Å; F387-G389 VanDerWaalsContact C-N 3.27Å; F387-G389 PolarHBondContact O-N 3.46Å; G389-D391 VanDerWaalsContact C-N 3.32Å; G389-D391 PolarHBondContact O-N 3.45Å; G389-Q393 VanDerWaalsContact O-CB 3.23Å; G389-Q393 WeakPolarHBondContact O-CB 3.22Å; G389-Q393 PolarHBondContact O-N 3.44Å
390	L	94.7	Very high	94	Very high	10 Å²	10	10.1 Å²	10.1	5%	0.052	5%	0.051	C	C	.	.	H	α-helix	trans	-64.1	-39.6	-178.8	-81.3	172.2	0	0	0	111.6	L136 I220 I386 F387 Q393 F394	L136-L390 HydrophobicContact CD2-CB 4.38Å; L136-L390 HydrophobicContact CD2-CD2 3.51Å; L136-L390 HydrophobicContact CD2-CG 3.68Å; I220-L390 HydrophobicContact CB-CD2 4.47Å; I220-L390 HydrophobicContact CG2-CD1 3.85Å; I220-L390 HydrophobicContact CG2-CD2 3.82Å; I386-L390 HydrophobicContact CG2-CD1 3.59Å; I386-L390 HydrophobicContact CG2-CG 4.09Å; I386-L390 VanDerWaalsContact O-CB 3.28Å; I386-L390 WeakPolarHBondContact O-CB 3.36Å; I386-L390 WeakPolarHBondContact O-CG 3.37Å; I386-L390 PolarHBondContact O-N 3.4Å; F387-L390 HydrophobicContact CD1-CD1 4.35Å; F387-L390 PolarHBondContact O-N 3.32Å; L390-Q393 PolarHBondContact O-N 3.44Å; L390-F394 WeakPolarHBondContact O-CB 3.37Å; L390-F394 WeakPolarHBondContact O-CD1 3.23Å; L390-F394 PolarHBondContact O-N 3.49Å
391	D	93.8	Very high	94	Very high	0 Å²	0	8.1 Å²	8.1	0%	0	4%	0.041	C	C	.	.	H	α-helix	trans	-61.5	-48.9	-179.3	-75.1	-11.6	0	0	0	112.2	G50 T239 A240 F387 G389 F394	G50-D391 WeakPolarHBondContact O-CB 3.42Å; T239-D391 WeakPolarHBondContact CB-OD1 3.27Å; T239-D391 PolarHBondContact OG1-OD1 2.96Å; A240-D391 WeakPolarHBondContact CA-OD2 3.07Å; A240-D391 WeakPolarHBondContact CB-OD2 3.32Å; A240-D391 PolarHBondContact N-OD2 3.21Å; F387-D391 PolarHBondContact O-N 3.11Å; F387-D391 VanDerWaalsContact O-N 3.08Å; G389-D391 VanDerWaalsContact C-N 3.32Å; G389-D391 PolarHBondContact O-N 3.45Å; D391-F394 VanDerWaalsContact CA-CE1 3.41Å; D391-F394 HydrophobicContact CB-CE1 4.12Å; D391-F394 HydrophobicContact CB-CZ 4.36Å; D391-F394 WeakPolarHBondContact O-CZ 3.48Å; D391-F394 VanDerWaalsContact OD1-CE1 3.25Å; D391-F394 WeakPolarHBondContact OD1-CE1 3.35Å
392	S	93.8	Very high	94.1	Very high	10 Å²	10	8.1 Å²	8.1	7%	0.07	4%	0.041	C	C	.	.	H	α-helix	trans	-66.4	-44.6	176.3	-44.2	0	0	0	0	111.9	E51 Y132 L388 F394 V395 C396	E51-S392 PolarHBondContact O-OG 2.87Å; E51-S392 WeakPolarHBondContact OE2-CA 3.45Å; Y132-S392 PolarHBondContact OH-OG 3.42Å; L388-S392 PolarHBondContact O-OG 3.45Å; S392-F394 VanDerWaalsContact C-N 3.29Å; S392-F394 PolarHBondContact O-N 3.18Å; S392-V395 PolarHBondContact O-N 3.09Å; S392-C396 PolarHBondContact O-N 2.84Å; S392-C396 VanDerWaalsContact O-N 3.09Å; S392-C396 PolarHBondContact O-SG 2.82Å
393	Q	95.3	Very high	94.1	Very high	0 Å²	0	8.1 Å²	8.1	0%	0	4%	0.041	C	C	.	.	H	α-helix	trans	-57.6	-43.1	-176.5	-177.4	65	27.4	0	0	112.2	N129 Y132 I133 G389 L390 V395 C396 V397	N129-Q393 PolarHBondContact O-NE2 3.46Å; N129-Q393 PolarHBondContact OD1-NE2 2.98Å; Y132-Q393 HydrophobicContact CD1-CB 4.35Å; I133-Q393 HydrophobicContact CB-CG 4.27Å; I133-Q393 HydrophobicContact CD1-CG 4.04Å; I133-Q393 HydrophobicContact CG1-CG 4.1Å; G389-Q393 VanDerWaalsContact O-CB 3.23Å; G389-Q393 WeakPolarHBondContact O-CB 3.22Å; G389-Q393 PolarHBondContact O-N 3.44Å; L390-Q393 PolarHBondContact O-N 3.44Å; Q393-V395 VanDerWaalsContact C-N 3.34Å; Q393-V395 PolarHBondContact O-N 3.17Å; Q393-C396 WeakPolarHBondContact O-CB 3.44Å; Q393-C396 PolarHBondContact O-N 2.87Å; Q393-V397 WeakPolarHBondContact O-CG2 3.41Å; Q393-V397 PolarHBondContact O-N 3.03Å; Q393-V397 VanDerWaalsContact O-N 3.17Å
394	F	91.1	Very high	94.1	Very high	2 Å²	2	7.4 Å²	7.4	1%	0.009	4%	0.04	C	C	.	.	H	α-helix	trans	-71.9	-31.9	-175.6	82.1	-131.4	0	0	0	111.9	I225 T232 V236 L390 D391 S392 V397 E398	I225-F394 HydrophobicContact CG2-CB 3.44Å; I225-F394 VanDerWaalsContact CG2-CB 3.44Å; I225-F394 HydrophobicContact CG2-CD2 4.26Å; I225-F394 HydrophobicContact CG2-CG 4.05Å; T232-F394 HydrophobicContact CG2-CD2 3.4Å; T232-F394 HydrophobicContact CG2-CE1 4.27Å; T232-F394 HydrophobicContact CG2-CE2 3.01Å; T232-F394 HydrophobicContact CG2-CG 4.32Å; T232-F394 HydrophobicContact CG2-CZ 3.57Å; V236-F394 HydrophobicContact CG1-CE1 3.68Å; V236-F394 HydrophobicContact CG1-CE2 4.27Å; V236-F394 HydrophobicContact CG1-CZ 3.24Å; L390-F394 WeakPolarHBondContact O-CB 3.37Å; L390-F394 WeakPolarHBondContact O-CD1 3.23Å; L390-F394 PolarHBondContact O-N 3.49Å; D391-F394 VanDerWaalsContact CA-CE1 3.41Å; D391-F394 HydrophobicContact CB-CE1 4.12Å; D391-F394 HydrophobicContact CB-CZ 4.36Å; D391-F394 WeakPolarHBondContact O-CZ 3.48Å; D391-F394 VanDerWaalsContact OD1-CE1 3.25Å; D391-F394 WeakPolarHBondContact OD1-CE1 3.35Å; S392-F394 VanDerWaalsContact C-N 3.29Å; S392-F394 PolarHBondContact O-N 3.18Å; F394-V397 PolarHBondContact O-N 3.46Å; F394-E398 VanDerWaalsContact O-CB 3.3Å; F394-E398 WeakPolarHBondContact O-CB 3.32Å; F394-E398 PolarHBondContact O-N 3.39Å
395	V	93.1	Very high	94.1	Very high	1 Å²	1	7.9 Å²	7.9	1%	0.006	4%	0.043	C	C	.	.	H	α-helix	trans	-69.2	-39	176.4	170.3	0	0	0	0	110.3	E51 C298 L302 S392 Q393 V397 E398 S399	E51-V395 HydrophobicContact CB-CB 4.23Å; E51-V395 HydrophobicContact CB-CG1 4.14Å; E51-V395 HydrophobicContact CB-CG2 4.02Å; E51-V395 HydrophobicContact CG-CB 4.36Å; E51-V395 HydrophobicContact CG-CG1 3.91Å; E51-V395 WeakPolarHBondContact OE2-CB 3.25Å; C298-V395 HydrophobicContact CB-CG1 3.73Å; L302-V395 HydrophobicContact CD1-CG1 3.72Å; L302-V395 HydrophobicContact CD1-CG2 4.19Å; L302-V395 HydrophobicContact CD2-CG1 4.2Å; L302-V395 HydrophobicContact CD2-CG2 4.28Å; L302-V395 HydrophobicContact CG-CG1 4.02Å; S392-V395 PolarHBondContact O-N 3.09Å; Q393-V395 VanDerWaalsContact C-N 3.34Å; Q393-V395 PolarHBondContact O-N 3.17Å; V395-V397 PolarHBondContact O-N 2.88Å; V395-E398 PolarHBondContact O-N 3.29Å; V395-S399 WeakPolarHBondContact O-CB 3.16Å; V395-S399 PolarHBondContact O-N 3.13Å
396	C	93.8	Very high	94	Very high	1 Å²	1	8.1 Å²	8.1	1%	0.007	4%	0.044	C	C	.	.	H	α-helix	trans	-58.5	-48.4	174.9	-61.2	0	0	0	0	111.2	E125 L128 S392 Q393 E398 S399 L400	E125-C396 WeakPolarHBondContact OE2-CA 3.35Å; E125-C396 WeakPolarHBondContact OE2-CB 3.35Å; L128-C396 HydrophobicContact CD2-CB 4.18Å; L128-C396 WeakPolarHBondContact CD2-SG 3.02Å; S392-C396 PolarHBondContact O-N 2.84Å; S392-C396 VanDerWaalsContact O-N 3.09Å; S392-C396 PolarHBondContact O-SG 2.82Å; Q393-C396 WeakPolarHBondContact O-CB 3.44Å; Q393-C396 PolarHBondContact O-N 2.87Å; C396-E398 PolarHBondContact O-N 3.46Å; C396-S399 WeakPolarHBondContact O-CB 3.22Å; C396-S399 PolarHBondContact O-N 3.46Å; C396-L400 PolarHBondContact O-N 2.95Å
397	V	94.9	Very high	93.9	Very high	0 Å²	0	9.1 Å²	9.1	0%	0	5%	0.049	C	C	.	.	H	α-helix	trans	-63.2	-43.3	175	-175.3	0	0	0	0	111.2	N129 W218 I225 Q393 F394 V395 S399 L400 V401 I422	N129-V397 WeakPolarHBondContact OD1-CG2 3.27Å; W218-V397 HydrophobicContact CH2-CG2 4.3Å; W218-V397 HydrophobicContact CZ3-CG2 3.95Å; I225-V397 HydrophobicContact CD1-CB 3.67Å; I225-V397 HydrophobicContact CD1-CG1 3.3Å; I225-V397 HydrophobicContact CD1-CG2 4.38Å; Q393-V397 WeakPolarHBondContact O-CG2 3.41Å; Q393-V397 PolarHBondContact O-N 3.03Å; Q393-V397 VanDerWaalsContact O-N 3.17Å; F394-V397 PolarHBondContact O-N 3.46Å; V395-V397 PolarHBondContact O-N 2.88Å; V397-S399 VanDerWaalsContact C-N 3.29Å; V397-S399 PolarHBondContact O-N 3.32Å; V397-L400 PolarHBondContact O-N 3.45Å; V397-V401 HydrophobicContact CG1-CG2 4.03Å; V397-V401 WeakPolarHBondContact O-CB 3.32Å; V397-V401 WeakPolarHBondContact O-CG2 3.43Å; V397-V401 PolarHBondContact O-N 3.39Å; V397-I422 HydrophobicContact CG1-CG2 4.33Å
398	E	92.8	Very high	93.8	Very high	4 Å²	4	13.5 Å²	13.5	2%	0.019	7%	0.065	C	C	.	.	H	α-helix	trans	-60.9	-38.7	178.7	-172.8	66.6	-155.8	0	0	111.6	Y305 F394 V395 C396 V401 T402 R418	Y305-E398 HydrophobicContact CE2-CG 4.41Å; Y305-E398 PolarHBondContact OH-OE1 2.92Å; F394-E398 VanDerWaalsContact O-CB 3.3Å; F394-E398 WeakPolarHBondContact O-CB 3.32Å; F394-E398 PolarHBondContact O-N 3.39Å; V395-E398 PolarHBondContact O-N 3.29Å; C396-E398 PolarHBondContact O-N 3.46Å; E398-V401 PolarHBondContact O-N 3.16Å; E398-T402 VanDerWaalsContact O-CB 3.24Å; E398-T402 WeakPolarHBondContact O-CB 3.46Å; E398-T402 PolarHBondContact O-N 3.5Å; E398-T402 PolarHBondContact O-OG1 3.42Å; E398-R418 IonicContact OE1-CZ 2.62Å; E398-R418 IonicContact OE1-NH2 3.43Å; E398-R418 PolarHBondContact OE1-NH2 3.06Å; E398-R418 IonicContact OE2-CZ 3.97Å; E398-R418 IonicContact OE2-NH2 2.72Å; E398-R418 PolarHBondContact OE2-NH2 2.71Å
399	S	93.9	Very high	93.6	Very high	1 Å²	1	15.6 Å²	15.6	1%	0.007	8%	0.079	C	C	.	.	H	α-helix	trans	-58.8	-52.2	176	-175.3	0	0	0	0	111.4	Q122 C298 V395 C396 V397 V401 T402 A403	Q122-S399 PolarHBondContact OE1-O 3.42Å; C298-S399 PolarHBondContact N-OG 2.97Å; V395-S399 WeakPolarHBondContact O-CB 3.16Å; V395-S399 PolarHBondContact O-N 3.13Å; C396-S399 WeakPolarHBondContact O-CB 3.22Å; C396-S399 PolarHBondContact O-N 3.46Å; V397-S399 VanDerWaalsContact C-N 3.29Å; V397-S399 PolarHBondContact O-N 3.32Å; S399-V401 PolarHBondContact O-N 2.99Å; S399-T402 PolarHBondContact O-N 2.86Å; S399-A403 PolarHBondContact O-N 3.32Å
400	L	94.8	Very high	93.3	Very high	21 Å²	21	22.2 Å²	22.2	11%	0.11	11%	0.11	C	C	.	.	H	α-helix	trans	-59.8	-46.7	177.5	-70.3	170	0	0	0	112.1	Q122 E125 A126 N129 C396 V397 A403 V404 M425	Q122-L400 HydrophobicContact CB-CD2 4.2Å; Q122-L400 WeakPolarHBondContact O-CD2 3.48Å; E125-L400 HydrophobicContact CB-CD2 3.88Å; E125-L400 HydrophobicContact CB-CG 4.09Å; A126-L400 HydrophobicContact CB-CD2 4.29Å; N129-L400 HydrophobicContact CB-CD1 4.12Å; C396-L400 PolarHBondContact O-N 2.95Å; V397-L400 PolarHBondContact O-N 3.45Å; L400-A403 PolarHBondContact O-N 2.94Å; L400-V404 WeakPolarHBondContact O-CG2 3.24Å; L400-V404 PolarHBondContact O-N 2.94Å; L400-V404 VanDerWaalsContact O-N 3.13Å; L400-M425 HydrophobicContact CB-SD 4.34Å
401	V	94.1	Very high	93.1	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-63.8	-44	179.7	172	0	0	0	0	110.2	V397 E398 S399 A403 V404 V405 R418 L421 I422 M425	V397-V401 HydrophobicContact CG1-CG2 4.03Å; V397-V401 WeakPolarHBondContact O-CB 3.32Å; V397-V401 WeakPolarHBondContact O-CG2 3.43Å; V397-V401 PolarHBondContact O-N 3.39Å; E398-V401 PolarHBondContact O-N 3.16Å; S399-V401 PolarHBondContact O-N 2.99Å; V401-A403 VanDerWaalsContact C-N 3.35Å; V401-A403 PolarHBondContact O-N 3.5Å; V401-V404 PolarHBondContact O-N 2.87Å; V401-V405 HydrophobicContact CG1-CG2 4Å; V401-V405 VanDerWaalsContact O-CB 3.3Å; V401-V405 WeakPolarHBondContact O-CB 3.32Å; V401-V405 WeakPolarHBondContact O-CG2 3.29Å; V401-V405 PolarHBondContact O-N 2.75Å; V401-R418 HydrophobicContact CG1-CG 4.17Å; V401-L421 HydrophobicContact CG1-CD2 4.35Å; V401-I422 HydrophobicContact CB-CG1 4.38Å; V401-I422 HydrophobicContact CG1-CD1 4.36Å; V401-I422 HydrophobicContact CG1-CG1 3.91Å; V401-I422 HydrophobicContact CG2-CG1 3.61Å; V401-M425 HydrophobicContact CG2-SD 3.64Å
402	T	93.7	Very high	93	Very high	1 Å²	1	27 Å²	27	1%	0.006	14%	0.136	C	C	.	.	H	α-helix	trans	-60.5	-45.1	178.3	-58.1	0	0	0	0	111	A301 Y305 E398 S399 V404 V405 D406	A301-T402 HydrophobicContact CB-CG2 4.27Å; Y305-T402 PolarHBondContact OH-OG1 3.48Å; E398-T402 VanDerWaalsContact O-CB 3.24Å; E398-T402 WeakPolarHBondContact O-CB 3.46Å; E398-T402 PolarHBondContact O-N 3.5Å; E398-T402 PolarHBondContact O-OG1 3.42Å; S399-T402 PolarHBondContact O-N 2.86Å; T402-V404 PolarHBondContact O-N 3.04Å; T402-V405 PolarHBondContact O-N 3.03Å; T402-D406 VanDerWaalsContact O-CB 3.3Å; T402-D406 WeakPolarHBondContact O-CB 3.36Å; T402-D406 PolarHBondContact O-N 3.36Å
403	A	94.7	Very high	92.7	Very high	1 Å²	1	29.2 Å²	29.2	1%	0.008	14%	0.142	C	C	.	.	H	α-helix	trans	-60.2	-44.9	178.3	0	0	0	0	0	112.2	I104 Q122 S399 L400 V401 M407	I104-A403 HydrophobicContact CD1-CB 4.26Å; I104-A403 HydrophobicContact CG1-CB 4.38Å; Q122-A403 HydrophobicContact CG-CB 3.92Å; Q122-A403 VanDerWaalsContact OE1-CB 3.32Å; S399-A403 PolarHBondContact O-N 3.32Å; L400-A403 PolarHBondContact O-N 2.94Å; V401-A403 VanDerWaalsContact C-N 3.35Å; V401-A403 PolarHBondContact O-N 3.5Å; A403-M407 WeakPolarHBondContact O-CB 3.49Å; A403-M407 VanDerWaalsContact O-CG 3.3Å; A403-M407 WeakPolarHBondContact O-CG 3.42Å; A403-M407 PolarHBondContact O-N 2.96Å
404	V	94.9	Very high	92.4	Very high	41 Å²	41	30.8 Å²	30.8	25%	0.248	15%	0.149	C	C	.	.	H	α-helix	trans	-70.6	-42.8	179.5	175.2	0	0	0	0	112	L400 V401 T402 D406 M407 Y408 F412 L421 M425	L400-V404 WeakPolarHBondContact O-CG2 3.24Å; L400-V404 PolarHBondContact O-N 2.94Å; L400-V404 VanDerWaalsContact O-N 3.13Å; V401-V404 PolarHBondContact O-N 2.87Å; T402-V404 PolarHBondContact O-N 3.04Å; V404-D406 VanDerWaalsContact C-N 3.32Å; V404-D406 PolarHBondContact O-N 3.4Å; V404-M407 PolarHBondContact O-N 3.06Å; V404-Y408 PolarHBondContact O-N 3.35Å; V404-Y408 VanDerWaalsContact O-N 3.09Å; V404-F412 HydrophobicContact CG1-CD2 4.08Å; V404-F412 HydrophobicContact CG1-CE2 3.65Å; V404-F412 HydrophobicContact CG1-CZ 4.15Å; V404-L421 HydrophobicContact CB-CD2 4.03Å; V404-L421 HydrophobicContact CG1-CD1 4.27Å; V404-L421 HydrophobicContact CG1-CD2 3.72Å; V404-M425 HydrophobicContact CB-CE 4.17Å; V404-M425 HydrophobicContact CG2-CE 3.64Å
405	V	93.6	Very high	92.2	Very high	12 Å²	12	32.8 Å²	32.8	7%	0.073	17%	0.17	C	C	.	.	H	α-helix	trans	-62.6	-39.7	177.9	170	0	0	0	0	111.1	V401 T402 Y408 P409 F412 R413 R418 L421	V401-V405 HydrophobicContact CG1-CG2 4Å; V401-V405 VanDerWaalsContact O-CB 3.3Å; V401-V405 WeakPolarHBondContact O-CB 3.32Å; V401-V405 WeakPolarHBondContact O-CG2 3.29Å; V401-V405 PolarHBondContact O-N 2.75Å; T402-V405 PolarHBondContact O-N 3.03Å; V405-Y408 CarbonylContact O-C 3.17Å; V405-Y408 VanDerWaalsContact O-C 3.3Å; V405-P409 WeakPolarHBondContact O-CA 3.47Å; V405-P409 VanDerWaalsContact O-N 3.08Å; V405-F412 HydrophobicContact CB-CB 4.44Å; V405-F412 HydrophobicContact CG2-CB 3.89Å; V405-R413 HydrophobicContact CG1-CG 3.78Å; V405-R418 HydrophobicContact CG2-CG 4.28Å; V405-L421 HydrophobicContact CG2-CD2 3.96Å
406	D	92.8	Very high	92	Very high	10 Å²	10	41.5 Å²	41.5	5%	0.053	20%	0.204	C	C	.	.	H	α-helix	trans	-77.2	-26.3	179.4	-72.5	-14.8	0	0	0	112.7	R35 G102 T105 T402 V404 P409 R413	R35-D406 IonicContact CZ-OD2 3.86Å; R35-D406 IonicContact NE-OD1 2.66Å; R35-D406 PolarHBondContact NE-OD1 3.28Å; R35-D406 IonicContact NE-OD2 2.71Å; R35-D406 PolarHBondContact NE-OD2 3.15Å; R35-D406 IonicContact NH2-OD2 3.93Å; R35-D406 PolarHBondContact NH2-OD2 3.49Å; G102-D406 PolarHBondContact N-OD2 3.23Å; T105-D406 HydrophobicContact CG2-CB 4.3Å; T402-D406 VanDerWaalsContact O-CB 3.3Å; T402-D406 WeakPolarHBondContact O-CB 3.36Å; T402-D406 PolarHBondContact O-N 3.36Å; V404-D406 VanDerWaalsContact C-N 3.32Å; V404-D406 PolarHBondContact O-N 3.4Å; D406-P409 WeakPolarHBondContact O-CD 3.33Å; D406-R413 IonicContact OD1-CZ 2.59Å; D406-R413 IonicContact OD1-NH2 2.68Å; D406-R413 PolarHBondContact OD1-NH2 2.97Å
407	M	93	Very high	92	Very high	34 Å²	34	47.1 Å²	47.1	17%	0.167	23%	0.225	C	C	.	.	H	α-helix	trans	-69.8	-35.6	170.3	-78.9	-178.6	64.4	0	0	113.1	I104 T105 Y119 A403 V404 P409	I104-M407 HydrophobicContact CB-CG 4.4Å; I104-M407 HydrophobicContact CB-SD 4.09Å; I104-M407 HydrophobicContact CD1-SD 3.48Å; I104-M407 WeakPolarHBondContact CD1-SD 3.29Å; I104-M407 HydrophobicContact CG1-SD 4.38Å; I104-M407 HydrophobicContact CG2-CG 4.32Å; I104-M407 HydrophobicContact CG2-SD 3.87Å; T105-M407 HydrophobicContact CG2-CG 3.92Å; Y119-M407 HydrophobicContact CE1-CE 4.36Å; Y119-M407 HydrophobicContact CE1-SD 4.5Å; Y119-M407 WeakPolarHBondContact OH-CE 3.37Å; A403-M407 WeakPolarHBondContact O-CB 3.49Å; A403-M407 VanDerWaalsContact O-CG 3.3Å; A403-M407 WeakPolarHBondContact O-CG 3.42Å; A403-M407 PolarHBondContact O-N 2.96Å; V404-M407 PolarHBondContact O-N 3.06Å; M407-P409 VanDerWaalsContact C-CD 3.47Å
408	Y	93.1	Very high	91.8	Very high	132 Å²	132	49 Å²	49	52%	0.518	23%	0.232	S	C	.	.	S	Bend	trans	-130	61.5	-177.1	-56.1	-78	0	0	0	111.8	V404 V405 E410 T411 F412	V404-Y408 PolarHBondContact O-N 3.35Å; V404-Y408 VanDerWaalsContact O-N 3.09Å; V405-Y408 CarbonylContact O-C 3.17Å; V405-Y408 VanDerWaalsContact O-C 3.3Å; Y408-E410 VanDerWaalsContact C-N 3.26Å; Y408-E410 PolarHBondContact O-N 3.16Å; Y408-T411 PolarHBondContact O-N 3.12Å; Y408-F412 HydrophobicContact CD2-CE2 4.4Å; Y408-F412 PolarHBondContact O-N 3.06Å; Y408-F412 VanDerWaalsContact O-N 3.15Å
409	P	89.6	Confident	91.9	Very high	46 Å²	46	50.8 Å²	50.8	30%	0.299	24%	0.241	S	C	.	.	H	α-helix	trans	-63.1	-35.9	-172.6	25.6	-34.1	0	0	0	111.7	V405 D406 M407 T411 R413	V405-P409 WeakPolarHBondContact O-CA 3.47Å; V405-P409 VanDerWaalsContact O-N 3.08Å; D406-P409 WeakPolarHBondContact O-CD 3.33Å; M407-P409 VanDerWaalsContact C-CD 3.47Å; P409-T411 PolarHBondContact O-N 3.22Å; P409-R413 HydrophobicContact CB-CG 4.37Å; P409-R413 VanDerWaalsContact O-CB 3.25Å; P409-R413 WeakPolarHBondContact O-CB 3.39Å; P409-R413 WeakPolarHBondContact O-CG 3.11Å; P409-R413 PolarHBondContact O-N 3.09Å; P409-R413 VanDerWaalsContact O-N 3.08Å
410	E	88.2	Confident	91.9	Very high	139 Å²	139	55.8 Å²	55.8	65%	0.65	27%	0.267	S	S	*	.	H	α-helix	trans	-62.7	-26	179.6	-65.5	-179.2	-177	0	0	113.1	Y32 Y408 K414	Y32-E410 HydrophobicContact CE1-CB 4.34Å; Y408-E410 VanDerWaalsContact C-N 3.26Å; Y408-E410 PolarHBondContact O-N 3.16Å; E410-K414 WeakPolarHBondContact O-CD 3.4Å; E410-K414 WeakPolarHBondContact O-CE 3.38Å
411	T	90.8	Very high	91.9	Very high	65 Å²	65	55.8 Å²	55.8	40%	0.399	27%	0.267	S	S	.	.	H	α-helix	trans	-92.4	-49.6	-177.3	-59.2	0	0	0	0	111.5	Y408 P409 R417	Y408-T411 PolarHBondContact O-N 3.12Å; P409-T411 PolarHBondContact O-N 3.22Å; T411-R417 WeakPolarHBondContact O-CD 3.49Å; T411-R417 PolarHBondContact O-NH1 3.22Å
412	F	91.6	Very high	92	Very high	45 Å²	45	55.8 Å²	55.8	20%	0.197	27%	0.267	C	S	.	.	H	α-helix	trans	-95.6	-14.8	-168.4	-65.9	-71.3	0	0	0	115	V404 V405 Y408 K414 R417 R418 L421	V404-F412 HydrophobicContact CG1-CD2 4.08Å; V404-F412 HydrophobicContact CG1-CE2 3.65Å; V404-F412 HydrophobicContact CG1-CZ 4.15Å; V405-F412 HydrophobicContact CB-CB 4.44Å; V405-F412 HydrophobicContact CG2-CB 3.89Å; Y408-F412 HydrophobicContact CD2-CE2 4.4Å; Y408-F412 PolarHBondContact O-N 3.06Å; Y408-F412 VanDerWaalsContact O-N 3.15Å; F412-K414 PolarHBondContact O-N 3.4Å; F412-R417 HydrophobicContact CD1-CB 4.5Å; F412-R418 PolarHBondContact O-N 3.05Å; F412-L421 HydrophobicContact CD1-CB 4.05Å; F412-L421 HydrophobicContact CD1-CD1 4.45Å; F412-L421 HydrophobicContact CD1-CD2 3.93Å; F412-L421 HydrophobicContact CD1-CG 4.38Å; F412-L421 HydrophobicContact CD2-CD2 4.49Å; F412-L421 HydrophobicContact CE1-CB 4.13Å; F412-L421 HydrophobicContact CE1-CD1 3.84Å; F412-L421 HydrophobicContact CE1-CD2 4.1Å; F412-L421 HydrophobicContact CE1-CG 4.25Å; F412-L421 HydrophobicContact CG-CD2 4.15Å; F412-L421 HydrophobicContact CZ-CD1 4.1Å; F412-L421 HydrophobicContact CZ-CD2 4.45Å
413	R	87.3	Confident	92.1	Very high	57 Å²	57	58.8 Å²	58.8	22%	0.215	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.9	11.3	174.5	-60.2	-173.7	-177.5	171.9	2.7	113.8	N33 V405 D406 P409	N33-R413 VanDerWaalsContact CB-O 3.27Å; N33-R413 WeakPolarHBondContact CB-O 3.19Å; N33-R413 PolarHBondContact N-O 2.8Å; N33-R413 PolarHBondContact ND2-O 3.27Å; V405-R413 HydrophobicContact CG1-CG 3.78Å; D406-R413 IonicContact OD1-CZ 2.59Å; D406-R413 IonicContact OD1-NH2 2.68Å; D406-R413 PolarHBondContact OD1-NH2 2.97Å; P409-R413 HydrophobicContact CB-CG 4.37Å; P409-R413 VanDerWaalsContact O-CB 3.25Å; P409-R413 WeakPolarHBondContact O-CB 3.39Å; P409-R413 WeakPolarHBondContact O-CG 3.11Å; P409-R413 PolarHBondContact O-N 3.09Å; P409-R413 VanDerWaalsContact O-N 3.08Å
414	K	89.1	Confident	92.1	Very high	34 Å²	34	62.3 Å²	62.3	15%	0.148	31%	0.306	C	S	.	.	B	Isolated β-bridge	trans	-101.6	128.4	178.2	-65.4	-173	179	-177.7	0	111.4	D30 Y32 E410 F412 Y416 R417	D30-K414 IonicContact OD1-NZ 2.84Å; D30-K414 IonicContact OD2-NZ 2.7Å; D30-K414 PolarHBondContact OD2-NZ 2.86Å; Y32-K414 HydrophobicContact CD1-CG 4.1Å; Y32-K414 HydrophobicContact CE1-CD 4.21Å; Y32-K414 HydrophobicContact CE1-CG 3.97Å; Y32-K414 VanDerWaalsContact OH-CE 3.3Å; Y32-K414 WeakPolarHBondContact OH-CE 3.35Å; Y32-K414 PolarHBondContact OH-NZ 3.19Å; E410-K414 WeakPolarHBondContact O-CD 3.4Å; E410-K414 WeakPolarHBondContact O-CE 3.38Å; F412-K414 PolarHBondContact O-N 3.4Å; K414-Y416 PolarHBondContact O-N 2.99Å; K414-R417 WeakPolarHBondContact O-CB 3.31Å; K414-R417 VanDerWaalsContact O-CG 3.28Å; K414-R417 WeakPolarHBondContact O-CG 3.45Å; K414-R417 PolarHBondContact O-N 3Å
415	G	87.1	Confident	92.1	Very high	43 Å²	43	62.2 Å²	62.2	44%	0.443	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.3	-129.2	175.1	0	0	0	0	0	112.8	N33	N33-G415 PolarHBondContact ND2-O 2.95Å; N33-G415 VanDerWaalsContact ND2-O 3.16Å
416	Y	89.3	Confident	92.2	Very high	184 Å²	184	61.9 Å²	61.9	72%	0.722	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.4	18.5	-178.2	-56.6	-73	0	0	0	114.4	K414 R418 E419 L420	K414-Y416 PolarHBondContact O-N 2.99Å; Y416-R418 VanDerWaalsContact C-N 3.31Å; Y416-R418 PolarHBondContact O-N 3.25Å; Y416-E419 WeakPolarHBondContact CA-OE2 3.43Å; Y416-E419 PolarHBondContact O-N 3.48Å; Y416-L420 WeakPolarHBondContact O-CG 3.13Å; Y416-L420 PolarHBondContact O-N 3.2Å; Y416-L420 VanDerWaalsContact O-N 3.09Å
417	R	92.6	Very high	92.4	Very high	119 Å²	119	65.2 Å²	65.2	45%	0.449	32%	0.319	S	S	.	.	H	α-helix	trans	-71.7	-25.8	-172.7	-68.8	177.6	-179.1	-177.6	1.5	113.1	T411 F412 K414 L421	T411-R417 WeakPolarHBondContact O-CD 3.49Å; T411-R417 PolarHBondContact O-NH1 3.22Å; F412-R417 HydrophobicContact CD1-CB 4.5Å; K414-R417 WeakPolarHBondContact O-CB 3.31Å; K414-R417 VanDerWaalsContact O-CG 3.28Å; K414-R417 WeakPolarHBondContact O-CG 3.45Å; K414-R417 PolarHBondContact O-N 3Å; R417-L421 WeakPolarHBondContact O-CB 3.25Å; R417-L421 PolarHBondContact O-N 3.39Å
418	R	91.9	Very high	92.6	Very high	40 Å²	40	67.2 Å²	67.2	15%	0.151	33%	0.333	C	S	.	.	H	α-helix	trans	-66.4	-45.3	172.5	-178	-176.3	178.5	-74.4	-7.8	110.5	I225 W226 E398 V401 V405 F412 Y416 L420 L421 I422	I225-R418 PolarHBondContact O-NH1 3.47Å; W226-R418 PolarHBondContact O-NH1 3.24Å; W226-R418 VanDerWaalsContact O-NH1 3.08Å; E398-R418 IonicContact OE1-CZ 2.62Å; E398-R418 IonicContact OE1-NH2 3.43Å; E398-R418 PolarHBondContact OE1-NH2 3.06Å; E398-R418 IonicContact OE2-CZ 3.97Å; E398-R418 IonicContact OE2-NH2 2.72Å; E398-R418 PolarHBondContact OE2-NH2 2.71Å; V401-R418 HydrophobicContact CG1-CG 4.17Å; V405-R418 HydrophobicContact CG2-CG 4.28Å; F412-R418 PolarHBondContact O-N 3.05Å; Y416-R418 VanDerWaalsContact C-N 3.31Å; Y416-R418 PolarHBondContact O-N 3.25Å; R418-L420 VanDerWaalsContact C-N 3.33Å; R418-L420 PolarHBondContact O-N 2.97Å; R418-L421 WeakPolarHBondContact O-CB 3.22Å; R418-L421 PolarHBondContact O-N 3.45Å; R418-I422 HydrophobicContact CG-CD1 4.4Å; R418-I422 WeakPolarHBondContact O-CG1 3.29Å; R418-I422 PolarHBondContact O-N 3.14Å
419	E	93.8	Very high	92.7	Very high	41 Å²	41	61.5 Å²	61.5	19%	0.192	31%	0.312	C	S	.	.	H	α-helix	trans	-61.4	-43.2	177.1	-64.7	86.9	156.7	0	0	110.9	W226 Y416 L421 I422 L423	W226-E419 WeakPolarHBondContact O-CG 3.21Å; Y416-E419 WeakPolarHBondContact CA-OE2 3.43Å; Y416-E419 PolarHBondContact O-N 3.48Å; E419-L421 VanDerWaalsContact C-N 3.34Å; E419-L421 PolarHBondContact O-N 3Å; E419-I422 PolarHBondContact O-N 3.24Å; E419-L423 PolarHBondContact O-N 3.29Å
420	L	94.4	Very high	93.1	Very high	106 Å²	106	61.3 Å²	61.3	56%	0.555	31%	0.307	S	S	*	.	H	α-helix	trans	-64.3	-36.5	174.6	-68.9	173.7	0	0	0	112.7	Y416 R418 L423 C424	Y416-L420 WeakPolarHBondContact O-CG 3.13Å; Y416-L420 PolarHBondContact O-N 3.2Å; Y416-L420 VanDerWaalsContact O-N 3.09Å; R418-L420 VanDerWaalsContact C-N 3.33Å; R418-L420 PolarHBondContact O-N 2.97Å; L420-L423 PolarHBondContact O-N 2.96Å; L420-C424 VanDerWaalsContact O-CB 3.28Å; L420-C424 WeakPolarHBondContact O-CB 2.97Å; L420-C424 PolarHBondContact O-N 2.94Å
421	L	94.9	Very high	93.6	Very high	21 Å²	21	60.9 Å²	60.9	11%	0.11	30%	0.303	C	S	.	.	H	α-helix	trans	-62.9	-46.7	174.9	179.5	64	0	0	0	111	V401 V404 V405 F412 R417 R418 E419 C424 M425	V401-L421 HydrophobicContact CG1-CD2 4.35Å; V404-L421 HydrophobicContact CB-CD2 4.03Å; V404-L421 HydrophobicContact CG1-CD1 4.27Å; V404-L421 HydrophobicContact CG1-CD2 3.72Å; V405-L421 HydrophobicContact CG2-CD2 3.96Å; F412-L421 HydrophobicContact CD1-CB 4.05Å; F412-L421 HydrophobicContact CD1-CD1 4.45Å; F412-L421 HydrophobicContact CD1-CD2 3.93Å; F412-L421 HydrophobicContact CD1-CG 4.38Å; F412-L421 HydrophobicContact CD2-CD2 4.49Å; F412-L421 HydrophobicContact CE1-CB 4.13Å; F412-L421 HydrophobicContact CE1-CD1 3.84Å; F412-L421 HydrophobicContact CE1-CD2 4.1Å; F412-L421 HydrophobicContact CE1-CG 4.25Å; F412-L421 HydrophobicContact CG-CD2 4.15Å; F412-L421 HydrophobicContact CZ-CD1 4.1Å; F412-L421 HydrophobicContact CZ-CD2 4.45Å; R417-L421 WeakPolarHBondContact O-CB 3.25Å; R417-L421 PolarHBondContact O-N 3.39Å; R418-L421 WeakPolarHBondContact O-CB 3.22Å; R418-L421 PolarHBondContact O-N 3.45Å; E419-L421 VanDerWaalsContact C-N 3.34Å; E419-L421 PolarHBondContact O-N 3Å; L421-C424 PolarHBondContact O-N 3.47Å; L421-M425 HydrophobicContact CD1-CE 3.89Å; L421-M425 HydrophobicContact CD1-CG 4.46Å; L421-M425 HydrophobicContact CD1-SD 4.49Å; L421-M425 HydrophobicContact CD2-CE 4.33Å; L421-M425 HydrophobicContact CG-CE 4.07Å; L421-M425 HydrophobicContact CG-SD 4.29Å; L421-M425 WeakPolarHBondContact O-CG 3.46Å; L421-M425 PolarHBondContact O-N 3.18Å
422	I	95.1	Very high	93.8	Very high	0 Å²	0	61.3 Å²	61.3	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-58.5	-50.1	175.7	-64.4	166.2	0	0	0	110	Y222 I225 V397 V401 R418 E419 C424 M425 S426	Y222-I422 HydrophobicContact CD2-CB 4.42Å; Y222-I422 HydrophobicContact CD2-CG2 3.76Å; Y222-I422 HydrophobicContact CE2-CB 4.36Å; Y222-I422 HydrophobicContact CE2-CG2 4.18Å; I225-I422 HydrophobicContact CD1-CG2 3.42Å; I225-I422 VanDerWaalsContact CD1-CG2 3.42Å; I225-I422 HydrophobicContact CG1-CD1 4.26Å; I225-I422 HydrophobicContact CG1-CG2 3.73Å; V397-I422 HydrophobicContact CG1-CG2 4.33Å; V401-I422 HydrophobicContact CB-CG1 4.38Å; V401-I422 HydrophobicContact CG1-CD1 4.36Å; V401-I422 HydrophobicContact CG1-CG1 3.91Å; V401-I422 HydrophobicContact CG2-CG1 3.61Å; R418-I422 HydrophobicContact CG-CD1 4.4Å; R418-I422 WeakPolarHBondContact O-CG1 3.29Å; R418-I422 PolarHBondContact O-N 3.14Å; E419-I422 PolarHBondContact O-N 3.24Å; I422-C424 VanDerWaalsContact C-N 3.31Å; I422-C424 PolarHBondContact O-N 3.37Å; I422-M425 PolarHBondContact O-N 2.89Å; I422-S426 WeakPolarHBondContact O-CB 3.27Å; I422-S426 PolarHBondContact O-N 3.41Å; I422-S426 PolarHBondContact O-OG 3.22Å
423	L	95.7	Very high	94.1	Very high	65 Å²	65	59.1 Å²	59.1	34%	0.34	29%	0.292	S	S	.	.	H	α-helix	trans	-57.8	-45	179.6	-177.7	61.5	0	0	0	111.5	Y222 E419 L420 S426 I427	Y222-L423 HydrophobicContact CD2-CB 4.22Å; Y222-L423 HydrophobicContact CD2-CD1 4.25Å; Y222-L423 HydrophobicContact CE2-CB 3.65Å; Y222-L423 HydrophobicContact CE2-CD1 4.16Å; Y222-L423 HydrophobicContact CE2-CG 4.44Å; E419-L423 PolarHBondContact O-N 3.29Å; L420-L423 PolarHBondContact O-N 2.96Å; L423-S426 PolarHBondContact O-N 3.36Å; L423-I427 HydrophobicContact CD1-CD1 3.96Å; L423-I427 HydrophobicContact CD1-CG1 4.3Å; L423-I427 HydrophobicContact CG-CD1 3.83Å; L423-I427 WeakPolarHBondContact O-CB 3.33Å; L423-I427 VanDerWaalsContact O-CG1 3.22Å; L423-I427 WeakPolarHBondContact O-CG1 3.29Å; L423-I427 PolarHBondContact O-N 3.32Å
424	C	95.6	Very high	94.6	Very high	74 Å²	74	58 Å²	58	50%	0.5	29%	0.29	S	S	.	.	H	α-helix	trans	-60.9	-48.1	177.6	-175	0	0	0	0	111.5	L420 L421 I422 I427 V428	L420-C424 VanDerWaalsContact O-CB 3.28Å; L420-C424 WeakPolarHBondContact O-CB 2.97Å; L420-C424 PolarHBondContact O-N 2.94Å; L421-C424 PolarHBondContact O-N 3.47Å; I422-C424 VanDerWaalsContact C-N 3.31Å; I422-C424 PolarHBondContact O-N 3.37Å; C424-I427 PolarHBondContact O-N 2.51Å; C424-V428 WeakPolarHBondContact O-CG2 3.47Å; C424-V428 PolarHBondContact O-N 2.64Å
425	M	94.8	Very high	94.9	Very high	40 Å²	40	60.5 Å²	60.5	20%	0.197	30%	0.304	C	S	.	.	H	α-helix	trans	-60.6	-45.9	176.8	-72.6	179.3	169.2	0	0	111.7	L400 V401 V404 L421 I422 I427 V428 S429	L400-M425 HydrophobicContact CB-SD 4.34Å; V401-M425 HydrophobicContact CG2-SD 3.64Å; V404-M425 HydrophobicContact CB-CE 4.17Å; V404-M425 HydrophobicContact CG2-CE 3.64Å; L421-M425 HydrophobicContact CD1-CE 3.89Å; L421-M425 HydrophobicContact CD1-CG 4.46Å; L421-M425 HydrophobicContact CD1-SD 4.49Å; L421-M425 HydrophobicContact CD2-CE 4.33Å; L421-M425 HydrophobicContact CG-CE 4.07Å; L421-M425 HydrophobicContact CG-SD 4.29Å; L421-M425 WeakPolarHBondContact O-CG 3.46Å; L421-M425 PolarHBondContact O-N 3.18Å; I422-M425 PolarHBondContact O-N 2.89Å; M425-I427 VanDerWaalsContact C-N 3.35Å; M425-I427 PolarHBondContact O-N 3.4Å; M425-V428 PolarHBondContact O-N 3.07Å; M425-S429 WeakPolarHBondContact O-CB 3.25Å; M425-S429 PolarHBondContact O-N 2.78Å; M425-S429 PolarHBondContact O-OG 2.94Å
426	S	95.9	Very high	95.4	Very high	5 Å²	5	58.6 Å²	58.6	4%	0.035	28%	0.284	C	S	.	.	H	α-helix	trans	-59.1	-42.9	175.5	-66.1	0	0	0	0	112.7	W218 I422 L423 F430	W218-S426 VanDerWaalsContact CE3-CB 3.41Å; W218-S426 VanDerWaalsContact CE3-OG 3.29Å; W218-S426 WeakPolarHBondContact CZ3-OG 3.42Å; I422-S426 WeakPolarHBondContact O-CB 3.27Å; I422-S426 PolarHBondContact O-N 3.41Å; I422-S426 PolarHBondContact O-OG 3.22Å; L423-S426 PolarHBondContact O-N 3.36Å; S426-F430 VanDerWaalsContact O-CB 3.26Å; S426-F430 WeakPolarHBondContact O-CB 3.41Å; S426-F430 PolarHBondContact O-N 3.34Å
427	I	96.9	Very high	95.8	Very high	79 Å²	79	49.9 Å²	49.9	41%	0.405	25%	0.25	S	C	.	.	H	α-helix	trans	-66.1	-44.9	178.8	-71.7	169.3	0	0	0	110.9	L423 C424 M425 F430 F431	L423-I427 HydrophobicContact CD1-CD1 3.96Å; L423-I427 HydrophobicContact CD1-CG1 4.3Å; L423-I427 HydrophobicContact CG-CD1 3.83Å; L423-I427 WeakPolarHBondContact O-CB 3.33Å; L423-I427 VanDerWaalsContact O-CG1 3.22Å; L423-I427 WeakPolarHBondContact O-CG1 3.29Å; L423-I427 PolarHBondContact O-N 3.32Å; C424-I427 PolarHBondContact O-N 2.51Å; M425-I427 VanDerWaalsContact C-N 3.35Å; M425-I427 PolarHBondContact O-N 3.4Å; I427-F430 WeakPolarHBondContact O-CB 3.05Å; I427-F430 PolarHBondContact O-N 3.18Å; I427-F431 HydrophobicContact CG2-CD2 3.74Å; I427-F431 HydrophobicContact CG2-CE2 3.44Å; I427-F431 VanDerWaalsContact CG2-CE2 3.44Å; I427-F431 WeakPolarHBondContact O-CD2 3.27Å; I427-F431 PolarHBondContact O-N 3.22Å
428	V	96.6	Very high	96	Very high	76 Å²	76	45.1 Å²	45.1	46%	0.461	23%	0.234	S	C	.	.	H	α-helix	trans	-61.9	-48	177.2	171.5	0	0	0	0	110.3	C424 M425 F430 F431 I432	C424-V428 WeakPolarHBondContact O-CG2 3.47Å; C424-V428 PolarHBondContact O-N 2.64Å; M425-V428 PolarHBondContact O-N 3.07Å; V428-F430 VanDerWaalsContact C-N 3.32Å; V428-F430 PolarHBondContact O-N 2.96Å; V428-F431 PolarHBondContact O-N 3.14Å; V428-I432 HydrophobicContact CG1-CD1 3.99Å; V428-I432 WeakPolarHBondContact O-CG1 3.44Å; V428-I432 PolarHBondContact O-N 3.4Å; V428-I432 VanDerWaalsContact O-N 3.11Å
429	S	96.3	Very high	96.2	Very high	12 Å²	12	45.2 Å²	45.2	8%	0.084	24%	0.236	C	C	.	.	H	α-helix	trans	-64.3	-34.6	177.9	-66	0	0	0	0	112.6	N129 M425 G433	N129-S429 PolarHBondContact ND2-OG 3.43Å; M425-S429 WeakPolarHBondContact O-CB 3.25Å; M425-S429 PolarHBondContact O-N 2.78Å; M425-S429 PolarHBondContact O-OG 2.94Å; S429-G433 PolarHBondContact O-N 2.93Å
430	F	97.5	Very high	96.3	Very high	43 Å²	43	43.3 Å²	43.3	19%	0.189	23%	0.227	C	C	.	.	H	α-helix	trans	-59.3	-50.6	171.6	169.4	-102.8	0	0	0	111.7	L214 A215 W218 S426 I427 V428 I432 G433 L434	L214-F430 HydrophobicContact CB-CE2 4.38Å; L214-F430 HydrophobicContact CD2-CD2 3.94Å; L214-F430 HydrophobicContact CD2-CE2 4.13Å; L214-F430 HydrophobicContact CG-CD2 3.9Å; L214-F430 HydrophobicContact CG-CE2 4.13Å; A215-F430 HydrophobicContact CB-CD2 4.41Å; A215-F430 HydrophobicContact CB-CE2 3.68Å; A215-F430 HydrophobicContact CB-CZ 4.1Å; W218-F430 AromaticContact CD1-CD2 3.86Å; W218-F430 HydrophobicContact CG-CB 4.26Å; S426-F430 VanDerWaalsContact O-CB 3.26Å; S426-F430 WeakPolarHBondContact O-CB 3.41Å; S426-F430 PolarHBondContact O-N 3.34Å; I427-F430 WeakPolarHBondContact O-CB 3.05Å; I427-F430 PolarHBondContact O-N 3.18Å; V428-F430 VanDerWaalsContact C-N 3.32Å; V428-F430 PolarHBondContact O-N 2.96Å; F430-I432 VanDerWaalsContact C-N 3.34Å; F430-I432 PolarHBondContact O-N 2.97Å; F430-G433 PolarHBondContact O-N 2.86Å; F430-G433 VanDerWaalsContact O-N 3.14Å; F430-L434 HydrophobicContact CE1-CD1 4.01Å; F430-L434 HydrophobicContact CE1-CD2 4.34Å; F430-L434 HydrophobicContact CE1-CG 4.27Å; F430-L434 HydrophobicContact CE2-CD2 3.97Å; F430-L434 HydrophobicContact CE2-CG 4.46Å; F430-L434 HydrophobicContact CZ-CD1 4.25Å; F430-L434 HydrophobicContact CZ-CD2 3.76Å; F430-L434 HydrophobicContact CZ-CG 4.17Å; F430-L434 WeakPolarHBondContact O-CG 3.03Å; F430-L434 PolarHBondContact O-N 3.08Å
431	F	97.8	Very high	96.4	Very high	130 Å²	130	38.2 Å²	38.2	57%	0.57	20%	0.201	S	C	*	.	H	α-helix	trans	-63.5	-37.6	-179.2	-77.7	-63.3	0	0	0	113.1	I427 V428 L434	I427-F431 HydrophobicContact CG2-CD2 3.74Å; I427-F431 HydrophobicContact CG2-CE2 3.44Å; I427-F431 VanDerWaalsContact CG2-CE2 3.44Å; I427-F431 WeakPolarHBondContact O-CD2 3.27Å; I427-F431 PolarHBondContact O-N 3.22Å; V428-F431 PolarHBondContact O-N 3.14Å; F431-L434 HydrophobicContact CD1-CD1 3.96Å
432	I	96.5	Very high	96.4	Very high	73 Å²	73	37.6 Å²	37.6	37%	0.374	20%	0.197	S	C	.	.	H	α-helix	trans	-67.9	-42.6	173.9	-58.4	168.5	0	0	0	109.9	V130 V428 F430 L434 I435	V130-I432 HydrophobicContact CG1-CB 3.99Å; V130-I432 HydrophobicContact CG1-CG2 3.61Å; V130-I432 HydrophobicContact CG2-CB 4.38Å; V130-I432 HydrophobicContact CG2-CD1 4.48Å; V130-I432 HydrophobicContact CG2-CG2 4.36Å; V428-I432 HydrophobicContact CG1-CD1 3.99Å; V428-I432 WeakPolarHBondContact O-CG1 3.44Å; V428-I432 PolarHBondContact O-N 3.4Å; V428-I432 VanDerWaalsContact O-N 3.11Å; F430-I432 VanDerWaalsContact C-N 3.34Å; F430-I432 PolarHBondContact O-N 2.97Å; I432-L434 PolarHBondContact O-N 2.79Å; I432-I435 WeakPolarHBondContact O-CB 3.06Å; I432-I435 WeakPolarHBondContact O-CG1 3.39Å; I432-I435 PolarHBondContact O-N 2.92Å
433	G	96.4	Very high	96.4	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-62.6	-25.7	179.1	0	0	0	0	0	114.2	S429 F430 I435 M436	S429-G433 PolarHBondContact O-N 2.93Å; F430-G433 PolarHBondContact O-N 2.86Å; F430-G433 VanDerWaalsContact O-N 3.14Å; G433-I435 PolarHBondContact O-N 2.82Å; G433-I435 VanDerWaalsContact O-N 3.13Å; G433-M436 WeakPolarHBondContact O-CB 3.5Å; G433-M436 PolarHBondContact O-N 2.96Å
434	L	97.7	Very high	96.4	Very high	33 Å²	33	36 Å²	36	17%	0.173	19%	0.189	C	C	.	.	G	3₁₀ helix	trans	-56.4	-29.3	175.5	-73.8	178	0	0	0	113.1	M206 A211 L214 F430 F431 I432 M436 C437	M206-L434 HydrophobicContact CE-CB 3.99Å; M206-L434 WeakPolarHBondContact CE-O 3.05Å; M206-L434 HydrophobicContact SD-CB 4.5Å; M206-L434 HydrophobicContact SD-CD2 4.37Å; A211-L434 HydrophobicContact CB-CD2 3.69Å; L214-L434 HydrophobicContact CD2-CD2 4.38Å; F430-L434 HydrophobicContact CE1-CD1 4.01Å; F430-L434 HydrophobicContact CE1-CD2 4.34Å; F430-L434 HydrophobicContact CE1-CG 4.27Å; F430-L434 HydrophobicContact CE2-CD2 3.97Å; F430-L434 HydrophobicContact CE2-CG 4.46Å; F430-L434 HydrophobicContact CZ-CD1 4.25Å; F430-L434 HydrophobicContact CZ-CD2 3.76Å; F430-L434 HydrophobicContact CZ-CG 4.17Å; F430-L434 WeakPolarHBondContact O-CG 3.03Å; F430-L434 PolarHBondContact O-N 3.08Å; F431-L434 HydrophobicContact CD1-CD1 3.96Å; I432-L434 PolarHBondContact O-N 2.79Å; L434-M436 PolarHBondContact O-N 3.36Å; L434-C437 WeakPolarHBondContact O-CB 3.41Å; L434-C437 PolarHBondContact O-N 2.82Å
435	I	96.8	Very high	96.3	Very high	86 Å²	86	32.7 Å²	32.7	44%	0.441	17%	0.166	S	C	.	.	G	3₁₀ helix	trans	-59.3	-36.1	176	-59.8	173.4	0	0	0	110.4	M203 I432 G433 C437 T438 V444	M203-I435 HydrophobicContact CE-CG2 3.58Å; I432-I435 WeakPolarHBondContact O-CB 3.06Å; I432-I435 WeakPolarHBondContact O-CG1 3.39Å; I432-I435 PolarHBondContact O-N 2.92Å; G433-I435 PolarHBondContact O-N 2.82Å; G433-I435 VanDerWaalsContact O-N 3.13Å; I435-C437 VanDerWaalsContact C-N 3.28Å; I435-C437 PolarHBondContact O-N 2.84Å; I435-T438 PolarHBondContact O-N 3.24Å; I435-T438 PolarHBondContact O-OG1 3.37Å; I435-V444 HydrophobicContact CG2-CG1 4.18Å; I435-V444 HydrophobicContact CG2-CG2 4.18Å
436	M	96.7	Very high	96.2	Very high	3 Å²	3	32.5 Å²	32.5	2%	0.015	17%	0.165	C	C	.	.	G	3₁₀ helix	trans	-80.1	-7.5	177.6	-57.7	177	-148.4	0	0	113.3	V130 V134 G433 L434 V444 F445 F448	V130-M436 HydrophobicContact CG1-CE 3.72Å; V134-M436 HydrophobicContact CG1-CB 4.21Å; V134-M436 HydrophobicContact CG2-CB 4Å; V134-M436 HydrophobicContact CG2-SD 3.9Å; G433-M436 WeakPolarHBondContact O-CB 3.5Å; G433-M436 PolarHBondContact O-N 2.96Å; L434-M436 PolarHBondContact O-N 3.36Å; M436-V444 HydrophobicContact CE-CG1 4.47Å; M436-V444 HydrophobicContact CG-CB 4.3Å; M436-V444 HydrophobicContact CG-CG1 4.01Å; M436-F445 HydrophobicContact CG-CB 4.45Å; M436-F445 HydrophobicContact SD-CB 4.24Å; M436-F445 HydrophobicContact SD-CD2 4.26Å; M436-F448 HydrophobicContact CE-CB 4.48Å; M436-F448 HydrophobicContact CE-CD1 3.88Å; M436-F448 HydrophobicContact CE-CD2 3.46Å; M436-F448 VanDerWaalsContact CE-CD2 3.46Å; M436-F448 HydrophobicContact CE-CE1 3.88Å; M436-F448 HydrophobicContact CE-CE2 3.47Å; M436-F448 VanDerWaalsContact CE-CE2 3.47Å; M436-F448 HydrophobicContact CE-CG 3.67Å; M436-F448 HydrophobicContact CE-CZ 3.67Å
437	C	97.6	Very high	96.1	Very high	1 Å²	1	32.4 Å²	32.4	1%	0.007	16%	0.164	C	C	.	.	G	3₁₀ helix	trans	-94.6	9.8	171.7	-62.9	0	0	0	0	113	M206 R207 L210 L434 I435	M206-C437 HydrophobicContact SD-CB 3.93Å; R207-C437 WeakPolarHBondContact CA-O 3.42Å; R207-C437 WeakPolarHBondContact CB-O 3.34Å; R207-C437 WeakPolarHBondContact CG-O 3.46Å; R207-C437 PolarHBondContact N-O 2.95Å; L210-C437 HydrophobicContact CB-CB 4.34Å; L434-C437 WeakPolarHBondContact O-CB 3.41Å; L434-C437 PolarHBondContact O-N 2.82Å; I435-C437 VanDerWaalsContact C-N 3.28Å; I435-C437 PolarHBondContact O-N 2.84Å
438	T	97.4	Very high	96	Very high	20 Å²	20	29.9 Å²	29.9	12%	0.123	15%	0.15	C	C	.	.	B	Isolated β-bridge	trans	-85.6	169.8	170.7	62.9	0	0	0	0	111.1	M203 E205 M206 I435 G440 G441	M203-T438 WeakPolarHBondContact CE-OG1 3.2Å; M203-T438 WeakPolarHBondContact O-CB 3.48Å; M203-T438 PolarHBondContact O-OG1 3.48Å; E205-T438 WeakPolarHBondContact O-CA 3.45Å; M206-T438 HydrophobicContact CE-CG2 3.81Å; M206-T438 HydrophobicContact SD-CG2 4.2Å; I435-T438 PolarHBondContact O-N 3.24Å; I435-T438 PolarHBondContact O-OG1 3.37Å; T438-G440 VanDerWaalsContact C-N 3.28Å; T438-G440 PolarHBondContact O-N 3.01Å; T438-G441 WeakPolarHBondContact O-CA 3.35Å; T438-G441 PolarHBondContact O-N 3.41Å; T438-G441 PolarHBondContact OG1-N 3.12Å
439	E	96.7	Very high	95.6	Very high	42 Å²	42	29 Å²	29	20%	0.196	14%	0.143	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-37	175.2	-68.5	179.3	160.4	0	0	112.4	K195 I196 S197 M203 G204 E205 G441	K195-E439 HydrophobicContact CB-CG 3.96Å; K195-E439 WeakPolarHBondContact O-CA 3.45Å; K195-E439 WeakPolarHBondContact O-CB 3.3Å; K195-E439 WeakPolarHBondContact O-CG 3.45Å; I196-E439 WeakPolarHBondContact CA-O 3.48Å; S197-E439 PolarHBondContact N-O 3.16Å; S197-E439 VanDerWaalsContact N-O 3.08Å; M203-E439 PolarHBondContact O-N 2.75Å; G204-E439 WeakPolarHBondContact CA-OE2 3.46Å; E205-E439 PolarHBondContact N-OE2 3.37Å; E205-E439 VanDerWaalsContact N-OE2 3.07Å; E205-E439 PolarHBondContact O-N 3.4Å; E205-E439 VanDerWaalsContact O-N 3.09Å; E439-G441 VanDerWaalsContact C-N 3.26Å; E439-G441 PolarHBondContact O-N 3.41Å
440	G	95.4	Very high	95.3	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	15%	0.153	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.8	3.4	170.7	0	0	0	0	0	114.6	S197 M203 T438 M442 Y443	S197-G440 VanDerWaalsContact OG-CA 3.24Å; S197-G440 WeakPolarHBondContact OG-CA 3.43Å; M203-G440 PolarHBondContact O-N 2.84Å; T438-G440 VanDerWaalsContact C-N 3.28Å; T438-G440 PolarHBondContact O-N 3.01Å; G440-M442 VanDerWaalsContact C-N 3.29Å; G440-M442 PolarHBondContact O-N 2.82Å; G440-Y443 PolarHBondContact O-N 2.91Å
441	G	96.1	Very high	94.9	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-63.7	-28.8	-169.9	0	0	0	0	0	114.6	T438 E439 Y443 V444 F445	T438-G441 WeakPolarHBondContact O-CA 3.35Å; T438-G441 PolarHBondContact O-N 3.41Å; T438-G441 PolarHBondContact OG1-N 3.12Å; E439-G441 VanDerWaalsContact C-N 3.26Å; E439-G441 PolarHBondContact O-N 3.41Å; G441-Y443 VanDerWaalsContact C-N 3.31Å; G441-Y443 PolarHBondContact O-N 3.14Å; G441-V444 PolarHBondContact O-N 3.2Å; G441-F445 WeakPolarHBondContact O-CB 3.32Å; G441-F445 PolarHBondContact O-N 3.25Å
442	M	94.3	Very high	94.5	Very high	7 Å²	7	22.5 Å²	22.5	3%	0.034	12%	0.119	C	C	.	.	H	α-helix	trans	-63.7	-35.7	177.7	-172	62.4	-159.6	0	0	112.3	W138 W189 L194 I196 P357 G440 F445 Q446 Y522	W138-M442 HydrophobicContact CH2-CE 4.45Å; W138-M442 HydrophobicContact CH2-SD 3.73Å; W138-M442 HydrophobicContact CZ2-SD 3.99Å; W189-M442 HydrophobicContact CZ2-SD 4.43Å; L194-M442 HydrophobicContact CD1-CB 4.13Å; L194-M442 HydrophobicContact CD1-CG 4.11Å; L194-M442 HydrophobicContact CD1-SD 4.26Å; I196-M442 HydrophobicContact CD1-CB 3.93Å; I196-M442 HydrophobicContact CD1-CG 4.15Å; P357-M442 HydrophobicContact CG-CE 4.26Å; G440-M442 VanDerWaalsContact C-N 3.29Å; G440-M442 PolarHBondContact O-N 2.82Å; M442-F445 HydrophobicContact CE-CD1 4Å; M442-F445 HydrophobicContact CE-CE1 4.4Å; M442-F445 WeakPolarHBondContact O-CB 3.14Å; M442-F445 PolarHBondContact O-N 3Å; M442-F445 HydrophobicContact SD-CD1 4.24Å; M442-Q446 HydrophobicContact CE-CG 4.03Å; M442-Q446 WeakPolarHBondContact O-CG 3.21Å; M442-Q446 PolarHBondContact O-N 2.98Å; M442-Y522 HydrophobicContact CE-CE2 4.16Å; M442-Y522 HydrophobicContact CG-CE2 3.94Å
443	Y	95	Very high	93.5	Very high	12 Å²	12	19 Å²	19	5%	0.047	10%	0.101	C	C	.	.	H	α-helix	trans	-68.1	-40.2	176.7	-59.9	-70.7	0	0	0	111.7	I196 S197 D198 G199 I200 G440 G441 Q446 L447 Y522 Y526 Y528	I196-Y443 HydrophobicContact CD1-CE2 4.4Å; I196-Y443 HydrophobicContact CG1-CE2 4.07Å; S197-Y443 WeakPolarHBondContact O-CE2 3.13Å; S197-Y443 PolarHBondContact O-OH 3.48Å; S197-Y443 VanDerWaalsContact O-OH 3.07Å; D198-Y443 PolarHBondContact O-OH 2.99Å; G199-Y443 VanDerWaalsContact CA-CE2 3.43Å; I200-Y443 HydrophobicContact CB-CG 4.34Å; G440-Y443 PolarHBondContact O-N 2.91Å; G441-Y443 VanDerWaalsContact C-N 3.31Å; G441-Y443 PolarHBondContact O-N 3.14Å; Y443-Q446 PolarHBondContact O-N 3.18Å; Y443-L447 PolarHBondContact O-N 2.94Å; Y443-L447 VanDerWaalsContact O-N 3.15Å; Y443-Y522 HydrophobicContact CD1-CD1 4.26Å; Y443-Y522 HydrophobicContact CD1-CG 4.22Å; Y443-Y522 AromaticContact CE1-CD1 3.48Å; Y443-Y522 HydrophobicContact CE1-CD1 3.48Å; Y443-Y522 VanDerWaalsContact CE1-CD1 3.48Å; Y443-Y522 HydrophobicContact CE1-CE1 4.23Å; Y443-Y522 AromaticContact CE1-CG 3.84Å; Y443-Y522 HydrophobicContact CE1-CG 3.84Å; Y443-Y526 AromaticContact CD1-CD1 3.68Å; Y443-Y526 HydrophobicContact CD1-CD1 3.68Å; Y443-Y526 AromaticContact CD1-CE1 3.65Å; Y443-Y526 HydrophobicContact CD1-CE1 3.65Å; Y443-Y526 HydrophobicContact CD1-CG 4.43Å; Y443-Y526 AromaticContact CE1-CD1 3.41Å; Y443-Y526 HydrophobicContact CE1-CD1 3.41Å; Y443-Y526 VanDerWaalsContact CE1-CD1 3.41Å; Y443-Y526 HydrophobicContact CE1-CD2 4.29Å; Y443-Y526 AromaticContact CE1-CE1 3.73Å; Y443-Y526 HydrophobicContact CE1-CE1 3.73Å; Y443-Y526 AromaticContact CE1-CG 3.71Å; Y443-Y526 HydrophobicContact CE1-CG 3.71Å; Y443-Y526 HydrophobicContact CG-CE1 4.43Å; Y443-Y528 WeakPolarHBondContact CA-OH 3.49Å; Y443-Y528 HydrophobicContact CD1-CE1 4.38Å; Y443-Y528 PolarHBondContact O-OH 3.13Å
444	V	95.8	Very high	92.7	Very high	20 Å²	20	19.4 Å²	19.4	12%	0.121	10%	0.104	C	C	.	.	H	α-helix	trans	-65.3	-45.5	174.6	-179.2	0	0	0	0	110.5	I200 M203 I435 M436 G441 Q446 L447 F448	I200-V444 HydrophobicContact CD1-CG2 4.15Å; I200-V444 HydrophobicContact CG1-CG2 4.16Å; M203-V444 HydrophobicContact CE-CG2 3.68Å; M203-V444 HydrophobicContact SD-CG2 4.01Å; I435-V444 HydrophobicContact CG2-CG1 4.18Å; I435-V444 HydrophobicContact CG2-CG2 4.18Å; M436-V444 HydrophobicContact CE-CG1 4.47Å; M436-V444 HydrophobicContact CG-CB 4.3Å; M436-V444 HydrophobicContact CG-CG1 4.01Å; G441-V444 PolarHBondContact O-N 3.2Å; V444-Q446 VanDerWaalsContact C-N 3.26Å; V444-Q446 PolarHBondContact O-N 3.28Å; V444-L447 WeakPolarHBondContact O-CB 3.18Å; V444-L447 PolarHBondContact O-N 2.89Å; V444-L447 VanDerWaalsContact O-N 3.08Å; V444-F448 HydrophobicContact CG1-CD2 4.08Å; V444-F448 HydrophobicContact CG1-CE2 3.98Å; V444-F448 WeakPolarHBondContact O-CD2 3.27Å; V444-F448 PolarHBondContact O-N 3.18Å; V444-F448 VanDerWaalsContact O-N 3.13Å
445	F	94.9	Very high	91.9	Very high	4 Å²	4	18.2 Å²	18.2	2%	0.018	10%	0.1	C	C	.	.	H	α-helix	trans	-53	-45	175.2	173.9	-85.6	0	0	0	111.5	Y131 V134 I135 W138 P357 M436 G441 M442 L447 F448 D449	Y131-F445 HydrophobicContact CD2-CD2 4.06Å; Y131-F445 AromaticContact CD2-CE2 3.62Å; Y131-F445 HydrophobicContact CD2-CE2 3.62Å; Y131-F445 AromaticContact CD2-CZ 3.99Å; Y131-F445 HydrophobicContact CD2-CZ 3.99Å; Y131-F445 HydrophobicContact CE2-CE2 4.36Å; Y131-F445 HydrophobicContact CE2-CZ 4.3Å; Y131-F445 WeakPolarHBondContact O-CE2 3.14Å; V134-F445 HydrophobicContact CB-CD2 4.31Å; V134-F445 HydrophobicContact CB-CE2 4.49Å; V134-F445 HydrophobicContact CG1-CD2 4.45Å; I135-F445 HydrophobicContact CD1-CE2 4.24Å; I135-F445 HydrophobicContact CD1-CZ 3.94Å; I135-F445 HydrophobicContact CG1-CE2 3.7Å; I135-F445 HydrophobicContact CG1-CZ 3.71Å; W138-F445 HydrophobicContact CH2-CB 4.5Å; W138-F445 AromaticContact CH2-CD1 3.78Å; W138-F445 HydrophobicContact CH2-CD1 3.78Å; W138-F445 AromaticContact CH2-CD2 3.59Å; W138-F445 HydrophobicContact CH2-CD2 3.59Å; W138-F445 AromaticContact CH2-CE1 3.81Å; W138-F445 HydrophobicContact CH2-CE1 3.81Å; W138-F445 AromaticContact CH2-CE2 3.59Å; W138-F445 HydrophobicContact CH2-CE2 3.59Å; W138-F445 AromaticContact CH2-CG 3.68Å; W138-F445 HydrophobicContact CH2-CG 3.68Å; W138-F445 AromaticContact CH2-CZ 3.72Å; W138-F445 HydrophobicContact CH2-CZ 3.72Å; W138-F445 HydrophobicContact CZ2-CD2 4.18Å; W138-F445 HydrophobicContact CZ2-CE2 4.48Å; W138-F445 HydrophobicContact CZ2-CG 4.31Å; W138-F445 HydrophobicContact CZ3-CD2 4.33Å; W138-F445 HydrophobicContact CZ3-CE1 4.1Å; W138-F445 AromaticContact CZ3-CE2 3.87Å; W138-F445 HydrophobicContact CZ3-CE2 3.87Å; W138-F445 AromaticContact CZ3-CZ 3.75Å; W138-F445 HydrophobicContact CZ3-CZ 3.75Å; P357-F445 HydrophobicContact CG-CE1 4.06Å; P357-F445 HydrophobicContact CG-CZ 4.49Å; M436-F445 HydrophobicContact CG-CB 4.45Å; M436-F445 HydrophobicContact SD-CB 4.24Å; M436-F445 HydrophobicContact SD-CD2 4.26Å; G441-F445 WeakPolarHBondContact O-CB 3.32Å; G441-F445 PolarHBondContact O-N 3.25Å; M442-F445 HydrophobicContact CE-CD1 4Å; M442-F445 HydrophobicContact CE-CE1 4.4Å; M442-F445 WeakPolarHBondContact O-CB 3.14Å; M442-F445 PolarHBondContact O-N 3Å; M442-F445 HydrophobicContact SD-CD1 4.24Å; F445-L447 PolarHBondContact O-N 2.87Å; F445-F448 WeakPolarHBondContact O-CB 3.44Å; F445-F448 PolarHBondContact O-N 2.86Å; F445-D449 HydrophobicContact CE1-CB 4.46Å; F445-D449 PolarHBondContact O-N 3.19Å
446	Q	92.4	Very high	91.5	Very high	36 Å²	36	14.5 Å²	14.5	17%	0.168	8%	0.081	C	C	.	.	H	α-helix	trans	-67.1	-33.1	178.1	-74.3	-152.5	-30.1	0	0	114.2	M442 Y443 V444 F448 D449 A450 L520 Y522 Y528	M442-Q446 HydrophobicContact CE-CG 4.03Å; M442-Q446 WeakPolarHBondContact O-CG 3.21Å; M442-Q446 PolarHBondContact O-N 2.98Å; Y443-Q446 PolarHBondContact O-N 3.18Å; V444-Q446 VanDerWaalsContact C-N 3.26Å; V444-Q446 PolarHBondContact O-N 3.28Å; Q446-F448 VanDerWaalsContact C-N 3.33Å; Q446-D449 PolarHBondContact O-N 3.16Å; Q446-A450 WeakPolarHBondContact O-CB 3.47Å; Q446-A450 PolarHBondContact O-N 3.25Å; Q446-L520 HydrophobicContact CB-CD2 4.21Å; Q446-Y522 HydrophobicContact CG-CD2 4.42Å; Q446-Y522 VanDerWaalsContact NE2-CD2 3.28Å; Q446-Y522 VanDerWaalsContact OE1-CD2 3.22Å; Q446-Y528 WeakPolarHBondContact CB-OH 3.5Å; Q446-Y528 PolarHBondContact OE1-OH 3.23Å; Q446-Y528 VanDerWaalsContact OE1-OH 3.09Å
447	L	93.5	Very high	91.3	Very high	4 Å²	4	14.4 Å²	14.4	2%	0.021	8%	0.08	C	C	.	.	H	α-helix	trans	-63.6	-41.7	172.9	-73	175.2	0	0	0	111.3	I200 Y443 V444 F445 Y451 L520 Y528	I200-L447 HydrophobicContact CD1-CD1 3.41Å; I200-L447 VanDerWaalsContact CD1-CD1 3.41Å; I200-L447 HydrophobicContact CD1-CG 4.49Å; Y443-L447 PolarHBondContact O-N 2.94Å; Y443-L447 VanDerWaalsContact O-N 3.15Å; V444-L447 WeakPolarHBondContact O-CB 3.18Å; V444-L447 PolarHBondContact O-N 2.89Å; V444-L447 VanDerWaalsContact O-N 3.08Å; F445-L447 PolarHBondContact O-N 2.87Å; L447-Y451 HydrophobicContact CD2-CD2 4.06Å; L447-Y451 HydrophobicContact CD2-CE2 3.97Å; L447-Y451 WeakPolarHBondContact O-CB 3.31Å; L447-Y451 PolarHBondContact O-N 3.15Å; L447-L520 HydrophobicContact CD2-CD2 4.02Å; L447-Y528 HydrophobicContact CD1-CD1 4.39Å; L447-Y528 HydrophobicContact CD1-CE1 4.27Å; L447-Y528 HydrophobicContact CD2-CD1 4.08Å; L447-Y528 HydrophobicContact CD2-CE1 4.05Å; L447-Y528 HydrophobicContact CG-CD1 4.26Å; L447-Y528 HydrophobicContact CG-CE1 3.87Å
448	F	93.6	Very high	91	Very high	25 Å²	25	14.3 Å²	14.3	11%	0.11	8%	0.08	C	C	.	.	I	π-helix	trans	-60.7	-51.2	174.3	-87.6	-105.4	0	0	0	111.6	H127 V130 Y131 M436 V444 F445 Q446 A450 A452 A453 M539	H127-F448 HydrophobicContact CB-CD1 4.27Å; H127-F448 HydrophobicContact CB-CE1 4.35Å; H127-F448 AromaticContact CD2-CE1 3.89Å; V130-F448 HydrophobicContact CB-CE1 4.33Å; V130-F448 HydrophobicContact CG1-CE1 4.19Å; V130-F448 HydrophobicContact CG1-CZ 4.49Å; Y131-F448 HydrophobicContact CD1-CB 3.9Å; Y131-F448 HydrophobicContact CD1-CD1 4.18Å; Y131-F448 HydrophobicContact CD2-CB 4.33Å; Y131-F448 HydrophobicContact CG-CB 3.72Å; Y131-F448 HydrophobicContact CG-CD1 4.4Å; Y131-F448 HydrophobicContact CG-CG 4.43Å; M436-F448 HydrophobicContact CE-CB 4.48Å; M436-F448 HydrophobicContact CE-CD1 3.88Å; M436-F448 HydrophobicContact CE-CD2 3.46Å; M436-F448 VanDerWaalsContact CE-CD2 3.46Å; M436-F448 HydrophobicContact CE-CE1 3.88Å; M436-F448 HydrophobicContact CE-CE2 3.47Å; M436-F448 VanDerWaalsContact CE-CE2 3.47Å; M436-F448 HydrophobicContact CE-CG 3.67Å; M436-F448 HydrophobicContact CE-CZ 3.67Å; V444-F448 HydrophobicContact CG1-CD2 4.08Å; V444-F448 HydrophobicContact CG1-CE2 3.98Å; V444-F448 WeakPolarHBondContact O-CD2 3.27Å; V444-F448 PolarHBondContact O-N 3.18Å; V444-F448 VanDerWaalsContact O-N 3.13Å; F445-F448 WeakPolarHBondContact O-CB 3.44Å; F445-F448 PolarHBondContact O-N 2.86Å; Q446-F448 VanDerWaalsContact C-N 3.33Å; F448-A450 PolarHBondContact O-N 2.71Å; F448-A452 HydrophobicContact CD1-CB 4.41Å; F448-A452 VanDerWaalsContact O-CB 3.31Å; F448-A452 WeakPolarHBondContact O-CB 3.21Å; F448-A452 PolarHBondContact O-N 2.96Å; F448-A453 PolarHBondContact O-N 3.27Å; F448-M539 HydrophobicContact CB-CE 4.32Å; F448-M539 HydrophobicContact CD1-CE 3.46Å; F448-M539 VanDerWaalsContact CD1-CE 3.46Å; F448-M539 HydrophobicContact CD2-CE 3.4Å; F448-M539 HydrophobicContact CD2-SD 4.29Å; F448-M539 HydrophobicContact CE1-CE 3.44Å; F448-M539 VanDerWaalsContact CE1-CE 3.44Å; F448-M539 HydrophobicContact CE2-CE 3.37Å; F448-M539 HydrophobicContact CE2-SD 4.28Å; F448-M539 HydrophobicContact CG-CE 3.45Å; F448-M539 VanDerWaalsContact CG-CE 3.45Å; F448-M539 HydrophobicContact CZ-CE 3.41Å; F448-M539 VanDerWaalsContact CZ-CE 3.41Å
449	D	89.9	Confident	90.8	Very high	58 Å²	58	13.4 Å²	13.4	31%	0.31	7%	0.074	S	C	.	.	I	π-helix	trans	-65.3	-37.4	-177.9	-170.4	54.1	0	0	0	112.8	Y131 F445 Q446	Y131-D449 HydrophobicContact CD2-CB 4.33Å; Y131-D449 HydrophobicContact CE2-CB 3.73Å; Y131-D449 WeakPolarHBondContact CE2-OD1 3.49Å; Y131-D449 PolarHBondContact OH-OD1 3.11Å; F445-D449 HydrophobicContact CE1-CB 4.46Å; F445-D449 PolarHBondContact O-N 3.19Å; Q446-D449 PolarHBondContact O-N 3.16Å
450	A	88.7	Confident	90.6	Very high	35 Å²	35	12.9 Å²	12.9	29%	0.289	7%	0.071	S	C	.	.	I	π-helix	trans	-84	-29.9	-176	0	0	0	0	0	114.2	Q446 F448 S454 L520	Q446-A450 WeakPolarHBondContact O-CB 3.47Å; Q446-A450 PolarHBondContact O-N 3.25Å; F448-A450 PolarHBondContact O-N 2.71Å; A450-S454 WeakPolarHBondContact O-CB 3.44Å; A450-L520 HydrophobicContact CB-CD1 3.8Å; A450-L520 HydrophobicContact CB-CD2 3.85Å; A450-L520 HydrophobicContact CB-CG 4.34Å
451	Y	90.7	Very high	90.7	Very high	13 Å²	13	12.9 Å²	12.9	5%	0.051	7%	0.071	C	C	.	.	I	π-helix	trans	-117.9	-44	-173.2	-68.2	-92	0	0	0	114.7	L447 S454 Y517 L520 G536 A540	L447-Y451 HydrophobicContact CD2-CD2 4.06Å; L447-Y451 HydrophobicContact CD2-CE2 3.97Å; L447-Y451 WeakPolarHBondContact O-CB 3.31Å; L447-Y451 PolarHBondContact O-N 3.15Å; Y451-S454 VanDerWaalsContact O-CB 3.23Å; Y451-S454 WeakPolarHBondContact O-CB 3.2Å; Y451-S454 PolarHBondContact O-OG 3.22Å; Y451-Y517 HydrophobicContact CE1-CE2 4.15Å; Y451-Y517 WeakPolarHBondContact CE1-OH 3.31Å; Y451-Y517 PolarHBondContact OH-OH 3.13Å; Y451-L520 HydrophobicContact CE2-CB 3.96Å; Y451-L520 HydrophobicContact CE2-CD2 4.05Å; Y451-G536 WeakPolarHBondContact CB-O 3.31Å; Y451-A540 WeakPolarHBondContact O-CB 3.18Å
452	A	87.4	Confident	90.6	Very high	0 Å²	0	12.9 Å²	12.9	0%	0	7%	0.071	C	C	.	.	I	π-helix	trans	-75.9	-54.4	-166.2	0	0	0	0	0	112.9	H127 F448 M539	H127-A452 HydrophobicContact CB-CB 3.74Å; F448-A452 HydrophobicContact CD1-CB 4.41Å; F448-A452 VanDerWaalsContact O-CB 3.31Å; F448-A452 WeakPolarHBondContact O-CB 3.21Å; F448-A452 PolarHBondContact O-N 2.96Å; A452-M539 HydrophobicContact CB-CB 3.99Å; A452-M539 HydrophobicContact CB-CE 3.45Å; A452-M539 VanDerWaalsContact CB-CE 3.45Å; A452-M539 HydrophobicContact CB-SD 4.46Å
453	A	76.5	Confident	90.7	Very high	0 Å²	0	13.5 Å²	13.5	0%	0	8%	0.075	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.2	64.6	165.5	0	0	0	0	0	107	I124 L128 Y131 F290 F448	I124-A453 HydrophobicContact CG2-CB 4.01Å; L128-A453 HydrophobicContact CB-CB 4.22Å; L128-A453 HydrophobicContact CD1-CB 3.82Å; Y131-A453 HydrophobicContact CE1-CB 4.06Å; F290-A453 HydrophobicContact CE1-CB 4.39Å; F290-A453 WeakPolarHBondContact CE1-O 3.29Å; F290-A453 WeakPolarHBondContact CZ-O 3.46Å; F448-A453 PolarHBondContact O-N 3.27Å
454	S	80.3	Confident	90.8	Very high	8 Å²	8	15.2 Å²	15.2	6%	0.056	8%	0.082	C	C	.	.			trans	-97.9	155.7	-179.8	67.1	0	0	0	0	111.9	A450 Y451 M456 C457 L458	A450-S454 WeakPolarHBondContact O-CB 3.44Å; Y451-S454 VanDerWaalsContact O-CB 3.23Å; Y451-S454 WeakPolarHBondContact O-CB 3.2Å; Y451-S454 PolarHBondContact O-OG 3.22Å; S454-M456 PolarHBondContact O-N 3.48Å; S454-C457 PolarHBondContact O-N 2.98Å; S454-C457 PolarHBondContact OG-SG 3.43Å; S454-C457 VanDerWaalsContact OG-SG 3.38Å; S454-L458 PolarHBondContact O-N 2.78Å
455	G	81.3	Confident	90.9	Very high	9 Å²	9	14.3 Å²	14.3	9%	0.093	8%	0.077	C	C	.	.	H	α-helix	trans	-58.8	-25.6	-178.4	0	0	0	0	0	111.7	F290 L459	F290-G455 VanDerWaalsContact CE2-CA 3.41Å; F290-G455 VanDerWaalsContact CZ-N 3.33Å; G455-L459 WeakPolarHBondContact O-CB 3.5Å; G455-L459 WeakPolarHBondContact O-CD1 3.48Å; G455-L459 WeakPolarHBondContact O-CG 3.48Å; G455-L459 PolarHBondContact O-N 3.02Å
456	M	86.7	Confident	90.9	Very high	8 Å²	8	14.1 Å²	14.1	4%	0.039	8%	0.076	C	C	.	.	H	α-helix	trans	-66.8	-43.9	174.6	-70.3	-54.7	-76.5	0	0	114.3	S454 L458 L459 F460 F510 F513 L514	S454-M456 PolarHBondContact O-N 3.48Å; M456-L458 VanDerWaalsContact C-N 3.31Å; M456-L459 PolarHBondContact O-N 2.71Å; M456-L459 HydrophobicContact SD-CD1 4.42Å; M456-F460 WeakPolarHBondContact O-CB 3.35Å; M456-F460 PolarHBondContact O-N 2.88Å; M456-F510 HydrophobicContact CE-CB 4.35Å; M456-F510 HydrophobicContact CE-CD1 4.45Å; M456-F510 HydrophobicContact CE-CD2 3.17Å; M456-F510 HydrophobicContact CE-CE2 3.35Å; M456-F510 HydrophobicContact CE-CG 3.77Å; M456-F510 HydrophobicContact CE-CZ 4.09Å; M456-F510 WeakPolarHBondContact CE-O 3.06Å; M456-F510 HydrophobicContact SD-CD2 3.98Å; M456-F510 HydrophobicContact SD-CE2 4.5Å; M456-F513 HydrophobicContact CE-CB 3.64Å; M456-F513 HydrophobicContact CE-CD1 3.41Å; M456-F513 VanDerWaalsContact CE-CD1 3.41Å; M456-F513 HydrophobicContact CE-CE1 4.24Å; M456-F513 HydrophobicContact CE-CG 3.73Å; M456-F513 HydrophobicContact CG-CB 4.4Å; M456-F513 HydrophobicContact CG-CD1 3.27Å; M456-F513 HydrophobicContact CG-CD2 3.87Å; M456-F513 HydrophobicContact CG-CE1 3.24Å; M456-F513 HydrophobicContact CG-CE2 3.85Å; M456-F513 HydrophobicContact CG-CG 3.6Å; M456-F513 HydrophobicContact CG-CZ 3.53Å; M456-F513 HydrophobicContact SD-CB 3.25Å; M456-F513 WeakPolarHBondContact SD-CB 3.4Å; M456-F513 HydrophobicContact SD-CD1 3.26Å; M456-F513 WeakPolarHBondContact SD-CD1 3.34Å; M456-F513 HydrophobicContact SD-CD2 3.65Å; M456-F513 HydrophobicContact SD-CE1 3.92Å; M456-F513 HydrophobicContact SD-CE2 4.26Å; M456-F513 HydrophobicContact SD-CG 3.09Å; M456-F513 WeakPolarHBondContact SD-CG 3.42Å; M456-F513 HydrophobicContact SD-CZ 4.37Å; M456-L514 HydrophobicContact CE-CD2 4.01Å; M456-L514 HydrophobicContact CE-CG 3.93Å
457	C	92.2	Very high	91.1	Very high	0 Å²	0	15.3 Å²	15.3	0%	0	8%	0.083	C	C	.	.	H	α-helix	trans	-63.7	-43.7	177.6	-61	0	0	0	0	109.8	I124 S454 F460 V461	I124-C457 HydrophobicContact CD1-CB 3.85Å; I124-C457 HydrophobicContact CG1-CB 4.3Å; S454-C457 PolarHBondContact O-N 2.98Å; S454-C457 PolarHBondContact OG-SG 3.43Å; S454-C457 VanDerWaalsContact OG-SG 3.38Å; C457-F460 PolarHBondContact O-N 3.44Å; C457-V461 WeakPolarHBondContact O-CG2 3.38Å; C457-V461 PolarHBondContact O-N 3.26Å
458	L	92.4	Very high	91.2	Very high	0 Å²	0	15.1 Å²	15.1	0%	0	8%	0.082	C	C	.	.	H	α-helix	trans	-63.4	-47.8	177.8	-59.1	-175.9	0	0	0	112.2	I124 F289 F290 C295 L296 S454 M456 F460 V461 A462	I124-L458 HydrophobicContact CD1-CD2 4.29Å; I124-L458 HydrophobicContact CG2-CD2 4.31Å; F289-L458 HydrophobicContact CB-CB 4.3Å; F289-L458 HydrophobicContact CB-CD1 4.06Å; F289-L458 HydrophobicContact CD1-CB 4.14Å; F290-L458 HydrophobicContact CD1-CD1 3.72Å; F290-L458 HydrophobicContact CD2-CD1 4.23Å; F290-L458 HydrophobicContact CE1-CD1 3.47Å; F290-L458 VanDerWaalsContact CE1-CD1 3.47Å; F290-L458 HydrophobicContact CE1-CG 4.35Å; F290-L458 HydrophobicContact CE2-CD1 4.02Å; F290-L458 HydrophobicContact CG-CD1 4.04Å; F290-L458 HydrophobicContact CZ-CD1 3.57Å; F290-L458 HydrophobicContact CZ-CG 4.24Å; C295-L458 HydrophobicContact CB-CB 4.46Å; C295-L458 HydrophobicContact CB-CD2 4.23Å; L296-L458 HydrophobicContact CD2-CD2 3.59Å; L296-L458 HydrophobicContact CG-CD2 4.07Å; S454-L458 PolarHBondContact O-N 2.78Å; M456-L458 VanDerWaalsContact C-N 3.31Å; L458-F460 VanDerWaalsContact C-N 3.28Å; L458-F460 PolarHBondContact O-N 2.87Å; L458-V461 PolarHBondContact O-N 3.41Å; L458-A462 WeakPolarHBondContact O-CB 3.2Å; L458-A462 PolarHBondContact O-N 3.3Å
459	L	92.2	Very high	91.4	Very high	0 Å²	0	13.9 Å²	13.9	0%	0	8%	0.076	C	C	.	.	H	α-helix	trans	-60.4	-39.2	176.7	-72	169.8	0	0	0	111.7	T286 F289 G455 M456 A462 I463 C506 I509	T286-L459 HydrophobicContact CG2-CD1 4.35Å; F289-L459 HydrophobicContact CD2-CD2 4.17Å; F289-L459 HydrophobicContact CE2-CD2 3.93Å; F289-L459 HydrophobicContact CZ-CD2 4.14Å; G455-L459 WeakPolarHBondContact O-CB 3.5Å; G455-L459 WeakPolarHBondContact O-CD1 3.48Å; G455-L459 WeakPolarHBondContact O-CG 3.48Å; G455-L459 PolarHBondContact O-N 3.02Å; M456-L459 PolarHBondContact O-N 2.71Å; M456-L459 HydrophobicContact SD-CD1 4.42Å; L459-A462 WeakPolarHBondContact O-CB 3.44Å; L459-A462 PolarHBondContact O-N 3.08Å; L459-I463 WeakPolarHBondContact O-CD1 3.36Å; L459-I463 VanDerWaalsContact O-CG1 3.27Å; L459-I463 WeakPolarHBondContact O-CG1 3.38Å; L459-I463 PolarHBondContact O-N 3.19Å; L459-C506 HydrophobicContact CD2-CB 4.05Å; L459-I509 HydrophobicContact CD1-CB 4.23Å; L459-I509 HydrophobicContact CD1-CG2 3.64Å
460	F	94.3	Very high	91.6	Very high	31 Å²	31	11.3 Å²	11.3	14%	0.136	6%	0.063	C	C	.	.	H	α-helix	trans	-63	-48.9	177.1	-174.5	-98.9	0	0	0	111.5	M456 C457 L458 A462 I463 F464 F510 M544 I547	M456-F460 WeakPolarHBondContact O-CB 3.35Å; M456-F460 PolarHBondContact O-N 2.88Å; C457-F460 PolarHBondContact O-N 3.44Å; L458-F460 VanDerWaalsContact C-N 3.28Å; L458-F460 PolarHBondContact O-N 2.87Å; F460-A462 VanDerWaalsContact C-N 3.32Å; F460-A462 PolarHBondContact O-N 3.48Å; F460-I463 PolarHBondContact O-N 3.28Å; F460-F464 HydrophobicContact CD1-CD2 4.19Å; F460-F464 HydrophobicContact CD1-CE2 4.17Å; F460-F464 HydrophobicContact CD2-CE2 4.16Å; F460-F464 AromaticContact CE1-CD2 3.93Å; F460-F464 HydrophobicContact CE1-CD2 3.93Å; F460-F464 AromaticContact CE1-CE2 3.61Å; F460-F464 HydrophobicContact CE1-CE2 3.61Å; F460-F464 AromaticContact CE2-CE2 3.63Å; F460-F464 HydrophobicContact CE2-CE2 3.63Å; F460-F464 HydrophobicContact CE2-CZ 4.46Å; F460-F464 HydrophobicContact CG-CE2 4.43Å; F460-F464 HydrophobicContact CZ-CD2 4.13Å; F460-F464 AromaticContact CZ-CE2 3.34Å; F460-F464 HydrophobicContact CZ-CE2 3.34Å; F460-F464 HydrophobicContact CZ-CZ 4.12Å; F460-F464 WeakPolarHBondContact O-CD2 3.33Å; F460-F464 PolarHBondContact O-N 3.47Å; F460-F510 HydrophobicContact CB-CD2 4.19Å; F460-F510 HydrophobicContact CB-CE2 3.82Å; F460-F510 HydrophobicContact CB-CZ 4.49Å; F460-F510 HydrophobicContact CD2-CE1 4.19Å; F460-F510 AromaticContact CD2-CE2 3.88Å; F460-F510 HydrophobicContact CD2-CE2 3.88Å; F460-F510 AromaticContact CD2-CZ 3.67Å; F460-F510 HydrophobicContact CD2-CZ 3.67Å; F460-F510 HydrophobicContact CE2-CZ 4.38Å; F460-F510 HydrophobicContact CG-CE2 4.29Å; F460-F510 HydrophobicContact CG-CZ 4.49Å; F460-M544 HydrophobicContact CB-CE 4.18Å; F460-M544 HydrophobicContact CB-CG 4.28Å; F460-M544 HydrophobicContact CD1-CB 3.93Å; F460-M544 HydrophobicContact CD1-CE 4.25Å; F460-M544 HydrophobicContact CD1-CG 3.8Å; F460-M544 HydrophobicContact CD2-CE 3.66Å; F460-M544 HydrophobicContact CE1-CB 3.91Å; F460-M544 HydrophobicContact CE1-CG 4.31Å; F460-M544 VanDerWaalsContact CE1-O 3.26Å; F460-M544 WeakPolarHBondContact CE1-O 3.49Å; F460-M544 HydrophobicContact CE2-CE 3.98Å; F460-M544 HydrophobicContact CG-CE 3.78Å; F460-M544 HydrophobicContact CG-CG 4.08Å; F460-M544 HydrophobicContact CZ-CB 4.48Å; F460-M544 HydrophobicContact CZ-CE 4.41Å; F460-I547 HydrophobicContact CD1-CD1 4.09Å; F460-I547 HydrophobicContact CE1-CB 4.46Å; F460-I547 HydrophobicContact CE1-CD1 3.97Å
461	V	96.1	Very high	91.9	Very high	0 Å²	0	17.1 Å²	17.1	0%	0	8%	0.078	C	C	.	.	H	α-helix	trans	-59.7	-44.3	176	172.6	0	0	0	0	110.9	I117 A120 T121 I124 C295 C457 L458 I463 F464 E465 I547	I117-V461 HydrophobicContact CG2-CG1 4.24Å; A120-V461 HydrophobicContact CB-CG2 4.15Å; T121-V461 HydrophobicContact CG2-CG1 3.81Å; I124-V461 HydrophobicContact CD1-CG2 4Å; C295-V461 HydrophobicContact CB-CB 3.94Å; C295-V461 HydrophobicContact CB-CG1 3.7Å; C457-V461 WeakPolarHBondContact O-CG2 3.38Å; C457-V461 PolarHBondContact O-N 3.26Å; L458-V461 PolarHBondContact O-N 3.41Å; V461-I463 VanDerWaalsContact C-N 3.27Å; V461-I463 PolarHBondContact O-N 2.9Å; V461-F464 PolarHBondContact O-N 3.5Å; V461-E465 HydrophobicContact CG1-CG 3.92Å; V461-E465 WeakPolarHBondContact O-CG 3.27Å; V461-E465 PolarHBondContact O-N 3.46Å; V461-I547 HydrophobicContact CG2-CD1 4.22Å
462	A	95.6	Very high	92.2	Very high	0 Å²	0	18.9 Å²	18.9	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-57.1	-37.6	-179.7	0	0	0	0	0	113.8	F289 C295 L458 L459 F460 S466	F289-A462 HydrophobicContact CD1-CB 4.41Å; F289-A462 HydrophobicContact CE1-CB 3.4Å; F289-A462 HydrophobicContact CZ-CB 3.92Å; C295-A462 VanDerWaalsContact SG-CA 3.53Å; C295-A462 VanDerWaalsContact SG-CB 3.55Å; L458-A462 WeakPolarHBondContact O-CB 3.2Å; L458-A462 PolarHBondContact O-N 3.3Å; L459-A462 WeakPolarHBondContact O-CB 3.44Å; L459-A462 PolarHBondContact O-N 3.08Å; F460-A462 VanDerWaalsContact C-N 3.32Å; F460-A462 PolarHBondContact O-N 3.48Å; A462-S466 WeakPolarHBondContact O-CB 3.33Å; A462-S466 PolarHBondContact O-N 2.9Å; A462-S466 PolarHBondContact O-OG 3.47Å
463	I	96	Very high	92.5	Very high	21 Å²	21	19.4 Å²	19.4	11%	0.108	9%	0.092	C	C	.	.	H	α-helix	trans	-60.4	-50.9	175.3	-66.8	160.5	0	0	0	109.5	L459 F460 V461 I467 C506 A507 F510	L459-I463 WeakPolarHBondContact O-CD1 3.36Å; L459-I463 VanDerWaalsContact O-CG1 3.27Å; L459-I463 WeakPolarHBondContact O-CG1 3.38Å; L459-I463 PolarHBondContact O-N 3.19Å; F460-I463 PolarHBondContact O-N 3.28Å; V461-I463 VanDerWaalsContact C-N 3.27Å; V461-I463 PolarHBondContact O-N 2.9Å; I463-I467 HydrophobicContact CG2-CD1 3.64Å; I463-I467 WeakPolarHBondContact O-CB 3.45Å; I463-I467 WeakPolarHBondContact O-CG1 3.24Å; I463-I467 PolarHBondContact O-N 3.3Å; I463-C506 HydrophobicContact CD1-CB 4.34Å; I463-C506 HydrophobicContact CG1-CB 3.66Å; I463-A507 HydrophobicContact CD1-CB 3.99Å; I463-A507 HydrophobicContact CG1-CB 4.31Å; I463-F510 HydrophobicContact CD1-CB 4.3Å
464	F	97.1	Very high	93.4	Very high	48 Å²	48	20.4 Å²	20.4	21%	0.211	10%	0.102	C	C	.	.	H	α-helix	trans	-71.6	-37.7	-176.8	-74.9	-76.8	0	0	0	113.2	F114 I117 F460 V461 I467 C468 I547	F114-F464 HydrophobicContact CD1-CD1 4.5Å; F114-F464 AromaticContact CE1-CD1 3.93Å; F114-F464 HydrophobicContact CE1-CD1 3.93Å; I117-F464 HydrophobicContact CD1-CB 4.01Å; I117-F464 HydrophobicContact CG1-CB 4.24Å; F460-F464 HydrophobicContact CD1-CD2 4.19Å; F460-F464 HydrophobicContact CD1-CE2 4.17Å; F460-F464 HydrophobicContact CD2-CE2 4.16Å; F460-F464 AromaticContact CE1-CD2 3.93Å; F460-F464 HydrophobicContact CE1-CD2 3.93Å; F460-F464 AromaticContact CE1-CE2 3.61Å; F460-F464 HydrophobicContact CE1-CE2 3.61Å; F460-F464 AromaticContact CE2-CE2 3.63Å; F460-F464 HydrophobicContact CE2-CE2 3.63Å; F460-F464 HydrophobicContact CE2-CZ 4.46Å; F460-F464 HydrophobicContact CG-CE2 4.43Å; F460-F464 HydrophobicContact CZ-CD2 4.13Å; F460-F464 AromaticContact CZ-CE2 3.34Å; F460-F464 HydrophobicContact CZ-CE2 3.34Å; F460-F464 HydrophobicContact CZ-CZ 4.12Å; F460-F464 WeakPolarHBondContact O-CD2 3.33Å; F460-F464 PolarHBondContact O-N 3.47Å; V461-F464 PolarHBondContact O-N 3.5Å; F464-I467 PolarHBondContact O-N 3.08Å; F464-C468 WeakPolarHBondContact O-CB 2.92Å; F464-C468 PolarHBondContact O-N 3.49Å; F464-I547 HydrophobicContact CB-CD1 4.08Å; F464-I547 HydrophobicContact CB-CG2 4.24Å; F464-I547 HydrophobicContact CD1-CG2 3.81Å; F464-I547 HydrophobicContact CD2-CD1 3.87Å; F464-I547 HydrophobicContact CD2-CG2 4.03Å; F464-I547 HydrophobicContact CE1-CG2 4.13Å; F464-I547 HydrophobicContact CE2-CG2 4.38Å; F464-I547 HydrophobicContact CG-CD1 4.16Å; F464-I547 HydrophobicContact CG-CG2 3.75Å; F464-I547 HydrophobicContact CZ-CG2 4.41Å
465	E	96.2	Very high	93.9	Very high	1 Å²	1	20.1 Å²	20.1	1%	0.005	10%	0.1	C	C	.	.	H	α-helix	trans	-61.4	-47.6	174.3	-73.6	-171.9	157.3	0	0	111.5	W107 I117 C295 V461 C468 I469	W107-E465 HydrophobicContact CH2-CB 4Å; W107-E465 HydrophobicContact CH2-CG 3.83Å; W107-E465 HydrophobicContact CZ2-CB 4.19Å; W107-E465 HydrophobicContact CZ2-CG 3.55Å; I117-E465 HydrophobicContact CD1-CG 4.09Å; I117-E465 HydrophobicContact CG2-CG 3.42Å; I117-E465 VanDerWaalsContact CG2-CG 3.42Å; I117-E465 WeakPolarHBondContact CG2-OE1 3.13Å; C295-E465 PolarHBondContact SG-OE2 3.06Å; V461-E465 HydrophobicContact CG1-CG 3.92Å; V461-E465 WeakPolarHBondContact O-CG 3.27Å; V461-E465 PolarHBondContact O-N 3.46Å; E465-C468 PolarHBondContact O-N 3.03Å; E465-I469 PolarHBondContact O-N 3.41Å
466	S	96.2	Very high	94.5	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-65	-42.2	178.5	-59.3	0	0	0	0	111.7	A462 G470 T502	A462-S466 WeakPolarHBondContact O-CB 3.33Å; A462-S466 PolarHBondContact O-N 2.9Å; A462-S466 PolarHBondContact O-OG 3.47Å; S466-G470 WeakPolarHBondContact O-CA 3.2Å; S466-G470 PolarHBondContact O-N 2.96Å; S466-T502 WeakPolarHBondContact OG-CG2 3.49Å
467	I	96.3	Very high	94.8	Very high	60 Å²	60	29.6 Å²	29.6	31%	0.308	14%	0.14	S	C	.	.	H	α-helix	trans	-64	-44.7	175.7	-71.7	169.2	0	0	0	110.8	I463 F464 W471 V472 P503	I463-I467 HydrophobicContact CG2-CD1 3.64Å; I463-I467 WeakPolarHBondContact O-CB 3.45Å; I463-I467 WeakPolarHBondContact O-CG1 3.24Å; I463-I467 PolarHBondContact O-N 3.3Å; F464-I467 PolarHBondContact O-N 3.08Å; I467-W471 WeakPolarHBondContact O-CB 3.46Å; I467-W471 PolarHBondContact O-N 3.46Å; I467-V472 PolarHBondContact O-N 3.41Å; I467-P503 HydrophobicContact CG1-CB 4.26Å
468	C	96.4	Very high	94.9	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	14%	0.141	C	C	.	.	I	π-helix	trans	-60	-52.7	-179.8	-179.7	0	0	0	0	110.9	W107 C111 F114 I117 F464 E465 V472 Y473	W107-C468 HydrophobicContact CZ3-CB 4.03Å; C111-C468 VanDerWaalsContact CB-SG 3.55Å; F114-C468 HydrophobicContact CB-CB 4.31Å; F114-C468 HydrophobicContact CD1-CB 4.44Å; F114-C468 HydrophobicContact CD2-CB 4.03Å; F114-C468 HydrophobicContact CG-CB 4Å; I117-C468 HydrophobicContact CD1-CB 4.21Å; F464-C468 WeakPolarHBondContact O-CB 2.92Å; F464-C468 PolarHBondContact O-N 3.49Å; E465-C468 PolarHBondContact O-N 3.03Å; C468-V472 WeakPolarHBondContact O-CB 3.29Å; C468-V472 PolarHBondContact O-N 2.88Å; C468-V472 VanDerWaalsContact O-N 3.16Å; C468-Y473 WeakPolarHBondContact O-CB 3.29Å; C468-Y473 PolarHBondContact O-N 3.33Å
469	I	96.4	Very high	94.9	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	14%	0.144	C	C	.	.	I	π-helix	trans	-73.3	-44.3	-178.4	-63.3	-58.9	0	0	0	112	L91 L95 W107 V110 E465 G474 G475 F478	L91-I469 HydrophobicContact CD1-CB 3.98Å; L91-I469 HydrophobicContact CD1-CG1 4.03Å; L91-I469 HydrophobicContact CD1-CG2 4.11Å; L91-I469 HydrophobicContact CD2-CG1 4.14Å; L91-I469 HydrophobicContact CG-CG1 4.25Å; L91-I469 HydrophobicContact CG-CG2 4.48Å; L95-I469 HydrophobicContact CD1-CD1 4.1Å; W107-I469 HydrophobicContact CH2-CD1 4.21Å; W107-I469 HydrophobicContact CH2-CG1 3.94Å; W107-I469 HydrophobicContact CZ3-CD1 3.86Å; W107-I469 HydrophobicContact CZ3-CG1 3.99Å; V110-I469 HydrophobicContact CG1-CD1 3.84Å; E465-I469 PolarHBondContact O-N 3.41Å; I469-G474 CarbonylContact O-C 3.58Å; I469-G474 PolarHBondContact O-N 2.75Å; I469-G475 PolarHBondContact O-N 2.7Å; I469-G475 VanDerWaalsContact O-N 3.17Å; I469-F478 HydrophobicContact CG2-CB 3.98Å; I469-F478 HydrophobicContact CG2-CD1 3.51Å; I469-F478 HydrophobicContact CG2-CD2 4.46Å; I469-F478 HydrophobicContact CG2-CE1 4.06Å; I469-F478 HydrophobicContact CG2-CG 3.74Å
470	G	94.8	Very high	94.9	Very high	3 Å²	3	34.4 Å²	34.4	3%	0.031	16%	0.164	C	C	.	.	I	π-helix	trans	-66.4	-42.9	-175.7	0	0	0	0	0	113.4	S466 G475	S466-G470 WeakPolarHBondContact O-CA 3.2Å; S466-G470 PolarHBondContact O-N 2.96Å; G470-G475 PolarHBondContact O-N 2.98Å
471	W	95.8	Very high	94.9	Very high	158 Å²	158	33.4 Å²	33.4	60%	0.598	16%	0.16	S	C	*	.	I	π-helix	trans	-117.4	-38	-169.2	-66.4	93.6	0	0	0	114.8	I467 M499 I500	I467-W471 WeakPolarHBondContact O-CB 3.46Å; I467-W471 PolarHBondContact O-N 3.46Å; W471-M499 HydrophobicContact CH2-CE 4.28Å; W471-M499 HydrophobicContact CZ2-CE 4.26Å; W471-M499 HydrophobicContact CZ3-CE 4.47Å; W471-M499 PolarHBondContact NE1-O 3.43Å; W471-I500 HydrophobicContact CZ2-CG1 4.48Å
472	V	95.4	Very high	94.8	Very high	49 Å²	49	33.4 Å²	33.4	30%	0.297	16%	0.16	S	C	.	.	I	π-helix	trans	-87.9	-55.3	-172.4	-176.4	0	0	0	0	111.5	F114 I467 C468 G474 T570	F114-V472 HydrophobicContact CE2-CB 4.27Å; F114-V472 HydrophobicContact CE2-CG1 4.13Å; F114-V472 HydrophobicContact CE2-CG2 3.83Å; F114-V472 HydrophobicContact CZ-CG2 4.37Å; I467-V472 PolarHBondContact O-N 3.41Å; C468-V472 WeakPolarHBondContact O-CB 3.29Å; C468-V472 PolarHBondContact O-N 2.88Å; C468-V472 VanDerWaalsContact O-N 3.16Å; V472-G474 VanDerWaalsContact C-N 3.31Å; V472-T570 HydrophobicContact CG1-CG2 3.61Å
473	Y	95.1	Very high	94.8	Very high	11 Å²	11	35.2 Å²	35.2	4%	0.043	17%	0.169	C	C	.	.	I	π-helix	trans	-69.2	-34.8	171.5	-174.7	-103	0	0	0	111.5	V110 C468 R477 F478 N481 P572	V110-Y473 HydrophobicContact CG1-CD1 4.46Å; V110-Y473 HydrophobicContact CG1-CD2 3.51Å; V110-Y473 HydrophobicContact CG1-CE2 3.81Å; V110-Y473 HydrophobicContact CG1-CG 3.86Å; V110-Y473 VanDerWaalsContact O-CD2 3.31Å; V110-Y473 WeakPolarHBondContact O-CD2 3.28Å; C468-Y473 WeakPolarHBondContact O-CB 3.29Å; C468-Y473 PolarHBondContact O-N 3.33Å; Y473-R477 HydrophobicContact CD1-CG 4.47Å; Y473-R477 HydrophobicContact CE1-CB 4.23Å; Y473-R477 HydrophobicContact CE1-CG 3.78Å; Y473-R477 VanDerWaalsContact CZ-CD 3.49Å; Y473-R477 PolarHBondContact O-NH1 2.94Å; Y473-F478 HydrophobicContact CD1-CB 4.1Å; Y473-F478 HydrophobicContact CE1-CB 4.09Å; Y473-F478 HydrophobicContact CE1-CD2 4.17Å; Y473-N481 PolarHBondContact OH-ND2 3.46Å; Y473-P572 HydrophobicContact CD2-CG 3.7Å; Y473-P572 HydrophobicContact CE2-CB 3.87Å; Y473-P572 HydrophobicContact CE2-CG 3.32Å
474	G	93.9	Very high	94.7	Very high	21 Å²	21	34.3 Å²	34.3	22%	0.216	16%	0.164	C	C	.	.	I	π-helix	trans	98.5	117.9	176.5	0	0	0	0	0	112.3	I469 V472 D476 R477 F478	I469-G474 CarbonylContact O-C 3.58Å; I469-G474 PolarHBondContact O-N 2.75Å; V472-G474 VanDerWaalsContact C-N 3.31Å; G474-D476 VanDerWaalsContact C-N 3.25Å; G474-D476 PolarHBondContact O-N 2.66Å; G474-R477 WeakPolarHBondContact O-CB 3.47Å; G474-R477 PolarHBondContact O-N 3.3Å; G474-R477 VanDerWaalsContact O-N 3.08Å; G474-F478 PolarHBondContact O-N 3.07Å
475	G	92.2	Very high	94.5	Very high	2 Å²	2	32.2 Å²	32.2	2%	0.021	16%	0.155	C	C	.	.	H	α-helix	trans	-59.6	-33	-179.7	0	0	0	0	0	113.8	I469 G470 F478 Y479	I469-G475 PolarHBondContact O-N 2.7Å; I469-G475 VanDerWaalsContact O-N 3.17Å; G470-G475 PolarHBondContact O-N 2.98Å; G475-F478 PolarHBondContact O-N 3.45Å; G475-Y479 WeakPolarHBondContact O-CB 3.38Å; G475-Y479 PolarHBondContact O-N 3.04Å
476	D	93.1	Very high	94.4	Very high	100 Å²	100	33.2 Å²	33.2	54%	0.535	16%	0.16	S	C	.	.	H	α-helix	trans	-65.3	-42.8	174.2	-76.7	-63	0	0	0	112.7	G474 Y479 L480 K495	G474-D476 VanDerWaalsContact C-N 3.25Å; G474-D476 PolarHBondContact O-N 2.66Å; D476-Y479 PolarHBondContact O-N 3.49Å; D476-L480 WeakPolarHBondContact O-CG 3.17Å; D476-L480 PolarHBondContact O-N 3.49Å; D476-K495 WeakPolarHBondContact OD1-CE 3.43Å; D476-K495 IonicContact OD1-NZ 3.36Å; D476-K495 PolarHBondContact OD1-NZ 3.34Å; D476-K495 IonicContact OD2-NZ 3.79Å; D476-K495 PolarHBondContact OD2-NZ 3.31Å
477	R	92.4	Very high	94.2	Very high	117 Å²	117	35.6 Å²	35.6	44%	0.442	19%	0.185	S	C	.	.	H	α-helix	trans	-62.8	-45.6	176.1	-179.5	-176.2	-71.8	164.5	-4.3	110.4	Y473 G474 Y479 L480 N481 P572	Y473-R477 HydrophobicContact CD1-CG 4.47Å; Y473-R477 HydrophobicContact CE1-CB 4.23Å; Y473-R477 HydrophobicContact CE1-CG 3.78Å; Y473-R477 VanDerWaalsContact CZ-CD 3.49Å; Y473-R477 PolarHBondContact O-NH1 2.94Å; G474-R477 WeakPolarHBondContact O-CB 3.47Å; G474-R477 PolarHBondContact O-N 3.3Å; G474-R477 VanDerWaalsContact O-N 3.08Å; R477-Y479 PolarHBondContact O-N 3.22Å; R477-L480 WeakPolarHBondContact O-CB 3.08Å; R477-L480 PolarHBondContact O-N 2.86Å; R477-N481 VanDerWaalsContact O-CG 3.25Å; R477-N481 PolarHBondContact O-N 3.39Å; R477-N481 PolarHBondContact O-OD1 3.14Å; R477-P572 VanDerWaalsContact NH1-CG 3.35Å
478	F	94.4	Very high	94	Very high	1 Å²	1	36.9 Å²	36.9	0%	0.004	19%	0.186	C	C	.	.	H	α-helix	trans	-65.2	-39.2	179	-166.5	-121.6	0	0	0	112.2	L91 A94 L95 I469 Y473 G474 G475 L480 N481 I482 W498	L91-F478 HydrophobicContact CG-CE1 4.3Å; A94-F478 HydrophobicContact CB-CZ 4.06Å; L95-F478 HydrophobicContact CB-CE2 4.38Å; L95-F478 HydrophobicContact CB-CZ 4.14Å; L95-F478 HydrophobicContact CD1-CE2 3.92Å; L95-F478 HydrophobicContact CD1-CZ 4.39Å; I469-F478 HydrophobicContact CG2-CB 3.98Å; I469-F478 HydrophobicContact CG2-CD1 3.51Å; I469-F478 HydrophobicContact CG2-CD2 4.46Å; I469-F478 HydrophobicContact CG2-CE1 4.06Å; I469-F478 HydrophobicContact CG2-CG 3.74Å; Y473-F478 HydrophobicContact CD1-CB 4.1Å; Y473-F478 HydrophobicContact CE1-CB 4.09Å; Y473-F478 HydrophobicContact CE1-CD2 4.17Å; G474-F478 PolarHBondContact O-N 3.07Å; G475-F478 PolarHBondContact O-N 3.45Å; F478-L480 VanDerWaalsContact C-N 3.33Å; F478-L480 PolarHBondContact O-N 3.37Å; F478-N481 WeakPolarHBondContact O-CB 3.42Å; F478-N481 PolarHBondContact O-N 3.07Å; F478-I482 HydrophobicContact CD1-CD1 3.8Å; F478-I482 HydrophobicContact CE1-CD1 3.68Å; F478-I482 HydrophobicContact CE1-CG1 4.47Å; F478-I482 HydrophobicContact CG-CD1 4.43Å; F478-I482 HydrophobicContact CZ-CD1 4.22Å; F478-I482 WeakPolarHBondContact O-CG1 3.1Å; F478-I482 PolarHBondContact O-N 3.28Å; F478-W498 HydrophobicContact CD1-CE3 4.12Å; F478-W498 AromaticContact CD1-CH2 3.89Å; F478-W498 HydrophobicContact CD1-CH2 3.89Å; F478-W498 AromaticContact CD1-CZ3 3.52Å; F478-W498 HydrophobicContact CD1-CZ3 3.52Å; F478-W498 AromaticContact CE1-CH2 3.73Å; F478-W498 HydrophobicContact CE1-CH2 3.73Å; F478-W498 HydrophobicContact CE1-CZ2 4.32Å; F478-W498 AromaticContact CE1-CZ3 3.86Å; F478-W498 HydrophobicContact CE1-CZ3 3.86Å
479	Y	92.9	Very high	93.7	Very high	17 Å²	17	43.1 Å²	43.1	7%	0.067	21%	0.214	C	C	.	.	H	α-helix	trans	-60.2	-39.9	172.4	-111.2	-113.7	0	0	0	113	G475 D476 R477 I482 E483 P490 F491 K495 W498	G475-Y479 WeakPolarHBondContact O-CB 3.38Å; G475-Y479 PolarHBondContact O-N 3.04Å; D476-Y479 PolarHBondContact O-N 3.49Å; R477-Y479 PolarHBondContact O-N 3.22Å; Y479-I482 PolarHBondContact O-N 3.37Å; Y479-E483 WeakPolarHBondContact O-CB 3.28Å; Y479-E483 PolarHBondContact O-N 2.62Å; Y479-P490 HydrophobicContact CE1-CB 4.22Å; Y479-P490 HydrophobicContact CE1-CG 4.34Å; Y479-F491 PolarHBondContact OH-O 2.85Å; Y479-K495 HydrophobicContact CD2-CB 3.97Å; Y479-K495 HydrophobicContact CD2-CD 4.47Å; Y479-K495 HydrophobicContact CD2-CG 4.05Å; Y479-K495 HydrophobicContact CE1-CB 4.44Å; Y479-K495 HydrophobicContact CE2-CB 3.42Å; Y479-K495 VanDerWaalsContact CE2-CB 3.42Å; Y479-K495 HydrophobicContact CE2-CG 4.01Å; Y479-K495 PolarHBondContact OH-N 3.12Å; Y479-W498 HydrophobicContact CD2-CE3 4.32Å; Y479-W498 AromaticContact CD2-CZ3 3.68Å; Y479-W498 HydrophobicContact CD2-CZ3 3.68Å; Y479-W498 HydrophobicContact CE2-CE3 4.05Å; Y479-W498 HydrophobicContact CE2-CH2 4.19Å; Y479-W498 AromaticContact CE2-CZ3 3.48Å; Y479-W498 HydrophobicContact CE2-CZ3 3.48Å; Y479-W498 VanDerWaalsContact CE2-CZ3 3.48Å
480	L	93.2	Very high	93.5	Very high	82 Å²	82	43.3 Å²	43.3	43%	0.429	22%	0.215	S	C	.	.	H	α-helix	trans	-65.5	-41.6	175.2	-72	169.2	0	0	0	111.8	D476 R477 F478 I482 E483 D484	D476-L480 WeakPolarHBondContact O-CG 3.17Å; D476-L480 PolarHBondContact O-N 3.49Å; R477-L480 WeakPolarHBondContact O-CB 3.08Å; R477-L480 PolarHBondContact O-N 2.86Å; F478-L480 VanDerWaalsContact C-N 3.33Å; F478-L480 PolarHBondContact O-N 3.37Å; L480-I482 VanDerWaalsContact C-N 3.27Å; L480-I482 PolarHBondContact O-N 3.23Å; L480-E483 PolarHBondContact O-N 3.47Å; L480-D484 PolarHBondContact O-N 3.26Å
481	N	94.2	Very high	93.4	Very high	10 Å²	10	49.5 Å²	49.5	5%	0.053	24%	0.241	C	C	.	.	H	α-helix	trans	-60.4	-40.1	174.4	-62.3	-19.5	0	0	0	111.4	F98 Y473 R477 F478 D484 M485	F98-N481 HydrophobicContact CD1-CB 4.48Å; F98-N481 HydrophobicContact CD2-CB 4Å; F98-N481 HydrophobicContact CE1-CB 4.22Å; F98-N481 VanDerWaalsContact CE1-ND2 3.33Å; F98-N481 WeakPolarHBondContact CE1-ND2 3.32Å; F98-N481 HydrophobicContact CE2-CB 3.73Å; F98-N481 HydrophobicContact CG-CB 4.38Å; F98-N481 HydrophobicContact CZ-CB 3.86Å; F98-N481 VanDerWaalsContact CZ-CG 3.43Å; F98-N481 WeakPolarHBondContact CZ-ND2 3.42Å; Y473-N481 PolarHBondContact OH-ND2 3.46Å; R477-N481 VanDerWaalsContact O-CG 3.25Å; R477-N481 PolarHBondContact O-N 3.39Å; R477-N481 PolarHBondContact O-OD1 3.14Å; F478-N481 WeakPolarHBondContact O-CB 3.42Å; F478-N481 PolarHBondContact O-N 3.07Å; N481-D484 WeakPolarHBondContact O-CB 3.18Å; N481-D484 PolarHBondContact O-N 3.08Å; N481-M485 WeakPolarHBondContact O-CG 3.4Å; N481-M485 PolarHBondContact O-N 3.12Å
482	I	94.3	Very high	93.2	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-66	-45.7	176.4	-69.4	165.4	0	0	0	110.9	F90 A94 F478 Y479 L480 D484 M485 I486 P490 W498	F90-I482 HydrophobicContact CE1-CD1 3.9Å; F90-I482 HydrophobicContact CE1-CG2 4.46Å; F90-I482 HydrophobicContact CZ-CD1 3.97Å; F90-I482 HydrophobicContact CZ-CG1 4.43Å; F90-I482 HydrophobicContact CZ-CG2 3.79Å; A94-I482 HydrophobicContact CB-CD1 4.34Å; A94-I482 HydrophobicContact CB-CG1 4.21Å; F478-I482 HydrophobicContact CD1-CD1 3.8Å; F478-I482 HydrophobicContact CE1-CD1 3.68Å; F478-I482 HydrophobicContact CE1-CG1 4.47Å; F478-I482 HydrophobicContact CG-CD1 4.43Å; F478-I482 HydrophobicContact CZ-CD1 4.22Å; F478-I482 WeakPolarHBondContact O-CG1 3.1Å; F478-I482 PolarHBondContact O-N 3.28Å; Y479-I482 PolarHBondContact O-N 3.37Å; L480-I482 VanDerWaalsContact C-N 3.27Å; L480-I482 PolarHBondContact O-N 3.23Å; I482-D484 PolarHBondContact O-N 3.27Å; I482-M485 HydrophobicContact CB-CE 4.37Å; I482-M485 HydrophobicContact CG1-CE 3.91Å; I482-M485 PolarHBondContact O-N 3.2Å; I482-M485 VanDerWaalsContact O-N 3.09Å; I482-I486 HydrophobicContact CG2-CD1 3.82Å; I482-I486 HydrophobicContact CG2-CG1 4.24Å; I482-I486 WeakPolarHBondContact O-CG1 3.33Å; I482-I486 PolarHBondContact O-N 3.03Å; I482-P490 HydrophobicContact CG2-CG 3.52Å; I482-W498 HydrophobicContact CD1-CH2 3.65Å; I482-W498 HydrophobicContact CD1-CZ3 4.03Å
483	E	94.4	Very high	93.1	Very high	39 Å²	39	46.9 Å²	46.9	18%	0.182	24%	0.24	C	C	.	.	H	α-helix	trans	-58.5	-37.5	176.1	-167.9	-175.8	-169.8	0	0	111.4	Y479 L480 G487 K489 L582	Y479-E483 WeakPolarHBondContact O-CB 3.28Å; Y479-E483 PolarHBondContact O-N 2.62Å; L480-E483 PolarHBondContact O-N 3.47Å; E483-G487 WeakPolarHBondContact O-CA 3.24Å; E483-G487 PolarHBondContact O-N 2.68Å; E483-K489 HydrophobicContact CB-CG 4.27Å; E483-K489 VanDerWaalsContact CD-CG 3.43Å; E483-K489 HydrophobicContact CG-CG 3.85Å; E483-K489 VanDerWaalsContact OE1-CE 3.27Å; E483-K489 WeakPolarHBondContact OE1-CE 3.26Å; E483-K489 WeakPolarHBondContact OE2-CE 3.42Å; E483-K489 IonicContact OE2-NZ 3.96Å; E483-L582 HydrophobicContact CB-CD1 3.78Å; E483-L582 HydrophobicContact CG-CD1 3.53Å
484	D	94	Very high	93.1	Very high	2 Å²	2	46.8 Å²	46.8	1%	0.011	24%	0.24	C	C	.	.	H	α-helix	trans	-64.9	-40	174.3	-177.7	68.8	0	0	0	112.8	Y308 L480 N481 I482 M578 R579 G580 K581 L582 A583	Y308-D484 VanDerWaalsContact CE1-OD2 3.29Å; Y308-D484 WeakPolarHBondContact CE1-OD2 3.43Å; Y308-D484 PolarHBondContact OH-OD2 3.12Å; L480-D484 PolarHBondContact O-N 3.26Å; N481-D484 WeakPolarHBondContact O-CB 3.18Å; N481-D484 PolarHBondContact O-N 3.08Å; I482-D484 PolarHBondContact O-N 3.27Å; D484-M578 HydrophobicContact CB-CB 4.39Å; D484-M578 HydrophobicContact CB-CG 4.12Å; D484-M578 HydrophobicContact CB-SD 3.78Å; D484-M578 VanDerWaalsContact OD2-CB 3.31Å; D484-M578 WeakPolarHBondContact OD2-CB 3.37Å; D484-R579 PolarHBondContact OD2-N 2.86Å; D484-G580 WeakPolarHBondContact OD1-CA 3.39Å; D484-G580 PolarHBondContact OD1-N 3.43Å; D484-G580 VanDerWaalsContact OD2-CA 3.31Å; D484-G580 WeakPolarHBondContact OD2-CA 3.41Å; D484-G580 PolarHBondContact OD2-N 3.05Å; D484-K581 PolarHBondContact OD1-N 3.24Å; D484-L582 HydrophobicContact CB-CB 4.03Å; D484-L582 HydrophobicContact CB-CD1 4.14Å; D484-L582 WeakPolarHBondContact OD1-CA 3.43Å; D484-L582 WeakPolarHBondContact OD1-CB 3.48Å; D484-L582 PolarHBondContact OD1-N 3.05Å; D484-A583 PolarHBondContact OD1-N 3.08Å
485	M	94	Very high	93	Very high	4 Å²	4	47.5 Å²	47.5	2%	0.02	24%	0.237	C	C	.	.	H	α-helix	trans	-68.9	-54.3	176.5	-72.8	-171.4	-66.1	0	0	112.8	A94 Q97 F98 Y308 N309 N481 I482	A94-M485 HydrophobicContact CB-CE 4.17Å; Q97-M485 HydrophobicContact CB-SD 4.33Å; Q97-M485 HydrophobicContact CG-SD 4.11Å; F98-M485 VanDerWaalsContact CA-SD 3.53Å; F98-M485 HydrophobicContact CB-CE 3.88Å; F98-M485 HydrophobicContact CB-SD 3.6Å; F98-M485 VanDerWaalsContact CB-SD 3.6Å; F98-M485 HydrophobicContact CD2-CG 4.3Å; F98-M485 HydrophobicContact CD2-SD 4.08Å; F98-M485 HydrophobicContact CG-SD 4.33Å; Y308-M485 HydrophobicContact CD1-CG 4.19Å; Y308-M485 HydrophobicContact CD2-CG 4.2Å; Y308-M485 HydrophobicContact CE1-CB 4.39Å; Y308-M485 HydrophobicContact CE1-CG 3.72Å; Y308-M485 HydrophobicContact CE2-CG 3.81Å; Y308-M485 HydrophobicContact CE2-SD 4.35Å; Y308-M485 HydrophobicContact CG-CG 4.41Å; Y308-M485 WeakPolarHBondContact O-CB 3.42Å; N309-M485 WeakPolarHBondContact CA-O 3.18Å; N481-M485 WeakPolarHBondContact O-CG 3.4Å; N481-M485 PolarHBondContact O-N 3.12Å; I482-M485 HydrophobicContact CB-CE 4.37Å; I482-M485 HydrophobicContact CG1-CE 3.91Å; I482-M485 PolarHBondContact O-N 3.2Å; I482-M485 VanDerWaalsContact O-N 3.09Å
486	I	94.1	Very high	93.2	Very high	22 Å²	22	53.8 Å²	53.8	11%	0.113	26%	0.26	C	S	.	.	H	α-helix	trans	-97.5	-12.2	-169.2	75.1	-177.3	0	0	0	113.6	Y313 I482 Y488 P490	Y313-I486 HydrophobicContact CG-CD1 4.46Å; I482-I486 HydrophobicContact CG2-CD1 3.82Å; I482-I486 HydrophobicContact CG2-CG1 4.24Å; I482-I486 WeakPolarHBondContact O-CG1 3.33Å; I482-I486 PolarHBondContact O-N 3.03Å; I486-Y488 HydrophobicContact CB-CD1 4.44Å; I486-Y488 HydrophobicContact CB-CE1 4.16Å; I486-Y488 HydrophobicContact CD1-CD1 4.24Å; I486-Y488 HydrophobicContact CD1-CD2 4.13Å; I486-Y488 HydrophobicContact CD1-CE1 3.91Å; I486-Y488 HydrophobicContact CD1-CE2 3.79Å; I486-Y488 HydrophobicContact CD1-CG 4.36Å; I486-Y488 WeakPolarHBondContact CD1-O 3.39Å; I486-Y488 HydrophobicContact CG1-CD1 3.9Å; I486-Y488 HydrophobicContact CG1-CE1 3.87Å; I486-Y488 HydrophobicContact CG1-CE2 4.48Å; I486-Y488 HydrophobicContact CG1-CG 4.24Å; I486-Y488 VanDerWaalsContact CG1-O 3.29Å; I486-Y488 WeakPolarHBondContact CG1-O 3.47Å; I486-Y488 WeakPolarHBondContact O-CD1 3.24Å; I486-P490 HydrophobicContact CD1-CG 4.22Å
487	G	91.8	Very high	93.3	Very high	50 Å²	50	49 Å²	49	52%	0.515	24%	0.235	S	C	.	.	S	Bend	trans	83.9	5.5	177.7	0	0	0	0	0	115.7	E483	E483-G487 WeakPolarHBondContact O-CA 3.24Å; E483-G487 PolarHBondContact O-N 2.68Å
488	Y	92	Very high	93.4	Very high	86 Å²	86	43.4 Å²	43.4	34%	0.337	21%	0.214	S	C	.	.	S	Bend	trans	-152.9	159.3	176.1	64.1	-87.5	0	0	0	111.5	N311 Y313 I486	N311-Y488 PolarHBondContact ND2-OH 3.07Å; N311-Y488 PolarHBondContact OD1-OH 3.33Å; N311-Y488 VanDerWaalsContact OD1-OH 3.06Å; Y313-Y488 AromaticContact CD1-CE2 3.81Å; Y313-Y488 HydrophobicContact CD1-CE2 3.81Å; Y313-Y488 HydrophobicContact CE1-CE2 4.28Å; I486-Y488 HydrophobicContact CB-CD1 4.44Å; I486-Y488 HydrophobicContact CB-CE1 4.16Å; I486-Y488 HydrophobicContact CD1-CD1 4.24Å; I486-Y488 HydrophobicContact CD1-CD2 4.13Å; I486-Y488 HydrophobicContact CD1-CE1 3.91Å; I486-Y488 HydrophobicContact CD1-CE2 3.79Å; I486-Y488 HydrophobicContact CD1-CG 4.36Å; I486-Y488 WeakPolarHBondContact CD1-O 3.39Å; I486-Y488 HydrophobicContact CG1-CD1 3.9Å; I486-Y488 HydrophobicContact CG1-CE1 3.87Å; I486-Y488 HydrophobicContact CG1-CE2 4.48Å; I486-Y488 HydrophobicContact CG1-CG 4.24Å; I486-Y488 VanDerWaalsContact CG1-O 3.29Å; I486-Y488 WeakPolarHBondContact CG1-O 3.47Å; I486-Y488 WeakPolarHBondContact O-CD1 3.24Å
489	K	89.9	Confident	93.5	Very high	131 Å²	131	44.7 Å²	44.7	57%	0.57	22%	0.22	S	C	*	.	P	Polyproline II helix	trans	-80.3	128.5	177.9	-66.5	-174.1	178.5	179.8	0	111.4	E483	E483-K489 HydrophobicContact CB-CG 4.27Å; E483-K489 VanDerWaalsContact CD-CG 3.43Å; E483-K489 HydrophobicContact CG-CG 3.85Å; E483-K489 VanDerWaalsContact OE1-CE 3.27Å; E483-K489 WeakPolarHBondContact OE1-CE 3.26Å; E483-K489 WeakPolarHBondContact OE2-CE 3.42Å; E483-K489 IonicContact OE2-NZ 3.96Å
490	P	92.1	Very high	93.6	Very high	5 Å²	5	48 Å²	48	3%	0.032	24%	0.238	C	C	.	.	P	Polyproline II helix	trans	-62.7	167.8	171.2	-20.1	30.7	0	0	0	112.9	F90 Y313 Y479 I482 I486 V492	F90-P490 HydrophobicContact CE1-CB 4.24Å; F90-P490 HydrophobicContact CE1-CG 3.93Å; F90-P490 HydrophobicContact CZ-CG 4.04Å; Y313-P490 HydrophobicContact CD2-CB 4.03Å; Y313-P490 HydrophobicContact CE1-CB 4.49Å; Y313-P490 HydrophobicContact CE2-CB 3.94Å; Y313-P490 HydrophobicContact CG-CB 4.35Å; Y479-P490 HydrophobicContact CE1-CB 4.22Å; Y479-P490 HydrophobicContact CE1-CG 4.34Å; I482-P490 HydrophobicContact CG2-CG 3.52Å; I486-P490 HydrophobicContact CD1-CG 4.22Å; P490-V492 PolarHBondContact O-N 3.11Å
491	F	92.8	Very high	93.7	Very high	133 Å²	133	47.1 Å²	47.1	58%	0.583	23%	0.234	S	C	*	.	P	Polyproline II helix	trans	-60	129.6	178	-176.3	-126.2	0	0	0	111.6	Y313 Y479 L493 I494	Y313-F491 WeakPolarHBondContact OH-CB 3.48Å; Y479-F491 PolarHBondContact OH-O 2.85Å; F491-L493 HydrophobicContact CD1-CB 3.49Å; F491-L493 VanDerWaalsContact CD1-CB 3.49Å; F491-L493 HydrophobicContact CD1-CD2 4.43Å; F491-L493 HydrophobicContact CE1-CB 3.31Å; F491-L493 HydrophobicContact CE1-CD2 3.87Å; F491-L493 HydrophobicContact CE1-CG 4.24Å; F491-L493 HydrophobicContact CG-CB 4.49Å; F491-L493 HydrophobicContact CZ-CB 4.19Å; F491-L493 PolarHBondContact O-N 3.3Å; F491-I494 PolarHBondContact O-N 3.41Å; F491-I494 VanDerWaalsContact O-N 3.12Å
492	V	91.8	Very high	93.7	Very high	86 Å²	86	46.7 Å²	46.7	52%	0.521	23%	0.231	S	C	.	.	H	α-helix	trans	-60	-26.1	-168	179.6	0	0	0	0	113.6	P490 I494 K495 W496	P490-V492 PolarHBondContact O-N 3.11Å; V492-I494 PolarHBondContact O-N 2.88Å; V492-K495 WeakPolarHBondContact O-CB 3.27Å; V492-K495 PolarHBondContact O-N 3.45Å; V492-W496 PolarHBondContact O-N 3.02Å
493	L	92.9	Very high	93.8	Very high	65 Å²	65	47.3 Å²	47.3	34%	0.34	24%	0.235	S	C	.	.	H	α-helix	trans	-55.8	-36.2	177.4	-178	62.5	0	0	0	112.4	V82 F491 K495 W496 C497 L501	V82-L493 HydrophobicContact CG1-CD2 4.17Å; F491-L493 HydrophobicContact CD1-CB 3.49Å; F491-L493 VanDerWaalsContact CD1-CB 3.49Å; F491-L493 HydrophobicContact CD1-CD2 4.43Å; F491-L493 HydrophobicContact CE1-CB 3.31Å; F491-L493 HydrophobicContact CE1-CD2 3.87Å; F491-L493 HydrophobicContact CE1-CG 4.24Å; F491-L493 HydrophobicContact CG-CB 4.49Å; F491-L493 HydrophobicContact CZ-CB 4.19Å; F491-L493 PolarHBondContact O-N 3.3Å; L493-K495 VanDerWaalsContact C-N 3.32Å; L493-K495 PolarHBondContact O-N 2.88Å; L493-W496 CarbonylContact O-C 3.59Å; L493-W496 PolarHBondContact O-N 3.02Å; L493-W496 VanDerWaalsContact O-N 3.09Å; L493-C497 PolarHBondContact O-N 3.5Å; L493-C497 PolarHBondContact O-SG 3.13Å; L493-L501 HydrophobicContact CD1-CD1 4.37Å
494	I	94.2	Very high	93.9	Very high	10 Å²	10	47.7 Å²	47.7	5%	0.051	25%	0.249	C	C	.	.	H	α-helix	trans	-62.9	-40.6	-178.8	-71.2	173.1	0	0	0	111.5	F90 Y313 F491 V492 W496 C497 W498	F90-I494 HydrophobicContact CD1-CD1 4.33Å; F90-I494 HydrophobicContact CD1-CG2 3.94Å; F90-I494 HydrophobicContact CE1-CG2 4.44Å; Y313-I494 HydrophobicContact CD2-CD1 4.24Å; Y313-I494 HydrophobicContact CE2-CD1 3.36Å; F491-I494 PolarHBondContact O-N 3.41Å; F491-I494 VanDerWaalsContact O-N 3.12Å; V492-I494 PolarHBondContact O-N 2.88Å; I494-W496 VanDerWaalsContact C-N 3.32Å; I494-W496 PolarHBondContact O-N 3.14Å; I494-C497 WeakPolarHBondContact O-CB 3.36Å; I494-C497 PolarHBondContact O-N 2.93Å; I494-W498 HydrophobicContact CG2-CD2 4.04Å; I494-W498 VanDerWaalsContact CG2-CE2 3.49Å; I494-W498 HydrophobicContact CG2-CE3 4.3Å; I494-W498 HydrophobicContact CG2-CH2 3.61Å; I494-W498 HydrophobicContact CG2-CZ2 3.29Å; I494-W498 HydrophobicContact CG2-CZ3 4.1Å; I494-W498 PolarHBondContact O-N 3.43Å; I494-W498 VanDerWaalsContact O-N 3.09Å
495	K	93.4	Very high	93.8	Very high	35 Å²	35	49.8 Å²	49.8	15%	0.152	26%	0.26	C	S	.	.	H	α-helix	trans	-56.2	-48.9	172.5	-168.1	-174	167	-169.1	0	111.1	D476 Y479 V492 L493 C497 W498 M499	D476-K495 WeakPolarHBondContact OD1-CE 3.43Å; D476-K495 IonicContact OD1-NZ 3.36Å; D476-K495 PolarHBondContact OD1-NZ 3.34Å; D476-K495 IonicContact OD2-NZ 3.79Å; D476-K495 PolarHBondContact OD2-NZ 3.31Å; Y479-K495 HydrophobicContact CD2-CB 3.97Å; Y479-K495 HydrophobicContact CD2-CD 4.47Å; Y479-K495 HydrophobicContact CD2-CG 4.05Å; Y479-K495 HydrophobicContact CE1-CB 4.44Å; Y479-K495 HydrophobicContact CE2-CB 3.42Å; Y479-K495 VanDerWaalsContact CE2-CB 3.42Å; Y479-K495 HydrophobicContact CE2-CG 4.01Å; Y479-K495 PolarHBondContact OH-N 3.12Å; V492-K495 WeakPolarHBondContact O-CB 3.27Å; V492-K495 PolarHBondContact O-N 3.45Å; L493-K495 VanDerWaalsContact C-N 3.32Å; L493-K495 PolarHBondContact O-N 2.88Å; K495-C497 VanDerWaalsContact C-N 3.28Å; K495-C497 PolarHBondContact O-N 3.29Å; K495-W498 PolarHBondContact O-N 2.92Å; K495-M499 HydrophobicContact CD-SD 4.4Å; K495-M499 VanDerWaalsContact CE-SD 3.58Å; K495-M499 HydrophobicContact CG-SD 4.07Å; K495-M499 WeakPolarHBondContact O-CG 3.3Å; K495-M499 PolarHBondContact O-N 3Å
496	W	95.3	Very high	93.8	Very high	134 Å²	134	49.6 Å²	49.6	51%	0.508	26%	0.259	S	S	.	.	H	α-helix	trans	-66.4	-31.2	179.6	-72.2	109.4	0	0	0	112.7	V492 L493 I494 I500 L501	V492-W496 PolarHBondContact O-N 3.02Å; L493-W496 CarbonylContact O-C 3.59Å; L493-W496 PolarHBondContact O-N 3.02Å; L493-W496 VanDerWaalsContact O-N 3.09Å; I494-W496 VanDerWaalsContact C-N 3.32Å; I494-W496 PolarHBondContact O-N 3.14Å; W496-I500 HydrophobicContact CE3-CD1 3.81Å; W496-I500 HydrophobicContact CE3-CG1 4.42Å; W496-I500 HydrophobicContact CZ3-CD1 3.75Å; W496-I500 PolarHBondContact O-N 3.04Å; W496-L501 PolarHBondContact O-N 3.06Å
497	C	95.6	Very high	93.7	Very high	0 Å²	0	50.5 Å²	50.5	0%	0	27%	0.27	C	S	.	.	I	π-helix	trans	-60.2	-53.3	171.5	-66.4	0	0	0	0	110.9	P87 L493 I494 K495 M499 I500 L501 T502 P503	P87-C497 HydrophobicContact CB-CB 3.61Å; P87-C497 HydrophobicContact CG-CB 3.42Å; P87-C497 VanDerWaalsContact CG-CB 3.42Å; L493-C497 PolarHBondContact O-N 3.5Å; L493-C497 PolarHBondContact O-SG 3.13Å; I494-C497 WeakPolarHBondContact O-CB 3.36Å; I494-C497 PolarHBondContact O-N 2.93Å; K495-C497 VanDerWaalsContact C-N 3.28Å; K495-C497 PolarHBondContact O-N 3.29Å; C497-M499 VanDerWaalsContact C-N 3.31Å; C497-M499 PolarHBondContact O-N 2.91Å; C497-I500 PolarHBondContact O-N 2.97Å; C497-L501 PolarHBondContact O-N 3.41Å; C497-T502 VanDerWaalsContact O-CB 3.32Å; C497-T502 WeakPolarHBondContact O-CB 3.08Å; C497-T502 PolarHBondContact O-N 3.33Å; C497-T502 PolarHBondContact O-OG1 3.16Å; C497-T502 VanDerWaalsContact O-OG1 3.09Å; C497-P503 WeakPolarHBondContact O-CD 3.3Å
498	W	94.9	Very high	93.7	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	27%	0.267	C	S	.	.	I	π-helix	trans	-60.7	-38.6	179	-59.1	-30.3	0	0	0	113.3	P87 F90 L91 F478 Y479 I482 I494 K495	P87-W498 PolarHBondContact O-NE1 3.34Å; F90-W498 AromaticContact CD1-CH2 3.76Å; F90-W498 HydrophobicContact CD1-CH2 3.76Å; F90-W498 AromaticContact CD1-CZ2 3.58Å; F90-W498 HydrophobicContact CD1-CZ2 3.58Å; F90-W498 AromaticContact CE1-CH2 3.83Å; F90-W498 HydrophobicContact CE1-CH2 3.83Å; F90-W498 HydrophobicContact CE1-CZ2 4.16Å; F90-W498 HydrophobicContact CG-CZ2 4.4Å; L91-W498 HydrophobicContact CB-CZ2 3.93Å; L91-W498 HydrophobicContact CD1-CD2 4.34Å; L91-W498 HydrophobicContact CD1-CG 4.11Å; F478-W498 HydrophobicContact CD1-CE3 4.12Å; F478-W498 AromaticContact CD1-CH2 3.89Å; F478-W498 HydrophobicContact CD1-CH2 3.89Å; F478-W498 AromaticContact CD1-CZ3 3.52Å; F478-W498 HydrophobicContact CD1-CZ3 3.52Å; F478-W498 AromaticContact CE1-CH2 3.73Å; F478-W498 HydrophobicContact CE1-CH2 3.73Å; F478-W498 HydrophobicContact CE1-CZ2 4.32Å; F478-W498 AromaticContact CE1-CZ3 3.86Å; F478-W498 HydrophobicContact CE1-CZ3 3.86Å; Y479-W498 HydrophobicContact CD2-CE3 4.32Å; Y479-W498 AromaticContact CD2-CZ3 3.68Å; Y479-W498 HydrophobicContact CD2-CZ3 3.68Å; Y479-W498 HydrophobicContact CE2-CE3 4.05Å; Y479-W498 HydrophobicContact CE2-CH2 4.19Å; Y479-W498 AromaticContact CE2-CZ3 3.48Å; Y479-W498 HydrophobicContact CE2-CZ3 3.48Å; Y479-W498 VanDerWaalsContact CE2-CZ3 3.48Å; I482-W498 HydrophobicContact CD1-CH2 3.65Å; I482-W498 HydrophobicContact CD1-CZ3 4.03Å; I494-W498 HydrophobicContact CG2-CD2 4.04Å; I494-W498 VanDerWaalsContact CG2-CE2 3.49Å; I494-W498 HydrophobicContact CG2-CE3 4.3Å; I494-W498 HydrophobicContact CG2-CH2 3.61Å; I494-W498 HydrophobicContact CG2-CZ2 3.29Å; I494-W498 HydrophobicContact CG2-CZ3 4.1Å; I494-W498 PolarHBondContact O-N 3.43Å; I494-W498 VanDerWaalsContact O-N 3.09Å; K495-W498 PolarHBondContact O-N 2.92Å
499	M	95.1	Very high	93.5	Very high	28 Å²	28	46.9 Å²	46.9	14%	0.138	26%	0.255	C	S	.	.	I	π-helix	trans	-76.9	-39.1	-176.7	-68.5	-177.2	72.2	0	0	113.1	W471 K495 C497	W471-M499 HydrophobicContact CH2-CE 4.28Å; W471-M499 HydrophobicContact CZ2-CE 4.26Å; W471-M499 HydrophobicContact CZ3-CE 4.47Å; W471-M499 PolarHBondContact NE1-O 3.43Å; K495-M499 HydrophobicContact CD-SD 4.4Å; K495-M499 VanDerWaalsContact CE-SD 3.58Å; K495-M499 HydrophobicContact CG-SD 4.07Å; K495-M499 WeakPolarHBondContact O-CG 3.3Å; K495-M499 PolarHBondContact O-N 3Å; C497-M499 VanDerWaalsContact C-N 3.31Å; C497-M499 PolarHBondContact O-N 2.91Å
500	I	95.4	Very high	93.5	Very high	85 Å²	85	42.1 Å²	42.1	44%	0.436	23%	0.234	S	C	.	.	I	π-helix	trans	-132.2	-56.3	-167.7	-56	-177.8	0	0	0	112.1	W471 W496 C497 P503 G504	W471-I500 HydrophobicContact CZ2-CG1 4.48Å; W496-I500 HydrophobicContact CE3-CD1 3.81Å; W496-I500 HydrophobicContact CE3-CG1 4.42Å; W496-I500 HydrophobicContact CZ3-CD1 3.75Å; W496-I500 PolarHBondContact O-N 3.04Å; C497-I500 PolarHBondContact O-N 2.97Å; I500-P503 WeakPolarHBondContact O-CD 3.47Å; I500-G504 PolarHBondContact O-N 2.93Å
501	L	95.5	Very high	93.4	Very high	65 Å²	65	46.7 Å²	46.7	34%	0.34	26%	0.258	S	S	.	.	I	π-helix	trans	-68.5	-51.4	-166.9	-55.5	174.8	0	0	0	112.1	L493 W496 C497 G504 I505	L493-L501 HydrophobicContact CD1-CD1 4.37Å; W496-L501 PolarHBondContact O-N 3.06Å; C497-L501 PolarHBondContact O-N 3.41Å; L501-G504 PolarHBondContact O-N 3.03Å; L501-I505 HydrophobicContact CB-CD1 4.38Å; L501-I505 VanDerWaalsContact O-CB 3.24Å; L501-I505 WeakPolarHBondContact O-CB 3.49Å; L501-I505 WeakPolarHBondContact O-CD1 3.42Å; L501-I505 WeakPolarHBondContact O-CG1 3.33Å; L501-I505 PolarHBondContact O-N 3.33Å
502	T	95.3	Very high	93	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-59.3	-55.6	-179.8	-50.9	0	0	0	0	112.1	C83 C84 V88 S466 C497 G504 I505 C506	C83-T502 PolarHBondContact O-OG1 2.04Å; C84-T502 HydrophobicContact CB-CG2 4.37Å; V88-T502 HydrophobicContact CG2-CG2 3.49Å; V88-T502 VanDerWaalsContact CG2-CG2 3.49Å; S466-T502 WeakPolarHBondContact OG-CG2 3.49Å; C497-T502 VanDerWaalsContact O-CB 3.32Å; C497-T502 WeakPolarHBondContact O-CB 3.08Å; C497-T502 PolarHBondContact O-N 3.33Å; C497-T502 PolarHBondContact O-OG1 3.16Å; C497-T502 VanDerWaalsContact O-OG1 3.09Å; T502-G504 VanDerWaalsContact C-N 3.32Å; T502-G504 PolarHBondContact O-N 3.29Å; T502-I505 PolarHBondContact O-N 2.62Å; T502-C506 VanDerWaalsContact O-CB 3.31Å; T502-C506 WeakPolarHBondContact O-CB 3.49Å; T502-C506 PolarHBondContact O-N 3.47Å; T502-C506 PolarHBondContact O-SG 2.98Å
503	P	95.7	Very high	92.6	Very high	14 Å²	14	41.4 Å²	41.4	9%	0.091	23%	0.228	C	C	.	.	H	α-helix	trans	-65	-35.7	-179	24.5	-32.6	0	0	0	112.2	I467 C497 I500 A507	I467-P503 HydrophobicContact CG1-CB 4.26Å; C497-P503 WeakPolarHBondContact O-CD 3.3Å; I500-P503 WeakPolarHBondContact O-CD 3.47Å; P503-A507 WeakPolarHBondContact O-CB 3.35Å; P503-A507 PolarHBondContact O-N 3.07Å
504	G	95.5	Very high	92.2	Very high	46 Å²	46	42 Å²	42	47%	0.474	23%	0.231	S	C	.	.	H	α-helix	trans	-66.7	-47.8	177.6	0	0	0	0	0	113.1	I500 L501 T502 G508	I500-G504 PolarHBondContact O-N 2.93Å; L501-G504 PolarHBondContact O-N 3.03Å; T502-G504 VanDerWaalsContact C-N 3.32Å; T502-G504 PolarHBondContact O-N 3.29Å; G504-G508 PolarHBondContact O-N 3.01Å
505	I	93.1	Very high	91.9	Very high	46 Å²	46	46.9 Å²	46.9	24%	0.236	26%	0.256	C	S	.	.	H	α-helix	trans	-63.4	-47.5	177.3	-69.7	169.5	0	0	0	110.1	F80 C83 L501 T502 A507 G508 I509	F80-I505 HydrophobicContact CD1-CG2 4.12Å; F80-I505 HydrophobicContact CE1-CG2 3.35Å; F80-I505 HydrophobicContact CZ-CG2 3.98Å; C83-I505 HydrophobicContact CB-CD1 3.75Å; L501-I505 HydrophobicContact CB-CD1 4.38Å; L501-I505 VanDerWaalsContact O-CB 3.24Å; L501-I505 WeakPolarHBondContact O-CB 3.49Å; L501-I505 WeakPolarHBondContact O-CD1 3.42Å; L501-I505 WeakPolarHBondContact O-CG1 3.33Å; L501-I505 PolarHBondContact O-N 3.33Å; T502-I505 PolarHBondContact O-N 2.62Å; I505-A507 PolarHBondContact O-N 3.47Å; I505-G508 PolarHBondContact O-N 3.3Å; I505-I509 HydrophobicContact CG2-CD1 3.66Å; I505-I509 VanDerWaalsContact O-CD1 3.32Å; I505-I509 WeakPolarHBondContact O-CD1 3.48Å; I505-I509 VanDerWaalsContact O-CG1 3.3Å; I505-I509 WeakPolarHBondContact O-CG1 3.47Å; I505-I509 PolarHBondContact O-N 3.3Å; I505-I509 VanDerWaalsContact O-N 3.09Å
506	C	92.8	Very high	91.4	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-63.1	-43.4	-179.8	-64	0	0	0	0	111.8	F289 L459 I463 T502 G508 I509 F510	F289-C506 WeakPolarHBondContact CZ-SG 3.36Å; L459-C506 HydrophobicContact CD2-CB 4.05Å; I463-C506 HydrophobicContact CD1-CB 4.34Å; I463-C506 HydrophobicContact CG1-CB 3.66Å; T502-C506 VanDerWaalsContact O-CB 3.31Å; T502-C506 WeakPolarHBondContact O-CB 3.49Å; T502-C506 PolarHBondContact O-N 3.47Å; T502-C506 PolarHBondContact O-SG 2.98Å; C506-G508 PolarHBondContact O-N 2.92Å; C506-I509 PolarHBondContact O-N 3.13Å; C506-F510 WeakPolarHBondContact O-CB 3.24Å; C506-F510 PolarHBondContact O-N 3.48Å
507	A	93.2	Very high	90.8	Very high	41 Å²	41	48 Å²	48	34%	0.339	26%	0.263	S	S	.	.	H	α-helix	trans	-63.1	-41.6	176.5	0	0	0	0	0	112.4	I463 P503 I505 L511	I463-A507 HydrophobicContact CD1-CB 3.99Å; I463-A507 HydrophobicContact CG1-CB 4.31Å; P503-A507 WeakPolarHBondContact O-CB 3.35Å; P503-A507 PolarHBondContact O-N 3.07Å; I505-A507 PolarHBondContact O-N 3.47Å; A507-L511 WeakPolarHBondContact O-CB 3.21Å; A507-L511 PolarHBondContact O-N 3.31Å
508	G	91.3	Very high	90.2	Very high	44 Å²	44	56 Å²	56	45%	0.454	30%	0.298	S	S	.	.	H	α-helix	trans	-60.8	-45	177.3	0	0	0	0	0	112.7	G504 I505 C506 F512	G504-G508 PolarHBondContact O-N 3.01Å; I505-G508 PolarHBondContact O-N 3.3Å; C506-G508 PolarHBondContact O-N 2.92Å; G508-F512 WeakPolarHBondContact O-CB 3.41Å; G508-F512 PolarHBondContact O-N 2.81Å
509	I	88.2	Confident	89.8	Confident	17 Å²	17	59.1 Å²	59.1	9%	0.087	32%	0.318	C	S	.	.	H	α-helix	trans	-72.1	-42.2	179.9	-62.8	158	0	0	0	111.2	F80 V282 L459 I505 C506 L511 F512 F513	F80-I509 HydrophobicContact CD1-CD1 4.47Å; F80-I509 HydrophobicContact CE1-CD1 3.15Å; F80-I509 HydrophobicContact CE2-CD1 4.45Å; F80-I509 HydrophobicContact CZ-CD1 3.14Å; F80-I509 HydrophobicContact CZ-CG1 4.24Å; V282-I509 HydrophobicContact CB-CG2 4.39Å; V282-I509 HydrophobicContact CG2-CG2 3.96Å; L459-I509 HydrophobicContact CD1-CB 4.23Å; L459-I509 HydrophobicContact CD1-CG2 3.64Å; I505-I509 HydrophobicContact CG2-CD1 3.66Å; I505-I509 VanDerWaalsContact O-CD1 3.32Å; I505-I509 WeakPolarHBondContact O-CD1 3.48Å; I505-I509 VanDerWaalsContact O-CG1 3.3Å; I505-I509 WeakPolarHBondContact O-CG1 3.47Å; I505-I509 PolarHBondContact O-N 3.3Å; I505-I509 VanDerWaalsContact O-N 3.09Å; C506-I509 PolarHBondContact O-N 3.13Å; I509-L511 VanDerWaalsContact C-N 3.31Å; I509-L511 PolarHBondContact O-N 3.4Å; I509-F512 PolarHBondContact O-N 3.02Å; I509-F512 VanDerWaalsContact O-N 3.16Å; I509-F513 WeakPolarHBondContact O-CB 3.5Å; I509-F513 PolarHBondContact O-N 3.27Å
510	F	89.4	Confident	89.4	Confident	30 Å²	30	59.5 Å²	59.5	13%	0.132	32%	0.32	C	S	.	.	H	α-helix	trans	-57.4	-47.9	176.2	178.8	-92.2	0	0	0	110.3	M456 F460 I463 C506 F512 F513 L514 M544	M456-F510 HydrophobicContact CE-CB 4.35Å; M456-F510 HydrophobicContact CE-CD1 4.45Å; M456-F510 HydrophobicContact CE-CD2 3.17Å; M456-F510 HydrophobicContact CE-CE2 3.35Å; M456-F510 HydrophobicContact CE-CG 3.77Å; M456-F510 HydrophobicContact CE-CZ 4.09Å; M456-F510 WeakPolarHBondContact CE-O 3.06Å; M456-F510 HydrophobicContact SD-CD2 3.98Å; M456-F510 HydrophobicContact SD-CE2 4.5Å; F460-F510 HydrophobicContact CB-CD2 4.19Å; F460-F510 HydrophobicContact CB-CE2 3.82Å; F460-F510 HydrophobicContact CB-CZ 4.49Å; F460-F510 HydrophobicContact CD2-CE1 4.19Å; F460-F510 AromaticContact CD2-CE2 3.88Å; F460-F510 HydrophobicContact CD2-CE2 3.88Å; F460-F510 AromaticContact CD2-CZ 3.67Å; F460-F510 HydrophobicContact CD2-CZ 3.67Å; F460-F510 HydrophobicContact CE2-CZ 4.38Å; F460-F510 HydrophobicContact CG-CE2 4.29Å; F460-F510 HydrophobicContact CG-CZ 4.49Å; I463-F510 HydrophobicContact CD1-CB 4.3Å; C506-F510 WeakPolarHBondContact O-CB 3.24Å; C506-F510 PolarHBondContact O-N 3.48Å; F510-F512 VanDerWaalsContact C-N 3.35Å; F510-F512 PolarHBondContact O-N 3.04Å; F510-F513 PolarHBondContact O-N 3.45Å; F510-L514 HydrophobicContact CD1-CD1 4.02Å; F510-L514 HydrophobicContact CE1-CD1 3.44Å; F510-L514 VanDerWaalsContact CE1-CD1 3.44Å; F510-L514 HydrophobicContact CE1-CG 4.22Å; F510-L514 HydrophobicContact CZ-CD1 3.92Å; F510-L514 HydrophobicContact CZ-CG 4.42Å; F510-L514 WeakPolarHBondContact O-CG 3.23Å; F510-L514 PolarHBondContact O-N 2.82Å; F510-L514 VanDerWaalsContact O-N 3.09Å; F510-M544 HydrophobicContact CE2-CE 3.74Å; F510-M544 HydrophobicContact CZ-CE 3.55Å
511	L	89.9	Confident	89	Confident	102 Å²	102	60.4 Å²	60.4	53%	0.534	32%	0.321	S	S	.	.	H	α-helix	trans	-61.2	-43.8	175.2	-178.1	63.3	0	0	0	111.8	A507 I509 F513 L514 I515	A507-L511 WeakPolarHBondContact O-CB 3.21Å; A507-L511 PolarHBondContact O-N 3.31Å; I509-L511 VanDerWaalsContact C-N 3.31Å; I509-L511 PolarHBondContact O-N 3.4Å; L511-F513 PolarHBondContact O-N 2.94Å; L511-L514 PolarHBondContact O-N 3.33Å; L511-I515 HydrophobicContact CD1-CD1 4.11Å; L511-I515 HydrophobicContact CD1-CG1 4.47Å; L511-I515 HydrophobicContact CD2-CD1 4.49Å; L511-I515 HydrophobicContact CG-CD1 3.84Å; L511-I515 VanDerWaalsContact O-CG1 3.28Å; L511-I515 WeakPolarHBondContact O-CG1 3.18Å; L511-I515 PolarHBondContact O-N 3.13Å
512	F	85.5	Confident	88.5	Confident	49 Å²	49	58 Å²	58	22%	0.215	31%	0.308	C	S	.	.	H	α-helix	trans	-60.8	-44.7	178.4	178.9	-93.9	0	0	0	112.4	P278 V282 G508 I509 F510 L514 I515 K516	P278-F512 HydrophobicContact CB-CD1 4.34Å; P278-F512 HydrophobicContact CB-CD2 4.22Å; P278-F512 HydrophobicContact CB-CE1 3.74Å; P278-F512 HydrophobicContact CB-CE2 3.59Å; P278-F512 HydrophobicContact CB-CZ 3.33Å; P278-F512 HydrophobicContact CG-CE1 4.46Å; P278-F512 HydrophobicContact CG-CE2 3.66Å; P278-F512 HydrophobicContact CG-CZ 3.58Å; V282-F512 HydrophobicContact CG2-CD1 3.56Å; V282-F512 HydrophobicContact CG2-CE1 3.92Å; G508-F512 WeakPolarHBondContact O-CB 3.41Å; G508-F512 PolarHBondContact O-N 2.81Å; I509-F512 PolarHBondContact O-N 3.02Å; I509-F512 VanDerWaalsContact O-N 3.16Å; F510-F512 VanDerWaalsContact C-N 3.35Å; F510-F512 PolarHBondContact O-N 3.04Å; F512-L514 VanDerWaalsContact C-N 3.32Å; F512-L514 PolarHBondContact O-N 3.3Å; F512-I515 PolarHBondContact O-N 3.22Å; F512-K516 HydrophobicContact CD2-CG 4.28Å; F512-K516 HydrophobicContact CE1-CB 4.04Å; F512-K516 HydrophobicContact CE1-CG 4.09Å; F512-K516 HydrophobicContact CE2-CB 4.44Å; F512-K516 HydrophobicContact CE2-CG 3.61Å; F512-K516 HydrophobicContact CZ-CB 3.93Å; F512-K516 HydrophobicContact CZ-CG 3.48Å; F512-K516 VanDerWaalsContact CZ-CG 3.48Å; F512-K516 PolarHBondContact O-N 3.06Å
513	F	82.5	Confident	87.7	Confident	58 Å²	58	62.5 Å²	62.5	25%	0.254	33%	0.332	S	S	.	.	H	α-helix	trans	-61.8	-40.9	177.5	-176.7	-75.6	0	0	0	111.5	V282 M456 I509 F510 L511 I515 K516 Y517	V282-F513 HydrophobicContact CG1-CD2 3.93Å; M456-F513 HydrophobicContact CE-CB 3.64Å; M456-F513 HydrophobicContact CE-CD1 3.41Å; M456-F513 VanDerWaalsContact CE-CD1 3.41Å; M456-F513 HydrophobicContact CE-CE1 4.24Å; M456-F513 HydrophobicContact CE-CG 3.73Å; M456-F513 HydrophobicContact CG-CB 4.4Å; M456-F513 HydrophobicContact CG-CD1 3.27Å; M456-F513 HydrophobicContact CG-CD2 3.87Å; M456-F513 HydrophobicContact CG-CE1 3.24Å; M456-F513 HydrophobicContact CG-CE2 3.85Å; M456-F513 HydrophobicContact CG-CG 3.6Å; M456-F513 HydrophobicContact CG-CZ 3.53Å; M456-F513 HydrophobicContact SD-CB 3.25Å; M456-F513 WeakPolarHBondContact SD-CB 3.4Å; M456-F513 HydrophobicContact SD-CD1 3.26Å; M456-F513 WeakPolarHBondContact SD-CD1 3.34Å; M456-F513 HydrophobicContact SD-CD2 3.65Å; M456-F513 HydrophobicContact SD-CE1 3.92Å; M456-F513 HydrophobicContact SD-CE2 4.26Å; M456-F513 HydrophobicContact SD-CG 3.09Å; M456-F513 WeakPolarHBondContact SD-CG 3.42Å; M456-F513 HydrophobicContact SD-CZ 4.37Å; I509-F513 WeakPolarHBondContact O-CB 3.5Å; I509-F513 PolarHBondContact O-N 3.27Å; F510-F513 PolarHBondContact O-N 3.45Å; L511-F513 PolarHBondContact O-N 2.94Å; F513-I515 VanDerWaalsContact C-N 3.31Å; F513-I515 PolarHBondContact O-N 2.87Å; F513-K516 CarbonylContact O-C 3.56Å; F513-K516 PolarHBondContact O-N 3.39Å; F513-Y517 AromaticContact CE1-CD2 3.95Å; F513-Y517 HydrophobicContact CE1-CD2 3.95Å; F513-Y517 WeakPolarHBondContact O-CA 3.3Å; F513-Y517 PolarHBondContact O-N 3.1Å
514	L	85.1	Confident	86.6	Confident	77 Å²	77	68.8 Å²	68.8	40%	0.403	37%	0.365	S	S	.	.	H	α-helix	trans	-61.8	-40.4	174.9	-69.5	179.4	0	0	0	111.8	M456 F510 L511 F512 W537	M456-L514 HydrophobicContact CE-CD2 4.01Å; M456-L514 HydrophobicContact CE-CG 3.93Å; F510-L514 HydrophobicContact CD1-CD1 4.02Å; F510-L514 HydrophobicContact CE1-CD1 3.44Å; F510-L514 VanDerWaalsContact CE1-CD1 3.44Å; F510-L514 HydrophobicContact CE1-CG 4.22Å; F510-L514 HydrophobicContact CZ-CD1 3.92Å; F510-L514 HydrophobicContact CZ-CG 4.42Å; F510-L514 WeakPolarHBondContact O-CG 3.23Å; F510-L514 PolarHBondContact O-N 2.82Å; F510-L514 VanDerWaalsContact O-N 3.09Å; L511-L514 PolarHBondContact O-N 3.33Å; F512-L514 VanDerWaalsContact C-N 3.32Å; F512-L514 PolarHBondContact O-N 3.3Å; L514-W537 HydrophobicContact CD2-CH2 4.06Å
515	I	86.6	Confident	86.1	Confident	114 Å²	114	72.7 Å²	72.7	59%	0.585	38%	0.379	S	S	*	.	H	α-helix	trans	-71	-37.9	179.9	-67.1	166.5	0	0	0	111.9	L511 F512 F513	L511-I515 HydrophobicContact CD1-CD1 4.11Å; L511-I515 HydrophobicContact CD1-CG1 4.47Å; L511-I515 HydrophobicContact CD2-CD1 4.49Å; L511-I515 HydrophobicContact CG-CD1 3.84Å; L511-I515 VanDerWaalsContact O-CG1 3.28Å; L511-I515 WeakPolarHBondContact O-CG1 3.18Å; L511-I515 PolarHBondContact O-N 3.13Å; F512-I515 PolarHBondContact O-N 3.22Å; F513-I515 VanDerWaalsContact C-N 3.31Å; F513-I515 PolarHBondContact O-N 2.87Å
516	K	83.6	Confident	85.9	Confident	125 Å²	125	72.1 Å²	72.1	54%	0.543	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.8	25.7	-175.7	-66.7	-62.3	-170.5	177	0	113.2	F512 F513 K518	F512-K516 HydrophobicContact CD2-CG 4.28Å; F512-K516 HydrophobicContact CE1-CB 4.04Å; F512-K516 HydrophobicContact CE1-CG 4.09Å; F512-K516 HydrophobicContact CE2-CB 4.44Å; F512-K516 HydrophobicContact CE2-CG 3.61Å; F512-K516 HydrophobicContact CZ-CB 3.93Å; F512-K516 HydrophobicContact CZ-CG 3.48Å; F512-K516 VanDerWaalsContact CZ-CG 3.48Å; F512-K516 PolarHBondContact O-N 3.06Å; F513-K516 CarbonylContact O-C 3.56Å; F513-K516 PolarHBondContact O-N 3.39Å; K516-K518 PolarHBondContact O-N 3.3Å
517	Y	83.6	Confident	85.9	Confident	66 Å²	66	76.9 Å²	76.9	26%	0.259	40%	0.399	S	S	.	.			trans	-53.2	128.8	179.4	175.3	-101.6	0	0	0	111.3	Y451 F513 P519 W537	Y451-Y517 HydrophobicContact CE1-CE2 4.15Å; Y451-Y517 WeakPolarHBondContact CE1-OH 3.31Å; Y451-Y517 PolarHBondContact OH-OH 3.13Å; F513-Y517 AromaticContact CE1-CD2 3.95Å; F513-Y517 HydrophobicContact CE1-CD2 3.95Å; F513-Y517 WeakPolarHBondContact O-CA 3.3Å; F513-Y517 PolarHBondContact O-N 3.1Å; Y517-P519 HydrophobicContact CE1-CG 4.2Å; Y517-W537 HydrophobicContact CD2-CH2 4.5Å; Y517-W537 AromaticContact CD2-CZ2 3.76Å; Y517-W537 HydrophobicContact CD2-CZ2 3.76Å; Y517-W537 HydrophobicContact CE1-CZ2 4.49Å; Y517-W537 AromaticContact CE2-CE2 3.98Å; Y517-W537 HydrophobicContact CE2-CH2 4.45Å; Y517-W537 AromaticContact CE2-CZ2 3.49Å; Y517-W537 HydrophobicContact CE2-CZ2 3.49Å; Y517-W537 VanDerWaalsContact CE2-CZ2 3.49Å; Y517-W537 HydrophobicContact CG-CZ2 4.32Å; Y517-W537 AromaticContact CZ-CE2 3.97Å; Y517-W537 AromaticContact CZ-CZ2 3.87Å; Y517-W537 AromaticContact CZ-NE1 3.54Å; Y517-W537 PolarHBondContact OH-NE1 2.96Å
518	K	82.9	Confident	85.9	Confident	169 Å²	169	75.1 Å²	75.1	74%	0.735	38%	0.383	S	S	*	.			trans	-116.2	126.3	172.9	-72.7	-179.1	-179.3	176.8	0	108.4	K516	K516-K518 PolarHBondContact O-N 3.3Å
519	P	85.5	Confident	86.1	Confident	66 Å²	66	74.1 Å²	74.1	43%	0.429	37%	0.369	S	S	.	.			trans	-58	141.7	176.4	-22.5	31.9	0	0	0	111.5	Y517 Y533	Y517-P519 HydrophobicContact CE1-CG 4.2Å; P519-Y533 HydrophobicContact CB-CD1 4.48Å; P519-Y533 HydrophobicContact CB-CE1 3.72Å; P519-Y533 HydrophobicContact CB-CE2 4.16Å; P519-Y533 WeakPolarHBondContact CB-OH 3.44Å
520	L	87.4	Confident	86.4	Confident	35 Å²	35	80.1 Å²	80.1	18%	0.183	40%	0.401	C	S	.	.			trans	-59.3	141.7	174.4	-179.2	67.7	0	0	0	110.7	Q446 L447 A450 Y451 Y528 Y533	Q446-L520 HydrophobicContact CB-CD2 4.21Å; L447-L520 HydrophobicContact CD2-CD2 4.02Å; A450-L520 HydrophobicContact CB-CD1 3.8Å; A450-L520 HydrophobicContact CB-CD2 3.85Å; A450-L520 HydrophobicContact CB-CG 4.34Å; Y451-L520 HydrophobicContact CE2-CB 3.96Å; Y451-L520 HydrophobicContact CE2-CD2 4.05Å; L520-Y528 HydrophobicContact CB-CD2 4.4Å; L520-Y528 HydrophobicContact CB-CE2 4.41Å; L520-Y528 HydrophobicContact CD2-CD2 4.26Å; L520-Y528 HydrophobicContact CD2-CE2 3.66Å; L520-Y528 HydrophobicContact CG-CD2 4.19Å; L520-Y528 HydrophobicContact CG-CE2 3.72Å; L520-Y528 WeakPolarHBondContact O-CD2 3.32Å; L520-Y533 HydrophobicContact CB-CE1 4.25Å; L520-Y533 WeakPolarHBondContact O-CE1 3.16Å; L520-Y533 PolarHBondContact O-OH 3.23Å
521	K	87.5	Confident	86.7	Confident	104 Å²	104	84.8 Å²	84.8	45%	0.452	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	146.4	172.7	-63.5	-173.7	179.4	-171.6	0	109.6	Y526	K521-Y526 WeakPolarHBondContact CA-O 3.2Å
522	Y	84.9	Confident	86.9	Confident	15 Å²	15	79.9 Å²	79.9	6%	0.059	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	131.2	172.7	-179.4	-111.9	0	0	0	110.8	I196 M442 Y443 Q446 N524 V525 Y526	I196-Y522 HydrophobicContact CD1-CD1 4.43Å; I196-Y522 HydrophobicContact CD1-CE1 3.43Å; I196-Y522 VanDerWaalsContact CD1-CE1 3.43Å; I196-Y522 WeakPolarHBondContact CD1-OH 3.28Å; M442-Y522 HydrophobicContact CE-CE2 4.16Å; M442-Y522 HydrophobicContact CG-CE2 3.94Å; Y443-Y522 HydrophobicContact CD1-CD1 4.26Å; Y443-Y522 HydrophobicContact CD1-CG 4.22Å; Y443-Y522 AromaticContact CE1-CD1 3.48Å; Y443-Y522 HydrophobicContact CE1-CD1 3.48Å; Y443-Y522 VanDerWaalsContact CE1-CD1 3.48Å; Y443-Y522 HydrophobicContact CE1-CE1 4.23Å; Y443-Y522 AromaticContact CE1-CG 3.84Å; Y443-Y522 HydrophobicContact CE1-CG 3.84Å; Q446-Y522 HydrophobicContact CG-CD2 4.42Å; Q446-Y522 VanDerWaalsContact NE2-CD2 3.28Å; Q446-Y522 VanDerWaalsContact OE1-CD2 3.22Å; Y522-N524 PolarHBondContact O-N 3.07Å; Y522-V525 PolarHBondContact O-N 3Å; Y522-V525 VanDerWaalsContact O-N 3.1Å; Y522-Y526 PolarHBondContact N-O 3.25Å; Y522-Y526 PolarHBondContact O-N 3Å
523	N	76.6	Confident	87.3	Confident	95 Å²	95	78.9 Å²	78.9	51%	0.508	39%	0.387	S	S	.	.	T	Hydrogen-bonded Turn	trans	47.3	27.1	-176.3	-73	-4.7	0	0	0	114.8	V525	N523-V525 PolarHBondContact O-N 2.88Å
524	N	74.5	Confident	87.9	Confident	146 Å²	146	78 Å²	78	78%	0.781	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.3	-0.3	-172.8	-62.2	-49.1	0	0	0	116.4	Y522	Y522-N524 PolarHBondContact O-N 3.07Å
525	V	83	Confident	88.3	Confident	128 Å²	128	77.9 Å²	77.9	78%	0.776	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.2	-48.3	-177.8	177.4	0	0	0	0	110.8	Y522 N523	Y522-V525 PolarHBondContact O-N 3Å; Y522-V525 VanDerWaalsContact O-N 3.1Å; N523-V525 PolarHBondContact O-N 2.88Å
526	Y	88.8	Confident	88.7	Confident	34 Å²	34	72.5 Å²	72.5	13%	0.133	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	130.7	-176.3	177.1	-94.5	0	0	0	111.2	D198 G199 I200 E201 Y443 K521 Y522 Y528	D198-Y526 WeakPolarHBondContact O-CD2 3.1Å; G199-Y526 VanDerWaalsContact CA-CE2 3.41Å; I200-Y526 VanDerWaalsContact CG2-OH 3.29Å; I200-Y526 WeakPolarHBondContact CG2-OH 3.46Å; I200-Y526 PolarHBondContact N-OH 3.48Å; E201-Y526 PolarHBondContact OE2-OH 2.96Å; Y443-Y526 AromaticContact CD1-CD1 3.68Å; Y443-Y526 HydrophobicContact CD1-CD1 3.68Å; Y443-Y526 AromaticContact CD1-CE1 3.65Å; Y443-Y526 HydrophobicContact CD1-CE1 3.65Å; Y443-Y526 HydrophobicContact CD1-CG 4.43Å; Y443-Y526 AromaticContact CE1-CD1 3.41Å; Y443-Y526 HydrophobicContact CE1-CD1 3.41Å; Y443-Y526 VanDerWaalsContact CE1-CD1 3.41Å; Y443-Y526 HydrophobicContact CE1-CD2 4.29Å; Y443-Y526 AromaticContact CE1-CE1 3.73Å; Y443-Y526 HydrophobicContact CE1-CE1 3.73Å; Y443-Y526 AromaticContact CE1-CG 3.71Å; Y443-Y526 HydrophobicContact CE1-CG 3.71Å; Y443-Y526 HydrophobicContact CG-CE1 4.43Å; K521-Y526 WeakPolarHBondContact CA-O 3.2Å; Y522-Y526 PolarHBondContact N-O 3.25Å; Y522-Y526 PolarHBondContact O-N 3Å; Y526-Y528 HydrophobicContact CD1-CD2 4.22Å; Y526-Y528 HydrophobicContact CD1-CE2 4.19Å; Y526-Y528 HydrophobicContact CE1-CD1 4.04Å; Y526-Y528 HydrophobicContact CE1-CD2 4.07Å; Y526-Y528 HydrophobicContact CE1-CE1 4.22Å; Y526-Y528 HydrophobicContact CE1-CE2 4.23Å; Y526-Y528 AromaticContact CE1-CG 3.96Å; Y526-Y528 HydrophobicContact CE1-CG 3.96Å
527	I	93.3	Very high	89.2	Confident	100 Å²	100	70.3 Å²	70.3	51%	0.513	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	127.6	177.6	-58	176.5	0	0	0	106.9
528	Y	94.3	Very high	89.7	Confident	4 Å²	4	74.5 Å²	74.5	2%	0.016	37%	0.374	C	S	.	.			trans	-69	147.3	179.1	-71.4	-102.9	0	0	0	110.3	I200 Y443 Q446 L447 L520 Y526 Y533	I200-Y528 HydrophobicContact CD1-CD1 4.41Å; I200-Y528 HydrophobicContact CD1-CE1 4.34Å; I200-Y528 HydrophobicContact CG2-CD1 4.38Å; Y443-Y528 WeakPolarHBondContact CA-OH 3.49Å; Y443-Y528 HydrophobicContact CD1-CE1 4.38Å; Y443-Y528 PolarHBondContact O-OH 3.13Å; Q446-Y528 WeakPolarHBondContact CB-OH 3.5Å; Q446-Y528 PolarHBondContact OE1-OH 3.23Å; Q446-Y528 VanDerWaalsContact OE1-OH 3.09Å; L447-Y528 HydrophobicContact CD1-CD1 4.39Å; L447-Y528 HydrophobicContact CD1-CE1 4.27Å; L447-Y528 HydrophobicContact CD2-CD1 4.08Å; L447-Y528 HydrophobicContact CD2-CE1 4.05Å; L447-Y528 HydrophobicContact CG-CD1 4.26Å; L447-Y528 HydrophobicContact CG-CE1 3.87Å; L520-Y528 HydrophobicContact CB-CD2 4.4Å; L520-Y528 HydrophobicContact CB-CE2 4.41Å; L520-Y528 HydrophobicContact CD2-CD2 4.26Å; L520-Y528 HydrophobicContact CD2-CE2 3.66Å; L520-Y528 HydrophobicContact CG-CD2 4.19Å; L520-Y528 HydrophobicContact CG-CE2 3.72Å; L520-Y528 WeakPolarHBondContact O-CD2 3.32Å; Y526-Y528 HydrophobicContact CD1-CD2 4.22Å; Y526-Y528 HydrophobicContact CD1-CE2 4.19Å; Y526-Y528 HydrophobicContact CE1-CD1 4.04Å; Y526-Y528 HydrophobicContact CE1-CD2 4.07Å; Y526-Y528 HydrophobicContact CE1-CE1 4.22Å; Y526-Y528 HydrophobicContact CE1-CE2 4.23Å; Y526-Y528 AromaticContact CE1-CG 3.96Å; Y526-Y528 HydrophobicContact CE1-CG 3.96Å; Y528-Y533 HydrophobicContact CD2-CE1 4.42Å; Y528-Y533 HydrophobicContact CG-CE1 4.36Å; Y528-Y533 PolarHBondContact N-OH 3.04Å; Y528-Y533 WeakPolarHBondContact O-CE2 3.31Å
529	P	94.8	Very high	90.3	Very high	23 Å²	23	67 Å²	67	15%	0.149	34%	0.342	C	S	.	.			trans	-67.9	157.7	172	30.5	-36.6	0	0	0	110.9	I200 E201 W531 G532 Y533	I200-P529 HydrophobicContact CG2-CG 3.81Å; E201-P529 HydrophobicContact CG-CG 4.37Å; E201-P529 WeakPolarHBondContact OE1-CB 3.42Å; E201-P529 VanDerWaalsContact OE1-CD 3.29Å; E201-P529 WeakPolarHBondContact OE1-CD 3.16Å; E201-P529 WeakPolarHBondContact OE1-CG 3.34Å; P529-W531 HydrophobicContact CB-CG 4.38Å; P529-W531 HydrophobicContact CG-CD2 4Å; P529-W531 HydrophobicContact CG-CG 4.29Å; P529-W531 HydrophobicContact CG-CZ2 3.67Å; P529-W531 VanDerWaalsContact CG-NE1 3.25Å; P529-W531 PolarHBondContact O-N 2.92Å; P529-W531 VanDerWaalsContact O-N 3.15Å; P529-G532 WeakPolarHBondContact O-CA 3.45Å; P529-G532 PolarHBondContact O-N 2.91Å; P529-Y533 PolarHBondContact O-N 3.11Å
530	D	94.6	Very high	90.7	Very high	143 Å²	143	64 Å²	64	77%	0.765	32%	0.323	S	S	*	.	H	α-helix	trans	-55.6	-36.8	-176.8	-69.2	-26.6	0	0	0	113.3	G532 Y533 G534	D530-G532 VanDerWaalsContact C-N 3.29Å; D530-G532 PolarHBondContact O-N 2.97Å; D530-Y533 PolarHBondContact O-N 3.06Å; D530-G534 PolarHBondContact O-N 2.66Å
531	W	95.3	Very high	91	Very high	127 Å²	127	66.1 Å²	66.1	48%	0.481	33%	0.332	S	S	.	.	H	α-helix	trans	-67.1	-30.6	175.7	65.9	-100.4	0	0	0	112.3	I200 E201 P529 G534 I535	I200-W531 HydrophobicContact CB-CH2 4.41Å; I200-W531 HydrophobicContact CD1-CH2 4.22Å; I200-W531 HydrophobicContact CD1-CZ3 4.37Å; I200-W531 HydrophobicContact CG1-CH2 4.07Å; I200-W531 HydrophobicContact CG2-CH2 3.63Å; I200-W531 HydrophobicContact CG2-CZ2 3.75Å; I200-W531 HydrophobicContact CG2-CZ3 4.49Å; E201-W531 HydrophobicContact CG-CZ2 4.2Å; P529-W531 HydrophobicContact CB-CG 4.38Å; P529-W531 HydrophobicContact CG-CD2 4Å; P529-W531 HydrophobicContact CG-CG 4.29Å; P529-W531 HydrophobicContact CG-CZ2 3.67Å; P529-W531 VanDerWaalsContact CG-NE1 3.25Å; P529-W531 PolarHBondContact O-N 2.92Å; P529-W531 VanDerWaalsContact O-N 3.15Å; W531-G534 CarbonylContact O-C 3.59Å; W531-G534 WeakPolarHBondContact O-CA 2.96Å; W531-G534 PolarHBondContact O-N 2.97Å; W531-I535 HydrophobicContact CE3-CD1 3.52Å; W531-I535 HydrophobicContact CE3-CG1 4.37Å; W531-I535 HydrophobicContact CZ3-CD1 3.51Å; W531-I535 WeakPolarHBondContact O-CG1 3.24Å; W531-I535 PolarHBondContact O-N 3.49Å
532	G	94.4	Very high	91.4	Very high	0 Å²	0	62.8 Å²	62.8	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-66.9	-42.3	175	0	0	0	0	0	111.5	P529 D530 G534 I535 G536	P529-G532 WeakPolarHBondContact O-CA 3.45Å; P529-G532 PolarHBondContact O-N 2.91Å; D530-G532 VanDerWaalsContact C-N 3.29Å; D530-G532 PolarHBondContact O-N 2.97Å; G532-G534 VanDerWaalsContact C-N 3.3Å; G532-G534 PolarHBondContact O-N 3.43Å; G532-I535 PolarHBondContact O-N 2.99Å; G532-G536 PolarHBondContact O-N 3.29Å
533	Y	93.3	Very high	91.9	Very high	28 Å²	28	62.1 Å²	62.1	11%	0.11	32%	0.32	C	S	.	.	H	α-helix	trans	-63	-38	169.5	-63	-49.4	0	0	0	112.1	P519 L520 Y528 P529 D530 G536 W537	P519-Y533 HydrophobicContact CB-CD1 4.48Å; P519-Y533 HydrophobicContact CB-CE1 3.72Å; P519-Y533 HydrophobicContact CB-CE2 4.16Å; P519-Y533 WeakPolarHBondContact CB-OH 3.44Å; L520-Y533 HydrophobicContact CB-CE1 4.25Å; L520-Y533 WeakPolarHBondContact O-CE1 3.16Å; L520-Y533 PolarHBondContact O-OH 3.23Å; Y528-Y533 HydrophobicContact CD2-CE1 4.42Å; Y528-Y533 HydrophobicContact CG-CE1 4.36Å; Y528-Y533 PolarHBondContact N-OH 3.04Å; Y528-Y533 WeakPolarHBondContact O-CE2 3.31Å; P529-Y533 PolarHBondContact O-N 3.11Å; D530-Y533 PolarHBondContact O-N 3.06Å; Y533-G536 PolarHBondContact O-N 3.5Å; Y533-W537 PolarHBondContact O-N 3.46Å
534	G	95	Very high	92.8	Very high	40 Å²	40	58.4 Å²	58.4	41%	0.412	30%	0.3	S	S	.	.	H	α-helix	trans	-58.1	-44.2	172.8	0	0	0	0	0	112.9	D530 W531 G532 W537 F538	D530-G534 PolarHBondContact O-N 2.66Å; W531-G534 CarbonylContact O-C 3.59Å; W531-G534 WeakPolarHBondContact O-CA 2.96Å; W531-G534 PolarHBondContact O-N 2.97Å; G532-G534 VanDerWaalsContact C-N 3.3Å; G532-G534 PolarHBondContact O-N 3.43Å; G534-W537 PolarHBondContact O-N 3.01Å; G534-F538 WeakPolarHBondContact O-CB 3.28Å; G534-F538 PolarHBondContact O-N 3.36Å
535	I	94.9	Very high	93.9	Very high	74 Å²	74	53.9 Å²	53.9	38%	0.379	28%	0.277	S	S	.	.	H	α-helix	trans	-62.6	-48	174.1	-68.6	173.2	0	0	0	110.6	W531 G532 W537 F538 M539	W531-I535 HydrophobicContact CE3-CD1 3.52Å; W531-I535 HydrophobicContact CE3-CG1 4.37Å; W531-I535 HydrophobicContact CZ3-CD1 3.51Å; W531-I535 WeakPolarHBondContact O-CG1 3.24Å; W531-I535 PolarHBondContact O-N 3.49Å; G532-I535 PolarHBondContact O-N 2.99Å; I535-W537 PolarHBondContact O-N 3.01Å; I535-F538 WeakPolarHBondContact O-CB 3.39Å; I535-F538 PolarHBondContact O-N 2.87Å; I535-F538 VanDerWaalsContact O-N 3.13Å; I535-M539 HydrophobicContact CG2-CG 4.38Å; I535-M539 HydrophobicContact CG2-SD 4.02Å; I535-M539 VanDerWaalsContact O-CG 3.29Å; I535-M539 WeakPolarHBondContact O-CG 3.47Å; I535-M539 PolarHBondContact O-N 3.21Å
536	G	93.9	Very high	94.5	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-55.4	-49.2	177.7	0	0	0	0	0	112.1	Y451 G532 Y533 F538 M539 A540	Y451-G536 WeakPolarHBondContact CB-O 3.31Å; G532-G536 PolarHBondContact O-N 3.29Å; Y533-G536 PolarHBondContact O-N 3.5Å; G536-F538 PolarHBondContact O-N 3.36Å; G536-M539 WeakPolarHBondContact O-CB 2.88Å; G536-M539 PolarHBondContact O-N 2.81Å; G536-A540 PolarHBondContact O-N 3.34Å
537	W	93.8	Very high	94.9	Very high	80 Å²	80	47.6 Å²	47.6	30%	0.303	24%	0.244	S	C	.	.	H	α-helix	trans	-65.5	-35.9	176.2	-82.8	111.4	0	0	0	113.4	L514 Y517 Y533 G534 I535 M539 A540 M541	L514-W537 HydrophobicContact CD2-CH2 4.06Å; Y517-W537 HydrophobicContact CD2-CH2 4.5Å; Y517-W537 AromaticContact CD2-CZ2 3.76Å; Y517-W537 HydrophobicContact CD2-CZ2 3.76Å; Y517-W537 HydrophobicContact CE1-CZ2 4.49Å; Y517-W537 AromaticContact CE2-CE2 3.98Å; Y517-W537 HydrophobicContact CE2-CH2 4.45Å; Y517-W537 AromaticContact CE2-CZ2 3.49Å; Y517-W537 HydrophobicContact CE2-CZ2 3.49Å; Y517-W537 VanDerWaalsContact CE2-CZ2 3.49Å; Y517-W537 HydrophobicContact CG-CZ2 4.32Å; Y517-W537 AromaticContact CZ-CE2 3.97Å; Y517-W537 AromaticContact CZ-CZ2 3.87Å; Y517-W537 AromaticContact CZ-NE1 3.54Å; Y517-W537 PolarHBondContact OH-NE1 2.96Å; Y533-W537 PolarHBondContact O-N 3.46Å; G534-W537 PolarHBondContact O-N 3.01Å; I535-W537 PolarHBondContact O-N 3.01Å; W537-M539 VanDerWaalsContact C-N 3.31Å; W537-M539 PolarHBondContact O-N 3.16Å; W537-A540 HydrophobicContact CE3-CB 4.39Å; W537-A540 PolarHBondContact O-N 3.32Å; W537-M541 VanDerWaalsContact O-CB 3.3Å; W537-M541 WeakPolarHBondContact O-CB 3.46Å; W537-M541 WeakPolarHBondContact O-CG 3.32Å; W537-M541 PolarHBondContact O-N 3.42Å
538	F	95.5	Very high	95.1	Very high	153 Å²	153	45.1 Å²	45.1	67%	0.671	23%	0.234	S	C	*	.	H	α-helix	trans	-60.7	-42.8	173.5	177.5	-99	0	0	0	111.4	G534 I535 G536 M541 S542	G534-F538 WeakPolarHBondContact O-CB 3.28Å; G534-F538 PolarHBondContact O-N 3.36Å; I535-F538 WeakPolarHBondContact O-CB 3.39Å; I535-F538 PolarHBondContact O-N 2.87Å; I535-F538 VanDerWaalsContact O-N 3.13Å; G536-F538 PolarHBondContact O-N 3.36Å; F538-M541 PolarHBondContact O-N 3.5Å; F538-S542 WeakPolarHBondContact O-CB 3.43Å; F538-S542 PolarHBondContact O-N 2.78Å
539	M	94.7	Very high	95.2	Very high	12 Å²	12	49.8 Å²	49.8	6%	0.059	26%	0.259	C	S	.	.	H	α-helix	trans	-63.3	-47.7	175.8	-64.7	172.2	80.7	0	0	111.8	F448 A452 I535 G536 W537 M541 S542	F448-M539 HydrophobicContact CB-CE 4.32Å; F448-M539 HydrophobicContact CD1-CE 3.46Å; F448-M539 VanDerWaalsContact CD1-CE 3.46Å; F448-M539 HydrophobicContact CD2-CE 3.4Å; F448-M539 HydrophobicContact CD2-SD 4.29Å; F448-M539 HydrophobicContact CE1-CE 3.44Å; F448-M539 VanDerWaalsContact CE1-CE 3.44Å; F448-M539 HydrophobicContact CE2-CE 3.37Å; F448-M539 HydrophobicContact CE2-SD 4.28Å; F448-M539 HydrophobicContact CG-CE 3.45Å; F448-M539 VanDerWaalsContact CG-CE 3.45Å; F448-M539 HydrophobicContact CZ-CE 3.41Å; F448-M539 VanDerWaalsContact CZ-CE 3.41Å; A452-M539 HydrophobicContact CB-CB 3.99Å; A452-M539 HydrophobicContact CB-CE 3.45Å; A452-M539 VanDerWaalsContact CB-CE 3.45Å; A452-M539 HydrophobicContact CB-SD 4.46Å; I535-M539 HydrophobicContact CG2-CG 4.38Å; I535-M539 HydrophobicContact CG2-SD 4.02Å; I535-M539 VanDerWaalsContact O-CG 3.29Å; I535-M539 WeakPolarHBondContact O-CG 3.47Å; I535-M539 PolarHBondContact O-N 3.21Å; G536-M539 WeakPolarHBondContact O-CB 2.88Å; G536-M539 PolarHBondContact O-N 2.81Å; W537-M539 VanDerWaalsContact C-N 3.31Å; W537-M539 PolarHBondContact O-N 3.16Å; M539-M541 VanDerWaalsContact C-N 3.33Å; M539-M541 PolarHBondContact O-N 3.11Å; M539-S542 WeakPolarHBondContact O-CB 3.4Å; M539-S542 PolarHBondContact O-N 3.48Å; M539-S542 PolarHBondContact O-OG 3.26Å
540	A	93.8	Very high	95.2	Very high	3 Å²	3	49.4 Å²	49.4	3%	0.025	26%	0.259	C	S	.	.	H	α-helix	trans	-60.5	-43.5	176.8	0	0	0	0	0	111.9	Y451 G536 W537 S542 S543 M544	Y451-A540 WeakPolarHBondContact O-CB 3.18Å; G536-A540 PolarHBondContact O-N 3.34Å; W537-A540 HydrophobicContact CE3-CB 4.39Å; W537-A540 PolarHBondContact O-N 3.32Å; A540-S542 VanDerWaalsContact C-N 3.34Å; A540-S542 PolarHBondContact O-N 3.2Å; A540-S543 PolarHBondContact O-OG 3.4Å; A540-S543 VanDerWaalsContact O-OG 3.12Å; A540-M544 WeakPolarHBondContact O-CG 3.16Å; A540-M544 PolarHBondContact O-N 2.93Å
541	M	94.8	Very high	95.3	Very high	79 Å²	79	44.3 Å²	44.3	39%	0.389	23%	0.231	S	C	.	.	H	α-helix	trans	-67.2	-35.8	178.5	-71	-59.2	-65.1	0	0	111.6	W537 F538 M539 S543 M544 V545	W537-M541 VanDerWaalsContact O-CB 3.3Å; W537-M541 WeakPolarHBondContact O-CB 3.46Å; W537-M541 WeakPolarHBondContact O-CG 3.32Å; W537-M541 PolarHBondContact O-N 3.42Å; F538-M541 PolarHBondContact O-N 3.5Å; M539-M541 VanDerWaalsContact C-N 3.33Å; M539-M541 PolarHBondContact O-N 3.11Å; M541-S543 CarbonylContact O-C 3.3Å; M541-S543 PolarHBondContact O-N 3.36Å; M541-M544 PolarHBondContact O-N 3.24Å; M541-V545 HydrophobicContact CB-CG2 4.31Å; M541-V545 HydrophobicContact CE-CG1 4.24Å; M541-V545 HydrophobicContact CE-CG2 4.41Å; M541-V545 WeakPolarHBondContact O-CG2 3.47Å; M541-V545 PolarHBondContact O-N 3.12Å
542	S	95.7	Very high	95.3	Very high	35 Å²	35	43.4 Å²	43.4	25%	0.245	24%	0.235	C	C	.	.	H	α-helix	trans	-50.7	-34.9	-176.1	75.4	0	0	0	0	113.9	V123 H127 F538 M539 A540 C546	V123-S542 WeakPolarHBondContact CG1-OG 3.32Å; H127-S542 PolarHBondContact CE1-OG 3.06Å; H127-S542 VanDerWaalsContact CE1-OG 3.27Å; F538-S542 WeakPolarHBondContact O-CB 3.43Å; F538-S542 PolarHBondContact O-N 2.78Å; M539-S542 WeakPolarHBondContact O-CB 3.4Å; M539-S542 PolarHBondContact O-N 3.48Å; M539-S542 PolarHBondContact O-OG 3.26Å; A540-S542 VanDerWaalsContact C-N 3.34Å; A540-S542 PolarHBondContact O-N 3.2Å; S542-C546 PolarHBondContact O-SG 3.41Å
543	S	95.7	Very high	95.3	Very high	1 Å²	1	49.3 Å²	49.3	1%	0.007	26%	0.257	C	S	.	.	H	α-helix	trans	-86.8	-45.6	173	58.3	0	0	0	0	112.5	A120 I124 A540 M541 V545 C546	A120-S543 VanDerWaalsContact CB-O 3.27Å; A120-S543 WeakPolarHBondContact CB-O 3.45Å; I124-S543 VanDerWaalsContact CG1-CB 3.48Å; A540-S543 PolarHBondContact O-OG 3.4Å; A540-S543 VanDerWaalsContact O-OG 3.12Å; M541-S543 CarbonylContact O-C 3.3Å; M541-S543 PolarHBondContact O-N 3.36Å; S543-V545 PolarHBondContact O-N 2.82Å; S543-C546 VanDerWaalsContact O-CB 3.26Å; S543-C546 WeakPolarHBondContact O-CB 3.47Å; S543-C546 PolarHBondContact O-N 2.93Å; S543-C546 VanDerWaalsContact O-N 3.12Å
544	M	95.3	Very high	95.4	Very high	16 Å²	16	49.1 Å²	49.1	8%	0.079	26%	0.258	C	S	.	.	H	α-helix	trans	-62	-37.5	-175.4	-68.7	173.5	59	0	0	113.1	F460 F510 A540 M541 C546 P548	F460-M544 HydrophobicContact CB-CE 4.18Å; F460-M544 HydrophobicContact CB-CG 4.28Å; F460-M544 HydrophobicContact CD1-CB 3.93Å; F460-M544 HydrophobicContact CD1-CE 4.25Å; F460-M544 HydrophobicContact CD1-CG 3.8Å; F460-M544 HydrophobicContact CD2-CE 3.66Å; F460-M544 HydrophobicContact CE1-CB 3.91Å; F460-M544 HydrophobicContact CE1-CG 4.31Å; F460-M544 VanDerWaalsContact CE1-O 3.26Å; F460-M544 WeakPolarHBondContact CE1-O 3.49Å; F460-M544 HydrophobicContact CE2-CE 3.98Å; F460-M544 HydrophobicContact CG-CE 3.78Å; F460-M544 HydrophobicContact CG-CG 4.08Å; F460-M544 HydrophobicContact CZ-CB 4.48Å; F460-M544 HydrophobicContact CZ-CE 4.41Å; F510-M544 HydrophobicContact CE2-CE 3.74Å; F510-M544 HydrophobicContact CZ-CE 3.55Å; A540-M544 WeakPolarHBondContact O-CG 3.16Å; A540-M544 PolarHBondContact O-N 2.93Å; M541-M544 PolarHBondContact O-N 3.24Å; M544-C546 VanDerWaalsContact C-N 3.27Å; M544-C546 PolarHBondContact O-N 3.4Å; M544-P548 WeakPolarHBondContact O-CD 3.38Å
545	V	96.1	Very high	95.3	Very high	51 Å²	51	48.9 Å²	48.9	31%	0.309	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.6	-18.2	178.2	-110.3	0	0	0	0	113.5	M541 S543 I547 P548 L549	M541-V545 HydrophobicContact CB-CG2 4.31Å; M541-V545 HydrophobicContact CE-CG1 4.24Å; M541-V545 HydrophobicContact CE-CG2 4.41Å; M541-V545 WeakPolarHBondContact O-CG2 3.47Å; M541-V545 PolarHBondContact O-N 3.12Å; S543-V545 PolarHBondContact O-N 2.82Å; V545-I547 PolarHBondContact O-N 3.46Å; V545-P548 HydrophobicContact CG1-CG 4.26Å; V545-P548 VanDerWaalsContact O-CD 3.27Å; V545-P548 WeakPolarHBondContact O-CD 3.18Å; V545-P548 WeakPolarHBondContact O-CG 3.44Å; V545-L549 HydrophobicContact CB-CD1 3.9Å; V545-L549 HydrophobicContact CB-CG 4.2Å; V545-L549 HydrophobicContact CG1-CD1 4.25Å; V545-L549 HydrophobicContact CG1-CG 4.25Å; V545-L549 WeakPolarHBondContact O-CB 3.34Å; V545-L549 VanDerWaalsContact O-CG 3.27Å; V545-L549 WeakPolarHBondContact O-CG 3.46Å; V545-L549 PolarHBondContact O-N 2.98Å
546	C	97.1	Very high	95.3	Very high	30 Å²	30	55 Å²	55	20%	0.203	27%	0.265	C	S	.	.	H	α-helix	trans	-57.1	-35.1	178.1	-66.6	0	0	0	0	112.4	G116 A120 S542 S543 M544 G550	G116-C546 WeakPolarHBondContact CA-O 3.43Å; A120-C546 HydrophobicContact CB-CB 4Å; S542-C546 PolarHBondContact O-SG 3.41Å; S543-C546 VanDerWaalsContact O-CB 3.26Å; S543-C546 WeakPolarHBondContact O-CB 3.47Å; S543-C546 PolarHBondContact O-N 2.93Å; S543-C546 VanDerWaalsContact O-N 3.12Å; M544-C546 VanDerWaalsContact C-N 3.27Å; M544-C546 PolarHBondContact O-N 3.4Å; C546-G550 WeakPolarHBondContact O-CA 3.26Å; C546-G550 PolarHBondContact O-N 2.98Å
547	I	97	Very high	95.3	Very high	0 Å²	0	61.2 Å²	61.2	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-68.2	-62.4	179.5	-61.2	170.7	0	0	0	111.6	I117 A120 F460 V461 F464 V545 L549 G550 I551	I117-I547 HydrophobicContact CG1-CD1 4.22Å; I117-I547 HydrophobicContact CG1-CG1 4.15Å; A120-I547 HydrophobicContact CB-CD1 4.15Å; A120-I547 HydrophobicContact CB-CG1 3.9Å; F460-I547 HydrophobicContact CD1-CD1 4.09Å; F460-I547 HydrophobicContact CE1-CB 4.46Å; F460-I547 HydrophobicContact CE1-CD1 3.97Å; V461-I547 HydrophobicContact CG2-CD1 4.22Å; F464-I547 HydrophobicContact CB-CD1 4.08Å; F464-I547 HydrophobicContact CB-CG2 4.24Å; F464-I547 HydrophobicContact CD1-CG2 3.81Å; F464-I547 HydrophobicContact CD2-CD1 3.87Å; F464-I547 HydrophobicContact CD2-CG2 4.03Å; F464-I547 HydrophobicContact CE1-CG2 4.13Å; F464-I547 HydrophobicContact CE2-CG2 4.38Å; F464-I547 HydrophobicContact CG-CD1 4.16Å; F464-I547 HydrophobicContact CG-CG2 3.75Å; F464-I547 HydrophobicContact CZ-CG2 4.41Å; V545-I547 PolarHBondContact O-N 3.46Å; I547-L549 PolarHBondContact O-N 3.42Å; I547-G550 PolarHBondContact O-N 3.38Å; I547-I551 HydrophobicContact CG2-CD1 4.11Å; I547-I551 WeakPolarHBondContact O-CG1 3.44Å; I547-I551 PolarHBondContact O-N 2.92Å
548	P	96.9	Very high	95.3	Very high	48 Å²	48	58.2 Å²	58.2	31%	0.312	28%	0.282	S	S	.	.	H	α-helix	trans	-63.6	-38.8	-179.5	25.2	-34.5	0	0	0	112.7	M544 V545 I551 I552	M544-P548 WeakPolarHBondContact O-CD 3.38Å; V545-P548 HydrophobicContact CG1-CG 4.26Å; V545-P548 VanDerWaalsContact O-CD 3.27Å; V545-P548 WeakPolarHBondContact O-CD 3.18Å; V545-P548 WeakPolarHBondContact O-CG 3.44Å; P548-I551 PolarHBondContact O-N 3.01Å; P548-I552 VanDerWaalsContact O-CG1 3.28Å; P548-I552 WeakPolarHBondContact O-CG1 3.33Å; P548-I552 PolarHBondContact O-N 3.18Å
549	L	96	Very high	95.2	Very high	102 Å²	102	55.9 Å²	55.9	53%	0.534	28%	0.283	S	S	.	.	H	α-helix	trans	-66	-38.8	175.8	-67.5	178.5	0	0	0	111.7	V545 I547 I552 W553	V545-L549 HydrophobicContact CB-CD1 3.9Å; V545-L549 HydrophobicContact CB-CG 4.2Å; V545-L549 HydrophobicContact CG1-CD1 4.25Å; V545-L549 HydrophobicContact CG1-CG 4.25Å; V545-L549 WeakPolarHBondContact O-CB 3.34Å; V545-L549 VanDerWaalsContact O-CG 3.27Å; V545-L549 WeakPolarHBondContact O-CG 3.46Å; V545-L549 PolarHBondContact O-N 2.98Å; I547-L549 PolarHBondContact O-N 3.42Å; L549-I552 PolarHBondContact O-N 2.95Å; L549-W553 WeakPolarHBondContact O-CB 3.26Å; L549-W553 PolarHBondContact O-N 3.37Å
550	G	95.3	Very high	95.1	Very high	15 Å²	15	57 Å²	57	16%	0.155	30%	0.298	C	S	.	.	H	α-helix	trans	-60.5	-45.4	174.2	0	0	0	0	0	112.1	C546 I547 W553 M554	C546-G550 WeakPolarHBondContact O-CA 3.26Å; C546-G550 PolarHBondContact O-N 2.98Å; I547-G550 PolarHBondContact O-N 3.38Å; G550-W553 PolarHBondContact O-N 3.19Å; G550-M554 WeakPolarHBondContact O-CB 3.47Å; G550-M554 VanDerWaalsContact O-CG 3.27Å; G550-M554 WeakPolarHBondContact O-CG 3.44Å; G550-M554 PolarHBondContact O-N 2.91Å
551	I	95.9	Very high	95.1	Very high	36 Å²	36	60.8 Å²	60.8	19%	0.185	32%	0.321	C	S	.	.	H	α-helix	trans	-58.5	-50.7	175.3	-68.9	166.5	0	0	0	110.5	L113 F114 I547 P548 W553 M554 I555	L113-I551 HydrophobicContact CD1-CG2 4.02Å; L113-I551 HydrophobicContact CG-CG1 4.47Å; L113-I551 HydrophobicContact CG-CG2 4.5Å; L113-I551 WeakPolarHBondContact O-CG1 3.28Å; F114-I551 HydrophobicContact CD1-CD1 4.13Å; F114-I551 HydrophobicContact CE1-CD1 3.77Å; F114-I551 HydrophobicContact CZ-CD1 4.45Å; I547-I551 HydrophobicContact CG2-CD1 4.11Å; I547-I551 WeakPolarHBondContact O-CG1 3.44Å; I547-I551 PolarHBondContact O-N 2.92Å; P548-I551 PolarHBondContact O-N 3.01Å; I551-W553 PolarHBondContact O-N 3.45Å; I551-M554 PolarHBondContact O-N 3.05Å; I551-I555 HydrophobicContact CG2-CD1 3.85Å; I551-I555 VanDerWaalsContact O-CG1 3.27Å; I551-I555 WeakPolarHBondContact O-CG1 3.08Å; I551-I555 PolarHBondContact O-N 3.15Å; I551-I555 VanDerWaalsContact O-N 3.08Å
552	I	95.8	Very high	95	Very high	108 Å²	108	63.8 Å²	63.8	55%	0.554	33%	0.332	S	S	*	.	H	α-helix	trans	-61.4	-46.5	-179.7	-68.1	165.7	0	0	0	110.7	P548 L549 I555 W556	P548-I552 VanDerWaalsContact O-CG1 3.28Å; P548-I552 WeakPolarHBondContact O-CG1 3.33Å; P548-I552 PolarHBondContact O-N 3.18Å; L549-I552 PolarHBondContact O-N 2.95Å; I552-I555 PolarHBondContact O-N 2.92Å; I552-W556 WeakPolarHBondContact O-CB 3.15Å; I552-W556 PolarHBondContact O-N 3.19Å
553	W	95.2	Very high	94.8	Very high	125 Å²	125	66.5 Å²	66.5	47%	0.473	35%	0.35	S	S	.	.	H	α-helix	trans	-63.8	-43	-178.3	-177.8	82.9	0	0	0	112.2	L549 G550 I551 W556 K557	L549-W553 WeakPolarHBondContact O-CB 3.26Å; L549-W553 PolarHBondContact O-N 3.37Å; G550-W553 PolarHBondContact O-N 3.19Å; I551-W553 PolarHBondContact O-N 3.45Å; W553-W556 PolarHBondContact O-N 2.71Å; W553-K557 HydrophobicContact CH2-CD 3.69Å; W553-K557 HydrophobicContact CZ2-CD 3.66Å; W553-K557 HydrophobicContact CZ3-CD 4.18Å; W553-K557 WeakPolarHBondContact O-CB 3.43Å; W553-K557 PolarHBondContact O-N 3.41Å
554	M	94.1	Very high	94.6	Very high	24 Å²	24	71.8 Å²	71.8	12%	0.118	38%	0.375	C	S	.	.	H	α-helix	trans	-65.2	-40.8	177.7	-72.8	-62.1	-96.3	0	0	112.2	P112 G550 I551 T558 L569	P112-M554 HydrophobicContact CB-CE 3.8Å; P112-M554 VanDerWaalsContact O-CE 3.29Å; P112-M554 WeakPolarHBondContact O-CE 3.32Å; G550-M554 WeakPolarHBondContact O-CB 3.47Å; G550-M554 VanDerWaalsContact O-CG 3.27Å; G550-M554 WeakPolarHBondContact O-CG 3.44Å; G550-M554 PolarHBondContact O-N 2.91Å; I551-M554 PolarHBondContact O-N 3.05Å; M554-T558 WeakPolarHBondContact O-CB 3.49Å; M554-T558 PolarHBondContact O-N 3.07Å; M554-T558 PolarHBondContact O-OG1 3.3Å; M554-L569 HydrophobicContact CB-CD1 4.15Å; M554-L569 HydrophobicContact CB-CD2 4.09Å; M554-L569 HydrophobicContact CE-CD2 4.06Å
555	I	94.6	Very high	94.6	Very high	35 Å²	35	74.1 Å²	74.1	18%	0.179	38%	0.383	C	S	.	.	H	α-helix	trans	-64.7	-41.3	174.7	-67.6	168.6	0	0	0	110.6	L113 I551 I552 F562 R565 M566 L569	L113-I555 HydrophobicContact CD1-CD1 4.09Å; L113-I555 HydrophobicContact CD1-CG1 3.89Å; I551-I555 HydrophobicContact CG2-CD1 3.85Å; I551-I555 VanDerWaalsContact O-CG1 3.27Å; I551-I555 WeakPolarHBondContact O-CG1 3.08Å; I551-I555 PolarHBondContact O-N 3.15Å; I551-I555 VanDerWaalsContact O-N 3.08Å; I552-I555 PolarHBondContact O-N 2.92Å; I555-F562 HydrophobicContact CG2-CD2 4.41Å; I555-F562 HydrophobicContact CG2-CE2 4.32Å; I555-R565 WeakPolarHBondContact O-CD 3.47Å; I555-R565 PolarHBondContact O-NH1 2.85Å; I555-M566 HydrophobicContact CD1-SD 4.05Å; I555-M566 HydrophobicContact CG1-SD 4.29Å; I555-L569 HydrophobicContact CG1-CD1 4.01Å
556	W	94.6	Very high	94.5	Very high	201 Å²	201	74.3 Å²	74.3	76%	0.761	38%	0.381	S	S	*	.	H	α-helix	trans	-68	-43.9	-178.9	-177.8	62.2	0	0	0	112.5	I552 W553	I552-W556 WeakPolarHBondContact O-CB 3.15Å; I552-W556 PolarHBondContact O-N 3.19Å; W553-W556 PolarHBondContact O-N 2.71Å
557	K	94.4	Very high	94.3	Very high	132 Å²	132	80.2 Å²	80.2	57%	0.574	40%	0.403	S	S	*	.	H	α-helix	trans	-71.2	-29.8	-177.7	-174	177.8	178.9	-177	0	113.7	W553 P559	W553-K557 HydrophobicContact CH2-CD 3.69Å; W553-K557 HydrophobicContact CZ2-CD 3.66Å; W553-K557 HydrophobicContact CZ3-CD 4.18Å; W553-K557 WeakPolarHBondContact O-CB 3.43Å; W553-K557 PolarHBondContact O-N 3.41Å; K557-P559 WeakPolarHBondContact O-CD 3.3Å
558	T	93.9	Very high	94.1	Very high	16 Å²	16	86.8 Å²	86.8	10%	0.098	43%	0.432	C	S	.	.	S	Bend	trans	-77.6	122.6	-175.5	-56.6	0	0	0	0	110.7	M554 R565 K568	M554-T558 WeakPolarHBondContact O-CB 3.49Å; M554-T558 PolarHBondContact O-N 3.07Å; M554-T558 PolarHBondContact O-OG1 3.3Å; T558-R565 HydrophobicContact CG2-CB 4.41Å; T558-R565 HydrophobicContact CG2-CG 4.07Å; T558-R565 VanDerWaalsContact O-CD 3.27Å; T558-R565 WeakPolarHBondContact O-CD 3.38Å; T558-R565 WeakPolarHBondContact O-CG 3.27Å; T558-R565 PolarHBondContact O-NE 3.49Å; T558-R565 PolarHBondContact O-NH1 3.44Å; T558-K568 HydrophobicContact CG2-CD 3.98Å
559	P	91.9	Very high	93.9	Very high	104 Å²	104	84.8 Å²	84.8	68%	0.675	42%	0.419	S	S	*	.			trans	-72.1	155.6	177.2	30.3	-35	0	0	0	111.5	K557	K557-P559 WeakPolarHBondContact O-CD 3.3Å
560	G	93.3	Very high	93.8	Very high	37 Å²	37	81.9 Å²	81.9	38%	0.381	41%	0.405	S	S	.	.	S	Bend	trans	117.7	-175.5	179	0	0	0	0	0	113.4	R565	G560-R565 VanDerWaalsContact O-CZ 3.3Å; G560-R565 PolarHBondContact O-NE 3.12Å; G560-R565 PolarHBondContact O-NH2 3.33Å
561	T	94.2	Very high	93.7	Very high	82 Å²	82	84.7 Å²	84.7	50%	0.503	42%	0.42	S	S	.	.			trans	-74.3	162.1	172.2	62.5	0	0	0	0	111.2	S563 E564 R565	T561-S563 VanDerWaalsContact C-N 3.28Å; T561-S563 PolarHBondContact O-N 2.85Å; T561-E564 PolarHBondContact N-OE2 3.26Å; T561-E564 PolarHBondContact O-N 3.38Å; T561-E564 VanDerWaalsContact OG1-CD 3.23Å; T561-E564 VanDerWaalsContact OG1-CG 3.26Å; T561-E564 WeakPolarHBondContact OG1-CG 3.34Å; T561-E564 PolarHBondContact OG1-N 3.35Å; T561-E564 PolarHBondContact OG1-OE2 3.04Å; T561-R565 VanDerWaalsContact O-CG 3.24Å; T561-R565 WeakPolarHBondContact O-CG 3.45Å; T561-R565 PolarHBondContact O-N 3.19Å
562	F	92.1	Very high	93.5	Very high	142 Å²	142	84.2 Å²	84.2	62%	0.623	42%	0.419	S	S	*	.	H	α-helix	trans	-56.1	-41.5	179.9	-177.1	-100.9	0	0	0	112.7	I555 R565 M566	I555-F562 HydrophobicContact CG2-CD2 4.41Å; I555-F562 HydrophobicContact CG2-CE2 4.32Å; F562-R565 PolarHBondContact O-N 2.89Å; F562-M566 HydrophobicContact CD1-CG 4.16Å; F562-M566 HydrophobicContact CE1-CG 3.75Å; F562-M566 HydrophobicContact CE2-CG 4.13Å; F562-M566 HydrophobicContact CE2-SD 4.24Å; F562-M566 HydrophobicContact CZ-CG 3.73Å; F562-M566 HydrophobicContact CZ-SD 4Å; F562-M566 WeakPolarHBondContact O-CB 3.38Å; F562-M566 VanDerWaalsContact O-CG 3.3Å; F562-M566 WeakPolarHBondContact O-CG 3.3Å; F562-M566 PolarHBondContact O-N 3.02Å
563	S	91.4	Very high	93.3	Very high	91 Å²	91	80.4 Å²	80.4	64%	0.636	40%	0.402	S	S	*	.	H	α-helix	trans	-65	-43.1	178.7	-173.1	0	0	0	0	112.4	T561 M566 K567	T561-S563 VanDerWaalsContact C-N 3.28Å; T561-S563 PolarHBondContact O-N 2.85Å; S563-M566 PolarHBondContact O-N 3.32Å; S563-K567 WeakPolarHBondContact O-CB 3.21Å; S563-K567 PolarHBondContact O-N 3.19Å
564	E	92.5	Very high	92.8	Very high	113 Å²	113	79.7 Å²	79.7	53%	0.528	41%	0.413	S	S	.	.	H	α-helix	trans	-64.9	-42.4	176.4	-70.6	166.4	155.5	0	0	111.9	T561 K567 K568	T561-E564 PolarHBondContact N-OE2 3.26Å; T561-E564 PolarHBondContact O-N 3.38Å; T561-E564 VanDerWaalsContact OG1-CD 3.23Å; T561-E564 VanDerWaalsContact OG1-CG 3.26Å; T561-E564 WeakPolarHBondContact OG1-CG 3.34Å; T561-E564 PolarHBondContact OG1-N 3.35Å; T561-E564 PolarHBondContact OG1-OE2 3.04Å; E564-K567 PolarHBondContact O-N 3.24Å; E564-K568 WeakPolarHBondContact O-CB 3.29Å; E564-K568 PolarHBondContact O-N 2.99Å
565	R	94.1	Very high	92.3	Very high	65 Å²	65	84.4 Å²	84.4	25%	0.245	44%	0.439	C	S	.	.	H	α-helix	trans	-59.4	-50.2	175.7	-68.4	173.7	-164.1	-147.7	1	110.8	I555 T558 G560 T561 F562 K567 K568 L569	I555-R565 WeakPolarHBondContact O-CD 3.47Å; I555-R565 PolarHBondContact O-NH1 2.85Å; T558-R565 HydrophobicContact CG2-CB 4.41Å; T558-R565 HydrophobicContact CG2-CG 4.07Å; T558-R565 VanDerWaalsContact O-CD 3.27Å; T558-R565 WeakPolarHBondContact O-CD 3.38Å; T558-R565 WeakPolarHBondContact O-CG 3.27Å; T558-R565 PolarHBondContact O-NE 3.49Å; T558-R565 PolarHBondContact O-NH1 3.44Å; G560-R565 VanDerWaalsContact O-CZ 3.3Å; G560-R565 PolarHBondContact O-NE 3.12Å; G560-R565 PolarHBondContact O-NH2 3.33Å; T561-R565 VanDerWaalsContact O-CG 3.24Å; T561-R565 WeakPolarHBondContact O-CG 3.45Å; T561-R565 PolarHBondContact O-N 3.19Å; F562-R565 PolarHBondContact O-N 2.89Å; R565-K567 PolarHBondContact O-N 3.04Å; R565-K568 PolarHBondContact O-N 3.04Å; R565-L569 WeakPolarHBondContact O-CB 3.45Å; R565-L569 VanDerWaalsContact O-CG 3.26Å; R565-L569 WeakPolarHBondContact O-CG 3.31Å; R565-L569 PolarHBondContact O-N 3.06Å
566	M	93.4	Very high	91.9	Very high	55 Å²	55	83.9 Å²	83.9	27%	0.271	44%	0.436	S	S	.	.	H	α-helix	trans	-60.4	-46.4	178.8	-71.2	-56.5	-64	0	0	111.2	L113 I555 F562 S563 K568 L569 T570	L113-M566 HydrophobicContact CD1-SD 4.49Å; L113-M566 HydrophobicContact CD2-CE 3.68Å; L113-M566 HydrophobicContact CD2-SD 4.47Å; I555-M566 HydrophobicContact CD1-SD 4.05Å; I555-M566 HydrophobicContact CG1-SD 4.29Å; F562-M566 HydrophobicContact CD1-CG 4.16Å; F562-M566 HydrophobicContact CE1-CG 3.75Å; F562-M566 HydrophobicContact CE2-CG 4.13Å; F562-M566 HydrophobicContact CE2-SD 4.24Å; F562-M566 HydrophobicContact CZ-CG 3.73Å; F562-M566 HydrophobicContact CZ-SD 4Å; F562-M566 WeakPolarHBondContact O-CB 3.38Å; F562-M566 VanDerWaalsContact O-CG 3.3Å; F562-M566 WeakPolarHBondContact O-CG 3.3Å; F562-M566 PolarHBondContact O-N 3.02Å; S563-M566 PolarHBondContact O-N 3.32Å; M566-K568 VanDerWaalsContact C-N 3.33Å; M566-K568 PolarHBondContact O-N 2.98Å; M566-L569 PolarHBondContact O-N 3.13Å; M566-T570 WeakPolarHBondContact O-CB 3.48Å; M566-T570 WeakPolarHBondContact O-CG2 3.37Å; M566-T570 PolarHBondContact O-N 3.33Å; M566-T570 PolarHBondContact O-OG1 3.36Å
567	K	92.8	Very high	91.3	Very high	153 Å²	153	80.5 Å²	80.5	67%	0.665	43%	0.427	S	S	*	.	H	α-helix	trans	-59.9	-42.8	177.1	-173.3	177.3	-179.5	-179.2	0	112	S563 E564 R565 T570 T571	S563-K567 WeakPolarHBondContact O-CB 3.21Å; S563-K567 PolarHBondContact O-N 3.19Å; E564-K567 PolarHBondContact O-N 3.24Å; R565-K567 PolarHBondContact O-N 3.04Å; K567-T570 PolarHBondContact O-OG1 2.85Å; K567-T571 WeakPolarHBondContact O-CB 3.31Å; K567-T571 PolarHBondContact O-N 3.04Å; K567-T571 PolarHBondContact O-OG1 3.37Å
568	K	92.9	Very high	90.9	Very high	138 Å²	138	77.7 Å²	77.7	60%	0.6	42%	0.417	S	S	*	.	H	α-helix	trans	-67.2	-43.4	179.2	-174.3	173.9	178.5	179	0	112	T558 E564 R565 M566 T571	T558-K568 HydrophobicContact CG2-CD 3.98Å; E564-K568 WeakPolarHBondContact O-CB 3.29Å; E564-K568 PolarHBondContact O-N 2.99Å; R565-K568 PolarHBondContact O-N 3.04Å; M566-K568 VanDerWaalsContact C-N 3.33Å; M566-K568 PolarHBondContact O-N 2.98Å; K568-T571 PolarHBondContact O-N 2.78Å
569	L	94.2	Very high	90.4	Very high	7 Å²	7	82.5 Å²	82.5	4%	0.037	43%	0.433	C	S	.	.	H	α-helix	trans	-76.7	-20.5	-176.5	-68.4	171.2	0	0	0	113.8	P112 L113 M554 I555 R565 M566	P112-L569 HydrophobicContact CB-CD2 4.04Å; P112-L569 VanDerWaalsContact CD-O 3.25Å; P112-L569 WeakPolarHBondContact CD-O 3.4Å; L113-L569 HydrophobicContact CB-CB 3.94Å; L113-L569 HydrophobicContact CD1-CB 4.16Å; L113-L569 HydrophobicContact CD1-CD1 3.99Å; L113-L569 PolarHBondContact N-O 3.32Å; M554-L569 HydrophobicContact CB-CD1 4.15Å; M554-L569 HydrophobicContact CB-CD2 4.09Å; M554-L569 HydrophobicContact CE-CD2 4.06Å; I555-L569 HydrophobicContact CG1-CD1 4.01Å; R565-L569 WeakPolarHBondContact O-CB 3.45Å; R565-L569 VanDerWaalsContact O-CG 3.26Å; R565-L569 WeakPolarHBondContact O-CG 3.31Å; R565-L569 PolarHBondContact O-N 3.06Å; M566-L569 PolarHBondContact O-N 3.13Å
570	T	93.9	Very high	89.7	Confident	40 Å²	40	78 Å²	78	25%	0.245	41%	0.406	C	S	.	.	H	α-helix	trans	-95.2	-5.7	173	61.2	0	0	0	0	113.5	L113 V472 M566 K567	L113-T570 HydrophobicContact CD2-CG2 3.97Å; V472-T570 HydrophobicContact CG1-CG2 3.61Å; M566-T570 WeakPolarHBondContact O-CB 3.48Å; M566-T570 WeakPolarHBondContact O-CG2 3.37Å; M566-T570 PolarHBondContact O-N 3.33Å; M566-T570 PolarHBondContact O-OG1 3.36Å; K567-T570 PolarHBondContact O-OG1 2.85Å
571	T	92.6	Very high	88.6	Confident	75 Å²	75	83.9 Å²	83.9	46%	0.46	42%	0.421	S	S	.	.	S	Bend	trans	-84.7	128.9	175	-61.2	0	0	0	0	109.8	K567 K568	K567-T571 WeakPolarHBondContact O-CB 3.31Å; K567-T571 PolarHBondContact O-N 3.04Å; K567-T571 PolarHBondContact O-OG1 3.37Å; K568-T571 PolarHBondContact O-N 2.78Å
572	P	92.7	Very high	87.6	Confident	25 Å²	25	82.9 Å²	82.9	16%	0.162	41%	0.412	C	S	.	.	P	Polyproline II helix	trans	-64.2	159.3	176.8	-20.2	32.8	0	0	0	112.7	K109 Y473 R477 L576	K109-P572 CarbonylContact O-C 3.6Å; K109-P572 WeakPolarHBondContact O-CA 3.13Å; Y473-P572 HydrophobicContact CD2-CG 3.7Å; Y473-P572 HydrophobicContact CE2-CB 3.87Å; Y473-P572 HydrophobicContact CE2-CG 3.32Å; R477-P572 VanDerWaalsContact NH1-CG 3.35Å; P572-L576 HydrophobicContact CB-CD2 4.42Å
573	S	90.6	Very high	86.4	Confident	29 Å²	29	77.2 Å²	77.2	20%	0.203	39%	0.391	C	S	.	.	P	Polyproline II helix	trans	-58.9	137.6	175.5	178.6	0	0	0	0	111.5	K109 D575 L576	K109-S573 PolarHBondContact O-N 3.37Å; S573-D575 PolarHBondContact O-N 3.31Å; S573-D575 VanDerWaalsContact O-N 3.17Å; S573-D575 PolarHBondContact OG-N 2.74Å; S573-L576 WeakPolarHBondContact O-CB 3.4Å; S573-L576 PolarHBondContact O-N 2.99Å
574	P	84.8	Confident	84.8	Confident	109 Å²	109	76.3 Å²	76.3	71%	0.708	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	-24.7	173.9	-23.3	33.5	0	0	0	114.3	L576	P574-L576 PolarHBondContact O-N 3.48Å
575	D	83.7	Confident	83.1	Confident	124 Å²	124	77.8 Å²	77.8	66%	0.663	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.4	-14.9	179.3	-57.5	-35.9	0	0	0	112.5	S573 K577	S573-D575 PolarHBondContact O-N 3.31Å; S573-D575 VanDerWaalsContact O-N 3.17Å; S573-D575 PolarHBondContact OG-N 2.74Å; D575-K577 VanDerWaalsContact C-N 3.34Å; D575-K577 PolarHBondContact O-N 3.38Å
576	L	85.4	Confident	80.9	Confident	23 Å²	23	76.8 Å²	76.8	12%	0.12	40%	0.403	C	S	.	.			trans	-82.8	80.3	179.7	-167.7	65.9	0	0	0	110.1	F98 T99 V110 P572 S573 P574	F98-L576 HydrophobicContact CD1-CD1 4.02Å; F98-L576 HydrophobicContact CD1-CD2 4.46Å; F98-L576 HydrophobicContact CD1-CG 4.4Å; F98-L576 HydrophobicContact CE1-CD1 3.66Å; F98-L576 HydrophobicContact CE1-CD2 3.75Å; F98-L576 HydrophobicContact CE1-CG 3.58Å; F98-L576 HydrophobicContact CZ-CD1 4.23Å; F98-L576 HydrophobicContact CZ-CG 4.06Å; T99-L576 HydrophobicContact CG2-CD1 3.9Å; V110-L576 HydrophobicContact CG2-CD2 3.9Å; P572-L576 HydrophobicContact CB-CD2 4.42Å; S573-L576 WeakPolarHBondContact O-CB 3.4Å; S573-L576 PolarHBondContact O-N 2.99Å; P574-L576 PolarHBondContact O-N 3.48Å
577	K	82.5	Confident	78.5	Confident	131 Å²	131	79 Å²	79	57%	0.57	42%	0.422	S	S	*	.			trans	-102.8	144.9	179.6	-61.6	-178.2	-177.6	178.5	0	111.6	D575	D575-K577 VanDerWaalsContact C-N 3.34Å; D575-K577 PolarHBondContact O-N 3.38Å
578	M	85.6	Confident	76.1	Confident	72 Å²	72	80.1 Å²	80.1	36%	0.355	42%	0.423	S	S	.	.			trans	-60.8	133.6	164.5	-74.6	-173	-61.7	0	0	109.3	F98 Y308 D484 A583	F98-M578 HydrophobicContact CE2-CG 4.4Å; Y308-M578 WeakPolarHBondContact OH-CA 3.31Å; D484-M578 HydrophobicContact CB-CB 4.39Å; D484-M578 HydrophobicContact CB-CG 4.12Å; D484-M578 HydrophobicContact CB-SD 3.78Å; D484-M578 VanDerWaalsContact OD2-CB 3.31Å; D484-M578 WeakPolarHBondContact OD2-CB 3.37Å; M578-A583 HydrophobicContact CB-CB 3.76Å; M578-A583 WeakPolarHBondContact O-CB 3.41Å
579	R	84.6	Confident	73.7	Confident	117 Å²	117	75.3 Å²	75.3	44%	0.442	41%	0.409	S	S	.	.			trans	-115.7	-0.9	-176.1	-64.7	-178	-72.2	-103.2	6	113.2	F98 S100 Y308 D484	F98-R579 PolarHBondContact O-NH2 3.42Å; S100-R579 PolarHBondContact OG-NH2 2.9Å; Y308-R579 HydrophobicContact CD1-CB 3.98Å; Y308-R579 HydrophobicContact CD2-CB 4.27Å; Y308-R579 VanDerWaalsContact CD2-NH2 3.28Å; Y308-R579 HydrophobicContact CE1-CB 3.82Å; Y308-R579 HydrophobicContact CE2-CB 4.05Å; Y308-R579 HydrophobicContact CE2-CG 4.44Å; Y308-R579 HydrophobicContact CG-CB 4.19Å; Y308-R579 PolarHBondContact OH-N 3.37Å; Y308-R579 VanDerWaalsContact OH-N 3.09Å; D484-R579 PolarHBondContact OD2-N 2.86Å
580	G	77.4	Confident	71.1	Confident	10 Å²	10	79.4 Å²	79.4	10%	0.103	43%	0.434	C	S	.	.	S	Bend	trans	-97.7	-155.5	-172.6	0	0	0	0	0	113.7	Y308 D484 A583 A584	Y308-G580 VanDerWaalsContact CE1-N 3.3Å; D484-G580 WeakPolarHBondContact OD1-CA 3.39Å; D484-G580 PolarHBondContact OD1-N 3.43Å; D484-G580 VanDerWaalsContact OD2-CA 3.31Å; D484-G580 WeakPolarHBondContact OD2-CA 3.41Å; D484-G580 PolarHBondContact OD2-N 3.05Å; G580-A583 PolarHBondContact O-N 2.91Å; G580-A584 PolarHBondContact O-N 3.2Å
581	K	68.4	Low	68.3	Low	160 Å²	160	81.9 Å²	81.9	70%	0.696	45%	0.446	S	S	*	.	H	α-helix	trans	-72.2	-32.4	-171.2	-67.6	-177.6	-179.5	177.5	0	113.3	D484 A584 L585	D484-K581 PolarHBondContact OD1-N 3.24Å; K581-A584 PolarHBondContact O-N 3.24Å; K581-L585 WeakPolarHBondContact O-CG 3.49Å; K581-L585 PolarHBondContact O-N 3.27Å
582	L	73.4	Confident	65.7	Low	62 Å²	62	83.3 Å²	83.3	33%	0.325	45%	0.45	S	S	.	.	H	α-helix	trans	-72.1	-35.4	178.7	-85.8	143.7	0	0	0	110.7	E483 D484 A584 L585 S586	E483-L582 HydrophobicContact CB-CD1 3.78Å; E483-L582 HydrophobicContact CG-CD1 3.53Å; D484-L582 HydrophobicContact CB-CB 4.03Å; D484-L582 HydrophobicContact CB-CD1 4.14Å; D484-L582 WeakPolarHBondContact OD1-CA 3.43Å; D484-L582 WeakPolarHBondContact OD1-CB 3.48Å; D484-L582 PolarHBondContact OD1-N 3.05Å; L582-A584 VanDerWaalsContact C-N 3.34Å; L582-L585 PolarHBondContact O-N 3.1Å; L582-S586 PolarHBondContact O-N 3.46Å
583	A	67.3	Low	63	Low	22 Å²	22	85 Å²	85	18%	0.182	47%	0.467	C	S	.	.	H	α-helix	trans	-60.3	-42.7	169.9	0	0	0	0	0	112.4	D484 M578 G580 L585 S586 A589	D484-A583 PolarHBondContact OD1-N 3.08Å; M578-A583 HydrophobicContact CB-CB 3.76Å; M578-A583 WeakPolarHBondContact O-CB 3.41Å; G580-A583 PolarHBondContact O-N 2.91Å; A583-L585 PolarHBondContact O-N 2.96Å; A583-S586 WeakPolarHBondContact O-CB 3.22Å; A583-S586 PolarHBondContact O-N 3.2Å; A583-S586 VanDerWaalsContact O-N 3.15Å; A583-A589 WeakPolarHBondContact O-CB 3.41Å
584	A	59	Low	60.3	Low	72 Å²	72	89.9 Å²	89.9	60%	0.595	49%	0.485	S	S	*	.	H	α-helix	trans	-64.7	-23.6	178.1	0	0	0	0	0	113.7	G580 K581 L582	G580-A584 PolarHBondContact O-N 3.2Å; K581-A584 PolarHBondContact O-N 3.24Å; L582-A584 VanDerWaalsContact C-N 3.34Å
585	L	56.2	Low	57.9	Low	144 Å²	144	90.9 Å²	90.9	75%	0.754	48%	0.483	S	S	*	.	H	α-helix	trans	-91.3	-8.4	177.5	-70	165.6	0	0	0	113.4	K581 L582 A583	K581-L585 WeakPolarHBondContact O-CG 3.49Å; K581-L585 PolarHBondContact O-N 3.27Å; L582-L585 PolarHBondContact O-N 3.1Å; A583-L585 PolarHBondContact O-N 2.96Å
586	S	47.6	Very low	55.6	Low	45 Å²	45	94 Å²	94	32%	0.315	49%	0.491	S	S	.	.	S	Bend	trans	-70	134.9	175.9	179.2	0	0	0	0	110.2	L582 A583 Y588 A589	L582-S586 PolarHBondContact O-N 3.46Å; A583-S586 WeakPolarHBondContact O-CB 3.22Å; A583-S586 PolarHBondContact O-N 3.2Å; A583-S586 VanDerWaalsContact O-N 3.15Å; S586-Y588 PolarHBondContact O-N 2.93Å; S586-A589 WeakPolarHBondContact O-CB 3.42Å; S586-A589 PolarHBondContact O-N 3.34Å
587	P	42.7	Very low	53.3	Low	102 Å²	102	98.2 Å²	98.2	66%	0.662	52%	0.518	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.7	-9.3	179.9	20	-29.9	0	0	0	114.4
588	Y	43.3	Very low	50.9	Low	176 Å²	176	97.8 Å²	97.8	69%	0.69	52%	0.522	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.5	-21.5	172.5	-72.1	-84.3	0	0	0	114.5	S586 V590 N591	S586-Y588 PolarHBondContact O-N 2.93Å; Y588-V590 PolarHBondContact O-N 2.95Å; Y588-N591 PolarHBondContact O-N 3.46Å
589	A	41.7	Very low	48.4	Very low	37 Å²	37	97.3 Å²	97.3	31%	0.306	54%	0.535	S	S	.	.	H	α-helix	trans	-67.2	-24.9	177.4	0	0	0	0	0	112.6	A583 S586 N591 A593	A583-A589 WeakPolarHBondContact O-CB 3.41Å; S586-A589 WeakPolarHBondContact O-CB 3.42Å; S586-A589 PolarHBondContact O-N 3.34Å; A589-N591 VanDerWaalsContact C-N 3.34Å; A589-A593 PolarHBondContact O-N 3.1Å
590	V	39.3	Very low	45.9	Very low	92 Å²	92	101.3 Å²	101.3	56%	0.558	56%	0.555	S	S	*	*	H	α-helix	trans	-72.7	-27.1	177.6	-176.6	0	0	0	0	111.8	Y588 K594	Y588-V590 PolarHBondContact O-N 2.95Å; V590-K594 PolarHBondContact O-N 3.06Å
591	N	36.3	Very low	43.7	Very low	92 Å²	92	108.3 Å²	108.3	49%	0.492	59%	0.589	S	S	.	*	H	α-helix	trans	-78.2	-35.3	-179.9	-74.7	-16.9	0	0	0	112.7	Y588 A589 K594 L595	Y588-N591 PolarHBondContact O-N 3.46Å; A589-N591 VanDerWaalsContact C-N 3.34Å; N591-K594 PolarHBondContact O-N 3.33Å; N591-L595 PolarHBondContact O-N 3.47Å
592	D	36.5	Very low	41.7	Very low	105 Å²	105	105.4 Å²	105.4	56%	0.561	59%	0.589	S	S	*	*	H	α-helix	trans	-71.7	-30.6	175.7	-83.8	-18.6	0	0	0	112.5	K596	D592-K596 PolarHBondContact O-N 3.13Å
593	A	37	Very low	39.5	Very low	62 Å²	62	109.1 Å²	109.1	51%	0.512	61%	0.614	S	S	.	*	H	α-helix	trans	-68.5	-39	172.2	0	0	0	0	0	111.9	A589 K596 T597	A589-A593 PolarHBondContact O-N 3.1Å; A593-K596 PolarHBondContact O-N 2.89Å; A593-T597 PolarHBondContact O-N 3.15Å; A593-T597 PolarHBondContact O-OG1 3.18Å; A593-T597 VanDerWaalsContact O-OG1 3.06Å
594	K	34.2	Very low	37.6	Very low	131 Å²	131	115.8 Å²	115.8	57%	0.57	65%	0.645	S	S	*	*	H	α-helix	trans	-67.8	-39.4	175	-101.1	-177.9	172.6	-177.9	0	113	V590 N591 K596 T597 D598	V590-K594 PolarHBondContact O-N 3.06Å; N591-K594 PolarHBondContact O-N 3.33Å; K594-K596 VanDerWaalsContact C-N 3.29Å; K594-K596 PolarHBondContact O-N 2.77Å; K594-T597 WeakPolarHBondContact CA-OG1 3.26Å; K594-T597 PolarHBondContact O-N 3.41Å; K594-T597 PolarHBondContact O-OG1 3.38Å; K594-D598 PolarHBondContact O-N 3.15Å
595	L	34.2	Very low	36.1	Very low	129 Å²	129	117.1 Å²	117.1	68%	0.675	65%	0.65	S	S	*	*	H	α-helix	trans	-65.3	-28.1	177.5	-106.7	134.6	0	0	0	113.5	N591	N591-L595 PolarHBondContact O-N 3.47Å
596	K	35.6	Very low	34.9	Very low	190 Å²	190	119.4 Å²	119.4	83%	0.826	66%	0.657	S	S	*	*	H	α-helix	trans	-78.6	-26.2	173.3	-80.3	-174.1	176.8	-178.8	0	114.1	D592 A593 K594	D592-K596 PolarHBondContact O-N 3.13Å; A593-K596 PolarHBondContact O-N 2.89Å; K594-K596 VanDerWaalsContact C-N 3.29Å; K594-K596 PolarHBondContact O-N 2.77Å
597	T	35.8	Very low	34	Very low	111 Å²	111	125.8 Å²	125.8	68%	0.681	68%	0.679	S	S	*	*	H	α-helix	trans	-84.9	-27.1	175.6	33.2	0	0	0	0	113.9	A593 K594	A593-T597 PolarHBondContact O-N 3.15Å; A593-T597 PolarHBondContact O-OG1 3.18Å; A593-T597 VanDerWaalsContact O-OG1 3.06Å; K594-T597 WeakPolarHBondContact CA-OG1 3.26Å; K594-T597 PolarHBondContact O-N 3.41Å; K594-T597 PolarHBondContact O-OG1 3.38Å
598	D	33.8	Very low	33.3	Very low	123 Å²	123	129.3 Å²	129.3	66%	0.658	69%	0.687	S	S	*	*	S	Bend	trans	-97.2	12.5	-175.6	-67.9	-20.5	0	0	0	113.9	K594 K600	K594-D598 PolarHBondContact O-N 3.15Å; D598-K600 PolarHBondContact O-N 3.44Å
599	G	32.8	Very low	32.6	Very low	61 Å²	61	127.9 Å²	127.9	63%	0.629	70%	0.697	S	S	*	*			trans	-72.9	42	179.7	0	0	0	0	0	116.3
600	K	30.8	Very low	32	Very low	201 Å²	201	134.5 Å²	134.5	87%	0.874	72%	0.721	S	S	*	*			trans	-99	83.6	154.9	-97.6	-175.1	177.1	179.2	0	107.7	D598 S602	D598-K600 PolarHBondContact O-N 3.44Å; K600-S602 PolarHBondContact O-N 3.41Å
601	I	31.4	Very low	31.7	Very low	158 Å²	158	143.7 Å²	143.7	81%	0.81	75%	0.754	S	S	*	*			trans	-70	112.7	170.3	-66.2	173.3	0	0	0	107.6	T603	I601-T603 PolarHBondContact O-N 3.38Å
602	S	27	Very low	31.5	Very low	99 Å²	99	146.3 Å²	146.3	69%	0.692	77%	0.767	S	S	*	*			trans	-62.9	121.7	164.6	42.2	0	0	0	0	109.4	K600 I604	K600-S602 PolarHBondContact O-N 3.41Å; S602-I604 PolarHBondContact O-N 3.12Å
603	T	26.5	Very low	31.2	Very low	140 Å²	140	148.4 Å²	148.4	86%	0.859	78%	0.778	S	S	*	*			trans	-53.7	115.6	169.7	41.1	0	0	0	0	110.8	I601	I601-T603 PolarHBondContact O-N 3.38Å
604	I	28	Very low	30.9	Very low	161 Å²	161	153.2 Å²	153.2	83%	0.826	79%	0.792	S	S	*	*			trans	-85.4	117.8	165	-66.1	173.7	0	0	0	107	S602	S602-I604 PolarHBondContact O-N 3.12Å
605	S	27.6	Very low	30.7	Very low	101 Å²	101	154.5 Å²	154.5	71%	0.706	81%	0.805	S	S	*	*			trans	-74.6	115.8	174.1	150.6	0	0	0	0	109.8	K607	S605-K607 PolarHBondContact O-N 3.43Å
606	E	30.5	Very low	30.5	Very low	192 Å²	192	156.1 Å²	156.1	90%	0.897	81%	0.814	S	S	*	*			trans	-72.1	108.8	158.7	-82.8	-178.4	150.5	0	0	109.3
607	K	29	Very low	30.1	Very low	179 Å²	179	153.9 Å²	153.9	78%	0.778	81%	0.813	S	S	*	*			trans	-154.8	131.5	154.3	-106.7	-178.3	-174.1	-175.2	0	110.1	S605	S605-K607 PolarHBondContact O-N 3.43Å
608	E	28.1	Very low	29.7	Very low	175 Å²	175	156.9 Å²	156.9	82%	0.818	82%	0.822	S	S	*	*			trans	82.3	96.5	158.8	-62.5	174.4	-177.8	0	0	118.5
609	T	28	Very low	29.4	Very low	147 Å²	147	159.5 Å²	159.5	90%	0.902	84%	0.835	S	S	*	*			trans	-118.2	102.5	143.7	38.2	0	0	0	0	109.4
610	H	29.3	Very low	29.1	Very low	175 Å²	175	167.8 Å²	167.8	81%	0.81	85%	0.852	S	S	*	*			trans	-119.2	139.9	155.6	-95.6	-69.1	0	0	0	107.5
611	F	33.1	Very low	28.9	Very low	285 Å²	285	164.7 Å²	164.7	100%	1.25	85%	0.85	S	S	*	*			trans	93.5	0	-176.8	-65.8	-78.3	0	0	0	116.8

Retrieved 611 of 611 residues in 1621.4 ms (Link to these results)

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