A0A024QYS2_HUMAN Loading...

Transmembrane 9 superfamily member

AlphaFold DB (Q9HD45), UniProt , Accession A0A024QYS2, Species HUMAN (Homo sapiens, Human), Gene n/a, Length 589 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	43.7	Very low	51.5	Low	245 Å²	245	126.2 Å²	126.2	100%	1.207	74%	0.739	S	S	*	*				0	110.8	0	-79.7	168.1	168.4	0	0	108.2
2	R	38.5	Very low	52.7	Low	244 Å²	244	120.4 Å²	120.4	92%	0.921	72%	0.717	S	S	*	*	P	Polyproline II helix	trans	-75.1	135.1	167.9	-80.9	-178.5	173.7	178.2	-2	107.9	L4	R2-L4 PolarHBondContact O-N 3.39Å
3	P	44.6	Very low	53.6	Low	122 Å²	122	115.2 Å²	115.2	79%	0.792	70%	0.695	S	S	*	*	P	Polyproline II helix	trans	-69.1	131.7	-179.5	28.4	-30.9	0	0	0	109.4
4	L	43.5	Very low	54.7	Low	153 Å²	153	110.6 Å²	110.6	80%	0.801	68%	0.676	S	S	*	*	P	Polyproline II helix	trans	-62.1	130.1	175.3	-87.8	144.7	0	0	0	109.8	R2 G6	R2-L4 PolarHBondContact O-N 3.39Å; L4-G6 PolarHBondContact O-N 2.92Å
5	P	48.2	Very low	55.6	Low	133 Å²	133	106.7 Å²	106.7	86%	0.864	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.2	12.7	-174.1	28.2	-32.6	0	0	0	114.9
6	G	51.1	Low	56.1	Low	45 Å²	45	106.6 Å²	106.6	46%	0.464	65%	0.652	S	S	.	*	T	Hydrogen-bonded Turn	trans	-97.4	-20	-179	0	0	0	0	0	115.8	L4 L8 G9 V10	L4-G6 PolarHBondContact O-N 2.92Å; G6-L8 PolarHBondContact O-N 2.71Å; G6-G9 PolarHBondContact O-N 2.76Å; G6-V10 PolarHBondContact O-N 2.99Å
7	A	52.5	Low	56.4	Low	75 Å²	75	111.1 Å²	111.1	62%	0.62	66%	0.655	S	S	*	*	H	α-helix	trans	-70.6	-33.1	-170	0	0	0	0	0	113.8	A11	A7-A11 PolarHBondContact O-N 2.78Å
8	L	52.7	Low	56.7	Low	155 Å²	155	111.2 Å²	111.2	81%	0.812	65%	0.651	S	S	*	*	H	α-helix	trans	-70.1	-35	179	-86.5	152.6	0	0	0	112.6	G6 A12	G6-L8 PolarHBondContact O-N 2.71Å; L8-A12 WeakPolarHBondContact O-CB 3.43Å; L8-A12 PolarHBondContact O-N 3.22Å; L8-A12 VanDerWaalsContact O-N 3.11Å
9	G	58.8	Low	56.8	Low	48 Å²	48	111.8 Å²	111.8	50%	0.495	65%	0.651	S	S	.	*	H	α-helix	trans	-69.3	-39.1	178.8	0	0	0	0	0	112.9	G6 A13	G6-G9 PolarHBondContact O-N 2.76Å; G9-A13 WeakPolarHBondContact O-CB 3.3Å; G9-A13 PolarHBondContact O-N 3.32Å
10	V	68.1	Low	56.6	Low	106 Å²	106	111.1 Å²	111.1	64%	0.642	64%	0.644	S	S	*	*	H	α-helix	trans	-69.8	-39.4	178.5	-178.5	0	0	0	0	111.2	G6 A13 A14	G6-V10 PolarHBondContact O-N 2.99Å; V10-A13 PolarHBondContact O-N 3.37Å; V10-A14 VanDerWaalsContact O-CB 3.3Å; V10-A14 WeakPolarHBondContact O-CB 3.31Å; V10-A14 PolarHBondContact O-N 3.22Å
11	A	64.7	Low	56.4	Low	62 Å²	62	112.2 Å²	112.2	51%	0.512	65%	0.647	S	S	.	*	H	α-helix	trans	-65.9	-41.3	176.2	0	0	0	0	0	112.4	A7 A14 A15	A7-A11 PolarHBondContact O-N 2.78Å; A11-A14 PolarHBondContact O-N 2.93Å; A11-A15 WeakPolarHBondContact O-CB 3.46Å; A11-A15 PolarHBondContact O-N 2.67Å
12	A	65.9	Low	56.6	Low	57 Å²	57	106.3 Å²	106.3	47%	0.471	62%	0.619	S	S	.	*	H	α-helix	trans	-66.2	-42.2	176.5	0	0	0	0	0	112.1	L8 A15 L16	L8-A12 WeakPolarHBondContact O-CB 3.43Å; L8-A12 PolarHBondContact O-N 3.22Å; L8-A12 VanDerWaalsContact O-N 3.11Å; A12-A15 PolarHBondContact O-N 3.38Å; A12-L16 WeakPolarHBondContact O-CB 3.06Å; A12-L16 PolarHBondContact O-N 2.93Å
13	A	65	Low	56.7	Low	53 Å²	53	100.3 Å²	100.3	44%	0.438	61%	0.605	S	S	.	*	H	α-helix	trans	-66	-39	176.5	0	0	0	0	0	112.3	G9 V10 L16 W17	G9-A13 WeakPolarHBondContact O-CB 3.3Å; G9-A13 PolarHBondContact O-N 3.32Å; V10-A13 PolarHBondContact O-N 3.37Å; A13-L16 PolarHBondContact O-N 2.92Å; A13-W17 WeakPolarHBondContact O-CB 3.3Å; A13-W17 PolarHBondContact O-N 2.91Å
14	A	68.9	Low	56.8	Low	51 Å²	51	99.1 Å²	99.1	42%	0.421	60%	0.597	S	S	.	*	H	α-helix	trans	-66	-39.9	175.1	0	0	0	0	0	112.1	V10 A11 W17 L18	V10-A14 VanDerWaalsContact O-CB 3.3Å; V10-A14 WeakPolarHBondContact O-CB 3.31Å; V10-A14 PolarHBondContact O-N 3.22Å; A11-A14 PolarHBondContact O-N 2.93Å; A14-W17 PolarHBondContact O-N 2.83Å; A14-L18 WeakPolarHBondContact O-CB 3.5Å; A14-L18 PolarHBondContact O-N 1.99Å
15	A	67.2	Low	56.8	Low	52 Å²	52	103.6 Å²	103.6	43%	0.43	60%	0.603	S	S	.	*	H	α-helix	trans	-64.8	-40.6	174.9	0	0	0	0	0	112	A11 A12 L18 L19	A11-A15 WeakPolarHBondContact O-CB 3.46Å; A11-A15 PolarHBondContact O-N 2.67Å; A12-A15 PolarHBondContact O-N 3.38Å; A15-L18 PolarHBondContact O-N 2.83Å; A15-L19 WeakPolarHBondContact O-CB 3.44Å; A15-L19 PolarHBondContact O-N 3.42Å
16	L	64.1	Low	56.6	Low	105 Å²	105	101.5 Å²	101.5	55%	0.55	59%	0.588	S	S	.	*	H	α-helix	trans	-67.7	-38.4	176.3	-122.2	143.5	0	0	0	112	A12 A13 L19 L20	A12-L16 WeakPolarHBondContact O-CB 3.06Å; A12-L16 PolarHBondContact O-N 2.93Å; A13-L16 PolarHBondContact O-N 2.92Å; L16-L19 PolarHBondContact O-N 3.04Å; L16-L20 HydrophobicContact CD2-CD1 3.91Å; L16-L20 WeakPolarHBondContact O-CB 3.41Å; L16-L20 WeakPolarHBondContact O-CD1 3.18Å; L16-L20 PolarHBondContact O-N 3.29Å
17	W	61.1	Low	56.4	Low	182 Å²	182	109.7 Å²	109.7	69%	0.689	61%	0.605	S	S	*	*	H	α-helix	trans	-67.2	-37.1	173	-95.2	62.8	0	0	0	112.7	A13 A14 L20 L21	A13-W17 WeakPolarHBondContact O-CB 3.3Å; A13-W17 PolarHBondContact O-N 2.91Å; A14-W17 PolarHBondContact O-N 2.83Å; W17-L20 PolarHBondContact O-N 3.31Å; W17-L21 HydrophobicContact CE3-CD1 4.44Å; W17-L21 VanDerWaalsContact O-CB 3.29Å; W17-L21 WeakPolarHBondContact O-CB 3.2Å; W17-L21 WeakPolarHBondContact O-CD1 3.44Å; W17-L21 VanDerWaalsContact O-CG 3.29Å; W17-L21 WeakPolarHBondContact O-CG 3.46Å; W17-L21 PolarHBondContact O-N 2.65Å
18	L	62.2	Low	56	Low	113 Å²	113	107.1 Å²	107.1	59%	0.592	58%	0.584	S	S	*	*	H	α-helix	trans	-64.9	-40.6	171.3	-107.9	127.5	0	0	0	111.6	A14 A15 L21 L22	A14-L18 WeakPolarHBondContact O-CB 3.5Å; A14-L18 PolarHBondContact O-N 1.99Å; A15-L18 PolarHBondContact O-N 2.83Å; L18-L21 PolarHBondContact O-N 3.37Å; L18-L22 WeakPolarHBondContact O-CB 2.78Å; L18-L22 WeakPolarHBondContact O-CD1 3.41Å; L18-L22 WeakPolarHBondContact O-CG 3.46Å; L18-L22 PolarHBondContact O-N 2.74Å
19	L	58.6	Low	56.3	Low	123 Å²	123	101.2 Å²	101.2	64%	0.644	55%	0.553	S	S	*	*	H	α-helix	trans	-65.1	-37.8	174.2	-97.1	143	0	0	0	112.9	A15 L16 L22	A15-L19 WeakPolarHBondContact O-CB 3.44Å; A15-L19 PolarHBondContact O-N 3.42Å; L16-L19 PolarHBondContact O-N 3.04Å; L19-L22 PolarHBondContact O-N 3.27Å
20	L	53.5	Low	56.6	Low	98 Å²	98	99.9 Å²	99.9	51%	0.513	53%	0.534	S	S	.	.	H	α-helix	trans	-75.1	-33.1	176	-84.1	151.2	0	0	0	112.7	L16 W17 L22 L23	L16-L20 HydrophobicContact CD2-CD1 3.91Å; L16-L20 WeakPolarHBondContact O-CB 3.41Å; L16-L20 WeakPolarHBondContact O-CD1 3.18Å; L16-L20 PolarHBondContact O-N 3.29Å; W17-L20 PolarHBondContact O-N 3.31Å; L20-L22 VanDerWaalsContact C-N 3.25Å; L20-L23 HydrophobicContact CD2-CD1 3.86Å; L20-L23 WeakPolarHBondContact O-CB 3.39Å; L20-L23 PolarHBondContact O-N 2.89Å
21	L	51.2	Low	56.7	Low	134 Å²	134	100.3 Å²	100.3	70%	0.702	53%	0.529	S	S	*	.	H	α-helix	trans	-73.4	-19.4	171.6	-76.7	162.8	0	0	0	112.5	W17 L18 L23	W17-L21 HydrophobicContact CE3-CD1 4.44Å; W17-L21 VanDerWaalsContact O-CB 3.29Å; W17-L21 WeakPolarHBondContact O-CB 3.2Å; W17-L21 WeakPolarHBondContact O-CD1 3.44Å; W17-L21 VanDerWaalsContact O-CG 3.29Å; W17-L21 WeakPolarHBondContact O-CG 3.46Å; W17-L21 PolarHBondContact O-N 2.65Å; L18-L21 PolarHBondContact O-N 3.37Å; L21-L23 VanDerWaalsContact C-N 3.33Å
22	L	47.7	Very low	57.2	Low	121 Å²	121	101.3 Å²	101.3	63%	0.634	52%	0.523	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.9	-0.5	171.4	-78.3	164.3	0	0	0	113.5	L18 L19 L20 P24	L18-L22 WeakPolarHBondContact O-CB 2.78Å; L18-L22 WeakPolarHBondContact O-CD1 3.41Å; L18-L22 WeakPolarHBondContact O-CG 3.46Å; L18-L22 PolarHBondContact O-N 2.74Å; L19-L22 PolarHBondContact O-N 3.27Å; L20-L22 VanDerWaalsContact C-N 3.25Å; L22-P24 WeakPolarHBondContact O-CD 2.89Å; L22-P24 VanDerWaalsContact O-N 3.14Å
23	L	41	Very low	58.1	Low	119 Å²	119	99.7 Å²	99.7	62%	0.623	51%	0.506	S	S	*	.	S	Bend	trans	-68.8	104.9	163	-74.8	161.9	0	0	0	106.8	L20 L21 R25	L20-L23 HydrophobicContact CD2-CD1 3.86Å; L20-L23 WeakPolarHBondContact O-CB 3.39Å; L20-L23 PolarHBondContact O-N 2.89Å; L21-L23 VanDerWaalsContact C-N 3.33Å; L23-R25 PolarHBondContact O-N 2.88Å
24	P	45.9	Very low	59.2	Low	96 Å²	96	98.6 Å²	98.6	62%	0.623	49%	0.493	S	S	*	.			trans	-60.1	135.9	174.7	-8.9	26.4	0	0	0	106.1	L22 T26	L22-P24 WeakPolarHBondContact O-CD 2.89Å; L22-P24 VanDerWaalsContact O-N 3.14Å; P24-T26 HydrophobicContact CB-CG2 3.95Å; P24-T26 HydrophobicContact CG-CG2 4.27Å; P24-T26 PolarHBondContact O-N 3.17Å
25	R	43.5	Very low	60.1	Low	247 Å²	247	96.3 Å²	96.3	93%	0.932	47%	0.474	S	S	*	.			trans	-64.4	88.6	156.9	-76.9	-174.8	174	159.5	-1.1	105.3	L23 R27	L23-R25 PolarHBondContact O-N 2.88Å; R25-R27 PolarHBondContact O-N 3.36Å
26	T	45.9	Very low	61.1	Low	89 Å²	89	99.9 Å²	99.9	55%	0.546	48%	0.482	S	S	.	.	P	Polyproline II helix	trans	-67.8	123.4	-171.6	53.4	0	0	0	0	108.6	P24 E32	P24-T26 HydrophobicContact CB-CG2 3.95Å; P24-T26 HydrophobicContact CG-CG2 4.27Å; P24-T26 PolarHBondContact O-N 3.17Å; T26-E32 WeakPolarHBondContact CB-OE1 3Å; T26-E32 VanDerWaalsContact CG2-OE1 3.26Å; T26-E32 WeakPolarHBondContact CG2-OE1 3.32Å; T26-E32 PolarHBondContact OG1-OE1 3.01Å
27	R	46.4	Very low	62.3	Low	217 Å²	217	99.9 Å²	99.9	82%	0.819	48%	0.482	S	S	*	.	P	Polyproline II helix	trans	-87.3	136.1	163.7	-71.5	-176.5	174.4	176.3	-2	105.6	R25 D29	R25-R27 PolarHBondContact O-N 3.36Å; R27-D29 PolarHBondContact O-N 2.99Å
28	A	44.4	Very low	63.6	Low	21 Å²	21	98.2 Å²	98.2	17%	0.174	48%	0.48	C	S	.	.	P	Polyproline II helix	trans	-52.4	123.9	160.8	0	0	0	0	0	106.6	T34	A28-T34 CarbonylContact C-O 3.46Å; A28-T34 WeakPolarHBondContact CB-O 3.5Å
29	D	58.9	Low	64.8	Low	32 Å²	32	95.3 Å²	95.3	17%	0.171	46%	0.463	C	S	.	.			trans	-155.8	173.5	-174	-160.5	3.8	0	0	0	108.7	R27 H31 E32 H33 T34 H75	R27-D29 PolarHBondContact O-N 2.99Å; D29-H31 PolarHBondContact O-N 2.9Å; D29-H31 IonicContact OD2-CD2 2.72Å; D29-H31 PolarHBondContact OD2-CD2 2.72Å; D29-E32 PolarHBondContact O-N 3Å; D29-H33 PolarHBondContact O-N 2.99Å; D29-T34 PolarHBondContact N-O 3.01Å; D29-H75 IonicContact OD1-CE1 2.95Å; D29-H75 PolarHBondContact OD1-CE1 2.87Å; D29-H75 IonicContact OD1-CG 2.98Å; D29-H75 IonicContact OD1-ND1 3.23Å; D29-H75 PolarHBondContact OD1-ND1 3Å; D29-H75 IonicContact OD1-NE2 3.07Å; D29-H75 IonicContact OD2-CG 2.85Å; D29-H75 IonicContact OD2-ND1 3.57Å
30	E	64.8	Low	66.2	Low	20 Å²	20	91.6 Å²	91.6	9%	0.093	44%	0.443	C	S	.	.	G	3₁₀ helix	trans	-52.9	-29.5	173.5	-57.9	-162.7	155.4	0	0	111.4	E32 H33 Y35 V42 W44 H75	E30-E32 PolarHBondContact O-N 3.45Å; E30-H33 PolarHBondContact O-CE1 3.48Å; E30-H33 PolarHBondContact O-N 2.96Å; E30-H33 PolarHBondContact O-ND1 3.49Å; E30-Y35 HydrophobicContact CG-CE1 4.09Å; E30-Y35 WeakPolarHBondContact CG-OH 3.5Å; E30-V42 WeakPolarHBondContact OE1-CA 3.49Å; E30-V42 WeakPolarHBondContact OE1-CB 3.29Å; E30-V42 PolarHBondContact OE1-N 2.95Å; E30-W44 PolarHBondContact OE2-NE1 3.26Å; E30-H75 WeakPolarHBondContact CG-NE2 3.38Å; E30-H75 IonicContact OE1-NE2 3.54Å; E30-H75 IonicContact OE2-NE2 2.88Å; E30-H75 PolarHBondContact OE2-NE2 3.12Å
31	H	70.1	Confident	67.9	Low	115 Å²	115	87 Å²	87	53%	0.532	42%	0.418	S	S	.	.	G	3₁₀ helix	trans	-63.8	-32.5	175.9	-66.1	-66.6	0	0	0	115.1	D29 H77	D29-H31 PolarHBondContact O-N 2.9Å; D29-H31 IonicContact OD2-CD2 2.72Å; D29-H31 PolarHBondContact OD2-CD2 2.72Å; H31-H77 AromaticContact CE1-CD2 3.4Å; H31-H77 PolarHBondContact CE1-CD2 2.91Å; H31-H77 AromaticContact ND1-CD2 3.69Å
32	E	76	Confident	69.7	Low	82 Å²	82	80.6 Å²	80.6	38%	0.383	39%	0.385	S	S	.	.	G	3₁₀ helix	trans	-98.4	-1.2	176.6	-67.7	-168.9	163.6	0	0	111.8	T26 D29 E30 T34	T26-E32 WeakPolarHBondContact CB-OE1 3Å; T26-E32 VanDerWaalsContact CG2-OE1 3.26Å; T26-E32 WeakPolarHBondContact CG2-OE1 3.32Å; T26-E32 PolarHBondContact OG1-OE1 3.01Å; D29-E32 PolarHBondContact O-N 3Å; E30-E32 PolarHBondContact O-N 3.45Å; E32-T34 PolarHBondContact O-N 3Å; E32-T34 VanDerWaalsContact O-N 3.15Å
33	H	83.8	Confident	71.8	Confident	23 Å²	23	74.9 Å²	74.9	11%	0.106	36%	0.355	C	S	.	.	T	Hydrogen-bonded Turn	trans	50.3	32.7	-171.4	-56.2	-63.5	0	0	0	113.2	D29 E30 D135 D136 R169 F204 R207	D29-H33 PolarHBondContact O-N 2.99Å; E30-H33 PolarHBondContact O-CE1 3.48Å; E30-H33 PolarHBondContact O-N 2.96Å; E30-H33 PolarHBondContact O-ND1 3.49Å; H33-D135 IonicContact CE1-OD1 3.74Å; H33-D135 IonicContact CG-OD1 2.92Å; H33-D135 IonicContact ND1-OD1 3.61Å; H33-D135 PolarHBondContact ND1-OD1 2.73Å; H33-D135 IonicContact ND1-OD2 2.87Å; H33-D136 IonicContact CE1-OD2 3.75Å; H33-D136 PolarHBondContact CE1-OD2 3.28Å; H33-D136 VanDerWaalsContact CE1-OD2 3.25Å; H33-D136 IonicContact NE2-OD2 3.97Å; H33-R169 WeakPolarHBondContact O-CD 3.35Å; H33-R169 WeakPolarHBondContact O-CG 3.48Å; H33-F204 HydrophobicContact CB-CE2 3.56Å; H33-F204 HydrophobicContact CB-CZ 3.41Å; H33-F204 VanDerWaalsContact CB-CZ 3.41Å; H33-F204 AromaticContact CD2-CZ 3.64Å; H33-F204 AromaticContact CG-CZ 3.63Å; H33-R207 PolarHBondContact CE1-NH2 3.12Å; H33-R207 PolarHBondContact NE2-NH2 3.48Å
34	T	87.6	Confident	74.1	Confident	30 Å²	30	69.3 Å²	69.3	18%	0.184	33%	0.326	C	S	.	.			trans	-125.1	133.2	178.1	55	0	0	0	0	109.9	A28 D29 E32 N168 R169	A28-T34 CarbonylContact C-O 3.46Å; A28-T34 WeakPolarHBondContact CB-O 3.5Å; D29-T34 PolarHBondContact N-O 3.01Å; E32-T34 PolarHBondContact O-N 3Å; E32-T34 VanDerWaalsContact O-N 3.15Å; T34-N168 WeakPolarHBondContact CA-O 3.04Å; T34-R169 HydrophobicContact CG2-CG 4.13Å
35	Y	89	Confident	76.3	Confident	3 Å²	3	65.1 Å²	65.1	1%	0.012	30%	0.298	C	S	.	.			trans	-126.5	138.3	-173.7	-60.2	-91.2	0	0	0	110.2	E30 E39 V41 F98 D135 N168 I170	E30-Y35 HydrophobicContact CG-CE1 4.09Å; E30-Y35 WeakPolarHBondContact CG-OH 3.5Å; Y35-E39 WeakPolarHBondContact CA-OE2 3.45Å; Y35-V41 HydrophobicContact CD1-CG2 3.96Å; Y35-V41 HydrophobicContact CE1-CG2 4.02Å; Y35-F98 HydrophobicContact CD2-CD2 4.44Å; Y35-F98 HydrophobicContact CD2-CE2 4.49Å; Y35-F98 HydrophobicContact CG-CD2 4.13Å; Y35-F98 HydrophobicContact CG-CG 4.33Å; Y35-D135 HydrophobicContact CE2-CB 4.48Å; Y35-D135 WeakPolarHBondContact OH-CB 3.4Å; Y35-D135 PolarHBondContact OH-OD1 3.28Å; Y35-N168 PolarHBondContact N-O 2.98Å; Y35-N168 WeakPolarHBondContact O-CB 3.45Å; Y35-I170 HydrophobicContact CD2-CD1 4.23Å; Y35-I170 HydrophobicContact CD2-CG1 4.11Å; Y35-I170 HydrophobicContact CE2-CD1 3.78Å; Y35-I170 HydrophobicContact CE2-CG1 3.92Å
36	Q	88.5	Confident	78.5	Confident	128 Å²	128	53.5 Å²	53.5	60%	0.598	26%	0.255	S	S	*	.			trans	-81	156.3	166.6	-59.7	-174	11.9	0	0	110.4	K38 E39 F98	Q36-K38 PolarHBondContact O-N 3.43Å; Q36-E39 HydrophobicContact CB-CB 4.27Å; Q36-E39 PolarHBondContact N-OE2 2.98Å; Q36-E39 WeakPolarHBondContact O-CB 3.15Å; Q36-E39 PolarHBondContact O-N 3.21Å; Q36-F98 WeakPolarHBondContact O-CD1 3.22Å
37	D	88.1	Confident	80.7	Confident	105 Å²	105	49.6 Å²	49.6	56%	0.561	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.8	130	177.5	-68.7	-8	0	0	0	110.3	E39 K99	D37-E39 PolarHBondContact O-N 2.7Å; D37-K99 WeakPolarHBondContact OD1-CD 3.12Å; D37-K99 IonicContact OD1-NZ 3.95Å; D37-K99 PolarHBondContact OD1-NZ 3.38Å
38	K	87.7	Confident	82.9	Confident	147 Å²	147	39.3 Å²	39.3	64%	0.639	19%	0.192	S	C	*	.	T	Hydrogen-bonded Turn	trans	64.6	15.1	-174.7	-53.6	-179.5	176.3	-177.7	0	115.7	Q36 F98	Q36-K38 PolarHBondContact O-N 3.43Å; K38-F98 WeakPolarHBondContact CA-O 3.46Å; K38-F98 PolarHBondContact N-O 3.34Å
39	E	88	Confident	85.1	Confident	52 Å²	52	38.4 Å²	38.4	24%	0.243	18%	0.184	C	C	.	.			trans	-65.5	150	168.1	-174.2	155.3	-146.3	0	0	110.9	Y35 Q36 D37 K97 F98	Y35-E39 WeakPolarHBondContact CA-OE2 3.45Å; Q36-E39 HydrophobicContact CB-CB 4.27Å; Q36-E39 PolarHBondContact N-OE2 2.98Å; Q36-E39 WeakPolarHBondContact O-CB 3.15Å; Q36-E39 PolarHBondContact O-N 3.21Å; D37-E39 PolarHBondContact O-N 2.7Å; E39-K97 CarbonylContact O-C 3.4Å; E39-K97 VanDerWaalsContact O-CA 3.22Å; E39-K97 WeakPolarHBondContact O-CA 3.2Å; E39-F98 PolarHBondContact O-N 3.4Å
40	E	88.8	Confident	86.6	Confident	44 Å²	44	37 Å²	37	21%	0.206	18%	0.177	C	C	.	.	B	Isolated β-bridge	trans	-66.1	132.3	177.1	173.7	167.2	-169.6	0	0	110.7	V42 K70	E40-V42 HydrophobicContact CG-CG2 4.2Å; E40-K70 WeakPolarHBondContact OE1-CE 3.41Å; E40-K70 IonicContact OE1-NZ 3.75Å; E40-K70 PolarHBondContact OE1-NZ 2.85Å; E40-K70 IonicContact OE2-NZ 2.74Å; E40-K70 PolarHBondContact OE2-NZ 3.23Å
41	V	89.1	Confident	87.6	Confident	1 Å²	1	41.8 Å²	41.8	1%	0.006	20%	0.195	C	C	.	.			trans	-115.4	123	172.4	177.3	0	0	0	0	107.5	Y35 I96 F98 I134 I170 W197	Y35-V41 HydrophobicContact CD1-CG2 3.96Å; Y35-V41 HydrophobicContact CE1-CG2 4.02Å; V41-I96 HydrophobicContact CB-CG2 4.18Å; V41-I96 PolarHBondContact N-O 2.87Å; V41-F98 HydrophobicContact CG2-CB 3.93Å; V41-F98 HydrophobicContact CG2-CD2 4.46Å; V41-I134 HydrophobicContact CG1-CG2 3.67Å; V41-I170 HydrophobicContact CG1-CD1 3.79Å; V41-I170 HydrophobicContact CG2-CD1 4.24Å; V41-W197 HydrophobicContact CG2-CH2 4.11Å; V41-W197 HydrophobicContact CG2-CZ2 4.31Å
42	V	89	Confident	88.2	Confident	0 Å²	0	39.6 Å²	39.6	0%	0	19%	0.185	C	C	.	.			trans	-91.8	121.4	-173.7	-172.7	0	0	0	0	109.7	E30 E40 W44 I73 H75 F91	E30-V42 WeakPolarHBondContact OE1-CA 3.49Å; E30-V42 WeakPolarHBondContact OE1-CB 3.29Å; E30-V42 PolarHBondContact OE1-N 2.95Å; E40-V42 HydrophobicContact CG-CG2 4.2Å; V42-W44 HydrophobicContact CB-CZ2 4.25Å; V42-W44 HydrophobicContact CG1-CD2 3.78Å; V42-W44 HydrophobicContact CG1-CE3 4.31Å; V42-W44 HydrophobicContact CG1-CG 4.22Å; V42-W44 HydrophobicContact CG1-CH2 4.19Å; V42-W44 HydrophobicContact CG1-CZ2 3.62Å; V42-I73 HydrophobicContact CG1-CG2 4.1Å; V42-I73 HydrophobicContact CG2-CG2 3.61Å; V42-H75 WeakPolarHBondContact CG2-NE2 3.46Å; V42-F91 HydrophobicContact CG1-CD2 3.66Å; V42-F91 HydrophobicContact CG1-CE2 3.81Å
43	L	91	Very high	88.6	Confident	2 Å²	2	35.7 Å²	35.7	1%	0.01	17%	0.167	C	C	.	.			trans	-88.5	112	166.2	173.9	71	0	0	0	108.8	M45 S92 L94 I96 M132 I134 I139 L161	L43-M45 HydrophobicContact CD2-CE 3.73Å; L43-M45 HydrophobicContact CG-CE 4.27Å; L43-S92 WeakPolarHBondContact CB-OG 3.19Å; L43-S92 WeakPolarHBondContact O-CB 3.48Å; L43-S92 PolarHBondContact O-N 2.88Å; L43-S92 PolarHBondContact O-OG 3.48Å; L43-L94 HydrophobicContact CD2-CD1 3.75Å; L43-I96 HydrophobicContact CB-CD1 3.92Å; L43-I96 HydrophobicContact CD2-CD1 4.45Å; L43-M132 HydrophobicContact CD1-CB 3.87Å; L43-M132 HydrophobicContact CD1-CE 4.44Å; L43-M132 HydrophobicContact CD1-SD 4.28Å; L43-M132 HydrophobicContact CD2-SD 4.27Å; L43-I134 HydrophobicContact CB-CG1 4.27Å; L43-I134 HydrophobicContact CD1-CD1 3.8Å; L43-I134 HydrophobicContact CD1-CG1 3.41Å; L43-I134 VanDerWaalsContact CD1-CG1 3.41Å; L43-I134 HydrophobicContact CG-CG1 4.44Å; L43-I139 HydrophobicContact CD1-CD1 4.22Å; L43-L161 HydrophobicContact CD2-CD1 4.06Å
44	W	90.6	Very high	88.5	Confident	2 Å²	2	37.4 Å²	37.4	1%	0.008	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	125.9	177.5	-63.3	101.6	0	0	0	110.8	E30 V42 I73 Y76 L89 M132 Y133	E30-W44 PolarHBondContact OE2-NE1 3.26Å; V42-W44 HydrophobicContact CB-CZ2 4.25Å; V42-W44 HydrophobicContact CG1-CD2 3.78Å; V42-W44 HydrophobicContact CG1-CE3 4.31Å; V42-W44 HydrophobicContact CG1-CG 4.22Å; V42-W44 HydrophobicContact CG1-CH2 4.19Å; V42-W44 HydrophobicContact CG1-CZ2 3.62Å; W44-I73 HydrophobicContact CH2-CD1 3.59Å; W44-I73 HydrophobicContact CH2-CG2 4.4Å; W44-I73 HydrophobicContact CZ2-CG2 4.49Å; W44-I73 HydrophobicContact CZ3-CD1 3.8Å; W44-Y76 HydrophobicContact CH2-CD2 4.05Å; W44-Y76 HydrophobicContact CH2-CE2 4.49Å; W44-Y76 HydrophobicContact CZ3-CD2 4.32Å; W44-Y76 HydrophobicContact CZ3-CE2 4.33Å; W44-L89 HydrophobicContact CB-CB 4.37Å; W44-L89 HydrophobicContact CB-CD2 4.06Å; W44-L89 HydrophobicContact CD2-CB 4.15Å; W44-L89 HydrophobicContact CD2-CD1 4.44Å; W44-L89 HydrophobicContact CE3-CB 3.68Å; W44-L89 HydrophobicContact CG-CB 4.48Å; W44-L89 HydrophobicContact CG-CD1 4.45Å; W44-L89 HydrophobicContact CZ3-CB 4.31Å; W44-M132 CarbonylContact O-C 3.58Å; W44-M132 WeakPolarHBondContact O-CA 3.48Å; W44-M132 WeakPolarHBondContact O-CB 3.29Å; W44-Y133 PolarHBondContact N-O 2.72Å; W44-Y133 PolarHBondContact O-N 2.88Å
45	M	90.9	Very high	88.2	Confident	7 Å²	7	36.5 Å²	36.5	3%	0.034	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	122.6	169.7	-61.9	-68	172	0	0	107.9	L43 Y60 F61 E90 S92 M132	L43-M45 HydrophobicContact CD2-CE 3.73Å; L43-M45 HydrophobicContact CG-CE 4.27Å; M45-Y60 HydrophobicContact CB-CD1 3.74Å; M45-Y60 HydrophobicContact CB-CD2 4.27Å; M45-Y60 HydrophobicContact CB-CE1 4.42Å; M45-Y60 HydrophobicContact CB-CG 3.66Å; M45-Y60 HydrophobicContact CE-CE1 4.46Å; M45-Y60 HydrophobicContact CG-CD1 3.82Å; M45-Y60 HydrophobicContact CG-CE1 4.04Å; M45-Y60 HydrophobicContact CG-CG 4.17Å; M45-Y60 HydrophobicContact SD-CD1 3.93Å; M45-Y60 HydrophobicContact SD-CD2 4.15Å; M45-Y60 HydrophobicContact SD-CE1 3.64Å; M45-Y60 HydrophobicContact SD-CE2 3.89Å; M45-Y60 HydrophobicContact SD-CG 4.18Å; M45-F61 HydrophobicContact CB-CE2 4.27Å; M45-F61 HydrophobicContact CG-CE2 4.4Å; M45-F61 HydrophobicContact CG-CZ 4.34Å; M45-E90 WeakPolarHBondContact CB-O 3.26Å; M45-E90 PolarHBondContact N-O 2.9Å; M45-E90 PolarHBondContact O-N 3.45Å; M45-S92 VanDerWaalsContact CE-CB 3.4Å; M45-M132 HydrophobicContact CE-CG 4.48Å; M45-M132 HydrophobicContact CE-SD 3.61Å; M45-M132 HydrophobicContact SD-CG 3.57Å; M45-M132 VanDerWaalsContact SD-CG 3.57Å; M45-M132 HydrophobicContact SD-SD 3.43Å
46	N	90.3	Very high	88.1	Confident	4 Å²	4	37.4 Å²	37.4	2%	0.021	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	-87.4	-177.8	-178.3	31.9	0	0	0	110.7	Y60 V87 E88 L89 Q131 Y133	N46-Y60 PolarHBondContact O-N 2.6Å; N46-V87 WeakPolarHBondContact OD1-CA 2.99Å; N46-E88 WeakPolarHBondContact CA-O 3.31Å; N46-E88 PolarHBondContact OD1-N 3.34Å; N46-E88 VanDerWaalsContact OD1-N 3.1Å; N46-L89 HydrophobicContact CB-CD2 4.13Å; N46-Q131 HydrophobicContact CB-CB 4.41Å; N46-Q131 WeakPolarHBondContact CB-O 3Å; N46-Q131 PolarHBondContact N-O 3.39Å; N46-Q131 PolarHBondContact ND2-OE1 3.45Å; N46-Y133 HydrophobicContact CB-CD2 4.02Å; N46-Y133 HydrophobicContact CB-CE2 4.02Å
47	T	91.8	Very high	88.1	Confident	7 Å²	7	31.6 Å²	31.6	4%	0.043	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	158.2	-169.8	50.4	0	0	0	0	112.3	Y58 Y130 Q131 S387	T47-Y58 CarbonylContact C-O 3.6Å; T47-Y58 WeakPolarHBondContact CA-O 3.43Å; T47-Y58 WeakPolarHBondContact CB-O 3.35Å; T47-Y130 CarbonylContact O-C 3.49Å; T47-Y130 VanDerWaalsContact O-CA 3.28Å; T47-Y130 WeakPolarHBondContact O-CA 3.13Å; T47-Q131 PolarHBondContact O-N 3.42Å; T47-S387 VanDerWaalsContact CG2-OG 3.29Å; T47-S387 WeakPolarHBondContact CG2-OG 3.37Å
48	V	92.4	Very high	88.2	Confident	1 Å²	1	28.3 Å²	28.3	1%	0.006	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	146	168.8	-64.4	0	0	0	0	109.1	T57 Y58 K59 Y60 L63 W129	V48-T57 CarbonylContact O-C 3.54Å; V48-T57 WeakPolarHBondContact O-CA 3.34Å; V48-Y58 PolarHBondContact N-O 2.91Å; V48-Y58 PolarHBondContact O-N 3.29Å; V48-K59 WeakPolarHBondContact CG2-O 3.49Å; V48-Y60 HydrophobicContact CG1-CD2 3.65Å; V48-Y60 HydrophobicContact CG1-CE2 4.11Å; V48-Y60 HydrophobicContact CG1-CG 4.34Å; V48-L63 HydrophobicContact CB-CD1 4.2Å; V48-L63 HydrophobicContact CG1-CD1 4.12Å; V48-L63 HydrophobicContact CG2-CD1 4.16Å; V48-L63 HydrophobicContact CG2-CG 4.22Å; V48-W129 CarbonylContact C-O 3.57Å; V48-W129 WeakPolarHBondContact CA-O 3.49Å
49	G	90.9	Very high	88.3	Confident	1 Å²	1	25.6 Å²	25.6	1%	0.01	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-171.2	169.5	176.8	0	0	0	0	0	113.7	E56 Y128 W129	G49-E56 WeakPolarHBondContact CA-O 3.15Å; G49-Y128 VanDerWaalsContact O-CA 3.28Å; G49-Y128 WeakPolarHBondContact O-CA 3.34Å; G49-W129 PolarHBondContact N-O 2.92Å; G49-W129 PolarHBondContact O-N 2.98Å; G49-W129 PolarHBondContact O-NE1 3.04Å
50	P	89.7	Confident	88.4	Confident	4 Å²	4	23.3 Å²	23.3	3%	0.026	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	141	178.7	-6.9	21.4	0	0	0	110.8	H52 N53 E56 Y128 W129	P50-H52 VanDerWaalsContact C-N 3.28Å; P50-H52 PolarHBondContact O-N 3.49Å; P50-N53 HydrophobicContact CB-CB 4.17Å; P50-N53 HydrophobicContact CG-CB 4.04Å; P50-N53 CarbonylContact O-C 3.48Å; P50-N53 PolarHBondContact O-N 2.86Å; P50-E56 WeakPolarHBondContact CD-O 3.22Å; P50-Y128 HydrophobicContact CB-CD2 4.25Å; P50-Y128 HydrophobicContact CB-CE2 3.92Å; P50-Y128 HydrophobicContact CG-CD2 4.4Å; P50-Y128 HydrophobicContact CG-CE2 3.67Å; P50-W129 PolarHBondContact O-NE1 3.41Å
51	Y	85.9	Confident	88.4	Confident	119 Å²	119	23.4 Å²	23.4	47%	0.467	10%	0.101	S	C	.	.	S	Bend	trans	-61.8	-34.8	178.7	-178	-98.7	0	0	0	113.5	R54 H127 W129	Y51-R54 VanDerWaalsContact O-CG 3.29Å; Y51-R54 WeakPolarHBondContact O-CG 3.4Å; Y51-H127 VanDerWaalsContact CB-O 3.25Å; Y51-H127 WeakPolarHBondContact CB-O 3.34Å; Y51-H127 PolarHBondContact N-O 2.77Å; Y51-W129 VanDerWaalsContact CA-CD1 3.44Å
52	H	83	Confident	88.3	Confident	70 Å²	70	26.7 Å²	26.7	32%	0.324	12%	0.124	S	C	.	.	S	Bend	trans	-80.9	-30.8	-179.7	-65.1	-45.2	0	0	0	113.6	P50 Y544	P50-H52 VanDerWaalsContact C-N 3.28Å; P50-H52 PolarHBondContact O-N 3.49Å; H52-Y544 HydrophobicContact CB-CE1 3.92Å
53	N	84.8	Confident	88.4	Confident	0 Å²	0	27.3 Å²	27.3	0%	0	13%	0.127	C	C	.	.			trans	-109.2	68.1	178.8	-69.4	-10	0	0	0	110	P50 Q55 E56 Y544	P50-N53 HydrophobicContact CB-CB 4.17Å; P50-N53 HydrophobicContact CG-CB 4.04Å; P50-N53 CarbonylContact O-C 3.48Å; P50-N53 PolarHBondContact O-N 2.86Å; N53-Q55 PolarHBondContact O-N 3.21Å; N53-E56 HydrophobicContact CB-CB 3.92Å; N53-E56 PolarHBondContact ND2-OE2 2.97Å; N53-E56 WeakPolarHBondContact O-CB 3.26Å; N53-E56 PolarHBondContact O-N 3.41Å; N53-Y544 VanDerWaalsContact CG-O 3.29Å; N53-Y544 WeakPolarHBondContact ND2-CE2 3.26Å; N53-Y544 PolarHBondContact ND2-O 3Å; N53-Y544 PolarHBondContact OD1-N 2.97Å; N53-Y544 PolarHBondContact OD1-O 3.01Å
54	R	81.4	Confident	88.3	Confident	59 Å²	59	28.6 Å²	28.6	22%	0.223	14%	0.135	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-15.9	-173	-59.8	-172.7	179.3	-174.2	3.9	114.7	Y51 A474 Y475	Y51-R54 VanDerWaalsContact O-CG 3.29Å; Y51-R54 WeakPolarHBondContact O-CG 3.4Å; R54-A474 VanDerWaalsContact NH1-C 3.3Å; R54-A474 PolarHBondContact NH1-O 2.9Å; R54-Y475 HydrophobicContact CB-CD2 3.65Å; R54-Y475 HydrophobicContact CB-CE2 3.54Å; R54-Y475 HydrophobicContact CG-CD2 4.36Å; R54-Y475 WeakPolarHBondContact O-CE2 3.43Å
55	Q	81.6	Confident	88.2	Confident	11 Å²	11	29.3 Å²	29.3	5%	0.051	14%	0.139	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.5	-15.2	179.1	-49.6	-68.5	-32.5	0	0	112	N53 T57 R388 W473 Y475 F547 Q548 F551	N53-Q55 PolarHBondContact O-N 3.21Å; Q55-T57 PolarHBondContact O-N 2.95Å; Q55-R388 VanDerWaalsContact CA-NH2 3.29Å; Q55-R388 VanDerWaalsContact CB-NH1 3.28Å; Q55-R388 VanDerWaalsContact O-CZ 3.28Å; Q55-R388 PolarHBondContact O-NE 3.43Å; Q55-R388 PolarHBondContact O-NH2 2.91Å; Q55-W473 HydrophobicContact CG-CE3 4.28Å; Q55-W473 HydrophobicContact CG-CZ3 4.19Å; Q55-Y475 PolarHBondContact OE1-OH 2.95Å; Q55-F547 WeakPolarHBondContact O-CE1 3.47Å; Q55-Q548 VanDerWaalsContact N-OE1 3.13Å; Q55-F551 HydrophobicContact CB-CD1 4.31Å; Q55-F551 HydrophobicContact CG-CD1 4.28Å; Q55-F551 HydrophobicContact CG-CE1 4.49Å
56	E	85.8	Confident	88	Confident	21 Å²	21	30.3 Å²	30.3	10%	0.098	15%	0.146	C	C	.	.			trans	-84.8	80.3	173.2	-172.3	173.3	-163.6	0	0	109.4	G49 P50 N53 Y58 F547	G49-E56 WeakPolarHBondContact CA-O 3.15Å; P50-E56 WeakPolarHBondContact CD-O 3.22Å; N53-E56 HydrophobicContact CB-CB 3.92Å; N53-E56 PolarHBondContact ND2-OE2 2.97Å; N53-E56 WeakPolarHBondContact O-CB 3.26Å; N53-E56 PolarHBondContact O-N 3.41Å; E56-Y58 HydrophobicContact CG-CE2 3.93Å; E56-Y58 WeakPolarHBondContact CG-OH 3.35Å; E56-Y58 PolarHBondContact OE1-OH 3.29Å; E56-F547 HydrophobicContact CB-CD1 4.1Å; E56-F547 HydrophobicContact CB-CE1 4.48Å; E56-F547 HydrophobicContact CG-CD1 4.2Å
57	T	89.1	Confident	87.9	Confident	7 Å²	7	33.8 Å²	33.8	4%	0.043	17%	0.168	C	C	.	.			trans	-105.9	147.4	179.9	54.6	0	0	0	0	110.9	V48 Q55 A386 S387	V48-T57 CarbonylContact O-C 3.54Å; V48-T57 WeakPolarHBondContact O-CA 3.34Å; Q55-T57 PolarHBondContact O-N 2.95Å; T57-A386 CarbonylContact O-C 3.56Å; T57-A386 WeakPolarHBondContact O-CA 3.39Å; T57-S387 WeakPolarHBondContact CB-OG 3.42Å; T57-S387 PolarHBondContact O-N 2.8Å; T57-S387 PolarHBondContact O-OG 2.86Å; T57-S387 PolarHBondContact OG1-OG 3.39Å
58	Y	90.8	Very high	87.6	Confident	36 Å²	36	34 Å²	34	14%	0.141	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	162.3	176.1	-54.2	-81	0	0	0	109.6	T47 V48 E56 S62 Y128 Y384 H385	T47-Y58 CarbonylContact C-O 3.6Å; T47-Y58 WeakPolarHBondContact CA-O 3.43Å; T47-Y58 WeakPolarHBondContact CB-O 3.35Å; V48-Y58 PolarHBondContact N-O 2.91Å; V48-Y58 PolarHBondContact O-N 3.29Å; E56-Y58 HydrophobicContact CG-CE2 3.93Å; E56-Y58 WeakPolarHBondContact CG-OH 3.35Å; E56-Y58 PolarHBondContact OE1-OH 3.29Å; Y58-S62 WeakPolarHBondContact CB-OG 3.33Å; Y58-Y128 HydrophobicContact CD2-CE1 4.21Å; Y58-Y128 HydrophobicContact CE2-CE1 4.34Å; Y58-Y384 WeakPolarHBondContact CE1-O 3.22Å; Y58-H385 WeakPolarHBondContact CD1-O 3.27Å
59	K	89.6	Confident	87.1	Confident	90 Å²	90	38.9 Å²	38.9	39%	0.391	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-53.4	141.5	172.7	-70.5	-176.6	173.9	-157.9	0	111.1	V48 F61 S62 E88	V48-K59 WeakPolarHBondContact CG2-O 3.49Å; K59-F61 VanDerWaalsContact C-N 3.28Å; K59-F61 PolarHBondContact O-N 2.94Å; K59-S62 WeakPolarHBondContact O-CB 3.31Å; K59-S62 PolarHBondContact O-N 3.31Å; K59-S62 PolarHBondContact O-OG 3.33Å; K59-E88 WeakPolarHBondContact CE-OE1 3.34Å; K59-E88 WeakPolarHBondContact CE-OE2 3.26Å; K59-E88 WeakPolarHBondContact CG-OE2 3.47Å; K59-E88 IonicContact NZ-OE1 2.75Å; K59-E88 PolarHBondContact NZ-OE1 3.26Å
60	Y	89.5	Confident	86.6	Confident	3 Å²	3	40.8 Å²	40.8	1%	0.012	21%	0.213	C	C	.	.	G	3₁₀ helix	trans	-52.4	-46.1	178.5	-175.9	-96.7	0	0	0	113	M45 N46 V48 S62 F65 Y130 K159	M45-Y60 HydrophobicContact CB-CD1 3.74Å; M45-Y60 HydrophobicContact CB-CD2 4.27Å; M45-Y60 HydrophobicContact CB-CE1 4.42Å; M45-Y60 HydrophobicContact CB-CG 3.66Å; M45-Y60 HydrophobicContact CE-CE1 4.46Å; M45-Y60 HydrophobicContact CG-CD1 3.82Å; M45-Y60 HydrophobicContact CG-CE1 4.04Å; M45-Y60 HydrophobicContact CG-CG 4.17Å; M45-Y60 HydrophobicContact SD-CD1 3.93Å; M45-Y60 HydrophobicContact SD-CD2 4.15Å; M45-Y60 HydrophobicContact SD-CE1 3.64Å; M45-Y60 HydrophobicContact SD-CE2 3.89Å; M45-Y60 HydrophobicContact SD-CG 4.18Å; N46-Y60 PolarHBondContact O-N 2.6Å; V48-Y60 HydrophobicContact CG1-CD2 3.65Å; V48-Y60 HydrophobicContact CG1-CE2 4.11Å; V48-Y60 HydrophobicContact CG1-CG 4.34Å; Y60-S62 PolarHBondContact O-N 3.24Å; Y60-F65 HydrophobicContact CD1-CD2 4.49Å; Y60-F65 HydrophobicContact CE1-CB 3.94Å; Y60-F65 AromaticContact CE1-CD2 3.87Å; Y60-F65 HydrophobicContact CE1-CD2 3.87Å; Y60-F65 HydrophobicContact CE1-CG 4.02Å; Y60-F65 HydrophobicContact CE2-CD2 4.35Å; Y60-F65 HydrophobicContact CE2-CE2 4.4Å; Y60-F65 AromaticContact CZ-CD2 3.76Å; Y60-Y130 HydrophobicContact CD2-CG 4.42Å; Y60-Y130 HydrophobicContact CE2-CD1 4.35Å; Y60-Y130 AromaticContact CE2-CD2 3.72Å; Y60-Y130 HydrophobicContact CE2-CD2 3.72Å; Y60-Y130 HydrophobicContact CE2-CE2 4.45Å; Y60-Y130 AromaticContact CE2-CG 3.67Å; Y60-Y130 HydrophobicContact CE2-CG 3.67Å; Y60-K159 PolarHBondContact OH-NZ 2.78Å
61	F	89.2	Confident	86	Confident	47 Å²	47	50.3 Å²	50.3	21%	0.206	25%	0.254	C	S	.	.	G	3₁₀ helix	trans	-82.8	10.6	179.1	-61.1	-80.9	0	0	0	114.4	M45 K59 L63 F65 V67 E90	M45-F61 HydrophobicContact CB-CE2 4.27Å; M45-F61 HydrophobicContact CG-CE2 4.4Å; M45-F61 HydrophobicContact CG-CZ 4.34Å; K59-F61 VanDerWaalsContact C-N 3.28Å; K59-F61 PolarHBondContact O-N 2.94Å; F61-L63 CarbonylContact C-O 3.58Å; F61-L63 WeakPolarHBondContact CA-O 3.14Å; F61-L63 VanDerWaalsContact O-O 3.13Å; F61-F65 HydrophobicContact CD1-CB 4.4Å; F61-V67 HydrophobicContact CD1-CG2 4Å; F61-V67 HydrophobicContact CE1-CB 4.26Å; F61-V67 HydrophobicContact CE1-CG2 3.46Å; F61-V67 VanDerWaalsContact CE1-CG2 3.46Å; F61-V67 HydrophobicContact CE2-CG2 4.43Å; F61-V67 HydrophobicContact CZ-CB 4.41Å; F61-V67 HydrophobicContact CZ-CG2 3.69Å; F61-E90 HydrophobicContact CD2-CB 4.04Å; F61-E90 WeakPolarHBondContact CD2-OE2 3.48Å; F61-E90 HydrophobicContact CE2-CB 3.77Å
62	S	87.3	Confident	85.6	Confident	70 Å²	70	48.7 Å²	48.7	49%	0.49	26%	0.26	S	S	.	.	G	3₁₀ helix	trans	-66.6	-31.7	164.9	65.6	0	0	0	0	111.3	Y58 K59 Y60	Y58-S62 WeakPolarHBondContact CB-OG 3.33Å; K59-S62 WeakPolarHBondContact O-CB 3.31Å; K59-S62 PolarHBondContact O-N 3.31Å; K59-S62 PolarHBondContact O-OG 3.33Å; Y60-S62 PolarHBondContact O-N 3.24Å
63	L	90	Very high	85.2	Confident	13 Å²	13	47.9 Å²	47.9	7%	0.068	26%	0.257	C	S	.	.	S	Bend	trans	-78.3	147	162.6	-69.7	175.9	0	0	0	109	V48 F61 F65 F120 A123 Y128 V143	V48-L63 HydrophobicContact CB-CD1 4.2Å; V48-L63 HydrophobicContact CG1-CD1 4.12Å; V48-L63 HydrophobicContact CG2-CD1 4.16Å; V48-L63 HydrophobicContact CG2-CG 4.22Å; F61-L63 CarbonylContact C-O 3.58Å; F61-L63 WeakPolarHBondContact CA-O 3.14Å; F61-L63 VanDerWaalsContact O-O 3.13Å; L63-F65 HydrophobicContact CB-CD2 3.71Å; L63-F65 HydrophobicContact CB-CE2 3.82Å; L63-F65 HydrophobicContact CD1-CE2 3.81Å; L63-F65 HydrophobicContact CG-CE2 4.49Å; L63-F65 PolarHBondContact O-N 2.8Å; L63-F120 HydrophobicContact CB-CE1 4.41Å; L63-A123 HydrophobicContact CD1-CB 4.07Å; L63-A123 HydrophobicContact CD2-CB 3.83Å; L63-Y128 HydrophobicContact CD1-CD1 4.41Å; L63-V143 HydrophobicContact CD1-CG1 4.48Å; L63-V143 HydrophobicContact CD1-CG2 3.86Å
64	P	88.8	Confident	84.2	Confident	28 Å²	28	51.8 Å²	51.8	18%	0.182	29%	0.285	C	S	.	.	S	Bend	trans	-75.9	44	-174.7	31.3	-33.4	0	0	0	112.8	K116 A119 F120	P64-K116 HydrophobicContact CB-CB 4.02Å; P64-K116 HydrophobicContact CB-CD 4.06Å; P64-K116 HydrophobicContact CB-CG 3.68Å; P64-K116 HydrophobicContact CG-CB 3.77Å; P64-K116 HydrophobicContact CG-CG 3.99Å; P64-A119 HydrophobicContact CG-CB 4.43Å; P64-F120 HydrophobicContact CB-CE2 4.43Å; P64-F120 HydrophobicContact CB-CZ 4.48Å; P64-F120 HydrophobicContact CG-CD2 3.96Å; P64-F120 HydrophobicContact CG-CE1 4.29Å; P64-F120 HydrophobicContact CG-CE2 3.56Å; P64-F120 HydrophobicContact CG-CG 4.5Å; P64-F120 HydrophobicContact CG-CZ 3.73Å
65	F	89.9	Confident	83.5	Confident	17 Å²	17	50.3 Å²	50.3	8%	0.075	28%	0.28	C	S	.	.			trans	-67.1	152.5	160.3	-67.9	-62.7	0	0	0	109.5	Y60 F61 L63 F120 V143 L155 M191	Y60-F65 HydrophobicContact CD1-CD2 4.49Å; Y60-F65 HydrophobicContact CE1-CB 3.94Å; Y60-F65 AromaticContact CE1-CD2 3.87Å; Y60-F65 HydrophobicContact CE1-CD2 3.87Å; Y60-F65 HydrophobicContact CE1-CG 4.02Å; Y60-F65 HydrophobicContact CE2-CD2 4.35Å; Y60-F65 HydrophobicContact CE2-CE2 4.4Å; Y60-F65 AromaticContact CZ-CD2 3.76Å; F61-F65 HydrophobicContact CD1-CB 4.4Å; L63-F65 HydrophobicContact CB-CD2 3.71Å; L63-F65 HydrophobicContact CB-CE2 3.82Å; L63-F65 HydrophobicContact CD1-CE2 3.81Å; L63-F65 HydrophobicContact CG-CE2 4.49Å; L63-F65 PolarHBondContact O-N 2.8Å; F65-F120 HydrophobicContact CD1-CE1 4.16Å; F65-F120 HydrophobicContact CD1-CZ 4.2Å; F65-F120 AromaticContact CE1-CE1 3.83Å; F65-F120 HydrophobicContact CE1-CE1 3.83Å; F65-F120 HydrophobicContact CE1-CZ 4.24Å; F65-F120 HydrophobicContact CE2-CE1 4.24Å; F65-F120 AromaticContact CZ-CE1 3.89Å; F65-F120 HydrophobicContact CZ-CE1 3.89Å; F65-V143 HydrophobicContact CE2-CG2 4.39Å; F65-V143 HydrophobicContact CZ-CG1 4.01Å; F65-V143 HydrophobicContact CZ-CG2 4.22Å; F65-L155 HydrophobicContact CE1-CD1 4.48Å; F65-M191 HydrophobicContact CD1-CE 3.59Å; F65-M191 HydrophobicContact CE1-CE 3.65Å
66	C	87.1	Confident	82.8	Confident	29 Å²	29	56.6 Å²	56.6	20%	0.196	31%	0.305	C	S	.	.			trans	-109.8	152.9	177.3	58.6	0	0	0	0	111.9	C108 I110	C66-C108 HydrophobicContact CB-CB 4.1Å; C66-C108 WeakPolarHBondContact CB-SG 3.31Å; C66-C108 WeakPolarHBondContact SG-CB 3.48Å; C66-C108 CovalentContact SG-SG 1.99Å; C66-C108 PolarHBondContact SG-SG 2.95Å; C66-I110 HydrophobicContact CB-CG1 4.11Å; C66-I110 WeakPolarHBondContact SG-CG1 3.28Å
67	V	87.8	Confident	81.8	Confident	77 Å²	77	57.8 Å²	57.8	47%	0.467	31%	0.31	S	S	.	.			trans	-82.3	146	180	-170.7	0	0	0	0	109.1	F61	F61-V67 HydrophobicContact CD1-CG2 4Å; F61-V67 HydrophobicContact CE1-CB 4.26Å; F61-V67 HydrophobicContact CE1-CG2 3.46Å; F61-V67 VanDerWaalsContact CE1-CG2 3.46Å; F61-V67 HydrophobicContact CE2-CG2 4.43Å; F61-V67 HydrophobicContact CZ-CB 4.41Å; F61-V67 HydrophobicContact CZ-CG2 3.69Å
68	G	84.7	Confident	80.8	Confident	11 Å²	11	62.5 Å²	62.5	11%	0.113	33%	0.332	C	S	.	.			trans	-66.1	175.9	172.5	0	0	0	0	0	113.9	K70 S92 G93	G68-K70 VanDerWaalsContact C-N 3.32Å; G68-K70 PolarHBondContact O-N 2.97Å; G68-S92 PolarHBondContact N-O 3Å; G68-G93 CarbonylContact C-O 3.55Å; G68-G93 VanDerWaalsContact C-O 3.29Å; G68-G93 WeakPolarHBondContact CA-O 3.47Å
69	S	82	Confident	80.1	Confident	103 Å²	103	63 Å²	63	72%	0.72	34%	0.339	S	S	*	.	S	Bend	trans	-72.4	-20.1	-172.6	53.4	0	0	0	0	114.7	G93	S69-G93 PolarHBondContact N-O 3.03Å
70	K	81.5	Confident	79.6	Confident	41 Å²	41	61.6 Å²	61.6	18%	0.178	34%	0.335	C	S	.	.			trans	-77.6	131.3	-176.7	-169.5	166.6	176.9	-179.3	0	110.4	E40 G68 F91 G93 D95	E40-K70 WeakPolarHBondContact OE1-CE 3.41Å; E40-K70 IonicContact OE1-NZ 3.75Å; E40-K70 PolarHBondContact OE1-NZ 2.85Å; E40-K70 IonicContact OE2-NZ 2.74Å; E40-K70 PolarHBondContact OE2-NZ 3.23Å; G68-K70 VanDerWaalsContact C-N 3.32Å; G68-K70 PolarHBondContact O-N 2.97Å; K70-F91 HydrophobicContact CB-CE1 3.94Å; K70-F91 HydrophobicContact CB-CZ 4.14Å; K70-F91 HydrophobicContact CD-CE1 4.43Å; K70-F91 HydrophobicContact CD-CZ 3.96Å; K70-F91 HydrophobicContact CG-CE1 3.96Å; K70-F91 HydrophobicContact CG-CZ 4Å; K70-F91 WeakPolarHBondContact O-CE1 3.38Å; K70-G93 VanDerWaalsContact CB-O 3.26Å; K70-G93 WeakPolarHBondContact CB-O 3.35Å; K70-G93 PolarHBondContact N-O 2.66Å; K70-D95 HydrophobicContact CD-CB 4.23Å; K70-D95 IonicContact NZ-OD1 3.67Å; K70-D95 PolarHBondContact NZ-OD1 3.03Å
71	K	76.6	Confident	79.2	Confident	205 Å²	205	61.4 Å²	61.4	89%	0.891	33%	0.334	S	S	*	.			trans	-105	-21	-171.9	-66.2	-173.1	178.8	-178	0	115.2
72	S	77.6	Confident	79	Confident	85 Å²	85	59.3 Å²	59.3	59%	0.594	33%	0.325	S	S	*	.			trans	-125.9	143.3	-174.7	58.7	0	0	0	0	110.9
73	I	74.2	Confident	78.8	Confident	52 Å²	52	56.2 Å²	56.2	27%	0.267	30%	0.304	S	S	.	.			trans	-110.8	151.6	173.4	-40.8	169.6	0	0	0	107.7	V42 W44 H75 F91	V42-I73 HydrophobicContact CG1-CG2 4.1Å; V42-I73 HydrophobicContact CG2-CG2 3.61Å; W44-I73 HydrophobicContact CH2-CD1 3.59Å; W44-I73 HydrophobicContact CH2-CG2 4.4Å; W44-I73 HydrophobicContact CZ2-CG2 4.49Å; W44-I73 HydrophobicContact CZ3-CD1 3.8Å; I73-H75 WeakPolarHBondContact CG2-O 3.19Å; I73-F91 HydrophobicContact CD1-CB 3.49Å; I73-F91 VanDerWaalsContact CD1-CB 3.49Å; I73-F91 HydrophobicContact CD1-CD1 4.26Å; I73-F91 HydrophobicContact CD1-CD2 3.81Å; I73-F91 HydrophobicContact CD1-CG 3.6Å; I73-F91 HydrophobicContact CG1-CB 4.04Å; I73-F91 HydrophobicContact CG1-CD1 3.82Å; I73-F91 HydrophobicContact CG1-CD2 3.73Å; I73-F91 HydrophobicContact CG1-CE1 4.15Å; I73-F91 HydrophobicContact CG1-CE2 4.11Å; I73-F91 HydrophobicContact CG1-CG 3.59Å; I73-F91 HydrophobicContact CG1-CZ 4.31Å
74	S	64	Low	78.6	Confident	83 Å²	83	57.1 Å²	57.1	58%	0.58	31%	0.309	S	S	*	.	S	Bend	trans	-74.8	-28.6	175.1	43	0	0	0	0	114.2
75	H	66	Low	78.3	Confident	27 Å²	27	60 Å²	60	13%	0.125	32%	0.32	C	S	.	.			trans	-147.8	157.8	-175.3	49.9	-107.4	0	0	0	111.3	D29 E30 V42 I73	D29-H75 IonicContact OD1-CE1 2.95Å; D29-H75 PolarHBondContact OD1-CE1 2.87Å; D29-H75 IonicContact OD1-CG 2.98Å; D29-H75 IonicContact OD1-ND1 3.23Å; D29-H75 PolarHBondContact OD1-ND1 3Å; D29-H75 IonicContact OD1-NE2 3.07Å; D29-H75 IonicContact OD2-CG 2.85Å; D29-H75 IonicContact OD2-ND1 3.57Å; E30-H75 WeakPolarHBondContact CG-NE2 3.38Å; E30-H75 IonicContact OE1-NE2 3.54Å; E30-H75 IonicContact OE2-NE2 2.88Å; E30-H75 PolarHBondContact OE2-NE2 3.12Å; V42-H75 WeakPolarHBondContact CG2-NE2 3.46Å; I73-H75 WeakPolarHBondContact CG2-O 3.19Å
76	Y	67	Low	77.9	Confident	143 Å²	143	59.5 Å²	59.5	56%	0.561	32%	0.319	S	S	*	.			trans	-130.5	135.8	175.5	-169.7	-96.9	0	0	0	109.5	W44 E78	W44-Y76 HydrophobicContact CH2-CD2 4.05Å; W44-Y76 HydrophobicContact CH2-CE2 4.49Å; W44-Y76 HydrophobicContact CZ3-CD2 4.32Å; W44-Y76 HydrophobicContact CZ3-CE2 4.33Å; Y76-E78 HydrophobicContact CE1-CB 3.91Å
77	H	64.3	Low	77.7	Confident	47 Å²	47	58.7 Å²	58.7	22%	0.218	31%	0.314	C	S	.	.			trans	-124	118.1	-178.7	-167.4	-79.9	0	0	0	110.1	H31 T79 E82	H31-H77 AromaticContact CE1-CD2 3.4Å; H31-H77 PolarHBondContact CE1-CD2 2.91Å; H31-H77 AromaticContact ND1-CD2 3.69Å; H77-T79 VanDerWaalsContact CE1-CG2 3.41Å; H77-T79 WeakPolarHBondContact CE1-CG2 3.44Å; H77-E82 IonicContact CE1-OE1 3.48Å; H77-E82 IonicContact CE1-OE2 2.66Å; H77-E82 IonicContact ND1-OE1 2.92Å; H77-E82 IonicContact ND1-OE2 2.71Å; H77-E82 PolarHBondContact ND1-OE2 2.91Å; H77-E82 VanDerWaalsContact ND1-OE2 3.16Å
78	E	68.5	Low	77.4	Confident	106 Å²	106	57.7 Å²	57.7	50%	0.495	30%	0.304	S	S	.	.			trans	-144.6	120.2	164.2	-169.9	-176.9	179.2	0	0	108.8	Y76 A83	Y76-E78 HydrophobicContact CE1-CB 3.91Å; E78-A83 HydrophobicContact CG-CB 4.43Å; E78-A83 WeakPolarHBondContact OE1-CB 2.91Å
79	T	77.7	Confident	77.3	Confident	46 Å²	46	57.7 Å²	57.7	28%	0.282	30%	0.301	S	S	.	.			trans	-97.2	156.7	174	62.5	0	0	0	0	111.1	H77 G81 E82 A83	H77-T79 VanDerWaalsContact CE1-CG2 3.41Å; H77-T79 WeakPolarHBondContact CE1-CG2 3.44Å; T79-G81 PolarHBondContact O-N 3.49Å; T79-E82 PolarHBondContact N-OE2 2.93Å; T79-E82 PolarHBondContact O-N 2.84Å; T79-E82 WeakPolarHBondContact OG1-CB 3.23Å; T79-E82 VanDerWaalsContact OG1-CD 3.28Å; T79-E82 WeakPolarHBondContact OG1-CG 2.94Å; T79-E82 PolarHBondContact OG1-N 3.21Å; T79-E82 VanDerWaalsContact OG1-N 3.15Å; T79-E82 PolarHBondContact OG1-OE2 2.95Å; T79-A83 PolarHBondContact O-N 2.8Å
80	L	78.9	Confident	77.5	Confident	60 Å²	60	55.7 Å²	55.7	31%	0.314	28%	0.281	S	S	.	.	H	α-helix	trans	-56.9	-35.6	172.9	-178.4	66.4	0	0	0	111.9	L84 T394 I401	L80-L84 HydrophobicContact CD1-CD1 4.44Å; L80-L84 HydrophobicContact CG-CD1 4.22Å; L80-L84 WeakPolarHBondContact O-CB 3.05Å; L80-L84 VanDerWaalsContact O-CG 3.31Å; L80-L84 WeakPolarHBondContact O-CG 3.48Å; L80-L84 PolarHBondContact O-N 3.08Å; L80-L84 VanDerWaalsContact O-N 3.14Å; L80-T394 HydrophobicContact CD1-CG2 4.25Å; L80-I401 HydrophobicContact CD2-CD1 4.16Å
81	G	80.1	Confident	77.7	Confident	0 Å²	0	55.2 Å²	55.2	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-66.1	-45	177.8	0	0	0	0	0	112.4	T79 L84 Q85	T79-G81 PolarHBondContact O-N 3.49Å; G81-L84 PolarHBondContact O-N 3.34Å; G81-Q85 WeakPolarHBondContact O-CG 3.17Å; G81-Q85 PolarHBondContact O-N 2.99Å; G81-Q85 VanDerWaalsContact O-N 3.14Å
82	E	84.2	Confident	78.3	Confident	2 Å²	2	45.6 Å²	45.6	1%	0.009	24%	0.237	C	C	.	.	H	α-helix	trans	-61.5	-46.9	175.2	-76.1	168	148.1	0	0	111.8	H77 T79 L84 Q85 G86 V87 R321	H77-E82 IonicContact CE1-OE1 3.48Å; H77-E82 IonicContact CE1-OE2 2.66Å; H77-E82 IonicContact ND1-OE1 2.92Å; H77-E82 IonicContact ND1-OE2 2.71Å; H77-E82 PolarHBondContact ND1-OE2 2.91Å; H77-E82 VanDerWaalsContact ND1-OE2 3.16Å; T79-E82 PolarHBondContact N-OE2 2.93Å; T79-E82 PolarHBondContact O-N 2.84Å; T79-E82 WeakPolarHBondContact OG1-CB 3.23Å; T79-E82 VanDerWaalsContact OG1-CD 3.28Å; T79-E82 WeakPolarHBondContact OG1-CG 2.94Å; T79-E82 PolarHBondContact OG1-N 3.21Å; T79-E82 VanDerWaalsContact OG1-N 3.15Å; T79-E82 PolarHBondContact OG1-OE2 2.95Å; E82-L84 VanDerWaalsContact C-N 3.29Å; E82-L84 PolarHBondContact O-N 3.11Å; E82-Q85 PolarHBondContact O-N 3.24Å; E82-G86 PolarHBondContact O-N 3.07Å; E82-V87 HydrophobicContact CB-CB 3.95Å; E82-V87 HydrophobicContact CB-CG1 4.26Å; E82-V87 HydrophobicContact CB-CG2 4.47Å; E82-V87 HydrophobicContact CG-CB 4.37Å; E82-V87 HydrophobicContact CG-CG1 4.33Å; E82-V87 WeakPolarHBondContact O-CB 3.3Å; E82-V87 PolarHBondContact O-N 3.01Å; E82-R321 HydrophobicContact CG-CB 3.99Å; E82-R321 WeakPolarHBondContact OE1-CB 3.38Å; E82-R321 IonicContact OE1-CZ 3.65Å; E82-R321 IonicContact OE1-NE 2.72Å; E82-R321 PolarHBondContact OE1-NE 3.35Å; E82-R321 IonicContact OE1-NH2 3.22Å
83	A	84.5	Confident	78.8	Confident	6 Å²	6	41.5 Å²	41.5	5%	0.05	21%	0.209	C	C	.	.	H	α-helix	trans	-63	-34.8	-179.5	0	0	0	0	0	112.6	E78 T79 G86 T394	E78-A83 HydrophobicContact CG-CB 4.43Å; E78-A83 WeakPolarHBondContact OE1-CB 2.91Å; T79-A83 PolarHBondContact O-N 2.8Å; A83-G86 PolarHBondContact O-N 2.72Å; A83-T394 HydrophobicContact CB-CG2 3.61Å
84	L	84.4	Confident	79.5	Confident	32 Å²	32	39.3 Å²	39.3	17%	0.168	20%	0.197	C	C	.	.	H	α-helix	trans	-75.8	-22.5	174.8	-72.8	172.4	0	0	0	113.4	L80 G81 E82 G86 L325 I329 I390 V398	L80-L84 HydrophobicContact CD1-CD1 4.44Å; L80-L84 HydrophobicContact CG-CD1 4.22Å; L80-L84 WeakPolarHBondContact O-CB 3.05Å; L80-L84 VanDerWaalsContact O-CG 3.31Å; L80-L84 WeakPolarHBondContact O-CG 3.48Å; L80-L84 PolarHBondContact O-N 3.08Å; L80-L84 VanDerWaalsContact O-N 3.14Å; G81-L84 PolarHBondContact O-N 3.34Å; E82-L84 VanDerWaalsContact C-N 3.29Å; E82-L84 PolarHBondContact O-N 3.11Å; L84-G86 VanDerWaalsContact C-N 3.32Å; L84-L325 HydrophobicContact CB-CD2 3.55Å; L84-L325 HydrophobicContact CD1-CD2 4.16Å; L84-I329 HydrophobicContact CD1-CD1 3.39Å; L84-I390 HydrophobicContact CD2-CD1 4.42Å; L84-I390 HydrophobicContact CD2-CG2 4.18Å; L84-V398 HydrophobicContact CD2-CG2 4.43Å
85	Q	84	Confident	80.6	Confident	87 Å²	87	38 Å²	38	41%	0.407	18%	0.184	S	C	.	.	H	α-helix	trans	-83.4	-9	174.1	-73.4	-178.5	-12.9	0	0	113	G81 E82 V87 L325	G81-Q85 WeakPolarHBondContact O-CG 3.17Å; G81-Q85 PolarHBondContact O-N 2.99Å; G81-Q85 VanDerWaalsContact O-N 3.14Å; E82-Q85 PolarHBondContact O-N 3.24Å; Q85-V87 HydrophobicContact CB-CG2 4.13Å; Q85-L325 HydrophobicContact CG-CD2 4.1Å
86	G	81.8	Confident	81.8	Confident	7 Å²	7	36.8 Å²	36.8	7%	0.072	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	76.8	26.8	-175.1	0	0	0	0	0	113.1	E82 A83 L84 E88 S387	E82-G86 PolarHBondContact O-N 3.07Å; A83-G86 PolarHBondContact O-N 2.72Å; L84-G86 VanDerWaalsContact C-N 3.32Å; G86-E88 PolarHBondContact O-N 2.94Å; G86-S387 PolarHBondContact O-OG 3.48Å
87	V	83.1	Confident	83	Confident	13 Å²	13	33.3 Å²	33.3	8%	0.079	17%	0.166	C	C	.	.			trans	-78	112.4	171.5	176.1	0	0	0	0	107.1	N46 E82 Q85 L89	N46-V87 WeakPolarHBondContact OD1-CA 2.99Å; E82-V87 HydrophobicContact CB-CB 3.95Å; E82-V87 HydrophobicContact CB-CG1 4.26Å; E82-V87 HydrophobicContact CB-CG2 4.47Å; E82-V87 HydrophobicContact CG-CB 4.37Å; E82-V87 HydrophobicContact CG-CG1 4.33Å; E82-V87 WeakPolarHBondContact O-CB 3.3Å; E82-V87 PolarHBondContact O-N 3.01Å; Q85-V87 HydrophobicContact CB-CG2 4.13Å; V87-L89 HydrophobicContact CG1-CD1 4.49Å; V87-L89 HydrophobicContact CG1-CD2 3.6Å; V87-L89 HydrophobicContact CG1-CG 3.81Å
88	E	79.6	Confident	84.3	Confident	56 Å²	56	31 Å²	31	26%	0.262	16%	0.156	S	C	.	.			trans	-116.2	96	176.7	-73.4	-175	122.7	0	0	107.5	N46 K59 G86 E90 S387	N46-E88 WeakPolarHBondContact CA-O 3.31Å; N46-E88 PolarHBondContact OD1-N 3.34Å; N46-E88 VanDerWaalsContact OD1-N 3.1Å; K59-E88 WeakPolarHBondContact CE-OE1 3.34Å; K59-E88 WeakPolarHBondContact CE-OE2 3.26Å; K59-E88 WeakPolarHBondContact CG-OE2 3.47Å; K59-E88 IonicContact NZ-OE1 2.75Å; K59-E88 PolarHBondContact NZ-OE1 3.26Å; G86-E88 PolarHBondContact O-N 2.94Å; E88-E90 PolarHBondContact O-N 3.28Å; E88-S387 WeakPolarHBondContact OE2-CA 3.41Å; E88-S387 VanDerWaalsContact OE2-CB 3.26Å; E88-S387 WeakPolarHBondContact OE2-CB 3.38Å
89	L	84	Confident	85.4	Confident	11 Å²	11	29.3 Å²	29.3	6%	0.058	15%	0.146	C	C	.	.			trans	-81.8	116.6	-178.9	-56	176.7	0	0	0	109.9	W44 N46 V87 Y133 R321	W44-L89 HydrophobicContact CB-CB 4.37Å; W44-L89 HydrophobicContact CB-CD2 4.06Å; W44-L89 HydrophobicContact CD2-CB 4.15Å; W44-L89 HydrophobicContact CD2-CD1 4.44Å; W44-L89 HydrophobicContact CE3-CB 3.68Å; W44-L89 HydrophobicContact CG-CB 4.48Å; W44-L89 HydrophobicContact CG-CD1 4.45Å; W44-L89 HydrophobicContact CZ3-CB 4.31Å; N46-L89 HydrophobicContact CB-CD2 4.13Å; V87-L89 HydrophobicContact CG1-CD1 4.49Å; V87-L89 HydrophobicContact CG1-CD2 3.6Å; V87-L89 HydrophobicContact CG1-CG 3.81Å; L89-Y133 HydrophobicContact CD2-CD2 4.1Å; L89-R321 VanDerWaalsContact CD2-NH1 3.31Å
90	E	85.2	Confident	86.1	Confident	61 Å²	61	30.1 Å²	30.1	29%	0.285	15%	0.149	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	144.6	172.2	-64.7	-166.9	-159.5	0	0	110.4	M45 F61 E88 S92	M45-E90 WeakPolarHBondContact CB-O 3.26Å; M45-E90 PolarHBondContact N-O 2.9Å; M45-E90 PolarHBondContact O-N 3.45Å; F61-E90 HydrophobicContact CD2-CB 4.04Å; F61-E90 WeakPolarHBondContact CD2-OE2 3.48Å; F61-E90 HydrophobicContact CE2-CB 3.77Å; E88-E90 PolarHBondContact O-N 3.28Å; E90-S92 PolarHBondContact O-N 3.16Å
91	F	87	Confident	86.8	Confident	30 Å²	30	31.7 Å²	31.7	13%	0.132	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	132	-178.3	-177.1	-130.9	0	0	0	111.5	V42 K70 I73 G93	V42-F91 HydrophobicContact CG1-CD2 3.66Å; V42-F91 HydrophobicContact CG1-CE2 3.81Å; K70-F91 HydrophobicContact CB-CE1 3.94Å; K70-F91 HydrophobicContact CB-CZ 4.14Å; K70-F91 HydrophobicContact CD-CE1 4.43Å; K70-F91 HydrophobicContact CD-CZ 3.96Å; K70-F91 HydrophobicContact CG-CE1 3.96Å; K70-F91 HydrophobicContact CG-CZ 4Å; K70-F91 WeakPolarHBondContact O-CE1 3.38Å; I73-F91 HydrophobicContact CD1-CB 3.49Å; I73-F91 VanDerWaalsContact CD1-CB 3.49Å; I73-F91 HydrophobicContact CD1-CD1 4.26Å; I73-F91 HydrophobicContact CD1-CD2 3.81Å; I73-F91 HydrophobicContact CD1-CG 3.6Å; I73-F91 HydrophobicContact CG1-CB 4.04Å; I73-F91 HydrophobicContact CG1-CD1 3.82Å; I73-F91 HydrophobicContact CG1-CD2 3.73Å; I73-F91 HydrophobicContact CG1-CE1 4.15Å; I73-F91 HydrophobicContact CG1-CE2 4.11Å; I73-F91 HydrophobicContact CG1-CG 3.59Å; I73-F91 HydrophobicContact CG1-CZ 4.31Å; F91-G93 VanDerWaalsContact C-N 3.29Å; F91-G93 PolarHBondContact O-N 3.42Å
92	S	87.7	Confident	87.4	Confident	3 Å²	3	33 Å²	33	2%	0.021	17%	0.166	C	C	.	.			trans	-67.4	-25.4	177.6	61.5	0	0	0	0	114.4	L43 M45 G68 E90 L94	L43-S92 WeakPolarHBondContact CB-OG 3.19Å; L43-S92 WeakPolarHBondContact O-CB 3.48Å; L43-S92 PolarHBondContact O-N 2.88Å; L43-S92 PolarHBondContact O-OG 3.48Å; M45-S92 VanDerWaalsContact CE-CB 3.4Å; G68-S92 PolarHBondContact N-O 3Å; E90-S92 PolarHBondContact O-N 3.16Å; S92-L94 VanDerWaalsContact C-N 3.27Å; S92-L94 PolarHBondContact O-N 3.14Å; S92-L94 PolarHBondContact OG-N 3.23Å
93	G	88.2	Confident	87.8	Confident	0 Å²	0	40 Å²	40	0%	0	20%	0.201	C	C	.	.			trans	78.3	5.9	-173.8	0	0	0	0	0	114.6	G68 S69 K70 F91	G68-G93 CarbonylContact C-O 3.55Å; G68-G93 VanDerWaalsContact C-O 3.29Å; G68-G93 WeakPolarHBondContact CA-O 3.47Å; S69-G93 PolarHBondContact N-O 3.03Å; K70-G93 VanDerWaalsContact CB-O 3.26Å; K70-G93 WeakPolarHBondContact CB-O 3.35Å; K70-G93 PolarHBondContact N-O 2.66Å; F91-G93 VanDerWaalsContact C-N 3.29Å; F91-G93 PolarHBondContact O-N 3.42Å
94	L	89.1	Confident	88.1	Confident	5 Å²	5	43.7 Å²	43.7	3%	0.026	22%	0.224	C	C	.	.			trans	-85.8	134.8	178.7	-56.1	-176.8	0	0	0	110.5	L43 S92 I96 Y107 Y193	L43-L94 HydrophobicContact CD2-CD1 3.75Å; S92-L94 VanDerWaalsContact C-N 3.27Å; S92-L94 PolarHBondContact O-N 3.14Å; S92-L94 PolarHBondContact OG-N 3.23Å; L94-I96 HydrophobicContact CB-CD1 4.35Å; L94-I96 HydrophobicContact CB-CG1 4.14Å; L94-I96 PolarHBondContact O-N 3.37Å; L94-Y107 HydrophobicContact CD2-CD1 4.02Å; L94-Y107 HydrophobicContact CD2-CD2 3.68Å; L94-Y107 HydrophobicContact CD2-CE1 4.49Å; L94-Y107 HydrophobicContact CD2-CE2 4.19Å; L94-Y107 HydrophobicContact CD2-CG 3.57Å; L94-Y193 HydrophobicContact CB-CE2 4.11Å; L94-Y193 HydrophobicContact CD1-CD2 3.86Å; L94-Y193 HydrophobicContact CD1-CE2 4.25Å; L94-Y193 HydrophobicContact CD1-CG 4.07Å; L94-Y193 HydrophobicContact CD2-CD1 3.92Å; L94-Y193 HydrophobicContact CD2-CD2 4.39Å; L94-Y193 HydrophobicContact CD2-CE1 3.92Å; L94-Y193 HydrophobicContact CD2-CE2 4.4Å; L94-Y193 HydrophobicContact CD2-CG 4.14Å; L94-Y193 HydrophobicContact CG-CE2 4.49Å
95	D	88	Confident	88.4	Confident	57 Å²	57	44 Å²	44	31%	0.305	23%	0.231	S	C	.	.			trans	-84.8	102.7	171.4	-163.7	35.7	0	0	0	108.3	K70 K97 Y193	K70-D95 HydrophobicContact CD-CB 4.23Å; K70-D95 IonicContact NZ-OD1 3.67Å; K70-D95 PolarHBondContact NZ-OD1 3.03Å; D95-K97 WeakPolarHBondContact OD2-CE 3.29Å; D95-K97 IonicContact OD2-NZ 2.7Å; D95-K97 PolarHBondContact OD2-NZ 3.21Å; D95-Y193 PolarHBondContact O-OH 3.48Å
96	I	90.7	Very high	88.8	Confident	1 Å²	1	43.4 Å²	43.4	1%	0.005	23%	0.234	C	C	.	.			trans	-117	129.7	175.6	-53.2	-179.9	0	0	0	107.1	V41 L43 L94 L161 I163 Y193 V195 W197	V41-I96 HydrophobicContact CB-CG2 4.18Å; V41-I96 PolarHBondContact N-O 2.87Å; L43-I96 HydrophobicContact CB-CD1 3.92Å; L43-I96 HydrophobicContact CD2-CD1 4.45Å; L94-I96 HydrophobicContact CB-CD1 4.35Å; L94-I96 HydrophobicContact CB-CG1 4.14Å; L94-I96 PolarHBondContact O-N 3.37Å; I96-L161 HydrophobicContact CD1-CD1 4.08Å; I96-I163 HydrophobicContact CG2-CD1 4.35Å; I96-Y193 HydrophobicContact CG1-CE2 4.45Å; I96-V195 HydrophobicContact CD1-CG2 4.1Å; I96-V195 HydrophobicContact CG1-CG2 4.02Å; I96-V195 HydrophobicContact CG2-CG1 4.17Å; I96-V195 HydrophobicContact CG2-CG2 4.22Å; I96-W197 HydrophobicContact CG2-CZ2 4.17Å
97	K	91.7	Very high	89.2	Confident	69 Å²	69	44.6 Å²	44.6	30%	0.3	24%	0.236	S	C	.	.	B	Isolated β-bridge	trans	-123.2	143.2	178.6	-67	173.5	-170.5	146.3	0	110.5	E39 D95 K99 D100 W197	E39-K97 CarbonylContact O-C 3.4Å; E39-K97 VanDerWaalsContact O-CA 3.22Å; E39-K97 WeakPolarHBondContact O-CA 3.2Å; D95-K97 WeakPolarHBondContact OD2-CE 3.29Å; D95-K97 IonicContact OD2-NZ 2.7Å; D95-K97 PolarHBondContact OD2-NZ 3.21Å; K97-K99 PolarHBondContact O-N 3.44Å; K97-D100 HydrophobicContact CB-CB 3.75Å; K97-D100 PolarHBondContact O-N 3.23Å; K97-D100 VanDerWaalsContact O-N 3.11Å; K97-W197 VanDerWaalsContact O-CZ2 3.29Å; K97-W197 WeakPolarHBondContact O-CZ2 3.46Å; K97-W197 PolarHBondContact O-NE1 3.2Å; K97-W197 VanDerWaalsContact O-NE1 3.08Å
98	F	91.9	Very high	89.6	Confident	0 Å²	0	45 Å²	45	0%	0	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.9	126.8	-178.6	-173.5	-113.4	0	0	0	111.1	Y35 Q36 K38 E39 V41 D100 F165 I170 W197	Y35-F98 HydrophobicContact CD2-CD2 4.44Å; Y35-F98 HydrophobicContact CD2-CE2 4.49Å; Y35-F98 HydrophobicContact CG-CD2 4.13Å; Y35-F98 HydrophobicContact CG-CG 4.33Å; Q36-F98 WeakPolarHBondContact O-CD1 3.22Å; K38-F98 WeakPolarHBondContact CA-O 3.46Å; K38-F98 PolarHBondContact N-O 3.34Å; E39-F98 PolarHBondContact O-N 3.4Å; V41-F98 HydrophobicContact CG2-CB 3.93Å; V41-F98 HydrophobicContact CG2-CD2 4.46Å; F98-D100 PolarHBondContact O-N 3.09Å; F98-F165 HydrophobicContact CE2-CB 4Å; F98-F165 HydrophobicContact CZ-CB 4.15Å; F98-I170 HydrophobicContact CD2-CG1 4.28Å; F98-I170 HydrophobicContact CE2-CG1 4.03Å; F98-W197 HydrophobicContact CD2-CE3 4.42Å; F98-W197 AromaticContact CD2-CH2 3.58Å; F98-W197 HydrophobicContact CD2-CH2 3.58Å; F98-W197 HydrophobicContact CD2-CZ2 4.4Å; F98-W197 AromaticContact CD2-CZ3 3.58Å; F98-W197 HydrophobicContact CD2-CZ3 3.58Å; F98-W197 HydrophobicContact CE2-CH2 4.25Å; F98-W197 AromaticContact CE2-CZ3 3.78Å; F98-W197 HydrophobicContact CE2-CZ3 3.78Å; F98-W197 HydrophobicContact CG-CH2 4.48Å
99	K	91.6	Very high	90.1	Very high	69 Å²	69	46.9 Å²	46.9	30%	0.3	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.1	20.4	-174.8	-58.4	176.6	-172.5	150.6	0	115.5	D37 K97 F165 G167 N168	D37-K99 WeakPolarHBondContact OD1-CD 3.12Å; D37-K99 IonicContact OD1-NZ 3.95Å; D37-K99 PolarHBondContact OD1-NZ 3.38Å; K97-K99 PolarHBondContact O-N 3.44Å; K99-F165 HydrophobicContact CD-CD2 4.36Å; K99-F165 HydrophobicContact CD-CE2 4Å; K99-F165 HydrophobicContact CD-CZ 4.29Å; K99-F165 VanDerWaalsContact CE-CE2 3.47Å; K99-F165 HydrophobicContact CG-CD1 4.44Å; K99-F165 HydrophobicContact CG-CD2 4.25Å; K99-F165 HydrophobicContact CG-CE1 4.31Å; K99-F165 HydrophobicContact CG-CE2 4.14Å; K99-F165 HydrophobicContact CG-CG 4.4Å; K99-F165 HydrophobicContact CG-CZ 4.16Å; K99-G167 WeakPolarHBondContact CE-O 3.43Å; K99-G167 PolarHBondContact NZ-O 2.9Å; K99-N168 PolarHBondContact NZ-OD1 3.12Å
100	D	92.7	Very high	90.4	Very high	63 Å²	63	46.7 Å²	46.7	34%	0.337	25%	0.247	S	C	.	.			trans	-110.1	113.2	175.4	-158.3	26.4	0	0	0	109.9	K97 F98 W197	K97-D100 HydrophobicContact CB-CB 3.75Å; K97-D100 PolarHBondContact O-N 3.23Å; K97-D100 VanDerWaalsContact O-N 3.11Å; F98-D100 PolarHBondContact O-N 3.09Å; D100-W197 VanDerWaalsContact C-CD1 3.45Å; D100-W197 PolarHBondContact O-NE1 3Å
101	D	93.7	Very high	90.7	Very high	94 Å²	94	47.3 Å²	47.3	50%	0.503	25%	0.252	S	S	.	.			trans	-73.9	127.6	179.7	-77.9	-13.3	0	0	0	110.3	V195 K196 W197	D101-V195 WeakPolarHBondContact CA-O 3.41Å; D101-K196 WeakPolarHBondContact OD1-CA 3.38Å; D101-W197 PolarHBondContact OD1-N 2.95Å
102	V	92.4	Very high	90.8	Very high	28 Å²	28	46 Å²	46	17%	0.17	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	108.8	175.7	-176.2	0	0	0	0	108.2	Y193 S194 V195	V102-Y193 HydrophobicContact CB-CE2 4.37Å; V102-Y193 HydrophobicContact CG1-CE1 4.5Å; V102-Y193 HydrophobicContact CG1-CE2 3.89Å; V102-S194 VanDerWaalsContact O-CA 3.31Å; V102-S194 WeakPolarHBondContact O-CA 3.4Å; V102-S194 WeakPolarHBondContact O-CB 3.15Å; V102-V195 HydrophobicContact CB-CB 3.99Å; V102-V195 HydrophobicContact CB-CG2 4.17Å; V102-V195 HydrophobicContact CG2-CB 4.11Å; V102-V195 HydrophobicContact CG2-CG2 4.22Å; V102-V195 PolarHBondContact N-O 3.15Å; V102-V195 PolarHBondContact O-N 3.21Å
103	M	92.7	Very high	90.9	Very high	149 Å²	149	49.6 Å²	49.6	73%	0.734	27%	0.266	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-58	152.7	171.8	-69.4	-63.4	-71	0	0	110.6	A105	M103-A105 PolarHBondContact O-N 3.27Å
104	P	91.7	Very high	91	Very high	82 Å²	82	56.8 Å²	56.8	53%	0.532	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-51.3	114	-179.6	-25.6	34	0	0	0	111.6	Y158 Y193	P104-Y158 HydrophobicContact CB-CE2 4.05Å; P104-Y158 HydrophobicContact CG-CE2 4.48Å; P104-Y193 WeakPolarHBondContact CA-O 3.49Å
105	A	90.1	Very high	91.1	Very high	40 Å²	40	64.5 Å²	64.5	33%	0.331	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	137.9	-177.3	0	0	0	0	0	109.8	M103 Y107 S192 Y193	M103-A105 PolarHBondContact O-N 3.27Å; A105-Y107 PolarHBondContact O-N 3.26Å; A105-S192 VanDerWaalsContact O-CA 3.26Å; A105-S192 WeakPolarHBondContact O-CA 3.29Å; A105-S192 WeakPolarHBondContact O-CB 3.49Å; A105-Y193 PolarHBondContact N-O 2.95Å; A105-Y193 PolarHBondContact O-N 3.37Å
106	T	91.3	Very high	91.3	Very high	74 Å²	74	65 Å²	65	45%	0.454	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74	119.3	170.1	-55.8	0	0	0	0	108.2	Q190 M191	T106-Q190 HydrophobicContact CG2-CB 3.9Å; T106-Q190 HydrophobicContact CG2-CG 4.29Å; T106-M191 WeakPolarHBondContact CA-O 3.47Å; T106-M191 WeakPolarHBondContact CG2-O 3.14Å
107	Y	91	Very high	91.3	Very high	32 Å²	32	68.7 Å²	68.7	13%	0.125	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	-21.3	179.4	64.2	-86.3	0	0	0	112.4	L94 A105 M191 Y193	L94-Y107 HydrophobicContact CD2-CD1 4.02Å; L94-Y107 HydrophobicContact CD2-CD2 3.68Å; L94-Y107 HydrophobicContact CD2-CE1 4.49Å; L94-Y107 HydrophobicContact CD2-CE2 4.19Å; L94-Y107 HydrophobicContact CD2-CG 3.57Å; A105-Y107 PolarHBondContact O-N 3.26Å; Y107-M191 HydrophobicContact CD1-CB 4.3Å; Y107-M191 WeakPolarHBondContact CD1-O 3.35Å; Y107-M191 VanDerWaalsContact CE1-C 3.46Å; Y107-M191 HydrophobicContact CE1-CB 3.58Å; Y107-M191 WeakPolarHBondContact CE1-O 3.41Å; Y107-M191 HydrophobicContact CE2-CB 4.09Å; Y107-M191 VanDerWaalsContact CZ-CB 3.47Å; Y107-M191 PolarHBondContact N-O 2.87Å; Y107-M191 WeakPolarHBondContact OH-CB 3.49Å; Y107-Y193 AromaticContact CD1-CD1 3.63Å; Y107-Y193 HydrophobicContact CD1-CD1 3.63Å; Y107-Y193 HydrophobicContact CD1-CE1 4.48Å; Y107-Y193 HydrophobicContact CD1-CG 4.26Å; Y107-Y193 HydrophobicContact CG-CD1 4.11Å
108	C	91.2	Very high	91.3	Very high	22 Å²	22	69.3 Å²	69.3	15%	0.149	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.5	155.6	-176.5	177.8	0	0	0	0	112.7	C66 M191	C66-C108 HydrophobicContact CB-CB 4.1Å; C66-C108 WeakPolarHBondContact CB-SG 3.31Å; C66-C108 WeakPolarHBondContact SG-CB 3.48Å; C66-C108 CovalentContact SG-SG 1.99Å; C66-C108 PolarHBondContact SG-SG 2.95Å; C108-M191 PolarHBondContact O-N 3.32Å
109	E	91.2	Very high	91.3	Very high	94 Å²	94	71.1 Å²	71.1	44%	0.439	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	133.5	170.3	-50.9	-165.7	147	0	0	110.7	I189 Q190	E109-I189 WeakPolarHBondContact CA-O 3.31Å; E109-Q190 HydrophobicContact CG-CG 4.07Å; E109-Q190 PolarHBondContact OE1-NE2 3.19Å
110	I	90.2	Very high	91.4	Very high	7 Å²	7	67.8 Å²	67.8	4%	0.036	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	117.2	176.7	-56.9	168.8	0	0	0	108.2	C66 L112 F120 K188 I189 M191	C66-I110 HydrophobicContact CB-CG1 4.11Å; C66-I110 WeakPolarHBondContact SG-CG1 3.28Å; I110-L112 PolarHBondContact O-N 3.18Å; I110-F120 HydrophobicContact CD1-CZ 4.47Å; I110-K188 WeakPolarHBondContact O-CA 3.33Å; I110-I189 PolarHBondContact N-O 2.85Å; I110-I189 PolarHBondContact O-N 2.91Å; I110-M191 HydrophobicContact CD1-CE 3.9Å; I110-M191 HydrophobicContact CD1-CG 3.66Å; I110-M191 HydrophobicContact CD1-SD 4.15Å; I110-M191 HydrophobicContact CG1-CG 4.17Å
111	D	90.8	Very high	91.4	Very high	75 Å²	75	66 Å²	66	40%	0.401	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	112.6	166.6	-67.3	-37.6	0	0	0	109	D113 K116 K188	D111-D113 PolarHBondContact O-N 3.43Å; D111-K116 WeakPolarHBondContact O-CD 3.35Å; D111-K116 PolarHBondContact O-NZ 2.79Å; D111-K188 VanDerWaalsContact OD1-CD 3.31Å; D111-K188 WeakPolarHBondContact OD1-CD 3.35Å; D111-K188 WeakPolarHBondContact OD1-CE 3.33Å; D111-K188 VanDerWaalsContact OD1-CG 3.3Å; D111-K188 WeakPolarHBondContact OD1-CG 3.08Å; D111-K188 IonicContact OD1-NZ 3.64Å; D111-K188 PolarHBondContact OD1-NZ 3.32Å; D111-K188 IonicContact OD2-NZ 2.78Å
112	L	88.7	Confident	91.3	Very high	2 Å²	2	67.8 Å²	67.8	1%	0.01	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	88.7	-173.4	-163.2	79.3	0	0	0	112	I110 K116 R117 F120 L183 V184 N186 T187 I189	I110-L112 PolarHBondContact O-N 3.18Å; L112-K116 HydrophobicContact CD1-CB 4.23Å; L112-R117 HydrophobicContact CD1-CB 4.36Å; L112-R117 HydrophobicContact CD2-CB 3.93Å; L112-R117 HydrophobicContact CD2-CG 4.01Å; L112-R117 HydrophobicContact CG-CB 4Å; L112-F120 HydrophobicContact CD1-CD2 3.89Å; L112-F120 HydrophobicContact CD1-CE2 4.13Å; L112-L183 HydrophobicContact CD1-CD2 4.26Å; L112-L183 HydrophobicContact CD2-CD2 4.02Å; L112-V184 VanDerWaalsContact CD2-O 3.3Å; L112-V184 WeakPolarHBondContact CD2-O 3.47Å; L112-N186 PolarHBondContact O-N 3.26Å; L112-T187 WeakPolarHBondContact CB-O 3.48Å; L112-T187 PolarHBondContact N-O 3.05Å; L112-I189 HydrophobicContact CD1-CD1 4.22Å; L112-I189 HydrophobicContact CD2-CD1 4.2Å
113	D	90	Very high	91.3	Very high	79 Å²	79	66.5 Å²	66.5	42%	0.422	34%	0.337	S	S	.	.			trans	-70.8	163.3	168.8	-55	-51.8	0	0	0	111.4	D111 E115 K116 R117	D111-D113 PolarHBondContact O-N 3.43Å; D113-E115 VanDerWaalsContact C-N 3.31Å; D113-E115 PolarHBondContact O-N 2.82Å; D113-K116 HydrophobicContact CB-CD 4.37Å; D113-K116 HydrophobicContact CB-CG 4.44Å; D113-K116 PolarHBondContact O-N 2.78Å; D113-K116 WeakPolarHBondContact OD2-CE 3.46Å; D113-K116 IonicContact OD2-NZ 3.25Å; D113-K116 PolarHBondContact OD2-NZ 3.16Å; D113-R117 WeakPolarHBondContact O-CB 3.47Å; D113-R117 PolarHBondContact O-N 3.01Å
114	K	90.3	Very high	91.3	Very high	150 Å²	150	59.6 Å²	59.6	65%	0.652	30%	0.303	S	S	*	.	H	α-helix	trans	-55.3	-44.9	178.7	-172.6	-178.6	175.9	-173.4	0	112.3	R117 D118	K114-R117 WeakPolarHBondContact O-CB 3.44Å; K114-R117 PolarHBondContact O-N 2.99Å; K114-D118 PolarHBondContact O-N 3.23Å
115	E	91.3	Very high	91.3	Very high	167 Å²	167	62.3 Å²	62.3	78%	0.78	31%	0.306	S	S	*	.	H	α-helix	trans	-64.4	-43.6	179.1	-64.1	179.8	177.2	0	0	112.3	D113 R117 D118 A119	D113-E115 VanDerWaalsContact C-N 3.31Å; D113-E115 PolarHBondContact O-N 2.82Å; E115-R117 VanDerWaalsContact C-N 3.33Å; E115-R117 PolarHBondContact O-N 3.48Å; E115-D118 PolarHBondContact O-N 2.71Å; E115-A119 PolarHBondContact O-N 3.1Å
116	K	91.2	Very high	91.2	Very high	67 Å²	67	62.1 Å²	62.1	29%	0.291	30%	0.3	S	S	.	.	H	α-helix	trans	-64.5	-39.7	177.5	-67.7	176	-179.7	147.2	0	111.7	P64 D111 L112 D113 A119 F120	P64-K116 HydrophobicContact CB-CB 4.02Å; P64-K116 HydrophobicContact CB-CD 4.06Å; P64-K116 HydrophobicContact CB-CG 3.68Å; P64-K116 HydrophobicContact CG-CB 3.77Å; P64-K116 HydrophobicContact CG-CG 3.99Å; D111-K116 WeakPolarHBondContact O-CD 3.35Å; D111-K116 PolarHBondContact O-NZ 2.79Å; L112-K116 HydrophobicContact CD1-CB 4.23Å; D113-K116 HydrophobicContact CB-CD 4.37Å; D113-K116 HydrophobicContact CB-CG 4.44Å; D113-K116 PolarHBondContact O-N 2.78Å; D113-K116 WeakPolarHBondContact OD2-CE 3.46Å; D113-K116 IonicContact OD2-NZ 3.25Å; D113-K116 PolarHBondContact OD2-NZ 3.16Å; K116-A119 PolarHBondContact O-N 3.45Å; K116-F120 WeakPolarHBondContact O-CD2 3.47Å; K116-F120 PolarHBondContact O-N 2.85Å; K116-F120 VanDerWaalsContact O-N 3.12Å
117	R	90.8	Very high	91.2	Very high	80 Å²	80	64.1 Å²	64.1	30%	0.302	30%	0.304	S	S	.	.	H	α-helix	trans	-59.2	-50.6	173.4	-174.5	-161.5	-179.9	-156	-3.6	110.5	L112 D113 K114 E115 A119 F120 V121 L183	L112-R117 HydrophobicContact CD1-CB 4.36Å; L112-R117 HydrophobicContact CD2-CB 3.93Å; L112-R117 HydrophobicContact CD2-CG 4.01Å; L112-R117 HydrophobicContact CG-CB 4Å; D113-R117 WeakPolarHBondContact O-CB 3.47Å; D113-R117 PolarHBondContact O-N 3.01Å; K114-R117 WeakPolarHBondContact O-CB 3.44Å; K114-R117 PolarHBondContact O-N 2.99Å; E115-R117 VanDerWaalsContact C-N 3.33Å; E115-R117 PolarHBondContact O-N 3.48Å; R117-A119 VanDerWaalsContact C-N 3.27Å; R117-A119 PolarHBondContact O-N 2.86Å; R117-F120 PolarHBondContact O-N 2.85Å; R117-V121 HydrophobicContact CG-CG2 4.29Å; R117-V121 VanDerWaalsContact O-CG2 3.32Å; R117-V121 WeakPolarHBondContact O-CG2 3.48Å; R117-V121 PolarHBondContact O-N 2.88Å; R117-L183 HydrophobicContact CG-CB 4.26Å; R117-L183 PolarHBondContact NE-O 2.75Å; R117-L183 PolarHBondContact NH2-O 3.07Å
118	D	92.3	Very high	91.3	Very high	82 Å²	82	63.2 Å²	63.2	44%	0.439	30%	0.3	S	S	.	.	H	α-helix	trans	-62.3	-36.8	-177.4	-67.4	-18.6	0	0	0	111.2	K114 E115 V121 Y122	K114-D118 PolarHBondContact O-N 3.23Å; E115-D118 PolarHBondContact O-N 2.71Å; D118-V121 PolarHBondContact O-N 3.31Å; D118-Y122 WeakPolarHBondContact O-CB 3.4Å; D118-Y122 PolarHBondContact O-N 3.44Å
119	A	92.2	Very high	91.4	Very high	37 Å²	37	63.7 Å²	63.7	31%	0.306	30%	0.299	S	S	.	.	H	α-helix	trans	-62.3	-46.1	173	0	0	0	0	0	112.9	P64 E115 K116 R117 Y122 A123	P64-A119 HydrophobicContact CG-CB 4.43Å; E115-A119 PolarHBondContact O-N 3.1Å; K116-A119 PolarHBondContact O-N 3.45Å; R117-A119 VanDerWaalsContact C-N 3.27Å; R117-A119 PolarHBondContact O-N 2.86Å; A119-Y122 PolarHBondContact O-N 2.85Å; A119-A123 WeakPolarHBondContact O-CB 3.39Å; A119-A123 PolarHBondContact O-N 3.29Å
120	F	93.4	Very high	91.5	Very high	0 Å²	0	59.4 Å²	59.4	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-66.2	-41.2	175.6	-77.2	-54.5	0	0	0	112.6	L63 P64 F65 I110 L112 K116 R117 Y122 A123 I124 V143 L155 L183	L63-F120 HydrophobicContact CB-CE1 4.41Å; P64-F120 HydrophobicContact CB-CE2 4.43Å; P64-F120 HydrophobicContact CB-CZ 4.48Å; P64-F120 HydrophobicContact CG-CD2 3.96Å; P64-F120 HydrophobicContact CG-CE1 4.29Å; P64-F120 HydrophobicContact CG-CE2 3.56Å; P64-F120 HydrophobicContact CG-CG 4.5Å; P64-F120 HydrophobicContact CG-CZ 3.73Å; F65-F120 HydrophobicContact CD1-CE1 4.16Å; F65-F120 HydrophobicContact CD1-CZ 4.2Å; F65-F120 AromaticContact CE1-CE1 3.83Å; F65-F120 HydrophobicContact CE1-CE1 3.83Å; F65-F120 HydrophobicContact CE1-CZ 4.24Å; F65-F120 HydrophobicContact CE2-CE1 4.24Å; F65-F120 AromaticContact CZ-CE1 3.89Å; F65-F120 HydrophobicContact CZ-CE1 3.89Å; I110-F120 HydrophobicContact CD1-CZ 4.47Å; L112-F120 HydrophobicContact CD1-CD2 3.89Å; L112-F120 HydrophobicContact CD1-CE2 4.13Å; K116-F120 WeakPolarHBondContact O-CD2 3.47Å; K116-F120 PolarHBondContact O-N 2.85Å; K116-F120 VanDerWaalsContact O-N 3.12Å; R117-F120 PolarHBondContact O-N 2.85Å; F120-Y122 VanDerWaalsContact C-N 3.31Å; F120-Y122 PolarHBondContact O-N 2.84Å; F120-A123 WeakPolarHBondContact O-CB 3.29Å; F120-A123 PolarHBondContact O-N 3.1Å; F120-I124 VanDerWaalsContact O-CG1 3.26Å; F120-I124 WeakPolarHBondContact O-CG1 3.33Å; F120-I124 PolarHBondContact O-N 3Å; F120-V143 HydrophobicContact CD1-CG1 4.07Å; F120-V143 HydrophobicContact CE1-CG1 4.49Å; F120-L155 HydrophobicContact CD1-CD1 3.74Å; F120-L155 HydrophobicContact CD2-CD2 4.47Å; F120-L155 HydrophobicContact CE1-CD1 3.89Å; F120-L155 HydrophobicContact CE1-CD2 4.35Å; F120-L155 HydrophobicContact CE2-CD2 4.16Å; F120-L155 HydrophobicContact CG-CD1 4.24Å; F120-L155 HydrophobicContact CZ-CD1 4.47Å; F120-L155 HydrophobicContact CZ-CD2 4.12Å; F120-L183 HydrophobicContact CB-CD1 3.72Å; F120-L183 HydrophobicContact CB-CD2 4.3Å; F120-L183 HydrophobicContact CD2-CD2 4.31Å
121	V	92.4	Very high	91.6	Very high	25 Å²	25	60.1 Å²	60.1	15%	0.152	28%	0.282	C	S	.	.	H	α-helix	trans	-59.9	-44.3	176	168.9	0	0	0	0	110.5	R117 D118 A123 I124 K125 Y153 L183	R117-V121 HydrophobicContact CG-CG2 4.29Å; R117-V121 VanDerWaalsContact O-CG2 3.32Å; R117-V121 WeakPolarHBondContact O-CG2 3.48Å; R117-V121 PolarHBondContact O-N 2.88Å; D118-V121 PolarHBondContact O-N 3.31Å; V121-A123 PolarHBondContact O-N 2.82Å; V121-I124 PolarHBondContact O-N 2.8Å; V121-K125 VanDerWaalsContact O-CB 3.27Å; V121-K125 WeakPolarHBondContact O-CB 3.32Å; V121-K125 PolarHBondContact O-N 2.86Å; V121-Y153 HydrophobicContact CB-CD2 4.3Å; V121-Y153 HydrophobicContact CG1-CD1 4.48Å; V121-Y153 HydrophobicContact CG1-CD2 3.63Å; V121-Y153 HydrophobicContact CG1-CE1 4.41Å; V121-Y153 HydrophobicContact CG1-CE2 3.52Å; V121-Y153 HydrophobicContact CG1-CG 4.12Å; V121-Y153 HydrophobicContact CG2-CD2 3.85Å; V121-Y153 HydrophobicContact CG2-CG 4.15Å; V121-L183 HydrophobicContact CG2-CD1 4.07Å
122	Y	92.1	Very high	91.7	Very high	132 Å²	132	56.6 Å²	56.6	52%	0.518	26%	0.263	S	S	.	.	H	α-helix	trans	-60.3	-44.5	175	178	-95.1	0	0	0	112.2	D118 A119 F120 K125 N126 Y128	D118-Y122 WeakPolarHBondContact O-CB 3.4Å; D118-Y122 PolarHBondContact O-N 3.44Å; A119-Y122 PolarHBondContact O-N 2.85Å; F120-Y122 VanDerWaalsContact C-N 3.31Å; F120-Y122 PolarHBondContact O-N 2.84Å; Y122-K125 PolarHBondContact O-N 2.85Å; Y122-N126 WeakPolarHBondContact CD2-ND2 3.31Å; Y122-N126 WeakPolarHBondContact CE2-ND2 3.48Å; Y122-N126 PolarHBondContact O-N 3.14Å; Y122-N126 VanDerWaalsContact O-N 3.14Å; Y122-N126 PolarHBondContact O-ND2 2.9Å; Y122-Y128 HydrophobicContact CE1-CE2 4.3Å
123	A	92.5	Very high	91.8	Very high	0 Å²	0	57.7 Å²	57.7	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-62.1	-45.6	178.3	0	0	0	0	0	111.8	L63 A119 F120 V121 N126 H127 Y128 V143	L63-A123 HydrophobicContact CD1-CB 4.07Å; L63-A123 HydrophobicContact CD2-CB 3.83Å; A119-A123 WeakPolarHBondContact O-CB 3.39Å; A119-A123 PolarHBondContact O-N 3.29Å; F120-A123 WeakPolarHBondContact O-CB 3.29Å; F120-A123 PolarHBondContact O-N 3.1Å; V121-A123 PolarHBondContact O-N 2.82Å; A123-N126 CarbonylContact O-C 3.49Å; A123-N126 PolarHBondContact O-N 3.13Å; A123-H127 PolarHBondContact O-N 3.42Å; A123-Y128 HydrophobicContact CB-CD1 4.11Å; A123-Y128 HydrophobicContact CB-CD2 4.35Å; A123-Y128 HydrophobicContact CB-CG 3.85Å; A123-Y128 WeakPolarHBondContact O-CB 3.26Å; A123-Y128 VanDerWaalsContact O-CD2 3.31Å; A123-Y128 WeakPolarHBondContact O-CD2 3.19Å; A123-Y128 PolarHBondContact O-N 2.87Å; A123-V143 HydrophobicContact CB-CG1 4.4Å
124	I	92.8	Very high	91.8	Very high	5 Å²	5	53.9 Å²	53.9	3%	0.026	25%	0.247	C	C	.	.	H	α-helix	trans	-66.2	-44.9	179.6	-65.2	164	0	0	0	110.6	F120 V121 N126 H127 V143 A146 Y153 Y154 L183	F120-I124 VanDerWaalsContact O-CG1 3.26Å; F120-I124 WeakPolarHBondContact O-CG1 3.33Å; F120-I124 PolarHBondContact O-N 3Å; V121-I124 PolarHBondContact O-N 2.8Å; I124-N126 PolarHBondContact O-N 2.84Å; I124-H127 PolarHBondContact O-N 3.31Å; I124-V143 HydrophobicContact CG1-CG1 4.38Å; I124-A146 HydrophobicContact CG2-CB 4.21Å; I124-Y153 HydrophobicContact CB-CD1 4.23Å; I124-Y153 HydrophobicContact CG2-CD1 3.81Å; I124-Y154 WeakPolarHBondContact CD1-O 3.43Å; I124-L183 HydrophobicContact CD1-CD1 3.58Å
125	K	90.9	Very high	91.7	Very high	138 Å²	138	46.9 Å²	46.9	60%	0.6	22%	0.217	S	C	*	.	H	α-helix	trans	-58.4	-34	178.3	-175.6	175.6	-179.7	176.6	0	112.7	V121 Y122 Y153	V121-K125 VanDerWaalsContact O-CB 3.27Å; V121-K125 WeakPolarHBondContact O-CB 3.32Å; V121-K125 PolarHBondContact O-N 2.86Å; Y122-K125 PolarHBondContact O-N 2.85Å; K125-Y153 HydrophobicContact CB-CE1 4.38Å
126	N	89.4	Confident	91.5	Very high	37 Å²	37	40 Å²	40	20%	0.198	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.1	15.3	179.3	-66.3	-52	0	0	0	113.5	Y122 A123 I124 Y128	Y122-N126 WeakPolarHBondContact CD2-ND2 3.31Å; Y122-N126 WeakPolarHBondContact CE2-ND2 3.48Å; Y122-N126 PolarHBondContact O-N 3.14Å; Y122-N126 VanDerWaalsContact O-N 3.14Å; Y122-N126 PolarHBondContact O-ND2 2.9Å; A123-N126 CarbonylContact O-C 3.49Å; A123-N126 PolarHBondContact O-N 3.13Å; I124-N126 PolarHBondContact O-N 2.84Å; N126-Y128 HydrophobicContact CB-CD2 3.76Å; N126-Y128 HydrophobicContact CB-CE2 3.61Å; N126-Y128 PolarHBondContact O-N 3.4Å
127	H	91	Very high	91.5	Very high	116 Å²	116	36.8 Å²	36.8	54%	0.537	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	50.8	54.7	-179.7	-60.2	-67.2	0	0	0	113	Y51 A123 I124	Y51-H127 VanDerWaalsContact CB-O 3.25Å; Y51-H127 WeakPolarHBondContact CB-O 3.34Å; Y51-H127 PolarHBondContact N-O 2.77Å; A123-H127 PolarHBondContact O-N 3.42Å; I124-H127 PolarHBondContact O-N 3.31Å
128	Y	93.1	Very high	91.5	Very high	13 Å²	13	33.5 Å²	33.5	5%	0.051	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	134.3	176.8	-86.7	-131.8	0	0	0	111	G49 P50 Y58 L63 Y122 A123 N126 V143	G49-Y128 VanDerWaalsContact O-CA 3.28Å; G49-Y128 WeakPolarHBondContact O-CA 3.34Å; P50-Y128 HydrophobicContact CB-CD2 4.25Å; P50-Y128 HydrophobicContact CB-CE2 3.92Å; P50-Y128 HydrophobicContact CG-CD2 4.4Å; P50-Y128 HydrophobicContact CG-CE2 3.67Å; Y58-Y128 HydrophobicContact CD2-CE1 4.21Å; Y58-Y128 HydrophobicContact CE2-CE1 4.34Å; L63-Y128 HydrophobicContact CD1-CD1 4.41Å; Y122-Y128 HydrophobicContact CE1-CE2 4.3Å; A123-Y128 HydrophobicContact CB-CD1 4.11Å; A123-Y128 HydrophobicContact CB-CD2 4.35Å; A123-Y128 HydrophobicContact CB-CG 3.85Å; A123-Y128 WeakPolarHBondContact O-CB 3.26Å; A123-Y128 VanDerWaalsContact O-CD2 3.31Å; A123-Y128 WeakPolarHBondContact O-CD2 3.19Å; A123-Y128 PolarHBondContact O-N 2.87Å; N126-Y128 HydrophobicContact CB-CD2 3.76Å; N126-Y128 HydrophobicContact CB-CE2 3.61Å; N126-Y128 PolarHBondContact O-N 3.4Å; Y128-V143 PolarHBondContact O-N 3.5Å
129	W	92.7	Very high	91.5	Very high	31 Å²	31	29.9 Å²	29.9	12%	0.117	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	162.2	169.8	65.1	-73.1	0	0	0	108.9	V48 G49 P50 Y51 Q131 W140 G141	V48-W129 CarbonylContact C-O 3.57Å; V48-W129 WeakPolarHBondContact CA-O 3.49Å; G49-W129 PolarHBondContact N-O 2.92Å; G49-W129 PolarHBondContact O-N 2.98Å; G49-W129 PolarHBondContact O-NE1 3.04Å; P50-W129 PolarHBondContact O-NE1 3.41Å; Y51-W129 VanDerWaalsContact CA-CD1 3.44Å; W129-Q131 HydrophobicContact CZ3-CB 3.84Å; W129-Q131 HydrophobicContact CZ3-CG 4.32Å; W129-W140 AromaticContact CE3-CD1 3.54Å; W129-W140 HydrophobicContact CE3-CG 4.44Å; W129-W140 AromaticContact CZ3-CD1 3.23Å; W129-W140 HydrophobicContact CZ3-CG 4.41Å; W129-W140 AromaticContact CZ3-NE1 3.6Å; W129-G141 CarbonylContact C-O 3.28Å; W129-G141 VanDerWaalsContact CA-O 3.24Å; W129-G141 WeakPolarHBondContact CA-O 3.5Å; W129-G141 WeakPolarHBondContact CB-O 3.28Å
130	Y	93.4	Very high	91.5	Very high	4 Å²	4	34.1 Å²	34.1	2%	0.016	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	152.7	176	62.7	-99.4	0	0	0	111	T47 Y60 M132 W140 G141 V143 K159 L175	T47-Y130 CarbonylContact O-C 3.49Å; T47-Y130 VanDerWaalsContact O-CA 3.28Å; T47-Y130 WeakPolarHBondContact O-CA 3.13Å; Y60-Y130 HydrophobicContact CD2-CG 4.42Å; Y60-Y130 HydrophobicContact CE2-CD1 4.35Å; Y60-Y130 AromaticContact CE2-CD2 3.72Å; Y60-Y130 HydrophobicContact CE2-CD2 3.72Å; Y60-Y130 HydrophobicContact CE2-CE2 4.45Å; Y60-Y130 AromaticContact CE2-CG 3.67Å; Y60-Y130 HydrophobicContact CE2-CG 3.67Å; Y130-M132 HydrophobicContact CD2-CG 3.92Å; Y130-M132 HydrophobicContact CD2-SD 4.16Å; Y130-M132 HydrophobicContact CE2-CE 3.85Å; Y130-M132 HydrophobicContact CE2-CG 4.08Å; Y130-M132 HydrophobicContact CE2-SD 3.73Å; Y130-W140 WeakPolarHBondContact O-CA 3.17Å; Y130-G141 WeakPolarHBondContact CD1-O 3.37Å; Y130-G141 PolarHBondContact N-O 2.99Å; Y130-G141 PolarHBondContact O-N 2.97Å; Y130-V143 HydrophobicContact CD1-CG2 4.08Å; Y130-K159 WeakPolarHBondContact OH-CE 3.36Å; Y130-L175 HydrophobicContact CE2-CD2 4.08Å
131	Q	91.9	Very high	91.5	Very high	22 Å²	22	34.4 Å²	34.4	10%	0.103	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	135.5	178.3	-161.5	175.5	18.5	0	0	110.7	N46 T47 W129 Y133 I139	N46-Q131 HydrophobicContact CB-CB 4.41Å; N46-Q131 WeakPolarHBondContact CB-O 3Å; N46-Q131 PolarHBondContact N-O 3.39Å; N46-Q131 PolarHBondContact ND2-OE1 3.45Å; T47-Q131 PolarHBondContact O-N 3.42Å; W129-Q131 HydrophobicContact CZ3-CB 3.84Å; W129-Q131 HydrophobicContact CZ3-CG 4.32Å; Q131-Y133 HydrophobicContact CG-CE2 4.1Å; Q131-Y133 VanDerWaalsContact NE2-CZ 3.34Å; Q131-Y133 PolarHBondContact NE2-OH 3.47Å; Q131-I139 CarbonylContact C-O 3.56Å; Q131-I139 WeakPolarHBondContact CA-O 3.33Å
132	M	92.7	Very high	91.5	Very high	1 Å²	1	38 Å²	38	1%	0.005	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	163.8	171.1	-49.6	177.8	-58.9	0	0	109.2	L43 W44 M45 Y130 I139 L175	L43-M132 HydrophobicContact CD1-CB 3.87Å; L43-M132 HydrophobicContact CD1-CE 4.44Å; L43-M132 HydrophobicContact CD1-SD 4.28Å; L43-M132 HydrophobicContact CD2-SD 4.27Å; W44-M132 CarbonylContact O-C 3.58Å; W44-M132 WeakPolarHBondContact O-CA 3.48Å; W44-M132 WeakPolarHBondContact O-CB 3.29Å; M45-M132 HydrophobicContact CE-CG 4.48Å; M45-M132 HydrophobicContact CE-SD 3.61Å; M45-M132 HydrophobicContact SD-CG 3.57Å; M45-M132 VanDerWaalsContact SD-CG 3.57Å; M45-M132 HydrophobicContact SD-SD 3.43Å; Y130-M132 HydrophobicContact CD2-CG 3.92Å; Y130-M132 HydrophobicContact CD2-SD 4.16Å; Y130-M132 HydrophobicContact CE2-CE 3.85Å; Y130-M132 HydrophobicContact CE2-CG 4.08Å; Y130-M132 HydrophobicContact CE2-SD 3.73Å; M132-I139 HydrophobicContact CB-CB 4.29Å; M132-I139 HydrophobicContact CE-CB 4.22Å; M132-I139 HydrophobicContact CE-CG2 3.73Å; M132-I139 PolarHBondContact N-O 3.4Å; M132-I139 PolarHBondContact O-N 3.01Å; M132-L175 HydrophobicContact CE-CD1 4.22Å; M132-L175 HydrophobicContact CE-CD2 3.67Å; M132-L175 HydrophobicContact CE-CG 4.45Å
133	Y	91	Very high	91.5	Very high	25 Å²	25	31.8 Å²	31.8	10%	0.098	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	140.7	175.6	-71.9	-81.3	0	0	0	110.6	W44 N46 L89 Q131 L137 P138 R321	W44-Y133 PolarHBondContact N-O 2.72Å; W44-Y133 PolarHBondContact O-N 2.88Å; N46-Y133 HydrophobicContact CB-CD2 4.02Å; N46-Y133 HydrophobicContact CB-CE2 4.02Å; L89-Y133 HydrophobicContact CD2-CD2 4.1Å; Q131-Y133 HydrophobicContact CG-CE2 4.1Å; Q131-Y133 VanDerWaalsContact NE2-CZ 3.34Å; Q131-Y133 PolarHBondContact NE2-OH 3.47Å; Y133-L137 WeakPolarHBondContact CA-O 3.49Å; Y133-P138 HydrophobicContact CD1-CB 4.12Å; Y133-P138 HydrophobicContact CE1-CB 3.59Å; Y133-P138 HydrophobicContact CE1-CG 4.45Å; Y133-R321 HydrophobicContact CE1-CG 4.11Å
134	I	90.8	Very high	91.5	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	123	164.7	-63.6	-178.3	0	0	0	105.7	V41 L43 D136 L137 I139 I163 I170 V173	V41-I134 HydrophobicContact CG1-CG2 3.67Å; L43-I134 HydrophobicContact CB-CG1 4.27Å; L43-I134 HydrophobicContact CD1-CD1 3.8Å; L43-I134 HydrophobicContact CD1-CG1 3.41Å; L43-I134 VanDerWaalsContact CD1-CG1 3.41Å; L43-I134 HydrophobicContact CG-CG1 4.44Å; I134-D136 VanDerWaalsContact C-N 3.28Å; I134-D136 PolarHBondContact O-N 3.2Å; I134-L137 PolarHBondContact N-O 3Å; I134-L137 VanDerWaalsContact O-CB 3.29Å; I134-L137 WeakPolarHBondContact O-CB 3.49Å; I134-L137 PolarHBondContact O-N 3.46Å; I134-I139 HydrophobicContact CB-CD1 4.35Å; I134-I139 HydrophobicContact CD1-CD1 3.83Å; I134-I139 HydrophobicContact CG1-CD1 3.76Å; I134-I163 HydrophobicContact CD1-CD1 4.01Å; I134-I170 HydrophobicContact CG2-CD1 4.01Å; I134-V173 HydrophobicContact CB-CG2 4.23Å; I134-V173 HydrophobicContact CD1-CG1 4.09Å; I134-V173 HydrophobicContact CG2-CG2 4.41Å
135	D	88.6	Confident	91.4	Very high	2 Å²	2	37.3 Å²	37.3	1%	0.011	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	51.7	45.3	176.8	-163.2	48.2	0	0	0	113.3	H33 Y35 L137 I170 R207	H33-D135 IonicContact CE1-OD1 3.74Å; H33-D135 IonicContact CG-OD1 2.92Å; H33-D135 IonicContact ND1-OD1 3.61Å; H33-D135 PolarHBondContact ND1-OD1 2.73Å; H33-D135 IonicContact ND1-OD2 2.87Å; Y35-D135 HydrophobicContact CE2-CB 4.48Å; Y35-D135 WeakPolarHBondContact OH-CB 3.4Å; Y35-D135 PolarHBondContact OH-OD1 3.28Å; D135-L137 PolarHBondContact O-N 2.94Å; D135-I170 HydrophobicContact CB-CB 4.27Å; D135-I170 HydrophobicContact CB-CD1 4.1Å; D135-R207 PolarHBondContact O-NH1 3.36Å; D135-R207 IonicContact OD2-NH1 3.69Å; D135-R207 PolarHBondContact OD2-NH1 2.8Å
136	D	87.1	Confident	91.3	Very high	22 Å²	22	32.6 Å²	32.6	12%	0.118	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	63.2	-3.7	-171.8	-65.6	-38.2	0	0	0	117	H33 I134 P138 R321	H33-D136 IonicContact CE1-OD2 3.75Å; H33-D136 PolarHBondContact CE1-OD2 3.28Å; H33-D136 VanDerWaalsContact CE1-OD2 3.25Å; H33-D136 IonicContact NE2-OD2 3.97Å; I134-D136 VanDerWaalsContact C-N 3.28Å; I134-D136 PolarHBondContact O-N 3.2Å; D136-P138 WeakPolarHBondContact O-CD 3.36Å; D136-R321 IonicContact OD1-CZ 3.39Å; D136-R321 IonicContact OD1-NE 3.96Å; D136-R321 PolarHBondContact OD1-NE 3.49Å; D136-R321 IonicContact OD1-NH2 3.47Å; D136-R321 PolarHBondContact OD1-NH2 2.96Å
137	L	90.9	Very high	91.2	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	121.1	178.3	-56.9	174.2	0	0	0	110.6	Y133 I134 D135 I170 V173 R207 F208 Y211	Y133-L137 WeakPolarHBondContact CA-O 3.49Å; I134-L137 PolarHBondContact N-O 3Å; I134-L137 VanDerWaalsContact O-CB 3.29Å; I134-L137 WeakPolarHBondContact O-CB 3.49Å; I134-L137 PolarHBondContact O-N 3.46Å; D135-L137 PolarHBondContact O-N 2.94Å; L137-I170 HydrophobicContact CD1-CG2 4.01Å; L137-V173 HydrophobicContact CB-CG2 4.38Å; L137-V173 HydrophobicContact CD1-CG2 3.92Å; L137-R207 HydrophobicContact CD2-CG 4.09Å; L137-F208 HydrophobicContact CD2-CE1 4.27Å; L137-F208 HydrophobicContact CD2-CE2 4.08Å; L137-F208 HydrophobicContact CD2-CZ 3.94Å; L137-Y211 HydrophobicContact CB-CE2 4.4Å; L137-Y211 HydrophobicContact CD2-CE2 3.95Å
138	P	91	Very high	90.7	Very high	12 Å²	12	37.4 Å²	37.4	8%	0.078	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	136.2	-178.9	29	-33.4	0	0	0	111.7	Y133 D136 W140 Y211	Y133-P138 HydrophobicContact CD1-CB 4.12Å; Y133-P138 HydrophobicContact CE1-CB 3.59Å; Y133-P138 HydrophobicContact CE1-CG 4.45Å; D136-P138 WeakPolarHBondContact O-CD 3.36Å; P138-W140 HydrophobicContact CB-CH2 3.96Å; P138-W140 HydrophobicContact CB-CZ2 3.66Å; P138-W140 HydrophobicContact CG-CH2 3.68Å; P138-W140 HydrophobicContact CG-CZ2 3.85Å; P138-W140 HydrophobicContact CG-CZ3 4.45Å; P138-Y211 HydrophobicContact CG-CD1 3.98Å; P138-Y211 HydrophobicContact CG-CE1 3.92Å; P138-Y211 HydrophobicContact CG-CE2 4.49Å; P138-Y211 HydrophobicContact CG-CG 4.27Å; P138-Y211 VanDerWaalsContact O-CE1 3.24Å; P138-Y211 WeakPolarHBondContact O-CE1 3.06Å; P138-Y211 PolarHBondContact O-OH 2.88Å
139	I	92.9	Very high	90.1	Very high	6 Å²	6	43 Å²	43	3%	0.031	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	130.5	176.5	-53.4	164.5	0	0	0	108.1	L43 Q131 M132 I134 L161 V173 L175	L43-I139 HydrophobicContact CD1-CD1 4.22Å; Q131-I139 CarbonylContact C-O 3.56Å; Q131-I139 WeakPolarHBondContact CA-O 3.33Å; M132-I139 HydrophobicContact CB-CB 4.29Å; M132-I139 HydrophobicContact CE-CB 4.22Å; M132-I139 HydrophobicContact CE-CG2 3.73Å; M132-I139 PolarHBondContact N-O 3.4Å; M132-I139 PolarHBondContact O-N 3.01Å; I134-I139 HydrophobicContact CB-CD1 4.35Å; I134-I139 HydrophobicContact CD1-CD1 3.83Å; I134-I139 HydrophobicContact CG1-CD1 3.76Å; I139-L161 HydrophobicContact CD1-CD2 4.41Å; I139-V173 HydrophobicContact CD1-CB 4.17Å; I139-V173 HydrophobicContact CD1-CG1 3.37Å; I139-V173 HydrophobicContact CG1-CB 4.17Å; I139-V173 HydrophobicContact CG1-CG1 3.77Å; I139-L175 HydrophobicContact CG2-CB 3.36Å; I139-L175 HydrophobicContact CG2-CD2 3.84Å; I139-L175 HydrophobicContact CG2-CG 4.19Å
140	W	91.6	Very high	89.3	Confident	125 Å²	125	43.2 Å²	43.2	47%	0.473	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	137	177.8	-58.6	-68.6	0	0	0	110.9	W129 Y130 P138 Y211	W129-W140 AromaticContact CE3-CD1 3.54Å; W129-W140 HydrophobicContact CE3-CG 4.44Å; W129-W140 AromaticContact CZ3-CD1 3.23Å; W129-W140 HydrophobicContact CZ3-CG 4.41Å; W129-W140 AromaticContact CZ3-NE1 3.6Å; Y130-W140 WeakPolarHBondContact O-CA 3.17Å; P138-W140 HydrophobicContact CB-CH2 3.96Å; P138-W140 HydrophobicContact CB-CZ2 3.66Å; P138-W140 HydrophobicContact CG-CH2 3.68Å; P138-W140 HydrophobicContact CG-CZ2 3.85Å; P138-W140 HydrophobicContact CG-CZ3 4.45Å; W140-Y211 AromaticContact CH2-CD1 3.66Å; W140-Y211 HydrophobicContact CH2-CD1 3.66Å; W140-Y211 HydrophobicContact CH2-CE1 4.15Å; W140-Y211 AromaticContact CZ3-CD1 3.55Å; W140-Y211 HydrophobicContact CZ3-CD1 3.55Å; W140-Y211 AromaticContact CZ3-CE1 3.78Å; W140-Y211 HydrophobicContact CZ3-CE1 3.78Å
141	G	92.5	Very high	88.7	Confident	7 Å²	7	50.5 Å²	50.5	7%	0.072	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	158.2	172.6	0	0	0	0	0	111.4	W129 Y130	W129-G141 CarbonylContact C-O 3.28Å; W129-G141 VanDerWaalsContact CA-O 3.24Å; W129-G141 WeakPolarHBondContact CA-O 3.5Å; W129-G141 WeakPolarHBondContact CB-O 3.28Å; Y130-G141 WeakPolarHBondContact CD1-O 3.37Å; Y130-G141 PolarHBondContact N-O 2.99Å; Y130-G141 PolarHBondContact O-N 2.97Å
142	I	92.9	Very high	88.5	Confident	99 Å²	99	51.8 Å²	51.8	51%	0.508	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	139.9	175.5	-55.5	174.3	0	0	0	107.3	G144	I142-G144 WeakPolarHBondContact CG2-O 3.45Å
143	V	92.7	Very high	88.4	Confident	2 Å²	2	54 Å²	54	1%	0.012	28%	0.276	C	S	.	.			trans	-63.7	-44.7	-178.3	172	0	0	0	0	111.5	L63 F65 F120 A123 I124 Y128 Y130 L155 W156	L63-V143 HydrophobicContact CD1-CG1 4.48Å; L63-V143 HydrophobicContact CD1-CG2 3.86Å; F65-V143 HydrophobicContact CE2-CG2 4.39Å; F65-V143 HydrophobicContact CZ-CG1 4.01Å; F65-V143 HydrophobicContact CZ-CG2 4.22Å; F120-V143 HydrophobicContact CD1-CG1 4.07Å; F120-V143 HydrophobicContact CE1-CG1 4.49Å; A123-V143 HydrophobicContact CB-CG1 4.4Å; I124-V143 HydrophobicContact CG1-CG1 4.38Å; Y128-V143 PolarHBondContact O-N 3.5Å; Y130-V143 HydrophobicContact CD1-CG2 4.08Å; V143-L155 HydrophobicContact CG1-CD1 3.7Å; V143-L155 VanDerWaalsContact O-CD1 3.31Å; V143-L155 WeakPolarHBondContact O-CD1 3.34Å; V143-W156 PolarHBondContact O-N 3.18Å
144	G	92	Very high	88.5	Confident	7 Å²	7	55.2 Å²	55.2	7%	0.072	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-172.1	-174.9	-175	0	0	0	0	0	112.1	I142 Y154 W156	I142-G144 WeakPolarHBondContact CG2-O 3.45Å; G144-Y154 CarbonylContact C-O 3.29Å; G144-Y154 WeakPolarHBondContact CA-O 3.46Å; G144-W156 VanDerWaalsContact CA-CD1 3.5Å
145	E	91.1	Very high	88.6	Confident	114 Å²	114	55.2 Å²	55.2	53%	0.533	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	142	-177.2	-172.1	171.1	-162.9	0	0	109.8	Y154 W156	E145-Y154 PolarHBondContact N-O 3.3Å; E145-Y154 PolarHBondContact O-N 2.97Å; E145-W156 HydrophobicContact CB-CZ2 4.35Å; E145-W156 WeakPolarHBondContact OE2-CZ2 3.44Å
146	A	88.2	Confident	88.9	Confident	40 Å²	40	57.8 Å²	57.8	33%	0.331	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	146.1	171.3	0	0	0	0	0	109.2	I124 Y153	I124-A146 HydrophobicContact CG2-CB 4.21Å; A146-Y153 HydrophobicContact CB-CD1 3.92Å; A146-Y153 HydrophobicContact CB-CE1 4.04Å
147	D	86.3	Confident	89.1	Confident	63 Å²	63	57.4 Å²	57.4	34%	0.337	29%	0.289	S	S	.	.			trans	-62.3	162.5	174.9	-143.5	-22.4	0	0	0	111.9	N149 G150 D152 Y154	D147-N149 PolarHBondContact O-N 3.43Å; D147-N149 VanDerWaalsContact O-N 3.16Å; D147-G150 PolarHBondContact O-N 2.83Å; D147-D152 HydrophobicContact CB-CB 4.09Å; D147-D152 PolarHBondContact N-O 3.16Å; D147-Y154 HydrophobicContact CB-CE2 3.89Å; D147-Y154 PolarHBondContact OD2-OH 2.86Å
148	E	81.4	Confident	89.3	Confident	191 Å²	191	59.1 Å²	59.1	89%	0.893	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.7	-32.9	178.7	-67.4	-173.9	172.8	0	0	112.3	G150	E148-G150 VanDerWaalsContact C-N 3.29Å; E148-G150 PolarHBondContact O-N 3.31Å
149	N	79.9	Confident	89.4	Confident	130 Å²	130	59 Å²	59	70%	0.695	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.5	-14.4	177.6	-63.2	-11.7	0	0	0	113.2	D147 E151	D147-N149 PolarHBondContact O-N 3.43Å; D147-N149 VanDerWaalsContact O-N 3.16Å; N149-E151 PolarHBondContact O-N 2.94Å
150	G	75.6	Confident	89.5	Confident	35 Å²	35	60.6 Å²	60.6	36%	0.361	30%	0.301	S	S	.	.	S	Bend	trans	72.7	2.3	-177.8	0	0	0	0	0	115.8	D147 E148 Y153	D147-G150 PolarHBondContact O-N 2.83Å; E148-G150 VanDerWaalsContact C-N 3.29Å; E148-G150 PolarHBondContact O-N 3.31Å; G150-Y153 PolarHBondContact O-OH 3.3Å
151	E	80.7	Confident	89.7	Confident	157 Å²	157	54.7 Å²	54.7	73%	0.734	28%	0.279	S	S	*	.	S	Bend	trans	-87.3	-35.1	-178.8	-63	-169.9	157.9	0	0	113.1	N149	N149-E151 PolarHBondContact O-N 2.94Å
152	D	88.3	Confident	89.8	Confident	49 Å²	49	56 Å²	56	26%	0.262	28%	0.283	S	S	.	.			trans	-107.2	139.1	-176.4	-78.6	-32.1	0	0	0	111.8	D147 Y154 K182	D147-D152 HydrophobicContact CB-CB 4.09Å; D147-D152 PolarHBondContact N-O 3.16Å; D152-Y154 HydrophobicContact CB-CE2 3.97Å; D152-K182 VanDerWaalsContact CG-CE 3.43Å; D152-K182 WeakPolarHBondContact OD1-CE 3.47Å; D152-K182 IonicContact OD1-NZ 2.65Å; D152-K182 PolarHBondContact OD1-NZ 3.06Å; D152-K182 WeakPolarHBondContact OD2-CE 3.37Å; D152-K182 IonicContact OD2-NZ 2.71Å; D152-K182 PolarHBondContact OD2-NZ 3.25Å
153	Y	91.4	Very high	90	Very high	47 Å²	47	51.2 Å²	51.2	18%	0.184	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	130.9	-178.9	-57.9	-78.8	0	0	0	110.4	V121 I124 K125 A146 G150 L183	V121-Y153 HydrophobicContact CB-CD2 4.3Å; V121-Y153 HydrophobicContact CG1-CD1 4.48Å; V121-Y153 HydrophobicContact CG1-CD2 3.63Å; V121-Y153 HydrophobicContact CG1-CE1 4.41Å; V121-Y153 HydrophobicContact CG1-CE2 3.52Å; V121-Y153 HydrophobicContact CG1-CG 4.12Å; V121-Y153 HydrophobicContact CG2-CD2 3.85Å; V121-Y153 HydrophobicContact CG2-CG 4.15Å; I124-Y153 HydrophobicContact CB-CD1 4.23Å; I124-Y153 HydrophobicContact CG2-CD1 3.81Å; K125-Y153 HydrophobicContact CB-CE1 4.38Å; A146-Y153 HydrophobicContact CB-CD1 3.92Å; A146-Y153 HydrophobicContact CB-CE1 4.04Å; G150-Y153 PolarHBondContact O-OH 3.3Å; Y153-L183 PolarHBondContact O-N 2.75Å
154	Y	92.4	Very high	90	Very high	51 Å²	51	51.4 Å²	51.4	20%	0.2	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	136.7	-178.1	-59.2	-90.2	0	0	0	110.9	I124 G144 E145 D147 D152 V181 K182	I124-Y154 WeakPolarHBondContact CD1-O 3.43Å; G144-Y154 CarbonylContact C-O 3.29Å; G144-Y154 WeakPolarHBondContact CA-O 3.46Å; E145-Y154 PolarHBondContact N-O 3.3Å; E145-Y154 PolarHBondContact O-N 2.97Å; D147-Y154 HydrophobicContact CB-CE2 3.89Å; D147-Y154 PolarHBondContact OD2-OH 2.86Å; D152-Y154 HydrophobicContact CB-CE2 3.97Å; Y154-V181 WeakPolarHBondContact CA-O 3.47Å; Y154-K182 HydrophobicContact CD1-CB 3.95Å; Y154-K182 HydrophobicContact CE1-CB 3.77Å; Y154-K182 HydrophobicContact CE1-CG 4.24Å
155	L	93.1	Very high	90.1	Very high	0 Å²	0	52.7 Å²	52.7	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	140.3	174.4	-172.5	73.2	0	0	0	110	F65 F120 V143 V181 L183 I189 M191	F65-L155 HydrophobicContact CE1-CD1 4.48Å; F120-L155 HydrophobicContact CD1-CD1 3.74Å; F120-L155 HydrophobicContact CD2-CD2 4.47Å; F120-L155 HydrophobicContact CE1-CD1 3.89Å; F120-L155 HydrophobicContact CE1-CD2 4.35Å; F120-L155 HydrophobicContact CE2-CD2 4.16Å; F120-L155 HydrophobicContact CG-CD1 4.24Å; F120-L155 HydrophobicContact CZ-CD1 4.47Å; F120-L155 HydrophobicContact CZ-CD2 4.12Å; V143-L155 HydrophobicContact CG1-CD1 3.7Å; V143-L155 VanDerWaalsContact O-CD1 3.31Å; V143-L155 WeakPolarHBondContact O-CD1 3.34Å; L155-V181 PolarHBondContact N-O 2.88Å; L155-V181 PolarHBondContact O-N 3.35Å; L155-L183 HydrophobicContact CB-CD2 3.99Å; L155-L183 HydrophobicContact CB-CG 4.33Å; L155-L183 HydrophobicContact CD2-CD2 4.45Å; L155-I189 HydrophobicContact CD2-CD1 4.27Å; L155-I189 HydrophobicContact CD2-CG2 4.47Å; L155-M191 HydrophobicContact CD2-CE 4.15Å
156	W	94	Very high	90.3	Very high	57 Å²	57	50 Å²	50	22%	0.216	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	120.1	169.9	-64	116.9	0	0	0	110.3	V143 G144 E145 E178 K180	V143-W156 PolarHBondContact O-N 3.18Å; G144-W156 VanDerWaalsContact CA-CD1 3.5Å; E145-W156 HydrophobicContact CB-CZ2 4.35Å; E145-W156 WeakPolarHBondContact OE2-CZ2 3.44Å; W156-E178 VanDerWaalsContact CE3-C 3.48Å; W156-K180 HydrophobicContact CE3-CB 4.18Å; W156-K180 HydrophobicContact CH2-CB 4.34Å; W156-K180 HydrophobicContact CZ3-CB 3.82Å
157	T	92.8	Very high	90.4	Very high	13 Å²	13	50 Å²	50	8%	0.08	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	-17	-173.9	66.5	0	0	0	0	114.5	E178 G179 V181 I189 Q190 M191 S192	T157-E178 PolarHBondContact N-O 3.42Å; T157-G179 PolarHBondContact N-O 2.99Å; T157-G179 PolarHBondContact OG1-O 2.7Å; T157-V181 HydrophobicContact CG2-CB 3.82Å; T157-V181 HydrophobicContact CG2-CG2 3.52Å; T157-I189 HydrophobicContact CG2-CG2 3.37Å; T157-Q190 WeakPolarHBondContact CB-O 3.38Å; T157-M191 HydrophobicContact CG2-SD 4.02Å; T157-M191 WeakPolarHBondContact O-CA 3.47Å; T157-S192 PolarHBondContact O-N 3.44Å
158	Y	94.2	Very high	90.7	Very high	36 Å²	36	51.1 Å²	51.1	14%	0.141	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	123.7	-179.2	178.1	-122.2	0	0	0	111.3	P104 K160 S177 E178 S192 S194	P104-Y158 HydrophobicContact CB-CE2 4.05Å; P104-Y158 HydrophobicContact CG-CE2 4.48Å; Y158-K160 HydrophobicContact CE1-CB 4.01Å; Y158-S177 WeakPolarHBondContact O-CA 3.24Å; Y158-E178 WeakPolarHBondContact CB-O 3.47Å; Y158-E178 HydrophobicContact CD1-CB 3.96Å; Y158-E178 HydrophobicContact CD1-CG 4.17Å; Y158-E178 PolarHBondContact N-O 3.14Å; Y158-E178 PolarHBondContact O-N 3.43Å; Y158-S192 WeakPolarHBondContact CA-O 3.41Å; Y158-S192 VanDerWaalsContact CD2-OG 3.29Å; Y158-S192 WeakPolarHBondContact CD2-OG 3.25Å; Y158-S194 VanDerWaalsContact OH-CB 3.3Å; Y158-S194 WeakPolarHBondContact OH-CB 3.41Å; Y158-S194 PolarHBondContact OH-OG 3.3Å
159	K	94.3	Very high	91.2	Very high	10 Å²	10	46.7 Å²	46.7	4%	0.043	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	111.4	177.1	-66.1	179.4	-174	174.3	0	110.3	Y60 Y130 L175 S192 Y193 S194	Y60-K159 PolarHBondContact OH-NZ 2.78Å; Y130-K159 WeakPolarHBondContact OH-CE 3.36Å; K159-L175 HydrophobicContact CB-CD1 3.95Å; K159-L175 HydrophobicContact CG-CD1 4.31Å; K159-S192 PolarHBondContact N-O 3.47Å; K159-Y193 CarbonylContact O-C 3.22Å; K159-Y193 VanDerWaalsContact O-CA 3.23Å; K159-Y193 WeakPolarHBondContact O-CA 3.36Å; K159-S194 PolarHBondContact O-N 3.43Å
160	K	95.1	Very high	91.8	Very high	39 Å²	39	40.5 Å²	40.5	17%	0.17	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	111.1	174.8	-177.7	-179	172.2	-146.5	0	109.7	Y158 E162 L175 T176	Y158-K160 HydrophobicContact CE1-CB 4.01Å; K160-E162 WeakPolarHBondContact CE-OE1 3.37Å; K160-E162 IonicContact NZ-OE1 3.8Å; K160-E162 PolarHBondContact NZ-OE1 3.2Å; K160-L175 WeakPolarHBondContact O-CA 3.49Å; K160-T176 PolarHBondContact N-O 3.31Å; K160-T176 PolarHBondContact O-N 3.36Å
161	L	95.4	Very high	92.6	Very high	2 Å²	2	39 Å²	39	1%	0.01	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97	119.4	176.4	-67.4	168.5	0	0	0	109.3	L43 I96 I139 N174 L175 S194 V195 K196	L43-L161 HydrophobicContact CD2-CD1 4.06Å; I96-L161 HydrophobicContact CD1-CD1 4.08Å; I139-L161 HydrophobicContact CD1-CD2 4.41Å; L161-N174 WeakPolarHBondContact CA-O 3.45Å; L161-L175 HydrophobicContact CD2-CB 4.27Å; L161-L175 HydrophobicContact CD2-CD1 3.69Å; L161-L175 HydrophobicContact CG-CD1 4.33Å; L161-S194 PolarHBondContact N-O 3.25Å; L161-V195 HydrophobicContact CB-CG2 4.4Å; L161-V195 HydrophobicContact CD1-CG2 4.38Å; L161-V195 CarbonylContact O-C 3.58Å; L161-V195 WeakPolarHBondContact O-CA 3.29Å; L161-K196 PolarHBondContact O-N 3.45Å
162	E	95.2	Very high	93.1	Very high	33 Å²	33	33.3 Å²	33.3	15%	0.154	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	113.5	170.7	-59	-167.3	161.5	0	0	108.7	K160 V173 N174 K196 K198	K160-E162 WeakPolarHBondContact CE-OE1 3.37Å; K160-E162 IonicContact NZ-OE1 3.8Å; K160-E162 PolarHBondContact NZ-OE1 3.2Å; E162-V173 WeakPolarHBondContact O-CA 3.48Å; E162-N174 HydrophobicContact CB-CB 4.28Å; E162-N174 PolarHBondContact N-O 3.01Å; E162-N174 PolarHBondContact O-N 3.02Å; E162-K196 CarbonylContact C-O 3.59Å; E162-K196 WeakPolarHBondContact CA-O 3.29Å; E162-K198 VanDerWaalsContact CD-NZ 3.25Å; E162-K198 IonicContact OE1-NZ 2.75Å; E162-K198 PolarHBondContact OE1-NZ 3.16Å; E162-K198 IonicContact OE2-NZ 3.57Å; E162-K198 PolarHBondContact OE2-NZ 2.72Å
163	I	95.1	Very high	93.4	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	118.3	-174.8	-52.9	175.1	0	0	0	109.1	I96 I134 I170 D172 V173 V195 K196 W197 K198	I96-I163 HydrophobicContact CG2-CD1 4.35Å; I134-I163 HydrophobicContact CD1-CD1 4.01Å; I163-I170 HydrophobicContact CG2-CG1 4.46Å; I163-I170 HydrophobicContact CG2-CG2 3.65Å; I163-D172 CarbonylContact C-O 3.6Å; I163-D172 WeakPolarHBondContact CA-O 3.4Å; I163-V173 HydrophobicContact CG1-CG1 4.39Å; I163-V173 HydrophobicContact CG2-CG2 4.3Å; I163-V195 HydrophobicContact CD1-CG1 3.72Å; I163-V195 HydrophobicContact CG1-CG1 4.28Å; I163-K196 PolarHBondContact N-O 3.23Å; I163-W197 HydrophobicContact CB-CD2 4.13Å; I163-W197 HydrophobicContact CB-CE3 3.77Å; I163-W197 HydrophobicContact CB-CH2 4.15Å; I163-W197 HydrophobicContact CB-CZ2 4.5Å; I163-W197 HydrophobicContact CB-CZ3 3.8Å; I163-W197 HydrophobicContact CD1-CH2 3.91Å; I163-W197 HydrophobicContact CD1-CZ2 3.8Å; I163-W197 HydrophobicContact CD1-CZ3 4.45Å; I163-W197 HydrophobicContact CG2-CD2 4.45Å; I163-W197 HydrophobicContact CG2-CE3 3.65Å; I163-W197 HydrophobicContact CG2-CH2 3.65Å; I163-W197 HydrophobicContact CG2-CZ2 4.45Å; I163-W197 HydrophobicContact CG2-CZ3 3.21Å; I163-W197 CarbonylContact O-C 3.51Å; I163-W197 WeakPolarHBondContact O-CA 3.43Å; I163-K198 PolarHBondContact O-N 3.06Å
164	G	94.7	Very high	93.5	Very high	5 Å²	5	32 Å²	32	5%	0.052	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	128.8	173.5	0	0	0	0	0	111	V171 D172 K198	G164-V171 WeakPolarHBondContact O-CG2 3.25Å; G164-V171 PolarHBondContact O-N 3.45Å; G164-D172 PolarHBondContact N-O 2.67Å; G164-D172 PolarHBondContact O-N 2.85Å; G164-K198 CarbonylContact C-O 3.43Å; G164-K198 VanDerWaalsContact CA-O 3.25Å; G164-K198 WeakPolarHBondContact CA-O 3.31Å
165	F	94.1	Very high	93.6	Very high	34 Å²	34	31 Å²	31	15%	0.149	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	146.3	174.2	72.7	-85.4	0	0	0	111.7	F98 K99 R169 W197 K198 K199 S200	F98-F165 HydrophobicContact CE2-CB 4Å; F98-F165 HydrophobicContact CZ-CB 4.15Å; K99-F165 HydrophobicContact CD-CD2 4.36Å; K99-F165 HydrophobicContact CD-CE2 4Å; K99-F165 HydrophobicContact CD-CZ 4.29Å; K99-F165 VanDerWaalsContact CE-CE2 3.47Å; K99-F165 HydrophobicContact CG-CD1 4.44Å; K99-F165 HydrophobicContact CG-CD2 4.25Å; K99-F165 HydrophobicContact CG-CE1 4.31Å; K99-F165 HydrophobicContact CG-CE2 4.14Å; K99-F165 HydrophobicContact CG-CG 4.4Å; K99-F165 HydrophobicContact CG-CZ 4.16Å; F165-R169 WeakPolarHBondContact CA-O 3.42Å; F165-W197 HydrophobicContact CB-CE3 4.23Å; F165-W197 HydrophobicContact CB-CZ3 4.36Å; F165-W197 HydrophobicContact CD1-CB 4.16Å; F165-W197 AromaticContact CD1-CE3 3.97Å; F165-W197 HydrophobicContact CD1-CE3 3.97Å; F165-W197 HydrophobicContact CE1-CB 4.09Å; F165-W197 HydrophobicContact CG-CE3 4.44Å; F165-K198 VanDerWaalsContact CD1-O 3.26Å; F165-K198 WeakPolarHBondContact CD1-O 3.32Å; F165-K198 PolarHBondContact N-O 3.17Å; F165-K199 HydrophobicContact CE1-CB 4.38Å; F165-K199 HydrophobicContact CZ-CB 4.13Å; F165-S200 PolarHBondContact O-N 3.25Å
166	N	93.3	Very high	93.6	Very high	59 Å²	59	33.7 Å²	33.7	32%	0.316	17%	0.174	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	110.6	170	-170.8	-3.9	0	0	0	109	N168 R169 V171 S200 V202	N166-N168 PolarHBondContact O-N 2.8Å; N166-N168 VanDerWaalsContact O-N 3.17Å; N166-R169 PolarHBondContact N-O 3.22Å; N166-R169 PolarHBondContact O-N 2.79Å; N166-V171 HydrophobicContact CB-CG1 3.77Å; N166-V171 HydrophobicContact CB-CG2 4.22Å; N166-S200 WeakPolarHBondContact CB-O 3.46Å; N166-V202 PolarHBondContact ND2-O 2.75Å
167	G	90.9	Very high	93.5	Very high	39 Å²	39	32.4 Å²	32.4	40%	0.402	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	63.7	-113.3	-172.9	0	0	0	0	0	112.2	K99	K99-G167 WeakPolarHBondContact CE-O 3.43Å; K99-G167 PolarHBondContact NZ-O 2.9Å
168	N	92.1	Very high	93.5	Very high	86 Å²	86	35.7 Å²	35.7	46%	0.46	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	-109.8	19.5	-179.1	-69.8	2.5	0	0	0	112.3	T34 Y35 K99 N166	T34-N168 WeakPolarHBondContact CA-O 3.04Å; Y35-N168 PolarHBondContact N-O 2.98Å; Y35-N168 WeakPolarHBondContact O-CB 3.45Å; K99-N168 PolarHBondContact NZ-OD1 3.12Å; N166-N168 PolarHBondContact O-N 2.8Å; N166-N168 VanDerWaalsContact O-N 3.17Å
169	R	92.1	Very high	93.1	Very high	98 Å²	98	35.6 Å²	35.6	37%	0.37	20%	0.199	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	148.3	-177.9	-53.1	-161.1	173.5	164.6	-4.4	111.8	H33 T34 F165 N166 F204	H33-R169 WeakPolarHBondContact O-CD 3.35Å; H33-R169 WeakPolarHBondContact O-CG 3.48Å; T34-R169 HydrophobicContact CG2-CG 4.13Å; F165-R169 WeakPolarHBondContact CA-O 3.42Å; N166-R169 PolarHBondContact N-O 3.22Å; N166-R169 PolarHBondContact O-N 2.79Å; R169-F204 HydrophobicContact CB-CD2 3.76Å; R169-F204 HydrophobicContact CB-CE2 4.25Å; R169-F204 HydrophobicContact CG-CD2 4.21Å; R169-F204 VanDerWaalsContact NH1-CD1 3.29Å
170	I	92.5	Very high	92.9	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85	132.4	173.1	-57.9	176.5	0	0	0	108.2	Y35 V41 F98 I134 D135 L137 I163 V173 W197	Y35-I170 HydrophobicContact CD2-CD1 4.23Å; Y35-I170 HydrophobicContact CD2-CG1 4.11Å; Y35-I170 HydrophobicContact CE2-CD1 3.78Å; Y35-I170 HydrophobicContact CE2-CG1 3.92Å; V41-I170 HydrophobicContact CG1-CD1 3.79Å; V41-I170 HydrophobicContact CG2-CD1 4.24Å; F98-I170 HydrophobicContact CD2-CG1 4.28Å; F98-I170 HydrophobicContact CE2-CG1 4.03Å; I134-I170 HydrophobicContact CG2-CD1 4.01Å; D135-I170 HydrophobicContact CB-CB 4.27Å; D135-I170 HydrophobicContact CB-CD1 4.1Å; L137-I170 HydrophobicContact CD1-CG2 4.01Å; I163-I170 HydrophobicContact CG2-CG1 4.46Å; I163-I170 HydrophobicContact CG2-CG2 3.65Å; I170-V173 HydrophobicContact CG2-CG2 4.13Å; I170-W197 HydrophobicContact CD1-CH2 4Å; I170-W197 HydrophobicContact CD1-CZ3 4.33Å; I170-W197 HydrophobicContact CG1-CH2 4.27Å; I170-W197 HydrophobicContact CG1-CZ3 4.1Å
171	V	92.4	Very high	92.7	Very high	3 Å²	3	42.9 Å²	42.9	2%	0.018	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	-21.4	-174.9	-62.4	0	0	0	0	113.8	G164 N166 R207	G164-V171 WeakPolarHBondContact O-CG2 3.25Å; G164-V171 PolarHBondContact O-N 3.45Å; N166-V171 HydrophobicContact CB-CG1 3.77Å; N166-V171 HydrophobicContact CB-CG2 4.22Å; V171-R207 HydrophobicContact CB-CB 4.41Å; V171-R207 WeakPolarHBondContact O-CB 3.48Å
172	D	92.8	Very high	92.5	Very high	39 Å²	39	46.9 Å²	46.9	21%	0.209	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	147.7	178	-174.4	26.8	0	0	0	110.4	I163 G164 N174 K210	I163-D172 CarbonylContact C-O 3.6Å; I163-D172 WeakPolarHBondContact CA-O 3.4Å; G164-D172 PolarHBondContact N-O 2.67Å; G164-D172 PolarHBondContact O-N 2.85Å; D172-N174 PolarHBondContact OD2-ND2 3.14Å; D172-K210 WeakPolarHBondContact OD1-CD 3.43Å; D172-K210 WeakPolarHBondContact OD1-CE 3.19Å; D172-K210 IonicContact OD1-NZ 3.35Å; D172-K210 PolarHBondContact OD1-NZ 3.21Å; D172-K210 IonicContact OD2-NZ 2.67Å
173	V	93.3	Very high	92.2	Very high	4 Å²	4	45.5 Å²	45.5	2%	0.024	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	127.4	170	-172	0	0	0	0	109.8	I134 L137 I139 E162 I163 I170 K210	I134-V173 HydrophobicContact CB-CG2 4.23Å; I134-V173 HydrophobicContact CD1-CG1 4.09Å; I134-V173 HydrophobicContact CG2-CG2 4.41Å; L137-V173 HydrophobicContact CB-CG2 4.38Å; L137-V173 HydrophobicContact CD1-CG2 3.92Å; I139-V173 HydrophobicContact CD1-CB 4.17Å; I139-V173 HydrophobicContact CD1-CG1 3.37Å; I139-V173 HydrophobicContact CG1-CB 4.17Å; I139-V173 HydrophobicContact CG1-CG1 3.77Å; E162-V173 WeakPolarHBondContact O-CA 3.48Å; I163-V173 HydrophobicContact CG1-CG1 4.39Å; I163-V173 HydrophobicContact CG2-CG2 4.3Å; I170-V173 HydrophobicContact CG2-CG2 4.13Å; V173-K210 PolarHBondContact O-NZ 3.35Å
174	N	94	Very high	91.8	Very high	63 Å²	63	48.6 Å²	48.6	34%	0.337	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	136.3	172	-79.3	-45.9	0	0	0	110.3	L161 E162 D172 K210	L161-N174 WeakPolarHBondContact CA-O 3.45Å; E162-N174 HydrophobicContact CB-CB 4.28Å; E162-N174 PolarHBondContact N-O 3.01Å; E162-N174 PolarHBondContact O-N 3.02Å; D172-N174 PolarHBondContact OD2-ND2 3.14Å; N174-K210 WeakPolarHBondContact OD1-CE 3.26Å; N174-K210 PolarHBondContact OD1-NZ 3.05Å
175	L	94.3	Very high	91.4	Very high	30 Å²	30	50.9 Å²	50.9	16%	0.157	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	127.9	170.3	173.8	73	0	0	0	109.3	Y130 M132 I139 K159 K160 L161	Y130-L175 HydrophobicContact CE2-CD2 4.08Å; M132-L175 HydrophobicContact CE-CD1 4.22Å; M132-L175 HydrophobicContact CE-CD2 3.67Å; M132-L175 HydrophobicContact CE-CG 4.45Å; I139-L175 HydrophobicContact CG2-CB 3.36Å; I139-L175 HydrophobicContact CG2-CD2 3.84Å; I139-L175 HydrophobicContact CG2-CG 4.19Å; K159-L175 HydrophobicContact CB-CD1 3.95Å; K159-L175 HydrophobicContact CG-CD1 4.31Å; K160-L175 WeakPolarHBondContact O-CA 3.49Å; L161-L175 HydrophobicContact CD2-CB 4.27Å; L161-L175 HydrophobicContact CD2-CD1 3.69Å; L161-L175 HydrophobicContact CG-CD1 4.33Å
176	T	94	Very high	91	Very high	57 Å²	57	56 Å²	56	35%	0.35	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	124.8	166.5	-48.6	0	0	0	0	108.1	K160 E178	K160-T176 PolarHBondContact N-O 3.31Å; K160-T176 PolarHBondContact O-N 3.36Å; T176-E178 HydrophobicContact CG2-CG 3.97Å
177	S	91.8	Very high	90.9	Very high	31 Å²	31	55.6 Å²	55.6	22%	0.217	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	123.1	176.6	-55.4	0	0	0	0	108.4	Y158	Y158-S177 WeakPolarHBondContact O-CA 3.24Å
178	E	91.6	Very high	90.9	Very high	82 Å²	82	60 Å²	60	38%	0.383	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	-173.5	177.8	-32.1	173.4	165.3	0	0	110	W156 T157 Y158 T176	W156-E178 VanDerWaalsContact CE3-C 3.48Å; T157-E178 PolarHBondContact N-O 3.42Å; Y158-E178 WeakPolarHBondContact CB-O 3.47Å; Y158-E178 HydrophobicContact CD1-CB 3.96Å; Y158-E178 HydrophobicContact CD1-CG 4.17Å; Y158-E178 PolarHBondContact N-O 3.14Å; Y158-E178 PolarHBondContact O-N 3.43Å; T176-E178 HydrophobicContact CG2-CG 3.97Å
179	G	87.3	Confident	90.8	Very high	34 Å²	34	56 Å²	56	35%	0.351	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	71.8	68.3	-179.6	0	0	0	0	0	112.3	T157 V181	T157-G179 PolarHBondContact N-O 2.99Å; T157-G179 PolarHBondContact OG1-O 2.7Å; G179-V181 PolarHBondContact O-N 3.24Å
180	K	89.3	Confident	90.8	Very high	149 Å²	149	56.2 Å²	56.2	65%	0.648	30%	0.299	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.6	121.6	175.7	60.3	179.3	-177.3	176.4	0	110.8	W156	W156-K180 HydrophobicContact CE3-CB 4.18Å; W156-K180 HydrophobicContact CH2-CB 4.34Å; W156-K180 HydrophobicContact CZ3-CB 3.82Å
181	V	91.4	Very high	90.8	Very high	53 Å²	53	56.3 Å²	56.3	32%	0.321	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	129	177	179.4	0	0	0	0	109.7	Y154 L155 T157 G179 I189	Y154-V181 WeakPolarHBondContact CA-O 3.47Å; L155-V181 PolarHBondContact N-O 2.88Å; L155-V181 PolarHBondContact O-N 3.35Å; T157-V181 HydrophobicContact CG2-CB 3.82Å; T157-V181 HydrophobicContact CG2-CG2 3.52Å; G179-V181 PolarHBondContact O-N 3.24Å; V181-I189 HydrophobicContact CG1-CG1 4.41Å
182	K	90.3	Very high	90.9	Very high	86 Å²	86	57.3 Å²	57.3	37%	0.374	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	131.9	179	-175	171.1	174.7	160.7	0	110.5	D152 Y154 V184	D152-K182 VanDerWaalsContact CG-CE 3.43Å; D152-K182 WeakPolarHBondContact OD1-CE 3.47Å; D152-K182 IonicContact OD1-NZ 2.65Å; D152-K182 PolarHBondContact OD1-NZ 3.06Å; D152-K182 WeakPolarHBondContact OD2-CE 3.37Å; D152-K182 IonicContact OD2-NZ 2.71Å; D152-K182 PolarHBondContact OD2-NZ 3.25Å; Y154-K182 HydrophobicContact CD1-CB 3.95Å; Y154-K182 HydrophobicContact CE1-CB 3.77Å; Y154-K182 HydrophobicContact CE1-CG 4.24Å; K182-V184 HydrophobicContact CB-CG2 4.44Å; K182-V184 HydrophobicContact CD-CG2 4.32Å; K182-V184 HydrophobicContact CG-CG2 4.03Å; K182-V184 PolarHBondContact O-N 2.84Å
183	L	88.6	Confident	91	Very high	3 Å²	3	56.5 Å²	56.5	2%	0.016	30%	0.3	C	S	.	.			trans	-77	86.3	179.8	-69.9	172.4	0	0	0	111.6	L112 R117 F120 V121 I124 Y153 L155 I189	L112-L183 HydrophobicContact CD1-CD2 4.26Å; L112-L183 HydrophobicContact CD2-CD2 4.02Å; R117-L183 HydrophobicContact CG-CB 4.26Å; R117-L183 PolarHBondContact NE-O 2.75Å; R117-L183 PolarHBondContact NH2-O 3.07Å; F120-L183 HydrophobicContact CB-CD1 3.72Å; F120-L183 HydrophobicContact CB-CD2 4.3Å; F120-L183 HydrophobicContact CD2-CD2 4.31Å; V121-L183 HydrophobicContact CG2-CD1 4.07Å; I124-L183 HydrophobicContact CD1-CD1 3.58Å; Y153-L183 PolarHBondContact O-N 2.75Å; L155-L183 HydrophobicContact CB-CD2 3.99Å; L155-L183 HydrophobicContact CB-CG 4.33Å; L155-L183 HydrophobicContact CD2-CD2 4.45Å; L183-I189 HydrophobicContact CD2-CD1 3.88Å
184	V	87.8	Confident	91	Very high	65 Å²	65	56.3 Å²	56.3	39%	0.394	30%	0.299	S	S	.	.			trans	-102.8	130.8	175.7	-178	0	0	0	0	109.6	L112 K182 T187	L112-V184 VanDerWaalsContact CD2-O 3.3Å; L112-V184 WeakPolarHBondContact CD2-O 3.47Å; K182-V184 HydrophobicContact CB-CG2 4.44Å; K182-V184 HydrophobicContact CD-CG2 4.32Å; K182-V184 HydrophobicContact CG-CG2 4.03Å; K182-V184 PolarHBondContact O-N 2.84Å; V184-T187 HydrophobicContact CB-CG2 3.83Å; V184-T187 HydrophobicContact CG1-CG2 4Å; V184-T187 WeakPolarHBondContact O-CB 3.11Å; V184-T187 WeakPolarHBondContact O-CG2 3.12Å; V184-T187 PolarHBondContact O-OG1 3.4Å
185	P	84.7	Confident	91.1	Very high	53 Å²	53	53.3 Å²	53.3	34%	0.344	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.4	150.1	-178.5	26.6	-34.5	0	0	0	112.1	T187	P185-T187 VanDerWaalsContact C-N 3.26Å; P185-T187 PolarHBondContact O-N 3.49Å
186	N	87.3	Confident	91.2	Very high	143 Å²	143	56.7 Å²	56.7	77%	0.765	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.5	31	-179.4	-57	-27.2	0	0	0	114	L112	L112-N186 PolarHBondContact O-N 3.26Å
187	T	90.1	Very high	91.3	Very high	49 Å²	49	55 Å²	55	30%	0.301	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	154	172.4	60.8	0	0	0	0	111	L112 V184 P185	L112-T187 WeakPolarHBondContact CB-O 3.48Å; L112-T187 PolarHBondContact N-O 3.05Å; V184-T187 HydrophobicContact CB-CG2 3.83Å; V184-T187 HydrophobicContact CG1-CG2 4Å; V184-T187 WeakPolarHBondContact O-CB 3.11Å; V184-T187 WeakPolarHBondContact O-CG2 3.12Å; V184-T187 PolarHBondContact O-OG1 3.4Å; P185-T187 VanDerWaalsContact C-N 3.26Å; P185-T187 PolarHBondContact O-N 3.49Å
188	K	90.7	Very high	91.4	Very high	133 Å²	133	58.5 Å²	58.5	58%	0.578	30%	0.295	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.9	125.3	171.4	-60.1	-163.3	175.4	-122.3	0	109.2	I110 D111	I110-K188 WeakPolarHBondContact O-CA 3.33Å; D111-K188 VanDerWaalsContact OD1-CD 3.31Å; D111-K188 WeakPolarHBondContact OD1-CD 3.35Å; D111-K188 WeakPolarHBondContact OD1-CE 3.33Å; D111-K188 VanDerWaalsContact OD1-CG 3.3Å; D111-K188 WeakPolarHBondContact OD1-CG 3.08Å; D111-K188 IonicContact OD1-NZ 3.64Å; D111-K188 PolarHBondContact OD1-NZ 3.32Å; D111-K188 IonicContact OD2-NZ 2.78Å
189	I	90.7	Very high	91.5	Very high	2 Å²	2	62.2 Å²	62.2	1%	0.01	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	118.2	178.4	-59.1	-179.7	0	0	0	108.5	E109 I110 L112 L155 T157 V181 L183 M191	E109-I189 WeakPolarHBondContact CA-O 3.31Å; I110-I189 PolarHBondContact N-O 2.85Å; I110-I189 PolarHBondContact O-N 2.91Å; L112-I189 HydrophobicContact CD1-CD1 4.22Å; L112-I189 HydrophobicContact CD2-CD1 4.2Å; L155-I189 HydrophobicContact CD2-CD1 4.27Å; L155-I189 HydrophobicContact CD2-CG2 4.47Å; T157-I189 HydrophobicContact CG2-CG2 3.37Å; V181-I189 HydrophobicContact CG1-CG1 4.41Å; L183-I189 HydrophobicContact CD2-CD1 3.88Å; I189-M191 HydrophobicContact CG2-SD 4.22Å
190	Q	92.3	Very high	91.8	Very high	102 Å²	102	61.8 Å²	61.8	48%	0.477	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	121.6	175.8	-66.3	-171.6	-17.7	0	0	110.1	T106 E109 T157	T106-Q190 HydrophobicContact CG2-CB 3.9Å; T106-Q190 HydrophobicContact CG2-CG 4.29Å; E109-Q190 HydrophobicContact CG-CG 4.07Å; E109-Q190 PolarHBondContact OE1-NE2 3.19Å; T157-Q190 WeakPolarHBondContact CB-O 3.38Å
191	M	92.8	Very high	91.9	Very high	1 Å²	1	61.6 Å²	61.6	1%	0.005	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	126.9	174.6	-60.4	-60.5	-115	0	0	109.5	F65 T106 Y107 C108 I110 L155 T157 I189	F65-M191 HydrophobicContact CD1-CE 3.59Å; F65-M191 HydrophobicContact CE1-CE 3.65Å; T106-M191 WeakPolarHBondContact CA-O 3.47Å; T106-M191 WeakPolarHBondContact CG2-O 3.14Å; Y107-M191 HydrophobicContact CD1-CB 4.3Å; Y107-M191 WeakPolarHBondContact CD1-O 3.35Å; Y107-M191 VanDerWaalsContact CE1-C 3.46Å; Y107-M191 HydrophobicContact CE1-CB 3.58Å; Y107-M191 WeakPolarHBondContact CE1-O 3.41Å; Y107-M191 HydrophobicContact CE2-CB 4.09Å; Y107-M191 VanDerWaalsContact CZ-CB 3.47Å; Y107-M191 PolarHBondContact N-O 2.87Å; Y107-M191 WeakPolarHBondContact OH-CB 3.49Å; C108-M191 PolarHBondContact O-N 3.32Å; I110-M191 HydrophobicContact CD1-CE 3.9Å; I110-M191 HydrophobicContact CD1-CG 3.66Å; I110-M191 HydrophobicContact CD1-SD 4.15Å; I110-M191 HydrophobicContact CG1-CG 4.17Å; L155-M191 HydrophobicContact CD2-CE 4.15Å; T157-M191 HydrophobicContact CG2-SD 4.02Å; T157-M191 WeakPolarHBondContact O-CA 3.47Å; I189-M191 HydrophobicContact CG2-SD 4.22Å
192	S	93.9	Very high	91.8	Very high	24 Å²	24	62 Å²	62	17%	0.168	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	154	-177.8	51.4	0	0	0	0	111.7	A105 T157 Y158 K159	A105-S192 VanDerWaalsContact O-CA 3.26Å; A105-S192 WeakPolarHBondContact O-CA 3.29Å; A105-S192 WeakPolarHBondContact O-CB 3.49Å; T157-S192 PolarHBondContact O-N 3.44Å; Y158-S192 WeakPolarHBondContact CA-O 3.41Å; Y158-S192 VanDerWaalsContact CD2-OG 3.29Å; Y158-S192 WeakPolarHBondContact CD2-OG 3.25Å; K159-S192 PolarHBondContact N-O 3.47Å
193	Y	94.3	Very high	91.8	Very high	22 Å²	22	64.2 Å²	64.2	9%	0.086	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	159.5	176.1	81.6	-67.3	0	0	0	110.7	L94 D95 I96 V102 P104 A105 Y107 K159 V195	L94-Y193 HydrophobicContact CB-CE2 4.11Å; L94-Y193 HydrophobicContact CD1-CD2 3.86Å; L94-Y193 HydrophobicContact CD1-CE2 4.25Å; L94-Y193 HydrophobicContact CD1-CG 4.07Å; L94-Y193 HydrophobicContact CD2-CD1 3.92Å; L94-Y193 HydrophobicContact CD2-CD2 4.39Å; L94-Y193 HydrophobicContact CD2-CE1 3.92Å; L94-Y193 HydrophobicContact CD2-CE2 4.4Å; L94-Y193 HydrophobicContact CD2-CG 4.14Å; L94-Y193 HydrophobicContact CG-CE2 4.49Å; D95-Y193 PolarHBondContact O-OH 3.48Å; I96-Y193 HydrophobicContact CG1-CE2 4.45Å; V102-Y193 HydrophobicContact CB-CE2 4.37Å; V102-Y193 HydrophobicContact CG1-CE1 4.5Å; V102-Y193 HydrophobicContact CG1-CE2 3.89Å; P104-Y193 WeakPolarHBondContact CA-O 3.49Å; A105-Y193 PolarHBondContact N-O 2.95Å; A105-Y193 PolarHBondContact O-N 3.37Å; Y107-Y193 AromaticContact CD1-CD1 3.63Å; Y107-Y193 HydrophobicContact CD1-CD1 3.63Å; Y107-Y193 HydrophobicContact CD1-CE1 4.48Å; Y107-Y193 HydrophobicContact CD1-CG 4.26Å; Y107-Y193 HydrophobicContact CG-CD1 4.11Å; K159-Y193 CarbonylContact O-C 3.22Å; K159-Y193 VanDerWaalsContact O-CA 3.23Å; K159-Y193 WeakPolarHBondContact O-CA 3.36Å; Y193-V195 HydrophobicContact CD2-CG2 4.02Å; Y193-V195 HydrophobicContact CE2-CG2 4.02Å
194	S	94.6	Very high	91.7	Very high	1 Å²	1	66.4 Å²	66.4	1%	0.007	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	147.3	166.7	65.2	0	0	0	0	109.6	V102 Y158 K159 L161	V102-S194 VanDerWaalsContact O-CA 3.31Å; V102-S194 WeakPolarHBondContact O-CA 3.4Å; V102-S194 WeakPolarHBondContact O-CB 3.15Å; Y158-S194 VanDerWaalsContact OH-CB 3.3Å; Y158-S194 WeakPolarHBondContact OH-CB 3.41Å; Y158-S194 PolarHBondContact OH-OG 3.3Å; K159-S194 PolarHBondContact O-N 3.43Å; L161-S194 PolarHBondContact N-O 3.25Å
195	V	95.4	Very high	91.6	Very high	0 Å²	0	70.8 Å²	70.8	0%	0	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	127.8	175.9	-175.2	0	0	0	0	108.3	I96 D101 V102 L161 I163 Y193	I96-V195 HydrophobicContact CD1-CG2 4.1Å; I96-V195 HydrophobicContact CG1-CG2 4.02Å; I96-V195 HydrophobicContact CG2-CG1 4.17Å; I96-V195 HydrophobicContact CG2-CG2 4.22Å; D101-V195 WeakPolarHBondContact CA-O 3.41Å; V102-V195 HydrophobicContact CB-CB 3.99Å; V102-V195 HydrophobicContact CB-CG2 4.17Å; V102-V195 HydrophobicContact CG2-CB 4.11Å; V102-V195 HydrophobicContact CG2-CG2 4.22Å; V102-V195 PolarHBondContact N-O 3.15Å; V102-V195 PolarHBondContact O-N 3.21Å; L161-V195 HydrophobicContact CB-CG2 4.4Å; L161-V195 HydrophobicContact CD1-CG2 4.38Å; L161-V195 CarbonylContact O-C 3.58Å; L161-V195 WeakPolarHBondContact O-CA 3.29Å; I163-V195 HydrophobicContact CD1-CG1 3.72Å; I163-V195 HydrophobicContact CG1-CG1 4.28Å; Y193-V195 HydrophobicContact CD2-CG2 4.02Å; Y193-V195 HydrophobicContact CE2-CG2 4.02Å
196	K	95.9	Very high	91.8	Very high	100 Å²	100	71.6 Å²	71.6	44%	0.435	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	122	172.5	-70.1	-167.5	175.2	-169.7	0	109.8	D101 L161 E162 I163	D101-K196 WeakPolarHBondContact OD1-CA 3.38Å; L161-K196 PolarHBondContact O-N 3.45Å; E162-K196 CarbonylContact C-O 3.59Å; E162-K196 WeakPolarHBondContact CA-O 3.29Å; I163-K196 PolarHBondContact N-O 3.23Å
197	W	95.6	Very high	91.9	Very high	22 Å²	22	65.4 Å²	65.4	8%	0.083	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	132.5	174.5	-67.2	90.7	0	0	0	110.3	V41 I96 K97 F98 D100 D101 I163 F165 I170	V41-W197 HydrophobicContact CG2-CH2 4.11Å; V41-W197 HydrophobicContact CG2-CZ2 4.31Å; I96-W197 HydrophobicContact CG2-CZ2 4.17Å; K97-W197 VanDerWaalsContact O-CZ2 3.29Å; K97-W197 WeakPolarHBondContact O-CZ2 3.46Å; K97-W197 PolarHBondContact O-NE1 3.2Å; K97-W197 VanDerWaalsContact O-NE1 3.08Å; F98-W197 HydrophobicContact CD2-CE3 4.42Å; F98-W197 AromaticContact CD2-CH2 3.58Å; F98-W197 HydrophobicContact CD2-CH2 3.58Å; F98-W197 HydrophobicContact CD2-CZ2 4.4Å; F98-W197 AromaticContact CD2-CZ3 3.58Å; F98-W197 HydrophobicContact CD2-CZ3 3.58Å; F98-W197 HydrophobicContact CE2-CH2 4.25Å; F98-W197 AromaticContact CE2-CZ3 3.78Å; F98-W197 HydrophobicContact CE2-CZ3 3.78Å; F98-W197 HydrophobicContact CG-CH2 4.48Å; D100-W197 VanDerWaalsContact C-CD1 3.45Å; D100-W197 PolarHBondContact O-NE1 3Å; D101-W197 PolarHBondContact OD1-N 2.95Å; I163-W197 HydrophobicContact CB-CD2 4.13Å; I163-W197 HydrophobicContact CB-CE3 3.77Å; I163-W197 HydrophobicContact CB-CH2 4.15Å; I163-W197 HydrophobicContact CB-CZ2 4.5Å; I163-W197 HydrophobicContact CB-CZ3 3.8Å; I163-W197 HydrophobicContact CD1-CH2 3.91Å; I163-W197 HydrophobicContact CD1-CZ2 3.8Å; I163-W197 HydrophobicContact CD1-CZ3 4.45Å; I163-W197 HydrophobicContact CG2-CD2 4.45Å; I163-W197 HydrophobicContact CG2-CE3 3.65Å; I163-W197 HydrophobicContact CG2-CH2 3.65Å; I163-W197 HydrophobicContact CG2-CZ2 4.45Å; I163-W197 HydrophobicContact CG2-CZ3 3.21Å; I163-W197 CarbonylContact O-C 3.51Å; I163-W197 WeakPolarHBondContact O-CA 3.43Å; F165-W197 HydrophobicContact CB-CE3 4.23Å; F165-W197 HydrophobicContact CB-CZ3 4.36Å; F165-W197 HydrophobicContact CD1-CB 4.16Å; F165-W197 AromaticContact CD1-CE3 3.97Å; F165-W197 HydrophobicContact CD1-CE3 3.97Å; F165-W197 HydrophobicContact CE1-CB 4.09Å; F165-W197 HydrophobicContact CG-CE3 4.44Å; I170-W197 HydrophobicContact CD1-CH2 4Å; I170-W197 HydrophobicContact CD1-CZ3 4.33Å; I170-W197 HydrophobicContact CG1-CH2 4.27Å; I170-W197 HydrophobicContact CG1-CZ3 4.1Å
198	K	94.9	Very high	91.8	Very high	104 Å²	104	63.4 Å²	63.4	45%	0.452	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	134.5	175.6	-69.7	-178.7	179	171.6	0	109.4	E162 I163 G164 F165 S200	E162-K198 VanDerWaalsContact CD-NZ 3.25Å; E162-K198 IonicContact OE1-NZ 2.75Å; E162-K198 PolarHBondContact OE1-NZ 3.16Å; E162-K198 IonicContact OE2-NZ 3.57Å; E162-K198 PolarHBondContact OE2-NZ 2.72Å; I163-K198 PolarHBondContact O-N 3.06Å; G164-K198 CarbonylContact C-O 3.43Å; G164-K198 VanDerWaalsContact CA-O 3.25Å; G164-K198 WeakPolarHBondContact CA-O 3.31Å; F165-K198 VanDerWaalsContact CD1-O 3.26Å; F165-K198 WeakPolarHBondContact CD1-O 3.32Å; F165-K198 PolarHBondContact N-O 3.17Å; K198-S200 PolarHBondContact O-N 2.82Å
199	K	94.3	Very high	91.6	Very high	160 Å²	160	61.2 Å²	61.2	70%	0.696	30%	0.295	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.2	129	170.4	-171.4	179.7	177.6	-174.3	0	108.7	F165	F165-K199 HydrophobicContact CE1-CB 4.38Å; F165-K199 HydrophobicContact CZ-CB 4.13Å
200	S	92.1	Very high	91.4	Very high	26 Å²	26	65.8 Å²	65.8	18%	0.182	32%	0.315	C	S	.	.			trans	-121	145.3	176.4	-179.2	0	0	0	0	110	F165 N166 K198 V202	F165-S200 PolarHBondContact O-N 3.25Å; N166-S200 WeakPolarHBondContact CB-O 3.46Å; K198-S200 PolarHBondContact O-N 2.82Å; S200-V202 VanDerWaalsContact C-N 3.34Å; S200-V202 WeakPolarHBondContact OG-CG2 3.26Å; S200-V202 PolarHBondContact OG-N 2.63Å
201	D	91.4	Very high	91.1	Very high	145 Å²	145	62.3 Å²	62.3	78%	0.775	30%	0.298	S	S	*	.			trans	-90.8	-0.4	177.9	-61.5	-42.4	0	0	0	112.6	K203	D201-K203 PolarHBondContact O-N 3.33Å
202	V	90.7	Very high	90.7	Very high	62 Å²	62	63.1 Å²	63.1	38%	0.376	30%	0.302	S	S	.	.			trans	-65.6	131.5	177.4	179.2	0	0	0	0	109.7	N166 S200 D206	N166-V202 PolarHBondContact ND2-O 2.75Å; S200-V202 VanDerWaalsContact C-N 3.34Å; S200-V202 WeakPolarHBondContact OG-CG2 3.26Å; S200-V202 PolarHBondContact OG-N 2.63Å; V202-D206 HydrophobicContact CG1-CB 4.25Å
203	K	90	Very high	90	Very high	132 Å²	132	64.2 Å²	64.2	57%	0.574	31%	0.305	S	S	*	.			trans	-70	153.5	175.8	-66.3	179.5	-179	175.6	0	110.2	D201 E205 D206 R207	D201-K203 PolarHBondContact O-N 3.33Å; K203-E205 VanDerWaalsContact C-N 3.27Å; K203-E205 PolarHBondContact O-N 2.88Å; K203-D206 PolarHBondContact O-N 2.91Å; K203-R207 PolarHBondContact O-N 3.44Å
204	F	86.9	Confident	89.2	Confident	49 Å²	49	67.3 Å²	67.3	22%	0.215	33%	0.329	C	S	.	.	S	Bend	trans	-59.8	-37.1	178.9	-178.9	-99	0	0	0	113.2	H33 R169 D206 R207	H33-F204 HydrophobicContact CB-CE2 3.56Å; H33-F204 HydrophobicContact CB-CZ 3.41Å; H33-F204 VanDerWaalsContact CB-CZ 3.41Å; H33-F204 AromaticContact CD2-CZ 3.64Å; H33-F204 AromaticContact CG-CZ 3.63Å; R169-F204 HydrophobicContact CB-CD2 3.76Å; R169-F204 HydrophobicContact CB-CE2 4.25Å; R169-F204 HydrophobicContact CG-CD2 4.21Å; R169-F204 VanDerWaalsContact NH1-CD1 3.29Å; F204-D206 VanDerWaalsContact C-N 3.33Å; F204-D206 PolarHBondContact O-N 2.88Å; F204-R207 VanDerWaalsContact CE2-CZ 3.49Å; F204-R207 VanDerWaalsContact CE2-NH1 3.25Å; F204-R207 VanDerWaalsContact CZ-CZ 3.44Å; F204-R207 WeakPolarHBondContact O-CB 3.43Å; F204-R207 WeakPolarHBondContact O-CD 3.46Å; F204-R207 WeakPolarHBondContact O-CG 3.37Å; F204-R207 PolarHBondContact O-N 3.2Å
205	E	85.8	Confident	88.4	Confident	157 Å²	157	71.2 Å²	71.2	73%	0.734	36%	0.356	S	S	*	.	G	3₁₀ helix	trans	-63.5	-38.8	178.2	-65.5	167.1	-167.7	0	0	111.7	K203 R207	K203-E205 VanDerWaalsContact C-N 3.27Å; K203-E205 PolarHBondContact O-N 2.88Å; E205-R207 VanDerWaalsContact C-N 3.28Å; E205-R207 PolarHBondContact O-N 2.99Å
206	D	87.9	Confident	87.6	Confident	70 Å²	70	73.2 Å²	73.2	37%	0.374	37%	0.365	S	S	.	.	G	3₁₀ helix	trans	-85.9	5.8	-177.2	-52.8	-36.9	0	0	0	112.7	V202 K203 F204 F208 D209	V202-D206 HydrophobicContact CG1-CB 4.25Å; K203-D206 PolarHBondContact O-N 2.91Å; F204-D206 VanDerWaalsContact C-N 3.33Å; F204-D206 PolarHBondContact O-N 2.88Å; D206-F208 PolarHBondContact O-N 2.93Å; D206-D209 WeakPolarHBondContact O-CB 3.22Å; D206-D209 PolarHBondContact O-N 3.22Å; D206-D209 VanDerWaalsContact O-N 3.16Å
207	R	89	Confident	86.6	Confident	12 Å²	12	68.5 Å²	68.5	5%	0.045	34%	0.344	C	S	.	.	G	3₁₀ helix	trans	-61.5	-30.2	-173.6	75.9	-177.3	-179.1	161.8	-4.2	113.5	H33 D135 L137 V171 K203 F204 E205	H33-R207 PolarHBondContact CE1-NH2 3.12Å; H33-R207 PolarHBondContact NE2-NH2 3.48Å; D135-R207 PolarHBondContact O-NH1 3.36Å; D135-R207 IonicContact OD2-NH1 3.69Å; D135-R207 PolarHBondContact OD2-NH1 2.8Å; L137-R207 HydrophobicContact CD2-CG 4.09Å; V171-R207 HydrophobicContact CB-CB 4.41Å; V171-R207 WeakPolarHBondContact O-CB 3.48Å; K203-R207 PolarHBondContact O-N 3.44Å; F204-R207 VanDerWaalsContact CE2-CZ 3.49Å; F204-R207 VanDerWaalsContact CE2-NH1 3.25Å; F204-R207 VanDerWaalsContact CZ-CZ 3.44Å; F204-R207 WeakPolarHBondContact O-CB 3.43Å; F204-R207 WeakPolarHBondContact O-CD 3.46Å; F204-R207 WeakPolarHBondContact O-CG 3.37Å; F204-R207 PolarHBondContact O-N 3.2Å; E205-R207 VanDerWaalsContact C-N 3.28Å; E205-R207 PolarHBondContact O-N 2.99Å
208	F	88.3	Confident	85.8	Confident	7 Å²	7	72.1 Å²	72.1	3%	0.031	36%	0.362	C	S	.	.	G	3₁₀ helix	trans	-82.6	-12.6	-178.2	-86.8	-83.8	0	0	0	113.8	L137 D206 K210 Y211 L212 Y318 T319	L137-F208 HydrophobicContact CD2-CE1 4.27Å; L137-F208 HydrophobicContact CD2-CE2 4.08Å; L137-F208 HydrophobicContact CD2-CZ 3.94Å; D206-F208 PolarHBondContact O-N 2.93Å; F208-K210 PolarHBondContact O-N 3.2Å; F208-Y211 AromaticContact CD1-CD2 3.85Å; F208-Y211 HydrophobicContact CD1-CD2 3.85Å; F208-Y211 HydrophobicContact CE1-CD2 4.39Å; F208-Y211 PolarHBondContact O-N 3.48Å; F208-L212 PolarHBondContact O-N 2.96Å; F208-Y318 HydrophobicContact CB-CE2 3.98Å; F208-T319 HydrophobicContact CD2-CG2 3.9Å; F208-T319 HydrophobicContact CE2-CG2 4.22Å; F208-T319 WeakPolarHBondContact CE2-O 3.42Å; F208-T319 WeakPolarHBondContact CZ-O 3.18Å
209	D	86.1	Confident	84.9	Confident	88 Å²	88	71.8 Å²	71.8	47%	0.471	36%	0.362	S	S	.	.	G	3₁₀ helix	trans	-56.3	-30.2	-177.8	-77.7	-2.6	0	0	0	113	D206 Y211 L212	D206-D209 WeakPolarHBondContact O-CB 3.22Å; D206-D209 PolarHBondContact O-N 3.22Å; D206-D209 VanDerWaalsContact O-N 3.16Å; D209-Y211 VanDerWaalsContact C-N 3.25Å; D209-Y211 PolarHBondContact O-N 3.44Å; D209-L212 PolarHBondContact O-N 2.86Å
210	K	86.7	Confident	84.4	Confident	97 Å²	97	74.2 Å²	74.2	42%	0.422	37%	0.367	S	S	.	.	G	3₁₀ helix	trans	-60.2	-33.4	174.6	-179.3	-175.4	173.2	-167.6	0	113.3	D172 V173 N174 F208	D172-K210 WeakPolarHBondContact OD1-CD 3.43Å; D172-K210 WeakPolarHBondContact OD1-CE 3.19Å; D172-K210 IonicContact OD1-NZ 3.35Å; D172-K210 PolarHBondContact OD1-NZ 3.21Å; D172-K210 IonicContact OD2-NZ 2.67Å; V173-K210 PolarHBondContact O-NZ 3.35Å; N174-K210 WeakPolarHBondContact OD1-CE 3.26Å; N174-K210 PolarHBondContact OD1-NZ 3.05Å; F208-K210 PolarHBondContact O-N 3.2Å
211	Y	85.8	Confident	84	Confident	30 Å²	30	76.2 Å²	76.2	12%	0.118	37%	0.374	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.7	-17.3	-178.2	-55.9	-69.5	0	0	0	112.5	L137 P138 W140 F208 D209	L137-Y211 HydrophobicContact CB-CE2 4.4Å; L137-Y211 HydrophobicContact CD2-CE2 3.95Å; P138-Y211 HydrophobicContact CG-CD1 3.98Å; P138-Y211 HydrophobicContact CG-CE1 3.92Å; P138-Y211 HydrophobicContact CG-CE2 4.49Å; P138-Y211 HydrophobicContact CG-CG 4.27Å; P138-Y211 VanDerWaalsContact O-CE1 3.24Å; P138-Y211 WeakPolarHBondContact O-CE1 3.06Å; P138-Y211 PolarHBondContact O-OH 2.88Å; W140-Y211 AromaticContact CH2-CD1 3.66Å; W140-Y211 HydrophobicContact CH2-CD1 3.66Å; W140-Y211 HydrophobicContact CH2-CE1 4.15Å; W140-Y211 AromaticContact CZ3-CD1 3.55Å; W140-Y211 HydrophobicContact CZ3-CD1 3.55Å; W140-Y211 AromaticContact CZ3-CE1 3.78Å; W140-Y211 HydrophobicContact CZ3-CE1 3.78Å; F208-Y211 AromaticContact CD1-CD2 3.85Å; F208-Y211 HydrophobicContact CD1-CD2 3.85Å; F208-Y211 HydrophobicContact CE1-CD2 4.39Å; F208-Y211 PolarHBondContact O-N 3.48Å; D209-Y211 VanDerWaalsContact C-N 3.25Å; D209-Y211 PolarHBondContact O-N 3.44Å
212	L	85.2	Confident	83.5	Confident	18 Å²	18	69.3 Å²	69.3	9%	0.094	34%	0.337	C	S	.	.	S	Bend	trans	-73	135.7	172.1	-56.5	-176.8	0	0	0	108.7	F208 D209 P214 Y318 I477 Y479	F208-L212 PolarHBondContact O-N 2.96Å; D209-L212 PolarHBondContact O-N 2.86Å; L212-P214 VanDerWaalsContact C-CD 3.43Å; L212-P214 WeakPolarHBondContact O-CD 3.32Å; L212-Y318 HydrophobicContact CD1-CE2 4.37Å; L212-Y318 HydrophobicContact CD2-CD2 4.34Å; L212-Y318 HydrophobicContact CD2-CE2 4.28Å; L212-I477 HydrophobicContact CD2-CB 3.94Å; L212-I477 HydrophobicContact CD2-CD1 4.48Å; L212-I477 HydrophobicContact CD2-CG2 3.7Å; L212-Y479 HydrophobicContact CB-CD1 4.31Å; L212-Y479 HydrophobicContact CB-CE1 4.39Å; L212-Y479 HydrophobicContact CD1-CD1 4.36Å; L212-Y479 HydrophobicContact CD1-CD2 4.42Å; L212-Y479 HydrophobicContact CD1-CG 4.13Å; L212-Y479 HydrophobicContact CD2-CD1 3.96Å; L212-Y479 HydrophobicContact CD2-CG 4.16Å; L212-Y479 HydrophobicContact CG-CD1 4.43Å
213	D	79	Confident	83.3	Confident	46 Å²	46	74 Å²	74	25%	0.246	35%	0.348	C	S	.	.			trans	-102.1	82.7	178.8	-175.3	-2.2	0	0	0	110.1	S215 F216 F217 K476	D213-S215 PolarHBondContact O-N 3.15Å; D213-S215 WeakPolarHBondContact OD1-CB 3.18Å; D213-S215 PolarHBondContact OD1-N 3.19Å; D213-S215 PolarHBondContact OD1-OG 3.17Å; D213-F216 HydrophobicContact CB-CB 4.23Å; D213-F216 PolarHBondContact O-N 3.38Å; D213-F216 VanDerWaalsContact O-N 3.16Å; D213-F216 PolarHBondContact OD1-N 3.17Å; D213-F216 VanDerWaalsContact OD2-CB 3.29Å; D213-F216 WeakPolarHBondContact OD2-CB 3.05Å; D213-F217 WeakPolarHBondContact O-CD2 3.34Å; D213-F217 PolarHBondContact O-N 2.97Å; D213-F217 VanDerWaalsContact O-N 3.13Å; D213-K476 IonicContact OD2-NZ 3.06Å; D213-K476 PolarHBondContact OD2-NZ 2.85Å
214	P	77.4	Confident	83.1	Confident	88 Å²	88	74 Å²	74	57%	0.571	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.5	-23.1	-178.1	27.8	-37	0	0	0	112.1	L212 F216	L212-P214 VanDerWaalsContact C-CD 3.43Å; L212-P214 WeakPolarHBondContact O-CD 3.32Å; P214-F216 VanDerWaalsContact C-N 3.28Å; P214-F216 PolarHBondContact O-N 3.31Å
215	S	78.8	Confident	82.9	Confident	83 Å²	83	71.7 Å²	71.7	58%	0.58	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.8	-31.2	179.3	82	0	0	0	0	112.1	D213 Q218	D213-S215 PolarHBondContact O-N 3.15Å; D213-S215 WeakPolarHBondContact OD1-CB 3.18Å; D213-S215 PolarHBondContact OD1-N 3.19Å; D213-S215 PolarHBondContact OD1-OG 3.17Å; S215-Q218 WeakPolarHBondContact O-CG 3.44Å; S215-Q218 PolarHBondContact O-NE2 3.49Å; S215-Q218 VanDerWaalsContact O-NE2 3.16Å
216	F	78.9	Confident	82.9	Confident	42 Å²	42	65 Å²	65	18%	0.184	31%	0.308	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.7	-46	178	-178.1	-101.5	0	0	0	112	D213 P214 Q218 Y466 F467 T470 K476	D213-F216 HydrophobicContact CB-CB 4.23Å; D213-F216 PolarHBondContact O-N 3.38Å; D213-F216 VanDerWaalsContact O-N 3.16Å; D213-F216 PolarHBondContact OD1-N 3.17Å; D213-F216 VanDerWaalsContact OD2-CB 3.29Å; D213-F216 WeakPolarHBondContact OD2-CB 3.05Å; P214-F216 VanDerWaalsContact C-N 3.28Å; P214-F216 PolarHBondContact O-N 3.31Å; F216-Q218 PolarHBondContact O-N 3.41Å; F216-Y466 HydrophobicContact CZ-CE1 4.32Å; F216-F467 HydrophobicContact CD1-CD1 4.42Å; F216-F467 AromaticContact CE1-CD1 3.71Å; F216-F467 HydrophobicContact CE1-CD1 3.71Å; F216-F467 HydrophobicContact CE1-CE1 4.11Å; F216-F467 HydrophobicContact CZ-CD1 4.01Å; F216-F467 HydrophobicContact CZ-CE1 4.21Å; F216-T470 VanDerWaalsContact CE1-OG1 3.28Å; F216-T470 WeakPolarHBondContact CE1-OG1 3.46Å; F216-T470 HydrophobicContact CZ-CG2 3.91Å; F216-T470 WeakPolarHBondContact CZ-OG1 3.15Å; F216-K476 HydrophobicContact CB-CD 4.42Å; F216-K476 HydrophobicContact CD1-CD 3.68Å; F216-K476 HydrophobicContact CD2-CD 4.49Å; F216-K476 VanDerWaalsContact CD2-NZ 3.32Å; F216-K476 HydrophobicContact CE1-CD 4.05Å; F216-K476 HydrophobicContact CG-CD 3.94Å
217	F	74.7	Confident	82.9	Confident	1 Å²	1	67.6 Å²	67.6	0%	0.004	32%	0.316	C	S	.	.	S	Bend	trans	-83.9	54.2	177.4	-64.1	-73.9	0	0	0	111.9	D213 H219 H222 F467 S471 K476 I477 Y478 Y479 V480	D213-F217 WeakPolarHBondContact O-CD2 3.34Å; D213-F217 PolarHBondContact O-N 2.97Å; D213-F217 VanDerWaalsContact O-N 3.13Å; F217-H219 PolarHBondContact O-N 3.36Å; F217-H222 AromaticContact CD1-NE2 3.87Å; F217-F467 HydrophobicContact CD1-CD1 4.21Å; F217-F467 HydrophobicContact CE1-CD1 4.28Å; F217-S471 VanDerWaalsContact CZ-OG 3.3Å; F217-S471 WeakPolarHBondContact CZ-OG 3.36Å; F217-K476 HydrophobicContact CE2-CB 4.22Å; F217-K476 HydrophobicContact CZ-CB 4.26Å; F217-I477 VanDerWaalsContact CE2-O 3.23Å; F217-I477 WeakPolarHBondContact CE2-O 3.26Å; F217-Y478 AromaticContact CE1-CD2 3.85Å; F217-Y478 HydrophobicContact CE1-CD2 3.85Å; F217-Y478 HydrophobicContact CE1-CE2 4.34Å; F217-Y478 HydrophobicContact CZ-CD2 4.4Å; F217-Y479 HydrophobicContact CB-CE1 3.64Å; F217-Y479 HydrophobicContact CD2-CD1 4Å; F217-Y479 AromaticContact CD2-CE1 3.5Å; F217-Y479 HydrophobicContact CD2-CE1 3.5Å; F217-Y479 VanDerWaalsContact CD2-CE1 3.5Å; F217-Y479 HydrophobicContact CE2-CD1 4.44Å; F217-Y479 HydrophobicContact CE2-CE1 4.34Å; F217-Y479 HydrophobicContact CG-CD1 4.38Å; F217-Y479 AromaticContact CG-CE1 3.74Å; F217-Y479 HydrophobicContact CG-CE1 3.74Å; F217-V480 HydrophobicContact CB-CG2 4.1Å; F217-V480 HydrophobicContact CD1-CG2 4.31Å; F217-V480 HydrophobicContact CG-CG2 4.32Å
218	Q	77.7	Confident	82.6	Confident	97 Å²	97	70.5 Å²	70.5	45%	0.453	33%	0.333	S	S	.	.			trans	-63.1	112.8	177.5	-62.7	-174.9	3.8	0	0	109.5	S215 F216 R220 I221 H222	S215-Q218 WeakPolarHBondContact O-CG 3.44Å; S215-Q218 PolarHBondContact O-NE2 3.49Å; S215-Q218 VanDerWaalsContact O-NE2 3.16Å; F216-Q218 PolarHBondContact O-N 3.41Å; Q218-R220 PolarHBondContact O-N 2.91Å; Q218-I221 HydrophobicContact CB-CD1 4.09Å; Q218-I221 HydrophobicContact CB-CG1 4.13Å; Q218-I221 PolarHBondContact O-N 3.34Å; Q218-H222 PolarHBondContact O-CD2 3.45Å
219	H	77.4	Confident	82.5	Confident	97 Å²	97	70.5 Å²	70.5	45%	0.449	33%	0.334	S	S	.	.	H	α-helix	trans	-51.1	-26.9	176.4	-65.7	-63.8	0	0	0	113.2	F217 H222 W223 F483	F217-H219 PolarHBondContact O-N 3.36Å; H219-H222 PolarHBondContact O-N 3.42Å; H219-W223 PolarHBondContact O-N 3.41Å; H219-F483 AromaticContact ND1-CE2 3.78Å
220	R	83.2	Confident	82.4	Confident	212 Å²	212	71.3 Å²	71.3	80%	0.8	33%	0.333	S	S	*	.	H	α-helix	trans	-60	-42.3	175	-67.3	-86.3	-77.4	-95.9	-3.2	112.8	Q218 F224	Q218-R220 PolarHBondContact O-N 2.91Å; R220-F224 WeakPolarHBondContact O-CB 3.47Å; R220-F224 PolarHBondContact O-N 2.89Å; R220-F224 VanDerWaalsContact O-N 3.08Å
221	I	82.5	Confident	82.4	Confident	67 Å²	67	71.9 Å²	71.9	34%	0.344	34%	0.339	S	S	.	.	H	α-helix	trans	-71.8	-41	-178.5	-57.1	172.5	0	0	0	109.8	Q218 F224 S225 I463 F467	Q218-I221 HydrophobicContact CB-CD1 4.09Å; Q218-I221 HydrophobicContact CB-CG1 4.13Å; Q218-I221 PolarHBondContact O-N 3.34Å; I221-F224 WeakPolarHBondContact O-CB 3.42Å; I221-F224 PolarHBondContact O-N 2.86Å; I221-S225 WeakPolarHBondContact O-CB 3.3Å; I221-S225 PolarHBondContact O-N 3.47Å; I221-I463 HydrophobicContact CG2-CG2 4.37Å; I221-F467 HydrophobicContact CB-CZ 4.12Å; I221-F467 HydrophobicContact CD1-CZ 4.42Å; I221-F467 HydrophobicContact CG2-CE2 3.8Å; I221-F467 HydrophobicContact CG2-CZ 3.67Å
222	H	82.4	Confident	82.4	Confident	0 Å²	0	73.5 Å²	73.5	0%	0	35%	0.348	C	S	.	.	H	α-helix	trans	-64.4	-41	176.1	-64.2	-76.7	0	0	0	112.4	F217 Q218 H219 F224 S225 I226 E464 F467 F483	F217-H222 AromaticContact CD1-NE2 3.87Å; Q218-H222 PolarHBondContact O-CD2 3.45Å; H219-H222 PolarHBondContact O-N 3.42Å; H222-F224 PolarHBondContact O-N 2.87Å; H222-S225 WeakPolarHBondContact O-CB 3.44Å; H222-S225 PolarHBondContact O-N 2.94Å; H222-I226 WeakPolarHBondContact O-CG1 3.22Å; H222-I226 PolarHBondContact O-N 3.49Å; H222-E464 IonicContact CE1-OE2 2.95Å; H222-E464 PolarHBondContact CE1-OE2 3.25Å; H222-E464 IonicContact CG-OE1 2.66Å; H222-E464 IonicContact ND1-OE1 2.77Å; H222-E464 PolarHBondContact ND1-OE1 2.66Å; H222-E464 IonicContact ND1-OE2 3.14Å; H222-E464 PolarHBondContact ND1-OE2 3.39Å; H222-F467 AromaticContact CE1-CD1 3.99Å; H222-F467 AromaticContact CE1-CD2 3.58Å; H222-F467 AromaticContact CE1-CE2 3.87Å; H222-F467 AromaticContact CE1-CG 3.65Å; H222-F467 AromaticContact ND1-CD2 3.97Å; H222-F483 HydrophobicContact CB-CD1 3.39Å; H222-F483 HydrophobicContact CB-CE1 3.46Å; H222-F483 VanDerWaalsContact CB-CE1 3.46Å; H222-F483 HydrophobicContact CB-CG 4.07Å; H222-F483 HydrophobicContact CB-CZ 4.14Å
223	W	86.6	Confident	82.5	Confident	160 Å²	160	73.2 Å²	73.2	61%	0.606	35%	0.347	S	S	*	.	H	α-helix	trans	-64.2	-39.2	174	-90.6	107.9	0	0	0	112.9	H219 S225 I226 F227 F483	H219-W223 PolarHBondContact O-N 3.41Å; W223-S225 VanDerWaalsContact C-N 3.35Å; W223-I226 PolarHBondContact O-N 2.91Å; W223-F227 WeakPolarHBondContact O-CB 3Å; W223-F227 PolarHBondContact O-N 2.73Å; W223-F483 AromaticContact CD1-CE1 3.88Å; W223-F483 AromaticContact CD1-CZ 3.9Å; W223-F483 HydrophobicContact CD2-CE1 4.47Å; W223-F483 HydrophobicContact CG-CE1 4.21Å; W223-F483 AromaticContact NE1-CE1 3.95Å; W223-F483 AromaticContact NE1-CZ 3.78Å
224	F	85	Confident	83.1	Confident	133 Å²	133	75.7 Å²	75.7	58%	0.583	36%	0.359	S	S	*	.	H	α-helix	trans	-62.4	-43.1	173.9	178.7	-98.8	0	0	0	111.9	R220 I221 H222 F227 N228	R220-F224 WeakPolarHBondContact O-CB 3.47Å; R220-F224 PolarHBondContact O-N 2.89Å; R220-F224 VanDerWaalsContact O-N 3.08Å; I221-F224 WeakPolarHBondContact O-CB 3.42Å; I221-F224 PolarHBondContact O-N 2.86Å; H222-F224 PolarHBondContact O-N 2.87Å; F224-F227 PolarHBondContact O-N 2.91Å; F224-N228 PolarHBondContact O-N 2.74Å
225	S	82.4	Confident	83.6	Confident	1 Å²	1	77.7 Å²	77.7	1%	0.007	36%	0.359	C	S	.	.	H	α-helix	trans	-58.4	-49.6	175.3	171.8	0	0	0	0	112.4	I221 H222 W223 F227 S229 I463 E464	I221-S225 WeakPolarHBondContact O-CB 3.3Å; I221-S225 PolarHBondContact O-N 3.47Å; H222-S225 WeakPolarHBondContact O-CB 3.44Å; H222-S225 PolarHBondContact O-N 2.94Å; W223-S225 VanDerWaalsContact C-N 3.35Å; S225-F227 PolarHBondContact O-N 3.01Å; S225-S229 WeakPolarHBondContact O-CB 3.39Å; S225-S229 PolarHBondContact O-N 3.3Å; S225-S229 VanDerWaalsContact O-N 3.09Å; S225-S229 PolarHBondContact O-OG 3.42Å; S225-I463 WeakPolarHBondContact OG-CB 3.41Å; S225-E464 VanDerWaalsContact CB-OE1 3.31Å; S225-E464 WeakPolarHBondContact CB-OE1 3.47Å; S225-E464 PolarHBondContact OG-OE1 3.41Å
226	I	86.4	Confident	84	Confident	16 Å²	16	74.1 Å²	74.1	8%	0.082	33%	0.333	C	S	.	.	H	α-helix	trans	-61.8	-45.2	176.9	-71.3	179.9	0	0	0	110.6	H222 W223 N228 S229 F230 F483 L486 V487 I490	H222-I226 WeakPolarHBondContact O-CG1 3.22Å; H222-I226 PolarHBondContact O-N 3.49Å; W223-I226 PolarHBondContact O-N 2.91Å; I226-N228 PolarHBondContact O-N 3.06Å; I226-S229 PolarHBondContact O-N 2.94Å; I226-F230 WeakPolarHBondContact O-CB 3.5Å; I226-F230 PolarHBondContact O-N 2.93Å; I226-F483 HydrophobicContact CD1-CB 4.42Å; I226-F483 HydrophobicContact CD1-CD1 3.34Å; I226-F483 HydrophobicContact CD1-CE1 3.98Å; I226-F483 HydrophobicContact CD1-CG 4.25Å; I226-F483 HydrophobicContact CG1-CD1 4.35Å; I226-L486 HydrophobicContact CD1-CB 4.11Å; I226-L486 HydrophobicContact CD1-CD1 3.74Å; I226-V487 HydrophobicContact CG1-CG2 4.39Å; I226-I490 HydrophobicContact CG2-CD1 4.18Å
227	F	87.1	Confident	84.4	Confident	124 Å²	124	74.9 Å²	74.9	54%	0.544	34%	0.341	S	S	.	.	H	α-helix	trans	-62.8	-45.1	-177.8	-174.1	-99	0	0	0	112.2	W223 F224 S225 S229 F230 M231	W223-F227 WeakPolarHBondContact O-CB 3Å; W223-F227 PolarHBondContact O-N 2.73Å; F224-F227 PolarHBondContact O-N 2.91Å; S225-F227 PolarHBondContact O-N 3.01Å; F227-S229 PolarHBondContact O-N 2.88Å; F227-F230 PolarHBondContact O-N 3.2Å; F227-M231 HydrophobicContact CD1-CG 4.3Å; F227-M231 HydrophobicContact CD1-SD 3.97Å; F227-M231 HydrophobicContact CE1-CG 3.97Å; F227-M231 HydrophobicContact CE1-SD 3.39Å; F227-M231 WeakPolarHBondContact CE1-SD 3.3Å; F227-M231 HydrophobicContact CZ-CG 4.24Å; F227-M231 HydrophobicContact CZ-SD 4.02Å; F227-M231 WeakPolarHBondContact O-CG 3.32Å; F227-M231 PolarHBondContact O-N 2.99Å
228	N	83.1	Confident	85.1	Confident	74 Å²	74	76.7 Å²	76.7	40%	0.396	36%	0.36	S	S	.	.	H	α-helix	trans	-59.6	-48	176	-173.7	-17.2	0	0	0	111.2	F224 I226 F230 M231 M232	F224-N228 PolarHBondContact O-N 2.74Å; I226-N228 PolarHBondContact O-N 3.06Å; N228-F230 VanDerWaalsContact C-N 3.29Å; N228-F230 PolarHBondContact O-N 3.18Å; N228-M231 WeakPolarHBondContact O-CB 3.39Å; N228-M231 PolarHBondContact O-N 3.02Å; N228-M232 WeakPolarHBondContact O-CG 3.25Å; N228-M232 PolarHBondContact O-N 3.35Å; N228-M232 VanDerWaalsContact O-N 3.09Å
229	S	85.3	Confident	85.4	Confident	7 Å²	7	74.7 Å²	74.7	5%	0.049	35%	0.353	C	S	.	.	H	α-helix	trans	-66.6	-33.1	179.9	-53.2	0	0	0	0	112.4	S225 I226 F227 M232 V233 S460	S225-S229 WeakPolarHBondContact O-CB 3.39Å; S225-S229 PolarHBondContact O-N 3.3Å; S225-S229 VanDerWaalsContact O-N 3.09Å; S225-S229 PolarHBondContact O-OG 3.42Å; I226-S229 PolarHBondContact O-N 2.94Å; F227-S229 PolarHBondContact O-N 2.88Å; S229-M232 WeakPolarHBondContact O-CB 3.29Å; S229-M232 PolarHBondContact O-N 3.48Å; S229-V233 WeakPolarHBondContact O-CG2 3.43Å; S229-V233 PolarHBondContact O-N 3.34Å; S229-S460 PolarHBondContact OG-O 3.12Å
230	F	85.8	Confident	85.6	Confident	104 Å²	104	71.2 Å²	71.2	46%	0.456	34%	0.338	S	S	.	.	H	α-helix	trans	-68.1	-40.5	173.6	-178.8	-106.5	0	0	0	112.3	I226 F227 N228 M232 V233 I234	I226-F230 WeakPolarHBondContact O-CB 3.5Å; I226-F230 PolarHBondContact O-N 2.93Å; F227-F230 PolarHBondContact O-N 3.2Å; N228-F230 VanDerWaalsContact C-N 3.29Å; N228-F230 PolarHBondContact O-N 3.18Å; F230-M232 VanDerWaalsContact C-N 3.28Å; F230-M232 PolarHBondContact O-N 3.44Å; F230-V233 WeakPolarHBondContact O-CB 3.47Å; F230-V233 PolarHBondContact O-N 3.11Å; F230-V233 VanDerWaalsContact O-N 3.17Å; F230-I234 HydrophobicContact CD1-CD1 3.83Å; F230-I234 HydrophobicContact CE1-CD1 3.33Å; F230-I234 HydrophobicContact CE1-CG1 4.18Å; F230-I234 HydrophobicContact CZ-CD1 3.76Å; F230-I234 HydrophobicContact CZ-CG1 4.21Å; F230-I234 PolarHBondContact O-N 2.92Å
231	M	86.6	Confident	85.5	Confident	110 Å²	110	63.8 Å²	63.8	54%	0.542	32%	0.318	S	S	.	.	H	α-helix	trans	-59.7	-41	172	-69.5	-173.4	79.2	0	0	111.5	F227 N228 V233 I234 F235	F227-M231 HydrophobicContact CD1-CG 4.3Å; F227-M231 HydrophobicContact CD1-SD 3.97Å; F227-M231 HydrophobicContact CE1-CG 3.97Å; F227-M231 HydrophobicContact CE1-SD 3.39Å; F227-M231 WeakPolarHBondContact CE1-SD 3.3Å; F227-M231 HydrophobicContact CZ-CG 4.24Å; F227-M231 HydrophobicContact CZ-SD 4.02Å; F227-M231 WeakPolarHBondContact O-CG 3.32Å; F227-M231 PolarHBondContact O-N 2.99Å; N228-M231 WeakPolarHBondContact O-CB 3.39Å; N228-M231 PolarHBondContact O-N 3.02Å; M231-V233 PolarHBondContact O-N 3.49Å; M231-I234 PolarHBondContact O-N 3.02Å; M231-F235 PolarHBondContact O-N 3.4Å
232	M	85	Confident	85.6	Confident	64 Å²	64	66.7 Å²	66.7	32%	0.315	33%	0.332	S	S	.	.	H	α-helix	trans	-61.8	-40.8	174.4	-68.8	-65.1	-70.9	0	0	112.2	N228 S229 F230 F235 L236 L456	N228-M232 WeakPolarHBondContact O-CG 3.25Å; N228-M232 PolarHBondContact O-N 3.35Å; N228-M232 VanDerWaalsContact O-N 3.09Å; S229-M232 WeakPolarHBondContact O-CB 3.29Å; S229-M232 PolarHBondContact O-N 3.48Å; F230-M232 VanDerWaalsContact C-N 3.28Å; F230-M232 PolarHBondContact O-N 3.44Å; M232-F235 PolarHBondContact O-N 2.87Å; M232-L236 VanDerWaalsContact O-CG 3.32Å; M232-L236 WeakPolarHBondContact O-CG 3.24Å; M232-L236 PolarHBondContact O-N 3.32Å; M232-L456 HydrophobicContact CE-CD2 3.58Å
233	V	88.1	Confident	85.4	Confident	12 Å²	12	68.3 Å²	68.3	7%	0.073	34%	0.34	C	S	.	.	H	α-helix	trans	-59.9	-50	173.7	169.4	0	0	0	0	111.3	S229 F230 M231 F235 L236 V237 I490 I493 V494	S229-V233 WeakPolarHBondContact O-CG2 3.43Å; S229-V233 PolarHBondContact O-N 3.34Å; F230-V233 WeakPolarHBondContact O-CB 3.47Å; F230-V233 PolarHBondContact O-N 3.11Å; F230-V233 VanDerWaalsContact O-N 3.17Å; M231-V233 PolarHBondContact O-N 3.49Å; V233-F235 VanDerWaalsContact C-N 3.27Å; V233-F235 PolarHBondContact O-N 2.84Å; V233-L236 PolarHBondContact O-N 3.47Å; V233-V237 HydrophobicContact CG1-CG2 4.05Å; V233-V237 WeakPolarHBondContact O-CB 3.31Å; V233-V237 WeakPolarHBondContact O-CG2 3.47Å; V233-V237 PolarHBondContact O-N 2.81Å; V233-I490 HydrophobicContact CG2-CG2 3.83Å; V233-I493 HydrophobicContact CG1-CB 4.42Å; V233-I493 HydrophobicContact CG1-CG2 3.61Å; V233-V494 HydrophobicContact CG2-CG2 3.38Å
234	I	89.7	Confident	84.8	Confident	97 Å²	97	63.7 Å²	63.7	50%	0.497	33%	0.327	S	S	.	.	H	α-helix	trans	-57.4	-45.2	179.6	-70.5	171	0	0	0	110.3	F230 M231 L236 G238	F230-I234 HydrophobicContact CD1-CD1 3.83Å; F230-I234 HydrophobicContact CE1-CD1 3.33Å; F230-I234 HydrophobicContact CE1-CG1 4.18Å; F230-I234 HydrophobicContact CZ-CD1 3.76Å; F230-I234 HydrophobicContact CZ-CG1 4.21Å; F230-I234 PolarHBondContact O-N 2.92Å; M231-I234 PolarHBondContact O-N 3.02Å; I234-L236 PolarHBondContact O-N 2.68Å; I234-G238 PolarHBondContact O-N 3.33Å
235	F	88.8	Confident	84.5	Confident	130 Å²	130	62.5 Å²	62.5	57%	0.57	33%	0.325	S	S	*	.	H	α-helix	trans	-60.7	-46.2	178.3	177.4	-102.3	0	0	0	112	M231 M232 V233 G238 L239	M231-F235 PolarHBondContact O-N 3.4Å; M232-F235 PolarHBondContact O-N 2.87Å; V233-F235 VanDerWaalsContact C-N 3.27Å; V233-F235 PolarHBondContact O-N 2.84Å; F235-G238 PolarHBondContact O-N 2.66Å; F235-L239 HydrophobicContact CE1-CD1 4.26Å; F235-L239 HydrophobicContact CZ-CD1 4.39Å; F235-L239 WeakPolarHBondContact O-CB 3.47Å; F235-L239 PolarHBondContact O-N 3.23Å
236	L	87.4	Confident	84.3	Confident	8 Å²	8	71.2 Å²	71.2	4%	0.042	36%	0.357	C	S	.	.	H	α-helix	trans	-71	-40.6	-178.5	-69.5	170.9	0	0	0	113.1	M232 V233 I234 G238 L239 V240 L456 V494 C497 V498	M232-L236 VanDerWaalsContact O-CG 3.32Å; M232-L236 WeakPolarHBondContact O-CG 3.24Å; M232-L236 PolarHBondContact O-N 3.32Å; V233-L236 PolarHBondContact O-N 3.47Å; I234-L236 PolarHBondContact O-N 2.68Å; L236-G238 VanDerWaalsContact C-N 3.29Å; L236-G238 PolarHBondContact O-N 3.3Å; L236-L239 PolarHBondContact O-N 3.36Å; L236-V240 WeakPolarHBondContact O-CG2 3.18Å; L236-V240 PolarHBondContact O-N 3.48Å; L236-L456 HydrophobicContact CD1-CB 4.44Å; L236-L456 HydrophobicContact CD1-CD1 4.3Å; L236-L456 HydrophobicContact CD2-CD1 3.76Å; L236-V494 HydrophobicContact CD1-CG1 3.82Å; L236-C497 HydrophobicContact CB-CB 4.09Å; L236-V498 HydrophobicContact CD1-CG2 3.87Å; L236-V498 HydrophobicContact CD2-CG2 4.42Å
237	V	87.3	Confident	83.4	Confident	59 Å²	59	71.3 Å²	71.3	36%	0.358	36%	0.359	S	S	.	.	H	α-helix	trans	-62.7	-41.3	172.6	172.7	0	0	0	0	109.9	V233 V240 S241 I493	V233-V237 HydrophobicContact CG1-CG2 4.05Å; V233-V237 WeakPolarHBondContact O-CB 3.31Å; V233-V237 WeakPolarHBondContact O-CG2 3.47Å; V233-V237 PolarHBondContact O-N 2.81Å; V237-V240 PolarHBondContact O-N 3.3Å; V237-S241 WeakPolarHBondContact O-CB 3.44Å; V237-S241 PolarHBondContact O-N 3.41Å; V237-S241 PolarHBondContact O-OG 3.03Å; V237-I493 HydrophobicContact CG2-CG2 4.12Å
238	G	88.3	Confident	82.6	Confident	39 Å²	39	68.2 Å²	68.2	40%	0.402	35%	0.348	S	S	.	.	H	α-helix	trans	-59.6	-44.3	173.2	0	0	0	0	0	112.3	I234 F235 L236 S241 M242	I234-G238 PolarHBondContact O-N 3.33Å; F235-G238 PolarHBondContact O-N 2.66Å; L236-G238 VanDerWaalsContact C-N 3.29Å; L236-G238 PolarHBondContact O-N 3.3Å; G238-S241 PolarHBondContact O-N 3.13Å; G238-M242 VanDerWaalsContact O-CB 3.27Å; G238-M242 WeakPolarHBondContact O-CB 3.47Å; G238-M242 PolarHBondContact O-N 2.81Å
239	L	84.1	Confident	82.3	Confident	55 Å²	55	73.1 Å²	73.1	29%	0.288	36%	0.361	S	S	.	.	H	α-helix	trans	-64.9	-47.8	176.8	-175	156.5	0	0	0	111.8	F235 L236 S241 M242 I243 V501	F235-L239 HydrophobicContact CE1-CD1 4.26Å; F235-L239 HydrophobicContact CZ-CD1 4.39Å; F235-L239 WeakPolarHBondContact O-CB 3.47Å; F235-L239 PolarHBondContact O-N 3.23Å; L236-L239 PolarHBondContact O-N 3.36Å; L239-S241 VanDerWaalsContact C-N 3.33Å; L239-S241 PolarHBondContact O-N 3.21Å; L239-M242 PolarHBondContact O-N 3.29Å; L239-I243 HydrophobicContact CD2-CD1 3.46Å; L239-I243 VanDerWaalsContact CD2-CD1 3.46Å; L239-I243 HydrophobicContact CD2-CG1 4.2Å; L239-I243 WeakPolarHBondContact O-CG1 3.15Å; L239-I243 PolarHBondContact O-N 3.05Å; L239-V501 HydrophobicContact CD2-CG1 4.23Å; L239-V501 HydrophobicContact CD2-CG2 3.58Å
240	V	81.6	Confident	81.5	Confident	23 Å²	23	80.4 Å²	80.4	14%	0.139	39%	0.392	C	S	.	.	H	α-helix	trans	-60.5	-44.4	175.9	171.3	0	0	0	0	110.7	L236 V237 M242 I243 L244 C497 I500 V501	L236-V240 WeakPolarHBondContact O-CG2 3.18Å; L236-V240 PolarHBondContact O-N 3.48Å; V237-V240 PolarHBondContact O-N 3.3Å; V240-M242 VanDerWaalsContact C-N 3.35Å; V240-M242 PolarHBondContact O-N 2.95Å; V240-I243 PolarHBondContact O-N 3.29Å; V240-L244 WeakPolarHBondContact O-CB 3.23Å; V240-L244 PolarHBondContact O-N 3.1Å; V240-C497 HydrophobicContact CG2-CB 4.01Å; V240-I500 HydrophobicContact CG1-CG2 4.09Å; V240-V501 HydrophobicContact CG2-CG2 3.52Å
241	S	83	Confident	80.4	Confident	56 Å²	56	76.9 Å²	76.9	39%	0.392	38%	0.378	S	S	.	.	H	α-helix	trans	-64.2	-40.5	177.9	-58.7	0	0	0	0	111.3	V237 G238 L239 L244 M245	V237-S241 WeakPolarHBondContact O-CB 3.44Å; V237-S241 PolarHBondContact O-N 3.41Å; V237-S241 PolarHBondContact O-OG 3.03Å; G238-S241 PolarHBondContact O-N 3.13Å; L239-S241 VanDerWaalsContact C-N 3.33Å; L239-S241 PolarHBondContact O-N 3.21Å; S241-L244 PolarHBondContact O-N 2.84Å; S241-M245 WeakPolarHBondContact O-CB 3.5Å; S241-M245 WeakPolarHBondContact O-CG 3.37Å; S241-M245 PolarHBondContact O-N 3.38Å
242	M	84	Confident	79.5	Confident	128 Å²	128	80 Å²	80	63%	0.631	38%	0.384	S	S	*	.	H	α-helix	trans	-63.9	-44.1	174.6	-178	-171.7	179.3	0	0	111.4	G238 L239 V240 M245 R246	G238-M242 VanDerWaalsContact O-CB 3.27Å; G238-M242 WeakPolarHBondContact O-CB 3.47Å; G238-M242 PolarHBondContact O-N 2.81Å; L239-M242 PolarHBondContact O-N 3.29Å; V240-M242 VanDerWaalsContact C-N 3.35Å; V240-M242 PolarHBondContact O-N 2.95Å; M242-M245 PolarHBondContact O-N 3.32Å; M242-R246 WeakPolarHBondContact O-CB 3.05Å; M242-R246 PolarHBondContact O-N 2.95Å
243	I	78.6	Confident	78.7	Confident	34 Å²	34	79.5 Å²	79.5	17%	0.174	39%	0.39	C	S	.	.	H	α-helix	trans	-59.1	-52.4	175.2	-72.1	176.1	0	0	0	109.5	L239 V240 M245 R246 T247 V501 Y504	L239-I243 HydrophobicContact CD2-CD1 3.46Å; L239-I243 VanDerWaalsContact CD2-CD1 3.46Å; L239-I243 HydrophobicContact CD2-CG1 4.2Å; L239-I243 WeakPolarHBondContact O-CG1 3.15Å; L239-I243 PolarHBondContact O-N 3.05Å; V240-I243 PolarHBondContact O-N 3.29Å; I243-M245 PolarHBondContact O-N 3.36Å; I243-R246 PolarHBondContact O-N 2.95Å; I243-T247 HydrophobicContact CG2-CG2 4.5Å; I243-T247 WeakPolarHBondContact O-CG2 3.32Å; I243-T247 PolarHBondContact O-N 2.92Å; I243-T247 PolarHBondContact O-OG1 3.11Å; I243-T247 VanDerWaalsContact O-OG1 3.09Å; I243-V501 HydrophobicContact CD1-CG1 4.39Å; I243-V501 HydrophobicContact CD1-CG2 4.34Å; I243-Y504 HydrophobicContact CD1-CD1 4.43Å; I243-Y504 HydrophobicContact CG2-CD1 3.46Å; I243-Y504 VanDerWaalsContact CG2-CD1 3.46Å; I243-Y504 HydrophobicContact CG2-CD2 4.4Å; I243-Y504 HydrophobicContact CG2-CE1 3.34Å; I243-Y504 HydrophobicContact CG2-CE2 4.33Å; I243-Y504 HydrophobicContact CG2-CG 4.01Å
244	L	74.3	Confident	77.5	Confident	64 Å²	64	83.1 Å²	83.1	34%	0.335	40%	0.403	S	S	.	.	H	α-helix	trans	-60.4	-43.1	-179.9	-176.8	65.2	0	0	0	111.9	V240 S241 T247 L248 F578	V240-L244 WeakPolarHBondContact O-CB 3.23Å; V240-L244 PolarHBondContact O-N 3.1Å; S241-L244 PolarHBondContact O-N 2.84Å; L244-T247 WeakPolarHBondContact CA-OG1 3.41Å; L244-T247 PolarHBondContact O-N 3.33Å; L244-T247 PolarHBondContact O-OG1 2.97Å; L244-L248 HydrophobicContact CD1-CD1 4Å; L244-L248 HydrophobicContact CD1-CG 4.19Å; L244-L248 HydrophobicContact CG-CD1 3.86Å; L244-L248 HydrophobicContact CG-CG 4.4Å; L244-L248 VanDerWaalsContact O-CB 3.27Å; L244-L248 WeakPolarHBondContact O-CB 3.43Å; L244-L248 WeakPolarHBondContact O-CG 3.45Å; L244-L248 PolarHBondContact O-N 3.07Å; L244-F578 HydrophobicContact CD1-CE2 4.31Å
245	M	77.6	Confident	76	Confident	107 Å²	107	82.5 Å²	82.5	53%	0.527	40%	0.395	S	S	.	.	H	α-helix	trans	-66.2	-39.4	176.6	-76.7	-66.4	-70	0	0	111.9	S241 M242 I243 R249	S241-M245 WeakPolarHBondContact O-CB 3.5Å; S241-M245 WeakPolarHBondContact O-CG 3.37Å; S241-M245 PolarHBondContact O-N 3.38Å; M242-M245 PolarHBondContact O-N 3.32Å; I243-M245 PolarHBondContact O-N 3.36Å; M245-R249 WeakPolarHBondContact O-CB 3.43Å; M245-R249 PolarHBondContact O-N 3.38Å
246	R	78.7	Confident	74.9	Confident	184 Å²	184	79.2 Å²	79.2	69%	0.694	39%	0.388	S	S	*	.	H	α-helix	trans	-67.2	-42.6	177.5	-175.8	179.1	-179.5	-176.8	0.8	111.1	M242 I243 K250	M242-R246 WeakPolarHBondContact O-CB 3.05Å; M242-R246 PolarHBondContact O-N 2.95Å; I243-R246 PolarHBondContact O-N 2.95Å; R246-K250 VanDerWaalsContact O-CB 3.24Å; R246-K250 WeakPolarHBondContact O-CB 3.45Å; R246-K250 PolarHBondContact O-N 3.48Å
247	T	67.9	Low	73.7	Confident	19 Å²	19	85.2 Å²	85.2	12%	0.117	41%	0.414	C	S	.	.	H	α-helix	trans	-65.1	-51.2	176.2	48.6	0	0	0	0	111.1	I243 L244 R249 K250 D251 Y504	I243-T247 HydrophobicContact CG2-CG2 4.5Å; I243-T247 WeakPolarHBondContact O-CG2 3.32Å; I243-T247 PolarHBondContact O-N 2.92Å; I243-T247 PolarHBondContact O-OG1 3.11Å; I243-T247 VanDerWaalsContact O-OG1 3.09Å; L244-T247 WeakPolarHBondContact CA-OG1 3.41Å; L244-T247 PolarHBondContact O-N 3.33Å; L244-T247 PolarHBondContact O-OG1 2.97Å; T247-R249 VanDerWaalsContact C-N 3.34Å; T247-R249 PolarHBondContact O-N 2.97Å; T247-K250 PolarHBondContact O-N 3.04Å; T247-D251 WeakPolarHBondContact O-CB 3.39Å; T247-D251 PolarHBondContact O-N 3.01Å; T247-Y504 HydrophobicContact CG2-CE1 4.39Å; T247-Y504 HydrophobicContact CG2-CE2 3.6Å; T247-Y504 WeakPolarHBondContact CG2-OH 3.4Å
248	L	70.2	Confident	72.2	Confident	59 Å²	59	85.6 Å²	85.6	31%	0.309	41%	0.412	S	S	.	.	H	α-helix	trans	-60.7	-43.3	-179.8	-70	173.7	0	0	0	111.3	L244 D251 Y252	L244-L248 HydrophobicContact CD1-CD1 4Å; L244-L248 HydrophobicContact CD1-CG 4.19Å; L244-L248 HydrophobicContact CG-CD1 3.86Å; L244-L248 HydrophobicContact CG-CG 4.4Å; L244-L248 VanDerWaalsContact O-CB 3.27Å; L244-L248 WeakPolarHBondContact O-CB 3.43Å; L244-L248 WeakPolarHBondContact O-CG 3.45Å; L244-L248 PolarHBondContact O-N 3.07Å; L248-D251 PolarHBondContact O-N 3.45Å; L248-Y252 WeakPolarHBondContact O-CD2 3.48Å; L248-Y252 PolarHBondContact O-N 2.99Å
249	R	75.8	Confident	70.7	Confident	177 Å²	177	92.3 Å²	92.3	67%	0.668	43%	0.433	S	S	*	.	H	α-helix	trans	-66.9	-42.4	178.4	-170	-173.5	-60.4	-145.7	0.3	112.5	M245 T247 D251 Y252 A253	M245-R249 WeakPolarHBondContact O-CB 3.43Å; M245-R249 PolarHBondContact O-N 3.38Å; T247-R249 VanDerWaalsContact C-N 3.34Å; T247-R249 PolarHBondContact O-N 2.97Å; R249-D251 PolarHBondContact O-N 3.46Å; R249-Y252 PolarHBondContact O-N 3.44Å; R249-A253 WeakPolarHBondContact O-CB 3.49Å; R249-A253 PolarHBondContact O-N 3.27Å
250	K	68.6	Low	69.6	Low	160 Å²	160	97.6 Å²	97.6	70%	0.696	46%	0.456	S	S	*	.	H	α-helix	trans	-64.1	-35.5	176.8	-169.9	-179.7	178.7	-171.7	0	110.9	R246 T247 R254	R246-K250 VanDerWaalsContact O-CB 3.24Å; R246-K250 WeakPolarHBondContact O-CB 3.45Å; R246-K250 PolarHBondContact O-N 3.48Å; T247-K250 PolarHBondContact O-N 3.04Å; K250-R254 WeakPolarHBondContact O-CB 3.46Å; K250-R254 PolarHBondContact O-N 2.68Å
251	D	63.5	Low	68.4	Low	30 Å²	30	100.7 Å²	100.7	16%	0.16	47%	0.47	C	S	.	.	H	α-helix	trans	-67.4	-51.3	173.9	-70.9	-23.6	0	0	0	111.3	T247 L248 R249 A253 R254 Y255 K275	T247-D251 WeakPolarHBondContact O-CB 3.39Å; T247-D251 PolarHBondContact O-N 3.01Å; L248-D251 PolarHBondContact O-N 3.45Å; R249-D251 PolarHBondContact O-N 3.46Å; D251-A253 PolarHBondContact O-N 2.94Å; D251-R254 PolarHBondContact O-N 3.11Å; D251-R254 VanDerWaalsContact O-N 3.14Å; D251-Y255 HydrophobicContact CB-CE2 4.17Å; D251-Y255 WeakPolarHBondContact O-CD2 3.42Å; D251-Y255 PolarHBondContact O-N 2.94Å; D251-K275 VanDerWaalsContact OD1-CE 3.26Å; D251-K275 WeakPolarHBondContact OD1-CE 3.45Å; D251-K275 IonicContact OD1-NZ 2.71Å; D251-K275 PolarHBondContact OD1-NZ 2.95Å; D251-K275 WeakPolarHBondContact OD2-CE 3.32Å; D251-K275 IonicContact OD2-NZ 3.45Å; D251-K275 PolarHBondContact OD2-NZ 2.76Å
252	Y	66.7	Low	67.1	Low	175 Å²	175	104.6 Å²	104.6	69%	0.686	49%	0.486	S	S	*	.	H	α-helix	trans	-57.3	-46.3	177.1	-86.1	-66.9	0	0	0	113.2	L248 R249 R254 Y255 S256	L248-Y252 WeakPolarHBondContact O-CD2 3.48Å; L248-Y252 PolarHBondContact O-N 2.99Å; R249-Y252 PolarHBondContact O-N 3.44Å; Y252-R254 PolarHBondContact O-N 3.15Å; Y252-Y255 PolarHBondContact O-N 3.16Å; Y252-S256 PolarHBondContact O-N 2.85Å; Y252-S256 VanDerWaalsContact O-N 3.07Å
253	A	68.4	Low	66	Low	53 Å²	53	104.9 Å²	104.9	44%	0.438	49%	0.49	S	S	.	.	H	α-helix	trans	-69.3	-19.9	-179.7	0	0	0	0	0	113.5	R249 D251 S256	R249-A253 WeakPolarHBondContact O-CB 3.49Å; R249-A253 PolarHBondContact O-N 3.27Å; D251-A253 PolarHBondContact O-N 2.94Å; A253-S256 PolarHBondContact O-OG 3.31Å; A253-S256 VanDerWaalsContact O-OG 3.09Å
254	R	62.7	Low	64.7	Low	88 Å²	88	111.2 Å²	111.2	33%	0.332	52%	0.521	S	S	.	.	H	α-helix	trans	-82	-43.1	173.3	-177.5	177.8	164.9	168	0.1	110.6	K250 D251 Y252 S256 K257 E258 G269	K250-R254 WeakPolarHBondContact O-CB 3.46Å; K250-R254 PolarHBondContact O-N 2.68Å; D251-R254 PolarHBondContact O-N 3.11Å; D251-R254 VanDerWaalsContact O-N 3.14Å; Y252-R254 PolarHBondContact O-N 3.15Å; R254-S256 VanDerWaalsContact C-N 3.32Å; R254-S256 PolarHBondContact O-N 3.32Å; R254-K257 CarbonylContact O-C 3.57Å; R254-K257 WeakPolarHBondContact O-CA 3.31Å; R254-K257 WeakPolarHBondContact O-CB 3.45Å; R254-K257 PolarHBondContact O-N 3.4Å; R254-E258 IonicContact CZ-OE1 3.32Å; R254-E258 VanDerWaalsContact CZ-OE1 3.32Å; R254-E258 IonicContact NE-OE1 2.78Å; R254-E258 PolarHBondContact NE-OE1 3.34Å; R254-E258 IonicContact NH2-OE1 2.96Å; R254-E258 PolarHBondContact NH2-OE1 2.86Å; R254-E258 PolarHBondContact O-N 2.94Å; R254-G269 PolarHBondContact NH2-O 3.17Å
255	Y	59.8	Low	63.9	Low	84 Å²	84	112.2 Å²	112.2	33%	0.329	53%	0.527	S	S	.	.	H	α-helix	trans	-61.9	-38.1	175.7	-70.5	-60.1	0	0	0	112.9	D251 Y252 K257 E258 E259 K275	D251-Y255 HydrophobicContact CB-CE2 4.17Å; D251-Y255 WeakPolarHBondContact O-CD2 3.42Å; D251-Y255 PolarHBondContact O-N 2.94Å; Y252-Y255 PolarHBondContact O-N 3.16Å; Y255-K257 PolarHBondContact O-N 2.87Å; Y255-E258 PolarHBondContact O-N 3.06Å; Y255-E259 PolarHBondContact O-N 3.4Å; Y255-E259 VanDerWaalsContact O-N 3.08Å; Y255-K275 PolarHBondContact OH-NZ 3.48Å
256	S	64.1	Low	62.7	Low	61 Å²	61	115.3 Å²	115.3	43%	0.427	53%	0.533	S	S	.	.	H	α-helix	trans	-62.9	-25	173.9	66	0	0	0	0	113	Y252 A253 R254 E260	Y252-S256 PolarHBondContact O-N 2.85Å; Y252-S256 VanDerWaalsContact O-N 3.07Å; A253-S256 PolarHBondContact O-OG 3.31Å; A253-S256 VanDerWaalsContact O-OG 3.09Å; R254-S256 VanDerWaalsContact C-N 3.32Å; R254-S256 PolarHBondContact O-N 3.32Å; S256-E260 WeakPolarHBondContact O-CG 3.36Å
257	K	62.3	Low	61.4	Low	134 Å²	134	113.9 Å²	113.9	58%	0.583	54%	0.539	S	S	*	.	H	α-helix	trans	-86.5	-33.4	174.6	-72.7	-175.2	173.8	-166.8	0	112.8	R254 Y255 E259 E260 M261	R254-K257 CarbonylContact O-C 3.57Å; R254-K257 WeakPolarHBondContact O-CA 3.31Å; R254-K257 WeakPolarHBondContact O-CB 3.45Å; R254-K257 PolarHBondContact O-N 3.4Å; Y255-K257 PolarHBondContact O-N 2.87Å; K257-E259 VanDerWaalsContact C-N 3.32Å; K257-E260 PolarHBondContact O-N 2.94Å; K257-E260 VanDerWaalsContact O-N 3.09Å; K257-M261 PolarHBondContact O-N 3.13Å; K257-M261 VanDerWaalsContact O-N 3.14Å
258	E	55.7	Low	60.5	Low	68 Å²	68	119.3 Å²	119.3	32%	0.318	57%	0.566	S	S	.	*	H	α-helix	trans	-68	-29.9	175.9	-79.1	172.4	-173.8	0	0	112.2	R254 Y255 E260	R254-E258 IonicContact CZ-OE1 3.32Å; R254-E258 VanDerWaalsContact CZ-OE1 3.32Å; R254-E258 IonicContact NE-OE1 2.78Å; R254-E258 PolarHBondContact NE-OE1 3.34Å; R254-E258 IonicContact NH2-OE1 2.96Å; R254-E258 PolarHBondContact NH2-OE1 2.86Å; R254-E258 PolarHBondContact O-N 2.94Å; Y255-E258 PolarHBondContact O-N 3.06Å; E258-E260 PolarHBondContact O-N 3.12Å
259	E	57.5	Low	59.6	Low	180 Å²	180	117.9 Å²	117.9	84%	0.841	57%	0.566	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.7	-19.9	169.1	-75.3	-178.5	-179.3	0	0	113.2	Y255 K257	Y255-E259 PolarHBondContact O-N 3.4Å; Y255-E259 VanDerWaalsContact O-N 3.08Å; K257-E259 VanDerWaalsContact C-N 3.32Å
260	E	61.7	Low	58.4	Low	165 Å²	165	113.9 Å²	113.9	77%	0.771	56%	0.558	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.2	-13.4	-179.4	-67.1	176	174.2	0	0	113.7	S256 K257 E258	S256-E260 WeakPolarHBondContact O-CG 3.36Å; K257-E260 PolarHBondContact O-N 2.94Å; K257-E260 VanDerWaalsContact O-N 3.09Å; E258-E260 PolarHBondContact O-N 3.12Å
261	M	54.9	Low	57.8	Low	88 Å²	88	110 Å²	110	43%	0.433	54%	0.542	S	S	.	.	S	Bend	trans	-94.9	135.7	-176.4	-91.3	165.2	69	0	0	112.3	K257 D265	K257-M261 PolarHBondContact O-N 3.13Å; K257-M261 VanDerWaalsContact O-N 3.14Å; M261-D265 HydrophobicContact CB-CB 4.32Å; M261-D265 HydrophobicContact CE-CB 3.43Å; M261-D265 VanDerWaalsContact CE-CB 3.43Å; M261-D265 HydrophobicContact CG-CB 4.46Å
262	D	55.7	Low	57.7	Low	138 Å²	138	117.1 Å²	117.1	74%	0.738	57%	0.568	S	S	*	*			trans	-63.1	152.4	177	-78.9	-29	0	0	0	112.6	M264 D265	D262-M264 PolarHBondContact O-N 2.83Å; D262-D265 WeakPolarHBondContact O-CB 3.43Å; D262-D265 PolarHBondContact O-N 3.4Å
263	D	61.2	Low	58.2	Low	134 Å²	134	109.2 Å²	109.2	72%	0.717	54%	0.539	S	S	*	.	H	α-helix	trans	-49.9	-29.4	-170.9	-80.3	-33.1	0	0	0	115.8	D265 R266	D263-D265 VanDerWaalsContact C-N 3.34Å; D263-R266 WeakPolarHBondContact O-CB 3.46Å
264	M	51.5	Low	58.8	Low	167 Å²	167	107.7 Å²	107.7	82%	0.823	52%	0.522	S	S	*	.	H	α-helix	trans	-72.9	-26.2	179.5	-74.6	-76.8	-71.4	0	0	113.5	D262	D262-M264 PolarHBondContact O-N 2.83Å
265	D	56.8	Low	59.7	Low	85 Å²	85	104.5 Å²	104.5	46%	0.455	51%	0.511	S	S	.	.	H	α-helix	trans	-89.7	-12.6	-176.3	-108.4	4.8	0	0	0	111.4	M261 D262 D263	M261-D265 HydrophobicContact CB-CB 4.32Å; M261-D265 HydrophobicContact CE-CB 3.43Å; M261-D265 VanDerWaalsContact CE-CB 3.43Å; M261-D265 HydrophobicContact CG-CB 4.46Å; D262-D265 WeakPolarHBondContact O-CB 3.43Å; D262-D265 PolarHBondContact O-N 3.4Å; D263-D265 VanDerWaalsContact C-N 3.34Å
266	R	53	Low	60.7	Low	173 Å²	173	102.3 Å²	102.3	65%	0.653	50%	0.504	S	S	*	.	H	α-helix	trans	-71.2	-33.3	177.2	-167.8	175.5	169.2	177	-3.3	113.1	D263	D263-R266 WeakPolarHBondContact O-CB 3.46Å
267	D	52.2	Low	61.8	Low	153 Å²	153	99.4 Å²	99.4	82%	0.818	48%	0.484	S	S	*	.	S	Bend	trans	-80.9	-23.2	-179.8	-99.2	-1.3	0	0	0	113.6
268	L	49	Very low	62.9	Low	133 Å²	133	95 Å²	95	70%	0.696	47%	0.465	S	S	*	.	S	Bend	trans	-88.4	-10.1	-178	-81.3	156.3	0	0	0	113.7	D270	L268-D270 PolarHBondContact O-N 2.98Å
269	G	50.5	Low	64.4	Low	30 Å²	30	91.9 Å²	91.9	31%	0.309	45%	0.451	S	S	.	.	S	Bend	trans	-74.3	60.6	174.5	0	0	0	0	0	111.6	R254 E271	R254-G269 PolarHBondContact NH2-O 3.17Å; G269-E271 PolarHBondContact O-N 3.32Å
270	D	50.5	Low	66	Low	92 Å²	92	83.4 Å²	83.4	49%	0.492	41%	0.411	S	S	.	.			trans	-36.9	114.6	173.7	-82.3	-32.2	0	0	0	110	L268 Y272	L268-D270 PolarHBondContact O-N 2.98Å; D270-Y272 HydrophobicContact CB-CD2 4.02Å; D270-Y272 HydrophobicContact CB-CE2 3.43Å; D270-Y272 VanDerWaalsContact CB-CE2 3.43Å; D270-Y272 WeakPolarHBondContact O-CD2 3.49Å; D270-Y272 PolarHBondContact O-N 3.35Å; D270-Y272 PolarHBondContact OD2-OH 3.06Å
271	E	55.9	Low	67.3	Low	78 Å²	78	75.6 Å²	75.6	36%	0.364	38%	0.375	S	S	.	.			trans	-58.7	109.6	169.9	-62.1	-176.1	156.4	0	0	106.6	G269 Q276	G269-E271 PolarHBondContact O-N 3.32Å; E271-Q276 HydrophobicContact CB-CG 3.72Å; E271-Q276 WeakPolarHBondContact O-CG 3.41Å; E271-Q276 PolarHBondContact O-NE2 3.37Å
272	Y	62.5	Low	69.1	Low	181 Å²	181	72 Å²	72	71%	0.71	36%	0.357	S	S	*	.			trans	-94.6	136.9	173.3	-75.2	-87.1	0	0	0	110.4	D270	D270-Y272 HydrophobicContact CB-CD2 4.02Å; D270-Y272 HydrophobicContact CB-CE2 3.43Å; D270-Y272 VanDerWaalsContact CB-CE2 3.43Å; D270-Y272 WeakPolarHBondContact O-CD2 3.49Å; D270-Y272 PolarHBondContact O-N 3.35Å; D270-Y272 PolarHBondContact OD2-OH 3.06Å
273	G	75.8	Confident	70.8	Confident	8 Å²	8	67.5 Å²	67.5	8%	0.082	33%	0.329	C	S	.	.	S	Bend	trans	90.6	-142	167.4	0	0	0	0	0	115.5	K275 Q276	G273-K275 PolarHBondContact O-N 3.16Å; G273-Q276 PolarHBondContact O-N 3.2Å; G273-Q276 VanDerWaalsContact O-N 3.16Å
274	W	81.3	Confident	72.2	Confident	21 Å²	21	64.8 Å²	64.8	8%	0.08	32%	0.319	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-21.8	-167.2	69.6	-87.2	0	0	0	115.5	V277 L507 N508 I582 Y583 V586	W274-V277 WeakPolarHBondContact O-CG2 3.42Å; W274-L507 WeakPolarHBondContact CA-O 3.49Å; W274-L507 HydrophobicContact CB-CB 3.63Å; W274-L507 PolarHBondContact N-O 3.31Å; W274-N508 VanDerWaalsContact CD1-OD1 3.25Å; W274-I582 HydrophobicContact CE3-CD1 3.82Å; W274-I582 HydrophobicContact CE3-CG1 4.39Å; W274-I582 HydrophobicContact CH2-CB 4.08Å; W274-I582 HydrophobicContact CZ3-CB 3.93Å; W274-I582 HydrophobicContact CZ3-CD1 3.88Å; W274-I582 HydrophobicContact CZ3-CG1 3.95Å; W274-Y583 AromaticContact CE3-CE1 3.89Å; W274-Y583 HydrophobicContact CE3-CE1 3.89Å; W274-Y583 HydrophobicContact CE3-CE2 4.42Å; W274-Y583 AromaticContact CE3-CZ 3.75Å; W274-Y583 HydrophobicContact CZ3-CD1 4.24Å; W274-Y583 AromaticContact CZ3-CE1 3.93Å; W274-Y583 HydrophobicContact CZ3-CE1 3.93Å; W274-Y583 PolarHBondContact O-OH 3.08Å; W274-V586 HydrophobicContact CH2-CG2 3.82Å; W274-V586 HydrophobicContact CZ3-CG2 3.86Å
275	K	81.1	Confident	74.2	Confident	22 Å²	22	57.4 Å²	57.4	10%	0.096	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-37.4	178.9	-71.2	-178.4	167.8	-178.6	0	112.6	D251 Y255 G273 V277 H278	D251-K275 VanDerWaalsContact OD1-CE 3.26Å; D251-K275 WeakPolarHBondContact OD1-CE 3.45Å; D251-K275 IonicContact OD1-NZ 2.71Å; D251-K275 PolarHBondContact OD1-NZ 2.95Å; D251-K275 WeakPolarHBondContact OD2-CE 3.32Å; D251-K275 IonicContact OD2-NZ 3.45Å; D251-K275 PolarHBondContact OD2-NZ 2.76Å; Y255-K275 PolarHBondContact OH-NZ 3.48Å; G273-K275 PolarHBondContact O-N 3.16Å; K275-V277 PolarHBondContact O-N 3.42Å; K275-V277 VanDerWaalsContact O-N 3.09Å; K275-H278 WeakPolarHBondContact O-CB 3.38Å; K275-H278 PolarHBondContact O-CD2 3.11Å; K275-H278 PolarHBondContact O-N 2.89Å
276	Q	82.4	Confident	75.7	Confident	37 Å²	37	56.9 Å²	56.9	17%	0.173	29%	0.287	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-24	-178.5	-73	-167.3	-33	0	0	114.3	E271 G273 H278 R435 E510	E271-Q276 HydrophobicContact CB-CG 3.72Å; E271-Q276 WeakPolarHBondContact O-CG 3.41Å; E271-Q276 PolarHBondContact O-NE2 3.37Å; G273-Q276 PolarHBondContact O-N 3.2Å; G273-Q276 VanDerWaalsContact O-N 3.16Å; Q276-H278 VanDerWaalsContact C-N 3.28Å; Q276-H278 PolarHBondContact O-N 3.31Å; Q276-R435 VanDerWaalsContact OE1-NH1 3.12Å; Q276-E510 PolarHBondContact OE1-OE1 3.14Å; Q276-E510 VanDerWaalsContact OE1-OE1 3.12Å; Q276-E510 PolarHBondContact OE1-OE2 3.07Å
277	V	86.8	Confident	77.7	Confident	1 Å²	1	54.8 Å²	54.8	1%	0.006	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.4	7.8	179.6	-65.2	0	0	0	0	113	W274 K275 G279 D280 V281 L507 E510 Y583	W274-V277 WeakPolarHBondContact O-CG2 3.42Å; K275-V277 PolarHBondContact O-N 3.42Å; K275-V277 VanDerWaalsContact O-N 3.09Å; V277-G279 PolarHBondContact O-N 3.27Å; V277-D280 PolarHBondContact O-N 3.02Å; V277-V281 HydrophobicContact CB-CG2 3.95Å; V277-V281 HydrophobicContact CG2-CG2 3.63Å; V277-V281 WeakPolarHBondContact O-CG2 3.3Å; V277-V281 PolarHBondContact O-N 3.3Å; V277-L507 HydrophobicContact CG2-CD2 4.02Å; V277-E510 HydrophobicContact CG1-CB 4.16Å; V277-E510 WeakPolarHBondContact CG1-O 3.19Å; V277-Y583 WeakPolarHBondContact CG2-OH 3.28Å
278	H	85.8	Confident	79.7	Confident	42 Å²	42	49.4 Å²	49.4	19%	0.194	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-50.6	-35.6	-179.7	75	73.5	0	0	0	113.1	K275 Q276 D280 Y583 I588	K275-H278 WeakPolarHBondContact O-CB 3.38Å; K275-H278 PolarHBondContact O-CD2 3.11Å; K275-H278 PolarHBondContact O-N 2.89Å; Q276-H278 VanDerWaalsContact C-N 3.28Å; Q276-H278 PolarHBondContact O-N 3.31Å; H278-D280 VanDerWaalsContact C-N 3.32Å; H278-D280 PolarHBondContact O-N 3.03Å; H278-Y583 HydrophobicContact CB-CD1 3.77Å; H278-Y583 HydrophobicContact CB-CE1 3.71Å; H278-I588 HydrophobicContact CB-CD1 3.68Å; H278-I588 WeakPolarHBondContact ND1-CD1 3.1Å
279	G	86.4	Confident	81.9	Confident	1 Å²	1	44.3 Å²	44.3	1%	0.01	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.1	-10.9	-177.9	0	0	0	0	0	114.1	V277 V430 N431	V277-G279 PolarHBondContact O-N 3.27Å; G279-V430 CarbonylContact O-C 3.56Å; G279-V430 VanDerWaalsContact O-CA 3.26Å; G279-V430 WeakPolarHBondContact O-CA 3.3Å; G279-N431 PolarHBondContact O-N 3.05Å
280	D	90.2	Very high	84.1	Confident	3 Å²	3	47 Å²	47	2%	0.016	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	-121.7	-18.4	-174	-72.3	-35.3	0	0	0	113.9	V277 H278 F282 R283 R435 Y512	V277-D280 PolarHBondContact O-N 3.02Å; H278-D280 VanDerWaalsContact C-N 3.32Å; H278-D280 PolarHBondContact O-N 3.03Å; D280-F282 VanDerWaalsContact C-N 3.29Å; D280-F282 PolarHBondContact O-N 3.49Å; D280-R283 WeakPolarHBondContact O-CB 3.48Å; D280-R283 WeakPolarHBondContact O-CG 3.46Å; D280-R283 PolarHBondContact O-N 2.89Å; D280-R283 VanDerWaalsContact O-N 3.15Å; D280-R283 IonicContact OD1-CZ 3.86Å; D280-R283 IonicContact OD1-NE 3.62Å; D280-R283 PolarHBondContact OD1-NE 3.45Å; D280-R283 IonicContact OD1-NH2 3.68Å; D280-R283 PolarHBondContact OD1-NH2 2.97Å; D280-R435 VanDerWaalsContact OD2-CB 3.3Å; D280-R435 WeakPolarHBondContact OD2-CB 3.26Å; D280-R435 PolarHBondContact OD2-N 3.27Å; D280-Y512 HydrophobicContact CB-CD1 3.92Å; D280-Y512 HydrophobicContact CB-CD2 4.11Å; D280-Y512 HydrophobicContact CB-CG 3.66Å
281	V	90	Very high	86.3	Confident	1 Å²	1	42.6 Å²	42.6	1%	0.006	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-33.6	-176.3	166.8	0	0	0	0	113.9	V277 R283 L507 W514 V579 Y583	V277-V281 HydrophobicContact CB-CG2 3.95Å; V277-V281 HydrophobicContact CG2-CG2 3.63Å; V277-V281 WeakPolarHBondContact O-CG2 3.3Å; V277-V281 PolarHBondContact O-N 3.3Å; V281-R283 VanDerWaalsContact C-N 3.35Å; V281-L507 HydrophobicContact CG2-CD2 4.02Å; V281-W514 PolarHBondContact O-NE1 3.05Å; V281-V579 HydrophobicContact CG1-CG1 3.3Å; V281-Y583 HydrophobicContact CB-CE2 4.04Å; V281-Y583 HydrophobicContact CG1-CD2 3.93Å; V281-Y583 HydrophobicContact CG1-CE2 3.57Å; V281-Y583 HydrophobicContact CG2-CE1 4.34Å; V281-Y583 HydrophobicContact CG2-CE2 3.69Å; V281-Y583 VanDerWaalsContact CG2-OH 3.28Å; V281-Y583 WeakPolarHBondContact CG2-OH 3.32Å
282	F	92.2	Very high	88.2	Confident	13 Å²	13	38.9 Å²	38.9	6%	0.057	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.6	13.4	-178.2	-63	-69	0	0	0	113.8	D280 F426 P427 C428 V430 V579 R580 Y583	D280-F282 VanDerWaalsContact C-N 3.29Å; D280-F282 PolarHBondContact O-N 3.49Å; F282-F426 HydrophobicContact CB-CB 4.2Å; F282-F426 HydrophobicContact CB-CD1 3.69Å; F282-F426 HydrophobicContact CB-CD2 4.33Å; F282-F426 HydrophobicContact CB-CE1 4.1Å; F282-F426 HydrophobicContact CB-CG 3.83Å; F282-F426 AromaticContact CD1-CD1 3.68Å; F282-F426 HydrophobicContact CD1-CD1 3.68Å; F282-F426 HydrophobicContact CD1-CE1 4.25Å; F282-F426 HydrophobicContact CD1-CG 4.42Å; F282-F426 HydrophobicContact CD2-CB 4.41Å; F282-F426 HydrophobicContact CG-CB 4.14Å; F282-F426 AromaticContact CG-CD1 3.81Å; F282-F426 HydrophobicContact CG-CD1 3.81Å; F282-F426 HydrophobicContact CG-CG 4.13Å; F282-P427 HydrophobicContact CD2-CG 4.38Å; F282-P427 HydrophobicContact CE1-CG 4.32Å; F282-P427 HydrophobicContact CE2-CG 3.44Å; F282-P427 VanDerWaalsContact CE2-CG 3.44Å; F282-P427 VanDerWaalsContact CZ-CD 3.49Å; F282-P427 HydrophobicContact CZ-CG 3.4Å; F282-P427 VanDerWaalsContact CZ-CG 3.4Å; F282-C428 HydrophobicContact CD2-CB 4.45Å; F282-C428 HydrophobicContact CE2-CB 4.44Å; F282-V430 HydrophobicContact CB-CG2 3.86Å; F282-V579 HydrophobicContact CE1-CG1 4.12Å; F282-V579 HydrophobicContact CZ-CG1 4.18Å; F282-R580 HydrophobicContact CE1-CG 3.9Å; F282-R580 HydrophobicContact CZ-CG 4.41Å; F282-Y583 HydrophobicContact CE2-CD2 4.22Å; F282-Y583 HydrophobicContact CE2-CG 4.17Å; F282-Y583 HydrophobicContact CZ-CD2 4.14Å; F282-Y583 HydrophobicContact CZ-CG 4.4Å
283	R	91.7	Very high	89.9	Confident	42 Å²	42	30.3 Å²	30.3	16%	0.158	16%	0.163	C	C	.	.	S	Bend	trans	-59.8	151.3	171.7	-78	-178.1	-168.8	-88.3	-5.1	111.5	D280 V281 V430 N431 A432 V433 P434 Q515	D280-R283 WeakPolarHBondContact O-CB 3.48Å; D280-R283 WeakPolarHBondContact O-CG 3.46Å; D280-R283 PolarHBondContact O-N 2.89Å; D280-R283 VanDerWaalsContact O-N 3.15Å; D280-R283 IonicContact OD1-CZ 3.86Å; D280-R283 IonicContact OD1-NE 3.62Å; D280-R283 PolarHBondContact OD1-NE 3.45Å; D280-R283 IonicContact OD1-NH2 3.68Å; D280-R283 PolarHBondContact OD1-NH2 2.97Å; V281-R283 VanDerWaalsContact C-N 3.35Å; R283-V430 HydrophobicContact CG-CG1 3.57Å; R283-N431 VanDerWaalsContact CZ-O 3.23Å; R283-N431 PolarHBondContact NH1-O 2.84Å; R283-N431 PolarHBondContact NH2-O 2.76Å; R283-A432 PolarHBondContact NH1-O 3.47Å; R283-A432 VanDerWaalsContact NH1-O 3.09Å; R283-V433 PolarHBondContact NH2-O 2.99Å; R283-P434 VanDerWaalsContact NH2-CA 3.32Å; R283-P434 VanDerWaalsContact NH2-N 3.12Å; R283-Q515 PolarHBondContact O-NE2 2.98Å
284	P	91.4	Very high	90.9	Very high	78 Å²	78	31.1 Å²	31.1	51%	0.506	17%	0.165	S	C	.	.	P	Polyproline II helix	trans	-60.9	143.9	171.2	26.8	-34.3	0	0	0	110.6	Q350	P284-Q350 HydrophobicContact CB-CB 4.06Å; P284-Q350 HydrophobicContact CB-CG 4.42Å
285	S	92.1	Very high	91.7	Very high	11 Å²	11	30.3 Å²	30.3	8%	0.077	16%	0.162	C	C	.	.	P	Polyproline II helix	trans	-59.1	153.4	175.1	53	0	0	0	0	111.1	H287 P288 Q350	S285-H287 PolarHBondContact O-N 3.48Å; S285-P288 WeakPolarHBondContact O-CD 3.18Å; S285-P288 WeakPolarHBondContact OG-CA 3.27Å; S285-Q350 PolarHBondContact OG-NE2 3.36Å; S285-Q350 PolarHBondContact OG-OE1 3.34Å
286	S	89.9	Confident	92.5	Very high	75 Å²	75	29.2 Å²	29.2	52%	0.524	16%	0.158	S	C	.	.	S	Bend	trans	-54.5	136.3	159.6	-170.3	0	0	0	0	109.7	W516	S286-W516 PolarHBondContact O-NE1 3.39Å
287	H	94.2	Very high	93.2	Very high	129 Å²	129	27.5 Å²	27.5	60%	0.597	15%	0.15	S	C	*	.	S	Bend	trans	48.1	63.8	-177.2	-55.9	-70.5	0	0	0	115	S285 L289 I290 F291	S285-H287 PolarHBondContact O-N 3.48Å; H287-L289 PolarHBondContact O-N 3.19Å; H287-I290 PolarHBondContact O-N 2.81Å; H287-F291 PolarHBondContact O-N 3.32Å
288	P	93.9	Very high	93.7	Very high	39 Å²	39	27.4 Å²	27.4	25%	0.253	15%	0.149	S	C	.	.	H	α-helix	trans	-59.8	-25.6	-173.9	25.7	-35.6	0	0	0	113.9	S285 S292 Y347 Q350	S285-P288 WeakPolarHBondContact O-CD 3.18Å; S285-P288 WeakPolarHBondContact OG-CA 3.27Å; P288-S292 VanDerWaalsContact O-CB 3.28Å; P288-S292 WeakPolarHBondContact O-CB 3.4Å; P288-S292 PolarHBondContact O-N 3.21Å; P288-S292 PolarHBondContact O-OG 3.46Å; P288-Y347 HydrophobicContact CB-CD2 4.37Å; P288-Y347 HydrophobicContact CB-CE2 4.3Å; P288-Y347 HydrophobicContact CG-CE2 4.41Å; P288-Q350 HydrophobicContact CB-CB 4.27Å
289	L	95.6	Very high	94.3	Very high	26 Å²	26	25.9 Å²	25.9	14%	0.136	14%	0.143	C	C	.	.	H	α-helix	trans	-64.5	-54.4	178.7	-166.9	156.9	0	0	0	111.5	H287 S292 S293 Y347 K357 Q358 I361	H287-L289 PolarHBondContact O-N 3.19Å; L289-S292 PolarHBondContact O-OG 2.86Å; L289-S292 VanDerWaalsContact O-OG 3.05Å; L289-S293 PolarHBondContact O-N 3.49Å; L289-S293 VanDerWaalsContact O-N 3.16Å; L289-S293 PolarHBondContact O-OG 3.11Å; L289-Y347 HydrophobicContact CB-CE2 4.06Å; L289-Y347 HydrophobicContact CG-CE2 4.5Å; L289-K357 HydrophobicContact CD1-CB 3.92Å; L289-Q358 HydrophobicContact CG-CB 4.18Å; L289-I361 HydrophobicContact CD1-CD1 4.45Å; L289-I361 HydrophobicContact CD2-CB 4.06Å; L289-I361 HydrophobicContact CD2-CD1 3.23Å; L289-I361 HydrophobicContact CD2-CG1 4.16Å; L289-I361 HydrophobicContact CD2-CG2 4.12Å; L289-I361 HydrophobicContact CG-CD1 4.47Å
290	I	95.7	Very high	94.8	Very high	87 Å²	87	25.8 Å²	25.8	45%	0.446	14%	0.142	S	C	.	.	H	α-helix	trans	-69.4	-42.1	-177	-62.7	169.4	0	0	0	109.7	H287 S292 S293 L294 W516	H287-I290 PolarHBondContact O-N 2.81Å; I290-S292 PolarHBondContact O-N 2.86Å; I290-S293 PolarHBondContact O-N 3.45Å; I290-L294 HydrophobicContact CG2-CD1 3.83Å; I290-L294 HydrophobicContact CG2-CG 4.28Å; I290-L294 WeakPolarHBondContact O-CG 3.28Å; I290-L294 PolarHBondContact O-N 3.48Å; I290-W516 HydrophobicContact CG2-CH2 4.43Å
291	F	97	Very high	95.2	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-56.7	-52.4	178.5	-173	-108.7	0	0	0	111.8	H287 S293 L294 I295 L346 Q515 W516 F519 Y572	H287-F291 PolarHBondContact O-N 3.32Å; F291-S293 PolarHBondContact O-N 3.31Å; F291-L294 PolarHBondContact O-N 3.49Å; F291-I295 HydrophobicContact CD1-CG1 4.5Å; F291-I295 HydrophobicContact CE1-CG1 4.21Å; F291-I295 HydrophobicContact CE2-CD1 4.49Å; F291-I295 HydrophobicContact CZ-CD1 4.29Å; F291-I295 HydrophobicContact CZ-CG1 4.22Å; F291-I295 WeakPolarHBondContact O-CG1 3.49Å; F291-I295 PolarHBondContact O-N 3.21Å; F291-L346 HydrophobicContact CD1-CD2 4.21Å; F291-L346 HydrophobicContact CE1-CD2 4.07Å; F291-Q515 HydrophobicContact CE1-CB 4.27Å; F291-Q515 HydrophobicContact CZ-CB 3.91Å; F291-W516 HydrophobicContact CB-CH2 4.14Å; F291-W516 HydrophobicContact CB-CZ2 3.6Å; F291-W516 AromaticContact CD2-CD2 3.7Å; F291-W516 HydrophobicContact CD2-CD2 3.7Å; F291-W516 AromaticContact CD2-CE2 3.59Å; F291-W516 AromaticContact CD2-CE3 3.87Å; F291-W516 HydrophobicContact CD2-CE3 3.87Å; F291-W516 HydrophobicContact CD2-CG 4.34Å; F291-W516 AromaticContact CD2-CH2 3.92Å; F291-W516 HydrophobicContact CD2-CH2 3.92Å; F291-W516 AromaticContact CD2-CZ2 3.74Å; F291-W516 HydrophobicContact CD2-CZ2 3.74Å; F291-W516 AromaticContact CD2-CZ3 3.98Å; F291-W516 HydrophobicContact CD2-CZ3 3.98Å; F291-W516 HydrophobicContact CE2-CD2 4.16Å; F291-W516 HydrophobicContact CE2-CE3 4.27Å; F291-W516 HydrophobicContact CE2-CG 4.49Å; F291-W516 HydrophobicContact CG-CZ2 4.12Å; F291-F519 HydrophobicContact CE2-CB 3.89Å; F291-F519 HydrophobicContact CE2-CG 4.31Å; F291-Y572 HydrophobicContact CE1-CD2 4.18Å; F291-Y572 HydrophobicContact CE1-CE1 4.3Å; F291-Y572 AromaticContact CE1-CE2 3.75Å; F291-Y572 HydrophobicContact CE1-CE2 3.75Å; F291-Y572 AromaticContact CE1-CZ 3.81Å; F291-Y572 AromaticContact CZ-CD2 3.58Å; F291-Y572 HydrophobicContact CZ-CD2 3.58Å; F291-Y572 AromaticContact CZ-CE2 3.58Å; F291-Y572 HydrophobicContact CZ-CE2 3.58Å; F291-Y572 HydrophobicContact CZ-CG 4.06Å
292	S	96.6	Very high	95.5	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-64.1	-37.4	179.2	57.7	0	0	0	0	113.5	P288 L289 I290 I295 G296 G343 Y347 Q358	P288-S292 VanDerWaalsContact O-CB 3.28Å; P288-S292 WeakPolarHBondContact O-CB 3.4Å; P288-S292 PolarHBondContact O-N 3.21Å; P288-S292 PolarHBondContact O-OG 3.46Å; L289-S292 PolarHBondContact O-OG 2.86Å; L289-S292 VanDerWaalsContact O-OG 3.05Å; I290-S292 PolarHBondContact O-N 2.86Å; S292-I295 PolarHBondContact O-N 2.95Å; S292-G296 PolarHBondContact O-N 2.84Å; S292-G343 WeakPolarHBondContact O-CA 3.43Å; S292-Y347 WeakPolarHBondContact OG-CD2 3.48Å; S292-Q358 WeakPolarHBondContact OG-CG 3.11Å
293	S	97.1	Very high	95.8	Very high	1 Å²	1	30 Å²	30	1%	0.007	17%	0.165	C	C	.	.	H	α-helix	trans	-65.8	-37.2	174.2	-65.9	0	0	0	0	112.9	L289 I290 F291 S297 Q358 G362	L289-S293 PolarHBondContact O-N 3.49Å; L289-S293 VanDerWaalsContact O-N 3.16Å; L289-S293 PolarHBondContact O-OG 3.11Å; I290-S293 PolarHBondContact O-N 3.45Å; F291-S293 PolarHBondContact O-N 3.31Å; S293-S297 WeakPolarHBondContact O-CB 3Å; S293-S297 PolarHBondContact O-N 2.93Å; S293-S297 PolarHBondContact O-OG 3.38Å; S293-Q358 PolarHBondContact OG-NE2 3.25Å; S293-Q358 PolarHBondContact OG-O 3.47Å; S293-G362 PolarHBondContact OG-N 3.31Å
294	L	97.7	Very high	96	Very high	24 Å²	24	28.8 Å²	28.8	13%	0.126	16%	0.163	C	C	.	.	H	α-helix	trans	-65.8	-44.7	174.6	-76.5	166.8	0	0	0	111.7	I290 F291 S297 G298 L365 W516 F519 I565	I290-L294 HydrophobicContact CG2-CD1 3.83Å; I290-L294 HydrophobicContact CG2-CG 4.28Å; I290-L294 WeakPolarHBondContact O-CG 3.28Å; I290-L294 PolarHBondContact O-N 3.48Å; F291-L294 PolarHBondContact O-N 3.49Å; L294-S297 PolarHBondContact O-N 2.97Å; L294-G298 PolarHBondContact O-N 3.4Å; L294-L365 HydrophobicContact CD2-CD2 3.74Å; L294-L365 HydrophobicContact CG-CD2 4.3Å; L294-W516 HydrophobicContact CD1-CH2 3.85Å; L294-W516 HydrophobicContact CD1-CZ3 3.99Å; L294-F519 HydrophobicContact CB-CE2 4.12Å; L294-F519 HydrophobicContact CB-CZ 3.86Å; L294-F519 HydrophobicContact CD1-CE1 4.08Å; L294-F519 HydrophobicContact CD1-CZ 4.13Å; L294-F519 HydrophobicContact CD2-CZ 4.32Å; L294-F519 HydrophobicContact CG-CZ 4.35Å; L294-I565 HydrophobicContact CD2-CD1 4.02Å; L294-I565 HydrophobicContact CD2-CG1 3.98Å; L294-I565 HydrophobicContact CD2-CG2 4.5Å; L294-I565 WeakPolarHBondContact O-CG2 3.33Å
295	I	97.5	Very high	96.1	Very high	4 Å²	4	26.5 Å²	26.5	2%	0.021	15%	0.148	C	C	.	.	H	α-helix	trans	-62.8	-47.4	177.3	-61.9	-60.9	0	0	0	110.9	F291 S292 S297 G298 C299 L346 F519 A569 Y572	F291-I295 HydrophobicContact CD1-CG1 4.5Å; F291-I295 HydrophobicContact CE1-CG1 4.21Å; F291-I295 HydrophobicContact CE2-CD1 4.49Å; F291-I295 HydrophobicContact CZ-CD1 4.29Å; F291-I295 HydrophobicContact CZ-CG1 4.22Å; F291-I295 WeakPolarHBondContact O-CG1 3.49Å; F291-I295 PolarHBondContact O-N 3.21Å; S292-I295 PolarHBondContact O-N 2.95Å; I295-S297 VanDerWaalsContact C-N 3.33Å; I295-S297 PolarHBondContact O-N 3.12Å; I295-G298 PolarHBondContact O-N 2.91Å; I295-C299 PolarHBondContact O-N 2.94Å; I295-C299 PolarHBondContact O-SG 2.92Å; I295-L346 HydrophobicContact CB-CD2 3.92Å; I295-L346 HydrophobicContact CG1-CD2 3.82Å; I295-L346 HydrophobicContact CG2-CD2 4Å; I295-F519 HydrophobicContact CD1-CD2 3.45Å; I295-F519 VanDerWaalsContact CD1-CD2 3.45Å; I295-F519 HydrophobicContact CD1-CE2 3.92Å; I295-F519 HydrophobicContact CD1-CG 4.45Å; I295-A569 HydrophobicContact CD1-CB 4.34Å; I295-Y572 HydrophobicContact CD1-CD1 3.6Å; I295-Y572 HydrophobicContact CD1-CE1 4.48Å; I295-Y572 HydrophobicContact CD1-CG 3.74Å; I295-Y572 HydrophobicContact CG1-CD1 3.96Å; I295-Y572 HydrophobicContact CG1-CE1 4.39Å; I295-Y572 HydrophobicContact CG1-CG 4.45Å; I295-Y572 HydrophobicContact CG2-CD1 4.14Å
296	G	97.6	Very high	96.3	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-57.5	-45.8	176.1	0	0	0	0	0	112.3	S292 G298 C299 Q300 N339	S292-G296 PolarHBondContact O-N 2.84Å; G296-G298 PolarHBondContact O-N 3.21Å; G296-C299 PolarHBondContact O-N 3Å; G296-Q300 PolarHBondContact O-N 3.44Å; G296-N339 VanDerWaalsContact C-OD1 3.25Å; G296-N339 WeakPolarHBondContact O-CA 3.41Å
297	S	97.7	Very high	96.5	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-63.2	-39.7	176.9	-58.3	0	0	0	0	112.2	S293 L294 I295 Q300 I301 N339	S293-S297 WeakPolarHBondContact O-CB 3Å; S293-S297 PolarHBondContact O-N 2.93Å; S293-S297 PolarHBondContact O-OG 3.38Å; L294-S297 PolarHBondContact O-N 2.97Å; I295-S297 VanDerWaalsContact C-N 3.33Å; I295-S297 PolarHBondContact O-N 3.12Å; S297-Q300 WeakPolarHBondContact O-CB 3.35Å; S297-Q300 PolarHBondContact O-N 3.4Å; S297-I301 VanDerWaalsContact O-CG1 3.3Å; S297-I301 WeakPolarHBondContact O-CG1 3.37Å; S297-I301 PolarHBondContact O-N 3.45Å; S297-N339 PolarHBondContact N-OD1 3.32Å
298	G	97.9	Very high	96.5	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-68.7	-38.7	178.3	0	0	0	0	0	113.3	L294 I295 G296 Q300 I301 F302 I565	L294-G298 PolarHBondContact O-N 3.4Å; I295-G298 PolarHBondContact O-N 2.91Å; G296-G298 PolarHBondContact O-N 3.21Å; G298-Q300 VanDerWaalsContact C-N 3.32Å; G298-Q300 PolarHBondContact O-N 3.43Å; G298-I301 PolarHBondContact O-N 3.07Å; G298-F302 WeakPolarHBondContact O-CB 3.43Å; G298-F302 PolarHBondContact O-N 2.96Å; G298-I565 WeakPolarHBondContact CA-O 3.16Å
299	C	97.7	Very high	96.4	Very high	9 Å²	9	21.8 Å²	21.8	6%	0.061	12%	0.118	C	C	.	.	H	α-helix	trans	-63.1	-38.7	171.4	-63.9	0	0	0	0	111.8	I295 G296 A303 V338 F342 M573	I295-C299 PolarHBondContact O-N 2.94Å; I295-C299 PolarHBondContact O-SG 2.92Å; G296-C299 PolarHBondContact O-N 3Å; C299-A303 WeakPolarHBondContact O-CB 3.36Å; C299-A303 PolarHBondContact O-N 3.45Å; C299-V338 HydrophobicContact CB-CG1 4.35Å; C299-F342 HydrophobicContact CB-CB 4.17Å; C299-F342 HydrophobicContact CB-CD2 3.77Å; C299-F342 HydrophobicContact CB-CE2 4.37Å; C299-F342 HydrophobicContact CB-CG 3.99Å; C299-M573 PolarHBondContact SG-SD 2.61Å
300	Q	97.8	Very high	96.2	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-64.6	-49.9	174.8	-174.9	-172.3	10.3	0	0	111.4	G296 S297 G298 F302 A303 V304 Y332 N339	G296-Q300 PolarHBondContact O-N 3.44Å; S297-Q300 WeakPolarHBondContact O-CB 3.35Å; S297-Q300 PolarHBondContact O-N 3.4Å; G298-Q300 VanDerWaalsContact C-N 3.32Å; G298-Q300 PolarHBondContact O-N 3.43Å; Q300-F302 PolarHBondContact O-N 2.68Å; Q300-A303 PolarHBondContact O-N 3.08Å; Q300-A303 VanDerWaalsContact O-N 3.12Å; Q300-V304 HydrophobicContact CG-CG2 4.36Å; Q300-V304 VanDerWaalsContact O-CG2 3.26Å; Q300-V304 WeakPolarHBondContact O-CG2 3.33Å; Q300-V304 PolarHBondContact O-N 3.29Å; Q300-Y332 VanDerWaalsContact CD-CE2 3.44Å; Q300-Y332 HydrophobicContact CG-CD2 4.47Å; Q300-Y332 HydrophobicContact CG-CE2 4.12Å; Q300-Y332 VanDerWaalsContact NE2-CE2 3.35Å; Q300-Y332 PolarHBondContact NE2-O 3.49Å; Q300-Y332 PolarHBondContact OE1-OH 3.4Å; Q300-Y332 VanDerWaalsContact OE1-OH 3.08Å; Q300-N339 HydrophobicContact CB-CB 3.92Å; Q300-N339 HydrophobicContact CG-CB 4.29Å; Q300-N339 PolarHBondContact OE1-ND2 3.38Å
301	I	97.4	Very high	96	Very high	24 Å²	24	20.9 Å²	20.9	12%	0.123	12%	0.115	C	C	.	.	H	α-helix	trans	-58.3	-41.4	178	-67.9	165.5	0	0	0	110.4	S297 G298 V304 S305 I366 A562 I565 M566	S297-I301 VanDerWaalsContact O-CG1 3.3Å; S297-I301 WeakPolarHBondContact O-CG1 3.37Å; S297-I301 PolarHBondContact O-N 3.45Å; G298-I301 PolarHBondContact O-N 3.07Å; I301-V304 PolarHBondContact O-N 3.46Å; I301-S305 WeakPolarHBondContact O-CB 3.49Å; I301-S305 PolarHBondContact O-N 3.46Å; I301-S305 PolarHBondContact O-OG 2.88Å; I301-I366 HydrophobicContact CD1-CD1 3.84Å; I301-I366 HydrophobicContact CD1-CG1 4.08Å; I301-A562 HydrophobicContact CD1-CB 4.18Å; I301-I565 HydrophobicContact CD1-CB 4.37Å; I301-I565 HydrophobicContact CD1-CG2 4.23Å; I301-M566 HydrophobicContact CB-CB 4.34Å; I301-M566 HydrophobicContact CG2-CB 3.89Å; I301-M566 HydrophobicContact CG2-CG 4.2Å; I301-M566 HydrophobicContact CG2-SD 4.16Å
302	F	97.6	Very high	95.7	Very high	61 Å²	61	21 Å²	21	27%	0.268	12%	0.115	S	C	.	.	H	α-helix	trans	-59.4	-50.6	174.5	177.1	-109.5	0	0	0	111.8	G298 Q300 V304 S305 L306 L488 C492 M566 I570	G298-F302 WeakPolarHBondContact O-CB 3.43Å; G298-F302 PolarHBondContact O-N 2.96Å; Q300-F302 PolarHBondContact O-N 2.68Å; F302-V304 VanDerWaalsContact C-N 3.32Å; F302-V304 PolarHBondContact O-N 3.42Å; F302-S305 PolarHBondContact O-N 3.17Å; F302-S305 PolarHBondContact O-OG 3.4Å; F302-L306 HydrophobicContact CE1-CD1 4.35Å; F302-L306 HydrophobicContact CZ-CD1 4.1Å; F302-L306 WeakPolarHBondContact O-CB 3.35Å; F302-L306 PolarHBondContact O-N 3.21Å; F302-L488 HydrophobicContact CD2-CD1 4.49Å; F302-L488 HydrophobicContact CE2-CD1 4.37Å; F302-L488 HydrophobicContact CE2-CD2 4.3Å; F302-L488 HydrophobicContact CE2-CG 4.31Å; F302-C492 WeakPolarHBondContact CE2-SG 3.2Å; F302-M566 HydrophobicContact CB-CG 3.89Å; F302-M566 HydrophobicContact CB-SD 4.44Å; F302-M566 HydrophobicContact CD2-CG 4.47Å; F302-M566 HydrophobicContact CD2-SD 4.39Å; F302-I570 HydrophobicContact CD2-CD1 3.73Å; F302-I570 HydrophobicContact CD2-CG1 4.42Å; F302-I570 HydrophobicContact CE2-CD1 4.23Å; F302-I570 HydrophobicContact CG-CD1 4.25Å
303	A	97.1	Very high	95.1	Very high	20 Å²	20	25 Å²	25	17%	0.165	14%	0.135	C	C	.	.	H	α-helix	trans	-59.7	-41.7	178.1	0	0	0	0	0	112.3	C299 Q300 L306 I307 T335 V338	C299-A303 WeakPolarHBondContact O-CB 3.36Å; C299-A303 PolarHBondContact O-N 3.45Å; Q300-A303 PolarHBondContact O-N 3.08Å; Q300-A303 VanDerWaalsContact O-N 3.12Å; A303-L306 PolarHBondContact O-N 2.93Å; A303-I307 WeakPolarHBondContact O-CB 3.18Å; A303-I307 VanDerWaalsContact O-CG1 3.27Å; A303-I307 WeakPolarHBondContact O-CG1 3.34Å; A303-I307 PolarHBondContact O-N 2.89Å; A303-T335 HydrophobicContact CB-CG2 4.45Å; A303-V338 HydrophobicContact CB-CG1 4.45Å
304	V	96.7	Very high	94.7	Very high	17 Å²	17	31 Å²	31	10%	0.103	17%	0.166	C	C	.	.	H	α-helix	trans	-63	-48.2	175.9	174.1	0	0	0	0	110.8	Q300 I301 F302 L306 I307 V308 V331 Y332 T335	Q300-V304 HydrophobicContact CG-CG2 4.36Å; Q300-V304 VanDerWaalsContact O-CG2 3.26Å; Q300-V304 WeakPolarHBondContact O-CG2 3.33Å; Q300-V304 PolarHBondContact O-N 3.29Å; I301-V304 PolarHBondContact O-N 3.46Å; F302-V304 VanDerWaalsContact C-N 3.32Å; F302-V304 PolarHBondContact O-N 3.42Å; V304-L306 VanDerWaalsContact C-N 3.3Å; V304-L306 PolarHBondContact O-N 2.71Å; V304-I307 PolarHBondContact O-N 2.89Å; V304-V308 HydrophobicContact CG1-CG2 4.03Å; V304-V308 WeakPolarHBondContact O-CB 3.28Å; V304-V308 VanDerWaalsContact O-CG2 3.25Å; V304-V308 WeakPolarHBondContact O-CG2 3.43Å; V304-V308 PolarHBondContact O-N 3.02Å; V304-V331 HydrophobicContact CB-CG1 4.4Å; V304-V331 HydrophobicContact CG1-CG1 4.2Å; V304-V331 HydrophobicContact CG2-CG1 4.28Å; V304-Y332 HydrophobicContact CG2-CD2 3.98Å; V304-T335 HydrophobicContact CG2-CG2 4.33Å; V304-T335 WeakPolarHBondContact CG2-OG1 3.23Å
305	S	94.5	Very high	94	Very high	29 Å²	29	35.9 Å²	35.9	20%	0.203	19%	0.188	C	C	.	.	H	α-helix	trans	-58.5	-43.9	179.1	70.1	0	0	0	0	111.5	I301 F302 I309	I301-S305 WeakPolarHBondContact O-CB 3.49Å; I301-S305 PolarHBondContact O-N 3.46Å; I301-S305 PolarHBondContact O-OG 2.88Å; F302-S305 PolarHBondContact O-N 3.17Å; F302-S305 PolarHBondContact O-OG 3.4Å; S305-I309 WeakPolarHBondContact O-CB 3.39Å; S305-I309 VanDerWaalsContact O-CD1 3.25Å; S305-I309 WeakPolarHBondContact O-CD1 3.41Å; S305-I309 WeakPolarHBondContact O-CG1 3.21Å; S305-I309 PolarHBondContact O-N 3.47Å
306	L	95	Very high	93.1	Very high	68 Å²	68	39.1 Å²	39.1	36%	0.356	21%	0.205	S	C	.	.	H	α-helix	trans	-64.8	-47.9	178.9	-175.5	154	0	0	0	111.5	F302 A303 V304 I309 I310 L488	F302-L306 HydrophobicContact CE1-CD1 4.35Å; F302-L306 HydrophobicContact CZ-CD1 4.1Å; F302-L306 WeakPolarHBondContact O-CB 3.35Å; F302-L306 PolarHBondContact O-N 3.21Å; A303-L306 PolarHBondContact O-N 2.93Å; V304-L306 VanDerWaalsContact C-N 3.3Å; V304-L306 PolarHBondContact O-N 2.71Å; L306-I309 PolarHBondContact O-N 3.13Å; L306-I310 HydrophobicContact CD2-CD1 3.48Å; L306-I310 VanDerWaalsContact CD2-CD1 3.48Å; L306-I310 HydrophobicContact CD2-CG1 4.47Å; L306-I310 HydrophobicContact CG-CD1 4.28Å; L306-I310 VanDerWaalsContact O-CG1 3.3Å; L306-I310 WeakPolarHBondContact O-CG1 3.38Å; L306-I310 PolarHBondContact O-N 3.28Å; L306-L488 HydrophobicContact CB-CD2 4.45Å
307	I	95	Very high	92.2	Very high	62 Å²	62	39.4 Å²	39.4	32%	0.318	21%	0.207	S	C	.	.	H	α-helix	trans	-66.7	-45.3	-178.5	-67.8	165.9	0	0	0	110.9	A303 V304 I309 I310 V311 V331 T335	A303-I307 WeakPolarHBondContact O-CB 3.18Å; A303-I307 VanDerWaalsContact O-CG1 3.27Å; A303-I307 WeakPolarHBondContact O-CG1 3.34Å; A303-I307 PolarHBondContact O-N 2.89Å; V304-I307 PolarHBondContact O-N 2.89Å; I307-I309 VanDerWaalsContact C-N 3.32Å; I307-I309 PolarHBondContact O-N 3.46Å; I307-I310 PolarHBondContact O-N 2.58Å; I307-V311 HydrophobicContact CG2-CG2 4.18Å; I307-V311 WeakPolarHBondContact O-CB 3.46Å; I307-V311 VanDerWaalsContact O-CG2 3.31Å; I307-V311 WeakPolarHBondContact O-CG2 3.22Å; I307-V311 PolarHBondContact O-N 3.28Å; I307-V331 HydrophobicContact CB-CG1 3.8Å; I307-V331 HydrophobicContact CD1-CG1 4.27Å; I307-V331 HydrophobicContact CG2-CB 4.48Å; I307-V331 HydrophobicContact CG2-CG1 3.62Å; I307-V331 HydrophobicContact CG2-CG2 3.92Å; I307-T335 HydrophobicContact CD1-CG2 3.68Å
308	V	92.9	Very high	91.3	Very high	16 Å²	16	41.4 Å²	41.4	10%	0.097	22%	0.215	C	C	.	.	H	α-helix	trans	-62.7	-39.7	179.4	171.8	0	0	0	0	111	V304 V311 A312 A328 V331	V304-V308 HydrophobicContact CG1-CG2 4.03Å; V304-V308 WeakPolarHBondContact O-CB 3.28Å; V304-V308 VanDerWaalsContact O-CG2 3.25Å; V304-V308 WeakPolarHBondContact O-CG2 3.43Å; V304-V308 PolarHBondContact O-N 3.02Å; V308-V311 PolarHBondContact O-N 2.89Å; V308-A312 WeakPolarHBondContact O-CB 3.33Å; V308-A312 PolarHBondContact O-N 3.33Å; V308-A328 HydrophobicContact CG2-CB 4.27Å; V308-V331 HydrophobicContact CG2-CB 4.13Å; V308-V331 HydrophobicContact CG2-CG1 4.15Å; V308-V331 HydrophobicContact CG2-CG2 4.3Å
309	I	92.3	Very high	90.3	Very high	9 Å²	9	43.3 Å²	43.3	5%	0.046	23%	0.226	C	C	.	.	H	α-helix	trans	-63.5	-44	175.4	-69.4	165.1	0	0	0	111	S305 L306 I307 A312 M313 M484 M485 L488	S305-I309 WeakPolarHBondContact O-CB 3.39Å; S305-I309 VanDerWaalsContact O-CD1 3.25Å; S305-I309 WeakPolarHBondContact O-CD1 3.41Å; S305-I309 WeakPolarHBondContact O-CG1 3.21Å; S305-I309 PolarHBondContact O-N 3.47Å; L306-I309 PolarHBondContact O-N 3.13Å; I307-I309 VanDerWaalsContact C-N 3.32Å; I307-I309 PolarHBondContact O-N 3.46Å; I309-A312 PolarHBondContact O-N 3.29Å; I309-M313 HydrophobicContact CG2-SD 4.26Å; I309-M313 VanDerWaalsContact O-CG 3.31Å; I309-M313 WeakPolarHBondContact O-CG 3.5Å; I309-M313 PolarHBondContact O-N 3.22Å; I309-M484 HydrophobicContact CD1-CE 4.15Å; I309-M484 HydrophobicContact CD1-SD 3.43Å; I309-M484 WeakPolarHBondContact CD1-SD 3.16Å; I309-M484 HydrophobicContact CG1-CE 3.62Å; I309-M484 HydrophobicContact CG1-SD 3.63Å; I309-M485 HydrophobicContact CG2-CB 3.7Å; I309-M485 HydrophobicContact CG2-CG 4.26Å; I309-L488 HydrophobicContact CD1-CB 4.46Å; I309-L488 HydrophobicContact CD1-CD2 3.79Å
310	I	92	Very high	89.4	Confident	62 Å²	62	48.2 Å²	48.2	32%	0.318	25%	0.248	S	C	.	.	H	α-helix	trans	-64.5	-45.3	179.1	-69.8	173.2	0	0	0	110.9	L306 I307 A312 M313 I314	L306-I310 HydrophobicContact CD2-CD1 3.48Å; L306-I310 VanDerWaalsContact CD2-CD1 3.48Å; L306-I310 HydrophobicContact CD2-CG1 4.47Å; L306-I310 HydrophobicContact CG-CD1 4.28Å; L306-I310 VanDerWaalsContact O-CG1 3.3Å; L306-I310 WeakPolarHBondContact O-CG1 3.38Å; L306-I310 PolarHBondContact O-N 3.28Å; I307-I310 PolarHBondContact O-N 2.58Å; I310-A312 VanDerWaalsContact C-N 3.33Å; I310-A312 PolarHBondContact O-N 3.04Å; I310-M313 WeakPolarHBondContact O-CB 3.39Å; I310-M313 PolarHBondContact O-N 2.81Å; I310-M313 VanDerWaalsContact O-N 3.16Å; I310-I314 HydrophobicContact CG2-CD1 3.82Å; I310-I314 WeakPolarHBondContact O-CG1 3.26Å; I310-I314 PolarHBondContact O-N 3.3Å
311	V	91.6	Very high	88.4	Confident	33 Å²	33	49.5 Å²	49.5	20%	0.2	25%	0.253	C	S	.	.	H	α-helix	trans	-63.3	-42.3	177.6	173.1	0	0	0	0	110.1	I307 V308 M313 I314 E315 L317 T327	I307-V311 HydrophobicContact CG2-CG2 4.18Å; I307-V311 WeakPolarHBondContact O-CB 3.46Å; I307-V311 VanDerWaalsContact O-CG2 3.31Å; I307-V311 WeakPolarHBondContact O-CG2 3.22Å; I307-V311 PolarHBondContact O-N 3.28Å; V308-V311 PolarHBondContact O-N 2.89Å; V311-M313 PolarHBondContact O-N 2.93Å; V311-I314 PolarHBondContact O-N 3.11Å; V311-E315 PolarHBondContact O-N 3.41Å; V311-L317 VanDerWaalsContact C-CD1 3.48Å; V311-L317 HydrophobicContact CB-CD1 4.48Å; V311-L317 HydrophobicContact CG1-CD1 3.6Å; V311-L317 HydrophobicContact CG1-CD2 4.42Å; V311-L317 VanDerWaalsContact O-CD1 3.25Å; V311-L317 WeakPolarHBondContact O-CD1 3.48Å; V311-T327 HydrophobicContact CG1-CG2 4Å
312	A	89.2	Confident	87.6	Confident	1 Å²	1	48.6 Å²	48.6	1%	0.008	25%	0.25	C	C	.	.	H	α-helix	trans	-61.6	-26.9	174.5	0	0	0	0	0	114.2	V308 I309 I310 L317 Y481	V308-A312 WeakPolarHBondContact O-CB 3.33Å; V308-A312 PolarHBondContact O-N 3.33Å; I309-A312 PolarHBondContact O-N 3.29Å; I310-A312 VanDerWaalsContact C-N 3.33Å; I310-A312 PolarHBondContact O-N 3.04Å; A312-L317 VanDerWaalsContact CA-CD1 3.5Å; A312-L317 HydrophobicContact CB-CD1 4.39Å; A312-Y481 HydrophobicContact CB-CD1 3.69Å; A312-Y481 HydrophobicContact CB-CD2 4.11Å; A312-Y481 HydrophobicContact CB-CE1 3.81Å; A312-Y481 HydrophobicContact CB-CE2 4.22Å; A312-Y481 HydrophobicContact CB-CG 3.85Å
313	M	85.8	Confident	87	Confident	84 Å²	84	46.4 Å²	46.4	41%	0.414	24%	0.242	S	C	.	.	H	α-helix	trans	-80.6	-24.6	173.9	-72.9	176.6	62.9	0	0	113.8	I309 I310 V311 M485	I309-M313 HydrophobicContact CG2-SD 4.26Å; I309-M313 VanDerWaalsContact O-CG 3.31Å; I309-M313 WeakPolarHBondContact O-CG 3.5Å; I309-M313 PolarHBondContact O-N 3.22Å; I310-M313 WeakPolarHBondContact O-CB 3.39Å; I310-M313 PolarHBondContact O-N 2.81Å; I310-M313 VanDerWaalsContact O-N 3.16Å; V311-M313 PolarHBondContact O-N 2.93Å; M313-M485 HydrophobicContact SD-CB 4.18Å; M313-M485 HydrophobicContact SD-SD 3.97Å
314	I	87.5	Confident	86.4	Confident	128 Å²	128	48.4 Å²	48.4	66%	0.656	25%	0.249	S	C	*	.	H	α-helix	trans	-94	-44.1	-175	-65.9	168.9	0	0	0	111.1	I310 V311	I310-I314 HydrophobicContact CG2-CD1 3.82Å; I310-I314 WeakPolarHBondContact O-CG1 3.26Å; I310-I314 PolarHBondContact O-N 3.3Å; V311-I314 PolarHBondContact O-N 3.11Å
315	E	83.3	Confident	86.1	Confident	126 Å²	126	50.5 Å²	50.5	59%	0.589	26%	0.259	S	S	*	.	S	Bend	trans	-102.4	5.3	-170.7	-68.1	178.2	174	0	0	113.3	V311 L317	V311-E315 PolarHBondContact O-N 3.41Å; E315-L317 VanDerWaalsContact C-N 3.34Å; E315-L317 HydrophobicContact CB-CD1 3.67Å; E315-L317 PolarHBondContact O-N 3.49Å
316	D	78.7	Confident	85.8	Confident	73 Å²	73	50.9 Å²	50.9	39%	0.39	26%	0.262	S	S	.	.			trans	45	56.8	-178.1	-75.6	-31.7	0	0	0	112.3	Y318 T319	D316-Y318 HydrophobicContact CB-CD1 4.08Å; D316-Y318 HydrophobicContact CB-CE1 3.49Å; D316-Y318 VanDerWaalsContact CB-CE1 3.49Å; D316-Y318 PolarHBondContact O-N 3.43Å; D316-Y318 WeakPolarHBondContact OD1-CE1 3.32Å; D316-T319 HydrophobicContact CB-CG2 4.19Å; D316-T319 WeakPolarHBondContact O-CB 3.21Å; D316-T319 WeakPolarHBondContact O-CG2 3.35Å; D316-T319 PolarHBondContact O-N 2.87Å; D316-T319 PolarHBondContact O-OG1 2.88Å
317	L	79.3	Confident	85.6	Confident	5 Å²	5	48.8 Å²	48.8	3%	0.026	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.2	-5.6	-172.4	-91.3	86.2	0	0	0	115.6	V311 A312 E315 T319 T327	V311-L317 VanDerWaalsContact C-CD1 3.48Å; V311-L317 HydrophobicContact CB-CD1 4.48Å; V311-L317 HydrophobicContact CG1-CD1 3.6Å; V311-L317 HydrophobicContact CG1-CD2 4.42Å; V311-L317 VanDerWaalsContact O-CD1 3.25Å; V311-L317 WeakPolarHBondContact O-CD1 3.48Å; A312-L317 VanDerWaalsContact CA-CD1 3.5Å; A312-L317 HydrophobicContact CB-CD1 4.39Å; E315-L317 VanDerWaalsContact C-N 3.34Å; E315-L317 HydrophobicContact CB-CD1 3.67Å; E315-L317 PolarHBondContact O-N 3.49Å; L317-T319 VanDerWaalsContact C-N 3.31Å; L317-T327 HydrophobicContact CD2-CG2 3.89Å
318	Y	78.3	Confident	85.5	Confident	43 Å²	43	47.3 Å²	47.3	17%	0.169	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.8	-12.5	174.6	65.8	-91.3	0	0	0	113.5	F208 L212 D316 I477 Y481	F208-Y318 HydrophobicContact CB-CE2 3.98Å; L212-Y318 HydrophobicContact CD1-CE2 4.37Å; L212-Y318 HydrophobicContact CD2-CD2 4.34Å; L212-Y318 HydrophobicContact CD2-CE2 4.28Å; D316-Y318 HydrophobicContact CB-CD1 4.08Å; D316-Y318 HydrophobicContact CB-CE1 3.49Å; D316-Y318 VanDerWaalsContact CB-CE1 3.49Å; D316-Y318 PolarHBondContact O-N 3.43Å; D316-Y318 WeakPolarHBondContact OD1-CE1 3.32Å; Y318-I477 HydrophobicContact CD2-CG2 4.09Å; Y318-I477 HydrophobicContact CG-CG2 4.1Å; Y318-Y481 HydrophobicContact CD1-CE2 4.08Å
319	T	77.2	Confident	85.5	Confident	39 Å²	39	48.5 Å²	48.5	24%	0.239	25%	0.254	C	S	.	.	S	Bend	trans	-73.7	-37.1	-179.5	53	0	0	0	0	112.3	F208 D316 L317	F208-T319 HydrophobicContact CD2-CG2 3.9Å; F208-T319 HydrophobicContact CE2-CG2 4.22Å; F208-T319 WeakPolarHBondContact CE2-O 3.42Å; F208-T319 WeakPolarHBondContact CZ-O 3.18Å; D316-T319 HydrophobicContact CB-CG2 4.19Å; D316-T319 WeakPolarHBondContact O-CB 3.21Å; D316-T319 WeakPolarHBondContact O-CG2 3.35Å; D316-T319 PolarHBondContact O-N 2.87Å; D316-T319 PolarHBondContact O-OG1 2.88Å; L317-T319 VanDerWaalsContact C-N 3.31Å
320	E	79	Confident	85.5	Confident	112 Å²	112	55.4 Å²	55.4	52%	0.523	28%	0.284	S	S	.	.	S	Bend	trans	-98.8	143.5	179.7	-69.9	-179.4	179.4	0	0	112.6	S323	E320-S323 PolarHBondContact OE2-OG 3.38Å
321	R	76.3	Confident	85.6	Confident	27 Å²	27	53 Å²	53	10%	0.102	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.8	132.7	178.4	-65.8	176.7	-71.8	170.4	3.1	110.8	E82 L89 Y133 D136 S323	E82-R321 HydrophobicContact CG-CB 3.99Å; E82-R321 WeakPolarHBondContact OE1-CB 3.38Å; E82-R321 IonicContact OE1-CZ 3.65Å; E82-R321 IonicContact OE1-NE 2.72Å; E82-R321 PolarHBondContact OE1-NE 3.35Å; E82-R321 IonicContact OE1-NH2 3.22Å; L89-R321 VanDerWaalsContact CD2-NH1 3.31Å; Y133-R321 HydrophobicContact CE1-CG 4.11Å; D136-R321 IonicContact OD1-CZ 3.39Å; D136-R321 IonicContact OD1-NE 3.96Å; D136-R321 PolarHBondContact OD1-NE 3.49Å; D136-R321 IonicContact OD1-NH2 3.47Å; D136-R321 PolarHBondContact OD1-NH2 2.96Å; R321-S323 PolarHBondContact O-N 3.2Å
322	G	80.1	Confident	85.8	Confident	5 Å²	5	53 Å²	53	5%	0.052	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	69	-7.8	176.9	0	0	0	0	0	116.2	M324 L325 S326	G322-M324 PolarHBondContact O-N 3.08Å; G322-L325 PolarHBondContact O-N 3.28Å; G322-S326 PolarHBondContact O-N 3.03Å; G322-S326 VanDerWaalsContact O-N 3.1Å; G322-S326 PolarHBondContact O-OG 2.92Å
323	S	85	Confident	86.1	Confident	15 Å²	15	53.3 Å²	53.3	11%	0.105	27%	0.271	C	S	.	.	H	α-helix	trans	-60.2	-40.2	-172.4	-174.7	0	0	0	0	113.1	E320 R321 L325 S326 T327	E320-S323 PolarHBondContact OE2-OG 3.38Å; R321-S323 PolarHBondContact O-N 3.2Å; S323-L325 VanDerWaalsContact C-N 3.29Å; S323-L325 PolarHBondContact O-N 3.39Å; S323-S326 VanDerWaalsContact CA-OG 3.32Å; S323-S326 WeakPolarHBondContact CA-OG 3.4Å; S323-S326 PolarHBondContact O-N 3.26Å; S323-S326 PolarHBondContact O-OG 3.45Å; S323-T327 VanDerWaalsContact O-CB 3.23Å; S323-T327 WeakPolarHBondContact O-CB 3.32Å; S323-T327 PolarHBondContact O-N 3.17Å; S323-T327 PolarHBondContact O-OG1 3.38Å
324	M	85.8	Confident	86.5	Confident	63 Å²	63	52 Å²	52	31%	0.31	27%	0.273	S	S	.	.	H	α-helix	trans	-57.1	-41.6	174.8	-172.5	-173.9	-177.8	0	0	112.6	G322 A328 F472	G322-M324 PolarHBondContact O-N 3.08Å; M324-A328 WeakPolarHBondContact O-CB 3.08Å; M324-A328 PolarHBondContact O-N 2.82Å; M324-F472 HydrophobicContact CE-CZ 4.46Å
325	L	89	Confident	86.9	Confident	61 Å²	61	46.5 Å²	46.5	32%	0.319	25%	0.246	S	C	.	.	H	α-helix	trans	-74.8	-44.3	-177.7	-178	63.4	0	0	0	111.4	L84 Q85 G322 S323 T327 A328 I329	L84-L325 HydrophobicContact CB-CD2 3.55Å; L84-L325 HydrophobicContact CD1-CD2 4.16Å; Q85-L325 HydrophobicContact CG-CD2 4.1Å; G322-L325 PolarHBondContact O-N 3.28Å; S323-L325 VanDerWaalsContact C-N 3.29Å; S323-L325 PolarHBondContact O-N 3.39Å; L325-T327 VanDerWaalsContact C-N 3.35Å; L325-A328 PolarHBondContact O-N 3.26Å; L325-I329 HydrophobicContact CD1-CD1 4.42Å; L325-I329 HydrophobicContact CG-CD1 4.2Å; L325-I329 WeakPolarHBondContact O-CG1 3.25Å; L325-I329 PolarHBondContact O-N 3.33Å
326	S	89.2	Confident	87.6	Confident	37 Å²	37	40.5 Å²	40.5	26%	0.259	22%	0.218	S	C	.	.	H	α-helix	trans	-62	-43.4	176.4	48.6	0	0	0	0	111.6	G322 S323 A328 I329 F330	G322-S326 PolarHBondContact O-N 3.03Å; G322-S326 VanDerWaalsContact O-N 3.1Å; G322-S326 PolarHBondContact O-OG 2.92Å; S323-S326 VanDerWaalsContact CA-OG 3.32Å; S323-S326 WeakPolarHBondContact CA-OG 3.4Å; S323-S326 PolarHBondContact O-N 3.26Å; S323-S326 PolarHBondContact O-OG 3.45Å; S326-A328 PolarHBondContact O-N 3.11Å; S326-I329 PolarHBondContact O-N 3.37Å; S326-F330 WeakPolarHBondContact O-CB 3.49Å; S326-F330 PolarHBondContact O-N 3.33Å
327	T	90.6	Very high	88.5	Confident	24 Å²	24	38.8 Å²	38.8	15%	0.147	21%	0.211	C	C	.	.	H	α-helix	trans	-62.6	-43	176	-63.9	0	0	0	0	111.1	V311 L317 S323 L325 I329 F330 V331	V311-T327 HydrophobicContact CG1-CG2 4Å; L317-T327 HydrophobicContact CD2-CG2 3.89Å; S323-T327 VanDerWaalsContact O-CB 3.23Å; S323-T327 WeakPolarHBondContact O-CB 3.32Å; S323-T327 PolarHBondContact O-N 3.17Å; S323-T327 PolarHBondContact O-OG1 3.38Å; L325-T327 VanDerWaalsContact C-N 3.35Å; T327-I329 PolarHBondContact O-N 3.23Å; T327-F330 PolarHBondContact O-N 3.48Å; T327-V331 HydrophobicContact CG2-CG2 4.06Å; T327-V331 WeakPolarHBondContact O-CB 3.48Å; T327-V331 WeakPolarHBondContact O-CG2 3.33Å; T327-V331 PolarHBondContact O-N 2.75Å
328	A	92.7	Very high	89.3	Confident	30 Å²	30	40.6 Å²	40.6	25%	0.248	22%	0.222	C	C	.	.	H	α-helix	trans	-60.6	-42	175.8	0	0	0	0	0	112.7	V308 M324 L325 S326 Y332	V308-A328 HydrophobicContact CG2-CB 4.27Å; M324-A328 WeakPolarHBondContact O-CB 3.08Å; M324-A328 PolarHBondContact O-N 2.82Å; L325-A328 PolarHBondContact O-N 3.26Å; S326-A328 PolarHBondContact O-N 3.11Å; A328-Y332 WeakPolarHBondContact O-CB 3.21Å; A328-Y332 PolarHBondContact O-N 2.7Å
329	I	92.9	Very high	90.3	Very high	41 Å²	41	38.6 Å²	38.6	21%	0.21	21%	0.214	C	C	.	.	H	α-helix	trans	-65.3	-45	177	-67.2	166.2	0	0	0	110.8	L84 L325 S326 T327 Y332 A333 I401	L84-I329 HydrophobicContact CD1-CD1 3.39Å; L325-I329 HydrophobicContact CD1-CD1 4.42Å; L325-I329 HydrophobicContact CG-CD1 4.2Å; L325-I329 WeakPolarHBondContact O-CG1 3.25Å; L325-I329 PolarHBondContact O-N 3.33Å; S326-I329 PolarHBondContact O-N 3.37Å; T327-I329 PolarHBondContact O-N 3.23Å; I329-Y332 PolarHBondContact O-N 3.24Å; I329-A333 PolarHBondContact O-N 2.91Å; I329-I401 HydrophobicContact CG2-CD1 4.32Å
330	F	92.2	Very high	91.2	Very high	155 Å²	155	36.8 Å²	36.8	68%	0.68	20%	0.204	S	C	*	.	H	α-helix	trans	-64.2	-47	179.2	-178.8	-98.3	0	0	0	111.9	S326 T327 Y332 A333 A334	S326-F330 WeakPolarHBondContact O-CB 3.49Å; S326-F330 PolarHBondContact O-N 3.33Å; T327-F330 PolarHBondContact O-N 3.48Å; F330-Y332 VanDerWaalsContact C-N 3.33Å; F330-Y332 PolarHBondContact O-N 3.23Å; F330-A333 PolarHBondContact O-N 3.06Å; F330-A334 WeakPolarHBondContact O-CB 3.42Å; F330-A334 PolarHBondContact O-N 3.18Å
331	V	94.7	Very high	92.1	Very high	11 Å²	11	35.2 Å²	35.2	7%	0.067	19%	0.193	C	C	.	.	H	α-helix	trans	-63.5	-39.6	176.5	173	0	0	0	0	110.8	V304 I307 V308 T327 A333 A334 T335	V304-V331 HydrophobicContact CB-CG1 4.4Å; V304-V331 HydrophobicContact CG1-CG1 4.2Å; V304-V331 HydrophobicContact CG2-CG1 4.28Å; I307-V331 HydrophobicContact CB-CG1 3.8Å; I307-V331 HydrophobicContact CD1-CG1 4.27Å; I307-V331 HydrophobicContact CG2-CB 4.48Å; I307-V331 HydrophobicContact CG2-CG1 3.62Å; I307-V331 HydrophobicContact CG2-CG2 3.92Å; V308-V331 HydrophobicContact CG2-CB 4.13Å; V308-V331 HydrophobicContact CG2-CG1 4.15Å; V308-V331 HydrophobicContact CG2-CG2 4.3Å; T327-V331 HydrophobicContact CG2-CG2 4.06Å; T327-V331 WeakPolarHBondContact O-CB 3.48Å; T327-V331 WeakPolarHBondContact O-CG2 3.33Å; T327-V331 PolarHBondContact O-N 2.75Å; V331-A333 VanDerWaalsContact C-N 3.35Å; V331-A333 PolarHBondContact O-N 3.37Å; V331-A334 PolarHBondContact O-N 2.9Å; V331-T335 HydrophobicContact CG1-CG2 4.18Å; V331-T335 WeakPolarHBondContact O-CB 3.21Å; V331-T335 VanDerWaalsContact O-CG2 3.3Å; V331-T335 WeakPolarHBondContact O-CG2 3.38Å; V331-T335 PolarHBondContact O-N 3.49Å; V331-T335 PolarHBondContact O-OG1 3.47Å
332	Y	95.8	Very high	93.1	Very high	33 Å²	33	37.2 Å²	37.2	13%	0.129	20%	0.203	C	C	.	.	H	α-helix	trans	-59.9	-45.2	174	-175.4	-90.6	0	0	0	111.7	Q300 V304 A328 I329 F330 T335 S336 I366 P367 I406	Q300-Y332 VanDerWaalsContact CD-CE2 3.44Å; Q300-Y332 HydrophobicContact CG-CD2 4.47Å; Q300-Y332 HydrophobicContact CG-CE2 4.12Å; Q300-Y332 VanDerWaalsContact NE2-CE2 3.35Å; Q300-Y332 PolarHBondContact NE2-O 3.49Å; Q300-Y332 PolarHBondContact OE1-OH 3.4Å; Q300-Y332 VanDerWaalsContact OE1-OH 3.08Å; V304-Y332 HydrophobicContact CG2-CD2 3.98Å; A328-Y332 WeakPolarHBondContact O-CB 3.21Å; A328-Y332 PolarHBondContact O-N 2.7Å; I329-Y332 PolarHBondContact O-N 3.24Å; F330-Y332 VanDerWaalsContact C-N 3.33Å; F330-Y332 PolarHBondContact O-N 3.23Å; Y332-T335 PolarHBondContact O-N 3.05Å; Y332-T335 PolarHBondContact O-OG1 3.41Å; Y332-S336 PolarHBondContact O-N 3.1Å; Y332-S336 PolarHBondContact O-OG 3.23Å; Y332-I366 HydrophobicContact CE2-CG2 4.38Å; Y332-P367 HydrophobicContact CE1-CG 3.95Å; Y332-I406 HydrophobicContact CD1-CD1 3.92Å; Y332-I406 HydrophobicContact CE1-CD1 3.89Å
333	A	95.1	Very high	93.8	Very high	7 Å²	7	37 Å²	37	6%	0.058	20%	0.2	C	C	.	.	H	α-helix	trans	-63.4	-46.6	176.2	0	0	0	0	0	111.9	I329 F330 V331 T335 S336 I401 V405 I406 L409	I329-A333 PolarHBondContact O-N 2.91Å; F330-A333 PolarHBondContact O-N 3.06Å; V331-A333 VanDerWaalsContact C-N 3.35Å; V331-A333 PolarHBondContact O-N 3.37Å; A333-T335 VanDerWaalsContact C-N 3.34Å; A333-T335 PolarHBondContact O-N 2.96Å; A333-S336 VanDerWaalsContact O-CB 3.26Å; A333-S336 WeakPolarHBondContact O-CB 3.29Å; A333-S336 PolarHBondContact O-N 3.35Å; A333-S336 PolarHBondContact O-OG 3.22Å; A333-I401 HydrophobicContact CB-CG2 4.24Å; A333-V405 HydrophobicContact CB-CG1 3.99Å; A333-I406 HydrophobicContact CB-CG1 4.1Å; A333-L409 VanDerWaalsContact O-CD1 3.32Å; A333-L409 WeakPolarHBondContact O-CD1 3.31Å
334	A	94.9	Very high	94.4	Very high	56 Å²	56	36.3 Å²	36.3	46%	0.463	20%	0.195	S	C	.	.	H	α-helix	trans	-63.6	-35.2	179.7	0	0	0	0	0	113.3	F330 V331 S336 P337	F330-A334 WeakPolarHBondContact O-CB 3.42Å; F330-A334 PolarHBondContact O-N 3.18Å; V331-A334 PolarHBondContact O-N 2.9Å; A334-S336 VanDerWaalsContact C-N 3.32Å; A334-S336 PolarHBondContact O-N 2.97Å; A334-P337 WeakPolarHBondContact O-CD 3.38Å
335	T	95.9	Very high	94.9	Very high	13 Å²	13	33.7 Å²	33.7	8%	0.08	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85	2.2	179.2	56.3	0	0	0	0	114	A303 V304 I307 V331 Y332 A333 P337 V338	A303-T335 HydrophobicContact CB-CG2 4.45Å; V304-T335 HydrophobicContact CG2-CG2 4.33Å; V304-T335 WeakPolarHBondContact CG2-OG1 3.23Å; I307-T335 HydrophobicContact CD1-CG2 3.68Å; V331-T335 HydrophobicContact CG1-CG2 4.18Å; V331-T335 WeakPolarHBondContact O-CB 3.21Å; V331-T335 VanDerWaalsContact O-CG2 3.3Å; V331-T335 WeakPolarHBondContact O-CG2 3.38Å; V331-T335 PolarHBondContact O-N 3.49Å; V331-T335 PolarHBondContact O-OG1 3.47Å; Y332-T335 PolarHBondContact O-N 3.05Å; Y332-T335 PolarHBondContact O-OG1 3.41Å; A333-T335 VanDerWaalsContact C-N 3.34Å; A333-T335 PolarHBondContact O-N 2.96Å; T335-P337 VanDerWaalsContact C-N 3.27Å; T335-P337 VanDerWaalsContact O-N 3.14Å; T335-V338 WeakPolarHBondContact O-CB 3.49Å; T335-V338 WeakPolarHBondContact O-CG2 3.31Å; T335-V338 PolarHBondContact O-N 2.76Å
336	S	96.8	Very high	95.2	Very high	1 Å²	1	31.3 Å²	31.3	1%	0.007	17%	0.171	C	C	.	.	H	α-helix	trans	-49.7	-35.4	175.7	-57.9	0	0	0	0	115	Y332 A333 A334 V338 N339 G340 N410	Y332-S336 PolarHBondContact O-N 3.1Å; Y332-S336 PolarHBondContact O-OG 3.23Å; A333-S336 VanDerWaalsContact O-CB 3.26Å; A333-S336 WeakPolarHBondContact O-CB 3.29Å; A333-S336 PolarHBondContact O-N 3.35Å; A333-S336 PolarHBondContact O-OG 3.22Å; A334-S336 VanDerWaalsContact C-N 3.32Å; A334-S336 PolarHBondContact O-N 2.97Å; S336-V338 PolarHBondContact O-N 3.19Å; S336-N339 WeakPolarHBondContact O-CB 3.44Å; S336-N339 PolarHBondContact O-N 2.87Å; S336-G340 PolarHBondContact O-N 3.34Å; S336-N410 PolarHBondContact O-OD1 3.42Å
337	P	97.3	Very high	95.5	Very high	36 Å²	36	30.1 Å²	30.1	23%	0.234	16%	0.161	C	C	.	.	H	α-helix	trans	-61.9	-26.5	175.4	-23.3	35.3	0	0	0	113.9	A334 T335 G340 Y341 L409 G413	A334-P337 WeakPolarHBondContact O-CD 3.38Å; T335-P337 VanDerWaalsContact C-N 3.27Å; T335-P337 VanDerWaalsContact O-N 3.14Å; P337-G340 PolarHBondContact O-N 2.87Å; P337-Y341 VanDerWaalsContact O-CB 3.3Å; P337-Y341 WeakPolarHBondContact O-CB 3.23Å; P337-Y341 PolarHBondContact O-N 3.06Å; P337-L409 HydrophobicContact CG-CB 4.04Å; P337-L409 HydrophobicContact CG-CD2 4.38Å; P337-G413 VanDerWaalsContact O-CA 3.3Å; P337-G413 WeakPolarHBondContact O-CA 3.3Å
338	V	97.4	Very high	95.7	Very high	43 Å²	43	29.8 Å²	29.8	26%	0.261	16%	0.161	S	C	.	.	H	α-helix	trans	-64.2	-45.1	176.9	179.7	0	0	0	0	110.2	C299 A303 T335 S336 G340 Y341 F342	C299-V338 HydrophobicContact CB-CG1 4.35Å; A303-V338 HydrophobicContact CB-CG1 4.45Å; T335-V338 WeakPolarHBondContact O-CB 3.49Å; T335-V338 WeakPolarHBondContact O-CG2 3.31Å; T335-V338 PolarHBondContact O-N 2.76Å; S336-V338 PolarHBondContact O-N 3.19Å; V338-G340 PolarHBondContact O-N 3.4Å; V338-Y341 PolarHBondContact O-N 3.42Å; V338-F342 HydrophobicContact CG1-CD2 3.66Å; V338-F342 HydrophobicContact CG1-CE2 3.78Å; V338-F342 WeakPolarHBondContact O-CD2 3.3Å; V338-F342 PolarHBondContact O-N 3.42Å
339	N	97.5	Very high	95.7	Very high	2 Å²	2	31.2 Å²	31.2	1%	0.011	16%	0.16	C	C	.	.	H	α-helix	trans	-57	-52.1	175.7	-173.9	-13	0	0	0	110.8	G296 S297 Q300 S336 Y341 G343 G362	G296-N339 VanDerWaalsContact C-OD1 3.25Å; G296-N339 WeakPolarHBondContact O-CA 3.41Å; S297-N339 PolarHBondContact N-OD1 3.32Å; Q300-N339 HydrophobicContact CB-CB 3.92Å; Q300-N339 HydrophobicContact CG-CB 4.29Å; Q300-N339 PolarHBondContact OE1-ND2 3.38Å; S336-N339 WeakPolarHBondContact O-CB 3.44Å; S336-N339 PolarHBondContact O-N 2.87Å; N339-Y341 VanDerWaalsContact C-N 3.33Å; N339-Y341 PolarHBondContact O-N 3.37Å; N339-G343 PolarHBondContact O-N 2.85Å; N339-G362 PolarHBondContact ND2-O 2.87Å
340	G	96.9	Very high	95.7	Very high	1 Å²	1	30.3 Å²	30.3	1%	0.01	16%	0.155	C	C	.	.	H	α-helix	trans	-60.4	-42.9	-180	0	0	0	0	0	112	S336 P337 V338 G344 N410 G413 T414	S336-G340 PolarHBondContact O-N 3.34Å; P337-G340 PolarHBondContact O-N 2.87Å; V338-G340 PolarHBondContact O-N 3.4Å; G340-G344 VanDerWaalsContact O-CA 3.28Å; G340-G344 WeakPolarHBondContact O-CA 2.93Å; G340-G344 PolarHBondContact O-N 3.31Å; G340-N410 WeakPolarHBondContact CA-OD1 3.4Å; G340-N410 PolarHBondContact N-OD1 2.73Å; G340-G413 CarbonylContact C-O 3.56Å; G340-T414 WeakPolarHBondContact CA-OG1 3.22Å; G340-T414 VanDerWaalsContact O-CA 3.29Å; G340-T414 WeakPolarHBondContact O-CA 3.36Å
341	Y	97.5	Very high	95.6	Very high	79 Å²	79	25.7 Å²	25.7	31%	0.31	15%	0.151	S	C	.	.	H	α-helix	trans	-63.2	-54.6	-179.5	-178.2	-89.8	0	0	0	112.1	P337 V338 N339 S345 G413 L416 L420 S421	P337-Y341 VanDerWaalsContact O-CB 3.3Å; P337-Y341 WeakPolarHBondContact O-CB 3.23Å; P337-Y341 PolarHBondContact O-N 3.06Å; V338-Y341 PolarHBondContact O-N 3.42Å; N339-Y341 VanDerWaalsContact C-N 3.33Å; N339-Y341 PolarHBondContact O-N 3.37Å; Y341-S345 WeakPolarHBondContact O-CB 3.2Å; Y341-S345 PolarHBondContact O-N 2.85Å; Y341-S345 PolarHBondContact O-OG 3.02Å; Y341-G413 VanDerWaalsContact CA-O 3.23Å; Y341-G413 WeakPolarHBondContact CA-O 3.45Å; Y341-G413 PolarHBondContact N-O 3.4Å; Y341-L416 HydrophobicContact CD2-CB 4.31Å; Y341-L420 HydrophobicContact CE2-CD1 4.47Å; Y341-S421 PolarHBondContact OH-OG 2.93Å
342	F	96.9	Very high	95.4	Very high	69 Å²	69	25.8 Å²	25.8	30%	0.303	15%	0.154	S	C	.	.	H	α-helix	trans	-70.6	-41.8	-177.6	-76.5	-76.8	0	0	0	112.2	C299 V338 S345 L346 M573	C299-F342 HydrophobicContact CB-CB 4.17Å; C299-F342 HydrophobicContact CB-CD2 3.77Å; C299-F342 HydrophobicContact CB-CE2 4.37Å; C299-F342 HydrophobicContact CB-CG 3.99Å; V338-F342 HydrophobicContact CG1-CD2 3.66Å; V338-F342 HydrophobicContact CG1-CE2 3.78Å; V338-F342 WeakPolarHBondContact O-CD2 3.3Å; V338-F342 PolarHBondContact O-N 3.42Å; F342-S345 PolarHBondContact O-OG 3.4Å; F342-S345 VanDerWaalsContact O-OG 3.07Å; F342-L346 WeakPolarHBondContact O-CB 3.42Å; F342-L346 PolarHBondContact O-N 3.31Å; F342-M573 HydrophobicContact CD1-CE 4.5Å; F342-M573 HydrophobicContact CE1-CE 3.86Å; F342-M573 HydrophobicContact CZ-CE 4.44Å
343	G	96.7	Very high	95.2	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-68.9	-46.7	177.6	0	0	0	0	0	112.8	S292 N339 L346 Y347	S292-G343 WeakPolarHBondContact O-CA 3.43Å; N339-G343 PolarHBondContact O-N 2.85Å; G343-L346 PolarHBondContact O-N 2.88Å; G343-Y347 WeakPolarHBondContact O-CB 3.26Å; G343-Y347 PolarHBondContact O-N 3.39Å
344	G	96.7	Very high	95.2	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-65.7	-41.6	-179.7	0	0	0	0	0	113.3	G340 A348 R418	G340-G344 VanDerWaalsContact O-CA 3.28Å; G340-G344 WeakPolarHBondContact O-CA 2.93Å; G340-G344 PolarHBondContact O-N 3.31Å; G344-A348 WeakPolarHBondContact O-CB 3.25Å; G344-A348 PolarHBondContact O-N 2.69Å; G344-R418 VanDerWaalsContact O-CG 3.31Å; G344-R418 WeakPolarHBondContact O-CG 3.18Å
345	S	95.7	Very high	95.1	Very high	9 Å²	9	43.5 Å²	43.5	6%	0.063	21%	0.207	C	C	.	.	H	α-helix	trans	-64.7	-47	176.1	60.4	0	0	0	0	111.8	Y341 F342 Y347 A348 R349 G417 S421	Y341-S345 WeakPolarHBondContact O-CB 3.2Å; Y341-S345 PolarHBondContact O-N 2.85Å; Y341-S345 PolarHBondContact O-OG 3.02Å; F342-S345 PolarHBondContact O-OG 3.4Å; F342-S345 VanDerWaalsContact O-OG 3.07Å; S345-Y347 PolarHBondContact O-N 3.33Å; S345-A348 PolarHBondContact O-N 3.17Å; S345-R349 VanDerWaalsContact O-CG 3.31Å; S345-R349 WeakPolarHBondContact O-CG 3.43Å; S345-R349 PolarHBondContact O-N 3.48Å; S345-G417 VanDerWaalsContact CB-O 3.26Å; S345-G417 WeakPolarHBondContact CB-O 3.49Å; S345-S421 WeakPolarHBondContact CB-OG 3.31Å
346	L	95.2	Very high	95.2	Very high	11 Å²	11	46.9 Å²	46.9	6%	0.058	22%	0.224	C	C	.	.	H	α-helix	trans	-63.5	-42.5	178.9	-178.8	58.1	0	0	0	111.8	F291 I295 F342 G343 A348 R349 Q350 Y572	F291-L346 HydrophobicContact CD1-CD2 4.21Å; F291-L346 HydrophobicContact CE1-CD2 4.07Å; I295-L346 HydrophobicContact CB-CD2 3.92Å; I295-L346 HydrophobicContact CG1-CD2 3.82Å; I295-L346 HydrophobicContact CG2-CD2 4Å; F342-L346 WeakPolarHBondContact O-CB 3.42Å; F342-L346 PolarHBondContact O-N 3.31Å; G343-L346 PolarHBondContact O-N 2.88Å; L346-A348 VanDerWaalsContact C-N 3.33Å; L346-A348 PolarHBondContact O-N 2.88Å; L346-R349 PolarHBondContact O-N 3.39Å; L346-Q350 HydrophobicContact CD1-CG 4.46Å; L346-Q350 WeakPolarHBondContact O-CG 3.38Å; L346-Q350 PolarHBondContact O-N 2.91Å; L346-Q350 VanDerWaalsContact O-N 3.09Å; L346-Y572 HydrophobicContact CD1-CE1 4.22Å; L346-Y572 VanDerWaalsContact CD1-OH 3.31Å; L346-Y572 WeakPolarHBondContact CD1-OH 3.48Å; L346-Y572 HydrophobicContact CD2-CE1 3.75Å
347	Y	96.5	Very high	95.1	Very high	11 Å²	11	52.5 Å²	52.5	4%	0.043	25%	0.248	C	C	.	.	H	α-helix	trans	-63.3	-39	176.9	-171.6	-113.5	0	0	0	112.6	P288 L289 S292 G343 S345 Q350 G352 R354 W355 Q358	P288-Y347 HydrophobicContact CB-CD2 4.37Å; P288-Y347 HydrophobicContact CB-CE2 4.3Å; P288-Y347 HydrophobicContact CG-CE2 4.41Å; L289-Y347 HydrophobicContact CB-CE2 4.06Å; L289-Y347 HydrophobicContact CG-CE2 4.5Å; S292-Y347 WeakPolarHBondContact OG-CD2 3.48Å; G343-Y347 WeakPolarHBondContact O-CB 3.26Å; G343-Y347 PolarHBondContact O-N 3.39Å; S345-Y347 PolarHBondContact O-N 3.33Å; Y347-Q350 PolarHBondContact O-N 3.48Å; Y347-G352 VanDerWaalsContact CE1-CA 3.47Å; Y347-G352 WeakPolarHBondContact CE1-O 3.07Å; Y347-G352 VanDerWaalsContact CZ-CA 3.41Å; Y347-G352 WeakPolarHBondContact O-CA 3.42Å; Y347-G352 PolarHBondContact O-N 3Å; Y347-R354 PolarHBondContact OH-N 3.16Å; Y347-W355 HydrophobicContact CD1-CB 4.33Å; Y347-W355 HydrophobicContact CE1-CB 4.37Å; Y347-Q358 HydrophobicContact CD1-CB 3.95Å; Y347-Q358 HydrophobicContact CD1-CG 4.17Å; Y347-Q358 HydrophobicContact CD2-CB 4.41Å; Y347-Q358 HydrophobicContact CD2-CG 4.13Å; Y347-Q358 HydrophobicContact CE1-CB 4.17Å; Y347-Q358 HydrophobicContact CG-CB 4.08Å; Y347-Q358 HydrophobicContact CG-CG 3.82Å
348	A	95.2	Very high	95.1	Very high	18 Å²	18	50.9 Å²	50.9	15%	0.149	24%	0.238	C	C	.	.	H	α-helix	trans	-64.4	-44.8	173.9	0	0	0	0	0	111.9	G344 S345 L346 Q350 G351 R418 G422	G344-A348 WeakPolarHBondContact O-CB 3.25Å; G344-A348 PolarHBondContact O-N 2.69Å; S345-A348 PolarHBondContact O-N 3.17Å; L346-A348 VanDerWaalsContact C-N 3.33Å; L346-A348 PolarHBondContact O-N 2.88Å; A348-Q350 PolarHBondContact O-N 3.14Å; A348-G351 PolarHBondContact O-N 3.09Å; A348-R418 HydrophobicContact CB-CG 4.21Å; A348-G422 CarbonylContact C-O 3.51Å; A348-G422 VanDerWaalsContact C-O 3.28Å
349	R	92.7	Very high	95	Very high	59 Å²	59	49.2 Å²	49.2	22%	0.223	23%	0.227	C	C	.	.	H	α-helix	trans	-61.3	-29.4	178	-72.8	172.7	64.8	-175.9	-0.7	113.2	S345 L346 G351 S421 G422	S345-R349 VanDerWaalsContact O-CG 3.31Å; S345-R349 WeakPolarHBondContact O-CG 3.43Å; S345-R349 PolarHBondContact O-N 3.48Å; L346-R349 PolarHBondContact O-N 3.39Å; R349-G351 VanDerWaalsContact C-N 3.27Å; R349-G351 PolarHBondContact O-N 3.13Å; R349-S421 VanDerWaalsContact CD-O 3.29Å; R349-S421 WeakPolarHBondContact CD-O 3.16Å; R349-S421 WeakPolarHBondContact CG-O 3.49Å; R349-G422 WeakPolarHBondContact CA-O 3.34Å; R349-G422 PolarHBondContact N-O 3.44Å
350	Q	92.2	Very high	95	Very high	22 Å²	22	53.6 Å²	53.6	10%	0.103	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.5	4.6	175.2	-68.7	-177	-25.1	0	0	113.7	P284 S285 P288 L346 Y347 A348	P284-Q350 HydrophobicContact CB-CB 4.06Å; P284-Q350 HydrophobicContact CB-CG 4.42Å; S285-Q350 PolarHBondContact OG-NE2 3.36Å; S285-Q350 PolarHBondContact OG-OE1 3.34Å; P288-Q350 HydrophobicContact CB-CB 4.27Å; L346-Q350 HydrophobicContact CD1-CG 4.46Å; L346-Q350 WeakPolarHBondContact O-CG 3.38Å; L346-Q350 PolarHBondContact O-N 2.91Å; L346-Q350 VanDerWaalsContact O-N 3.09Å; Y347-Q350 PolarHBondContact O-N 3.48Å; A348-Q350 PolarHBondContact O-N 3.14Å
351	G	90.4	Very high	95	Very high	59 Å²	59	57 Å²	57	61%	0.608	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.4	17.6	-179.9	0	0	0	0	0	114.5	A348 R349 R353	A348-G351 PolarHBondContact O-N 3.09Å; R349-G351 VanDerWaalsContact C-N 3.27Å; R349-G351 PolarHBondContact O-N 3.13Å; G351-R353 PolarHBondContact O-N 3.46Å
352	G	90.7	Very high	94.9	Very high	12 Å²	12	53.2 Å²	53.2	12%	0.124	25%	0.249	C	C	.	.			trans	-68.7	117.9	-179.4	0	0	0	0	0	113.6	Y347	Y347-G352 VanDerWaalsContact CE1-CA 3.47Å; Y347-G352 WeakPolarHBondContact CE1-O 3.07Å; Y347-G352 VanDerWaalsContact CZ-CA 3.41Å; Y347-G352 WeakPolarHBondContact O-CA 3.42Å; Y347-G352 PolarHBondContact O-N 3Å
353	R	90.9	Very high	94.8	Very high	230 Å²	230	50 Å²	50	87%	0.868	24%	0.235	S	C	*	.			trans	-85.5	-31.5	179.8	-62.3	-171.7	-179.3	-162.6	0.4	114.3	G351 W355	G351-R353 PolarHBondContact O-N 3.46Å; R353-W355 VanDerWaalsContact C-N 3.28Å; R353-W355 PolarHBondContact O-N 3.16Å
354	R	94.5	Very high	94.8	Very high	157 Å²	157	52.3 Å²	52.3	59%	0.592	25%	0.245	S	C	*	.			trans	-88.4	57.6	-173.6	-64.3	-175.8	-66.9	-174.4	-0.2	112.2	Y347 I356 K357 Q358	Y347-R354 PolarHBondContact OH-N 3.16Å; R354-I356 VanDerWaalsContact C-N 3.35Å; R354-I356 PolarHBondContact O-N 2.94Å; R354-K357 PolarHBondContact O-N 3.37Å; R354-Q358 PolarHBondContact O-N 3.19Å
355	W	94.4	Very high	94.7	Very high	81 Å²	81	55 Å²	55	31%	0.307	26%	0.259	S	S	.	.	H	α-helix	trans	-65.9	-32.9	-170.3	66	-92.1	0	0	0	114	Y347 R353 K357 Q358 M359 L411 T414 R418	Y347-W355 HydrophobicContact CD1-CB 4.33Å; Y347-W355 HydrophobicContact CE1-CB 4.37Å; R353-W355 VanDerWaalsContact C-N 3.28Å; R353-W355 PolarHBondContact O-N 3.16Å; W355-K357 VanDerWaalsContact C-N 3.29Å; W355-K357 PolarHBondContact O-N 3.24Å; W355-Q358 PolarHBondContact O-N 3.5Å; W355-Q358 VanDerWaalsContact O-N 3.17Å; W355-M359 PolarHBondContact O-N 2.96Å; W355-L411 HydrophobicContact CZ3-CD1 4.11Å; W355-T414 HydrophobicContact CE3-CG2 4.21Å; W355-R418 VanDerWaalsContact CB-NH1 3.34Å
356	I	96.5	Very high	94.7	Very high	85 Å²	85	55.1 Å²	55.1	44%	0.436	26%	0.259	S	S	.	.	H	α-helix	trans	-59.9	-42.1	175.5	-61.3	173.6	0	0	0	110.4	R354 Q358 M359 F360	R354-I356 VanDerWaalsContact C-N 3.35Å; R354-I356 PolarHBondContact O-N 2.94Å; I356-Q358 VanDerWaalsContact C-N 3.34Å; I356-Q358 PolarHBondContact O-N 2.86Å; I356-M359 WeakPolarHBondContact O-CB 3.04Å; I356-M359 PolarHBondContact O-N 3.38Å; I356-F360 HydrophobicContact CG2-CD2 3.72Å; I356-F360 HydrophobicContact CG2-CE2 3.65Å; I356-F360 VanDerWaalsContact O-CD2 3.28Å; I356-F360 WeakPolarHBondContact O-CD2 3.45Å; I356-F360 PolarHBondContact O-N 3.44Å
357	K	96.1	Very high	94.7	Very high	118 Å²	118	55.2 Å²	55.2	51%	0.513	26%	0.26	S	S	.	.	H	α-helix	trans	-64.3	-39.6	177.3	-66.5	-167.2	177.9	-166.7	0	112.1	L289 R354 W355 I361	L289-K357 HydrophobicContact CD1-CB 3.92Å; R354-K357 PolarHBondContact O-N 3.37Å; W355-K357 VanDerWaalsContact C-N 3.29Å; W355-K357 PolarHBondContact O-N 3.24Å; K357-I361 WeakPolarHBondContact O-CB 3.26Å; K357-I361 WeakPolarHBondContact O-CG1 3.21Å; K357-I361 PolarHBondContact O-N 3.48Å
358	Q	96.2	Very high	94.6	Very high	2 Å²	2	57.5 Å²	57.5	1%	0.009	28%	0.281	C	S	.	.	H	α-helix	trans	-63.9	-41.8	175.7	-176.1	-77.4	-30.8	0	0	111.2	L289 S292 S293 Y347 R354 W355 I356 I361 G362	L289-Q358 HydrophobicContact CG-CB 4.18Å; S292-Q358 WeakPolarHBondContact OG-CG 3.11Å; S293-Q358 PolarHBondContact OG-NE2 3.25Å; S293-Q358 PolarHBondContact OG-O 3.47Å; Y347-Q358 HydrophobicContact CD1-CB 3.95Å; Y347-Q358 HydrophobicContact CD1-CG 4.17Å; Y347-Q358 HydrophobicContact CD2-CB 4.41Å; Y347-Q358 HydrophobicContact CD2-CG 4.13Å; Y347-Q358 HydrophobicContact CE1-CB 4.17Å; Y347-Q358 HydrophobicContact CG-CB 4.08Å; Y347-Q358 HydrophobicContact CG-CG 3.82Å; R354-Q358 PolarHBondContact O-N 3.19Å; W355-Q358 PolarHBondContact O-N 3.5Å; W355-Q358 VanDerWaalsContact O-N 3.17Å; I356-Q358 VanDerWaalsContact C-N 3.34Å; I356-Q358 PolarHBondContact O-N 2.86Å; Q358-I361 PolarHBondContact O-N 2.9Å; Q358-G362 PolarHBondContact O-N 3.37Å
359	M	96.5	Very high	94.6	Very high	9 Å²	9	58.9 Å²	58.9	4%	0.044	29%	0.285	C	S	.	.	H	α-helix	trans	-59.9	-48.8	176.2	-178.9	-160.8	79.3	0	0	111.9	W355 I356 G362 A363 N410 L411 T414	W355-M359 PolarHBondContact O-N 2.96Å; I356-M359 WeakPolarHBondContact O-CB 3.04Å; I356-M359 PolarHBondContact O-N 3.38Å; M359-G362 PolarHBondContact O-N 3.24Å; M359-A363 WeakPolarHBondContact O-CB 3.44Å; M359-A363 PolarHBondContact O-N 3.37Å; M359-N410 PolarHBondContact O-ND2 3.23Å; M359-N410 VanDerWaalsContact O-ND2 3.11Å; M359-L411 HydrophobicContact CE-CD1 4.49Å; M359-L411 HydrophobicContact SD-CB 3.71Å; M359-L411 HydrophobicContact SD-CD1 3.35Å; M359-L411 WeakPolarHBondContact SD-CD1 3.3Å; M359-L411 HydrophobicContact SD-CG 4.11Å; M359-T414 HydrophobicContact CB-CG2 4.2Å; M359-T414 HydrophobicContact CG-CG2 4.44Å
360	F	96.8	Very high	94.7	Very high	94 Å²	94	58.7 Å²	58.7	41%	0.412	29%	0.291	S	S	.	.	H	α-helix	trans	-61.4	-45.9	177.9	-88	-77.3	0	0	0	111.9	I356 A363 F364 L407	I356-F360 HydrophobicContact CG2-CD2 3.72Å; I356-F360 HydrophobicContact CG2-CE2 3.65Å; I356-F360 VanDerWaalsContact O-CD2 3.28Å; I356-F360 WeakPolarHBondContact O-CD2 3.45Å; I356-F360 PolarHBondContact O-N 3.44Å; F360-A363 PolarHBondContact O-N 2.82Å; F360-F364 HydrophobicContact CD1-CD2 4.18Å; F360-F364 AromaticContact CD1-CE2 3.82Å; F360-F364 HydrophobicContact CD1-CE2 3.82Å; F360-F364 HydrophobicContact CE1-CE2 4.27Å; F360-F364 WeakPolarHBondContact O-CD2 3.31Å; F360-F364 PolarHBondContact O-N 3.15Å; F360-F364 VanDerWaalsContact O-N 3.11Å; F360-L407 HydrophobicContact CD1-CD1 4.01Å; F360-L407 HydrophobicContact CE1-CD1 3.53Å; F360-L407 HydrophobicContact CZ-CD1 4.28Å
361	I	96.5	Very high	94.8	Very high	72 Å²	72	60 Å²	60	37%	0.369	30%	0.301	S	S	.	.	H	α-helix	trans	-64.7	-42.9	178.4	-72.1	170.5	0	0	0	110.2	L289 K357 Q358 A363 F364 L365	L289-I361 HydrophobicContact CD1-CD1 4.45Å; L289-I361 HydrophobicContact CD2-CB 4.06Å; L289-I361 HydrophobicContact CD2-CD1 3.23Å; L289-I361 HydrophobicContact CD2-CG1 4.16Å; L289-I361 HydrophobicContact CD2-CG2 4.12Å; L289-I361 HydrophobicContact CG-CD1 4.47Å; K357-I361 WeakPolarHBondContact O-CB 3.26Å; K357-I361 WeakPolarHBondContact O-CG1 3.21Å; K357-I361 PolarHBondContact O-N 3.48Å; Q358-I361 PolarHBondContact O-N 2.9Å; I361-A363 PolarHBondContact O-N 2.99Å; I361-F364 PolarHBondContact O-N 3.43Å; I361-L365 WeakPolarHBondContact O-CB 3.25Å; I361-L365 PolarHBondContact O-N 3.16Å
362	G	95	Very high	94.9	Very high	0 Å²	0	59.2 Å²	59.2	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-61.1	-43.3	175.4	0	0	0	0	0	113.4	S293 N339 Q358 M359	S293-G362 PolarHBondContact OG-N 3.31Å; N339-G362 PolarHBondContact ND2-O 2.87Å; Q358-G362 PolarHBondContact O-N 3.37Å; M359-G362 PolarHBondContact O-N 3.24Å
363	A	95.9	Very high	95	Very high	1 Å²	1	60.3 Å²	60.3	1%	0.008	30%	0.298	C	S	.	.	H	α-helix	trans	-64.2	-41.4	-179.7	0	0	0	0	0	112.7	M359 F360 I361 P367 N410	M359-A363 WeakPolarHBondContact O-CB 3.44Å; M359-A363 PolarHBondContact O-N 3.37Å; F360-A363 PolarHBondContact O-N 2.82Å; I361-A363 PolarHBondContact O-N 2.99Å; A363-P367 WeakPolarHBondContact O-CD 3.38Å; A363-P367 WeakPolarHBondContact O-CG 3.35Å; A363-N410 HydrophobicContact CB-CB 4.36Å; A363-N410 WeakPolarHBondContact CB-ND2 3.38Å; A363-N410 PolarHBondContact N-ND2 3Å
364	F	95.9	Very high	95.1	Very high	49 Å²	49	50 Å²	50	22%	0.215	26%	0.262	C	S	.	.	H	α-helix	trans	-101.1	-9.4	-170.9	-69.7	-66	0	0	0	114.4	F360 I361 I366 A368 C402 F403 L407	F360-F364 HydrophobicContact CD1-CD2 4.18Å; F360-F364 AromaticContact CD1-CE2 3.82Å; F360-F364 HydrophobicContact CD1-CE2 3.82Å; F360-F364 HydrophobicContact CE1-CE2 4.27Å; F360-F364 WeakPolarHBondContact O-CD2 3.31Å; F360-F364 PolarHBondContact O-N 3.15Å; F360-F364 VanDerWaalsContact O-N 3.11Å; I361-F364 PolarHBondContact O-N 3.43Å; F364-I366 PolarHBondContact O-N 3.05Å; F364-A368 WeakPolarHBondContact O-CA 3.3Å; F364-A368 WeakPolarHBondContact O-CB 3.39Å; F364-A368 PolarHBondContact O-N 2.69Å; F364-C402 HydrophobicContact CE1-CB 4.08Å; F364-F403 HydrophobicContact CE1-CD1 4.34Å; F364-F403 HydrophobicContact CE1-CE1 4.09Å; F364-F403 HydrophobicContact CE1-CZ 4.3Å; F364-F403 HydrophobicContact CE2-CE1 4.37Å; F364-F403 AromaticContact CZ-CD1 3.75Å; F364-F403 HydrophobicContact CZ-CD1 3.75Å; F364-F403 AromaticContact CZ-CE1 3.52Å; F364-F403 HydrophobicContact CZ-CE1 3.52Å; F364-F403 HydrophobicContact CZ-CZ 4.16Å; F364-L407 HydrophobicContact CE2-CD1 3.6Å; F364-L407 HydrophobicContact CZ-CD1 3.75Å
365	L	95.4	Very high	95	Very high	55 Å²	55	49 Å²	49	29%	0.288	26%	0.262	S	S	.	.	H	α-helix	trans	-54.5	-54.3	-175.8	-175.5	69.3	0	0	0	112.9	L294 I361 M369	L294-L365 HydrophobicContact CD2-CD2 3.74Å; L294-L365 HydrophobicContact CG-CD2 4.3Å; I361-L365 WeakPolarHBondContact O-CB 3.25Å; I361-L365 PolarHBondContact O-N 3.16Å; L365-M369 WeakPolarHBondContact O-CB 3.2Å; L365-M369 PolarHBondContact O-N 2.76Å
366	I	95.9	Very high	94.9	Very high	13 Å²	13	51.1 Å²	51.1	7%	0.067	27%	0.274	C	S	.	.	H	α-helix	trans	-76.9	-47.8	-178.8	-53.1	-59.1	0	0	0	111.3	I301 Y332 F364 A368 M369 V370 I565	I301-I366 HydrophobicContact CD1-CD1 3.84Å; I301-I366 HydrophobicContact CD1-CG1 4.08Å; Y332-I366 HydrophobicContact CE2-CG2 4.38Å; F364-I366 PolarHBondContact O-N 3.05Å; I366-A368 VanDerWaalsContact C-N 3.33Å; I366-A368 PolarHBondContact O-N 3.23Å; I366-M369 HydrophobicContact CD1-CE 3.61Å; I366-M369 HydrophobicContact CG2-CE 4.26Å; I366-M369 WeakPolarHBondContact O-CB 3.36Å; I366-M369 PolarHBondContact O-N 2.98Å; I366-V370 HydrophobicContact CG2-CG2 4.28Å; I366-V370 WeakPolarHBondContact O-CG2 3.48Å; I366-V370 PolarHBondContact O-N 2.98Å; I366-I565 HydrophobicContact CD1-CD1 3.6Å
367	P	95.3	Very high	94.7	Very high	13 Å²	13	47.5 Å²	47.5	8%	0.084	26%	0.255	C	S	.	.	H	α-helix	trans	-60.1	-39.8	178.7	-26.8	37.5	0	0	0	113.3	Y332 A363 V370 C371	Y332-P367 HydrophobicContact CE1-CG 3.95Å; A363-P367 WeakPolarHBondContact O-CD 3.38Å; A363-P367 WeakPolarHBondContact O-CG 3.35Å; P367-V370 PolarHBondContact O-N 3.47Å; P367-C371 VanDerWaalsContact O-CB 3.23Å; P367-C371 WeakPolarHBondContact O-CB 3.45Å; P367-C371 PolarHBondContact O-N 3.2Å; P367-C371 PolarHBondContact O-SG 3.29Å
368	A	94.6	Very high	94.5	Very high	59 Å²	59	42.4 Å²	42.4	49%	0.488	23%	0.233	S	C	.	.	H	α-helix	trans	-68	-35.7	177.8	0	0	0	0	0	112.1	F364 I366 G372	F364-A368 WeakPolarHBondContact O-CA 3.3Å; F364-A368 WeakPolarHBondContact O-CB 3.39Å; F364-A368 PolarHBondContact O-N 2.69Å; I366-A368 VanDerWaalsContact C-N 3.33Å; I366-A368 PolarHBondContact O-N 3.23Å; A368-G372 WeakPolarHBondContact O-CA 3.49Å; A368-G372 PolarHBondContact O-N 3.42Å
369	M	94.8	Very high	94.3	Very high	46 Å²	46	49.1 Å²	49.1	23%	0.227	26%	0.263	C	S	.	.	H	α-helix	trans	-63.6	-48.5	173.5	174.4	178.3	50.7	0	0	111.2	L365 I366 G372 T373 T561 I565	L365-M369 WeakPolarHBondContact O-CB 3.2Å; L365-M369 PolarHBondContact O-N 2.76Å; I366-M369 HydrophobicContact CD1-CE 3.61Å; I366-M369 HydrophobicContact CG2-CE 4.26Å; I366-M369 WeakPolarHBondContact O-CB 3.36Å; I366-M369 PolarHBondContact O-N 2.98Å; M369-G372 PolarHBondContact O-N 3.38Å; M369-T373 WeakPolarHBondContact O-CG2 3.35Å; M369-T373 PolarHBondContact O-N 3.03Å; M369-T373 VanDerWaalsContact O-N 3.11Å; M369-T373 PolarHBondContact O-OG1 3.43Å; M369-T373 VanDerWaalsContact O-OG1 3.12Å; M369-T561 HydrophobicContact CE-CG2 4.19Å; M369-T561 HydrophobicContact SD-CG2 3.51Å; M369-T561 VanDerWaalsContact SD-CG2 3.51Å; M369-I565 HydrophobicContact CE-CD1 4.5Å
370	V	94.8	Very high	94.1	Very high	56 Å²	56	49.6 Å²	49.6	34%	0.339	27%	0.265	S	S	.	.	H	α-helix	trans	-66.1	-47.1	179.5	176.8	0	0	0	0	111.3	I366 P367 G372 T373 A374 V558	I366-V370 HydrophobicContact CG2-CG2 4.28Å; I366-V370 WeakPolarHBondContact O-CG2 3.48Å; I366-V370 PolarHBondContact O-N 2.98Å; P367-V370 PolarHBondContact O-N 3.47Å; V370-G372 VanDerWaalsContact C-N 3.32Å; V370-G372 PolarHBondContact O-N 3.39Å; V370-T373 PolarHBondContact O-OG1 3.45Å; V370-A374 WeakPolarHBondContact O-CB 3.41Å; V370-A374 PolarHBondContact O-N 2.99Å; V370-V558 HydrophobicContact CG2-CG1 3.86Å
371	C	93.4	Very high	93.9	Very high	49 Å²	49	45.1 Å²	45.1	33%	0.331	25%	0.246	S	C	.	.	H	α-helix	trans	-67.2	-35.3	179.3	-64.7	0	0	0	0	111.5	P367 F375	P367-C371 VanDerWaalsContact O-CB 3.23Å; P367-C371 WeakPolarHBondContact O-CB 3.45Å; P367-C371 PolarHBondContact O-N 3.2Å; P367-C371 PolarHBondContact O-SG 3.29Å; C371-F375 WeakPolarHBondContact O-CB 3.46Å; C371-F375 PolarHBondContact O-N 2.89Å
372	G	93	Very high	93.6	Very high	42 Å²	42	46.2 Å²	46.2	43%	0.433	25%	0.251	S	S	.	.	H	α-helix	trans	-65.7	-45.3	177.7	0	0	0	0	0	112.6	A368 M369 V370 F376	A368-G372 WeakPolarHBondContact O-CA 3.49Å; A368-G372 PolarHBondContact O-N 3.42Å; M369-G372 PolarHBondContact O-N 3.38Å; V370-G372 VanDerWaalsContact C-N 3.32Å; V370-G372 PolarHBondContact O-N 3.39Å; G372-F376 PolarHBondContact O-N 3.42Å; G372-F376 VanDerWaalsContact O-N 3.16Å
373	T	93.7	Very high	93.3	Very high	36 Å²	36	54.6 Å²	54.6	22%	0.221	28%	0.284	C	S	.	.	H	α-helix	trans	-69.4	-42.7	175.6	54.2	0	0	0	0	111.6	M369 V370 F375 F376 I377 V558	M369-T373 WeakPolarHBondContact O-CG2 3.35Å; M369-T373 PolarHBondContact O-N 3.03Å; M369-T373 VanDerWaalsContact O-N 3.11Å; M369-T373 PolarHBondContact O-OG1 3.43Å; M369-T373 VanDerWaalsContact O-OG1 3.12Å; V370-T373 PolarHBondContact O-OG1 3.45Å; T373-F375 VanDerWaalsContact C-N 3.33Å; T373-F375 PolarHBondContact O-N 3.12Å; T373-F376 PolarHBondContact O-N 2.86Å; T373-I377 VanDerWaalsContact O-CG1 3.31Å; T373-I377 WeakPolarHBondContact O-CG1 3.3Å; T373-I377 PolarHBondContact O-N 3.49Å; T373-V558 HydrophobicContact CG2-CG2 3.69Å; T373-V558 WeakPolarHBondContact OG1-CG2 3.2Å
374	A	92.4	Very high	92.9	Very high	14 Å²	14	58.1 Å²	58.1	12%	0.116	30%	0.298	C	S	.	.	H	α-helix	trans	-60.5	-42	175.5	0	0	0	0	0	111.6	V370 I377 N378 I390	V370-A374 WeakPolarHBondContact O-CB 3.41Å; V370-A374 PolarHBondContact O-N 2.99Å; A374-I377 PolarHBondContact O-N 3.37Å; A374-N378 WeakPolarHBondContact O-CB 3.31Å; A374-N378 PolarHBondContact O-N 2.98Å; A374-I390 HydrophobicContact CB-CD1 4.4Å
375	F	91.9	Very high	92.5	Very high	134 Å²	134	63.5 Å²	63.5	59%	0.588	32%	0.323	S	S	*	.	H	α-helix	trans	-62.1	-44.2	177	179	-97.1	0	0	0	112.2	C371 T373 N378 F379	C371-F375 WeakPolarHBondContact O-CB 3.46Å; C371-F375 PolarHBondContact O-N 2.89Å; T373-F375 VanDerWaalsContact C-N 3.33Å; T373-F375 PolarHBondContact O-N 3.12Å; F375-N378 PolarHBondContact O-N 3.32Å; F375-F379 PolarHBondContact O-N 2.93Å
376	F	92.3	Very high	92.2	Very high	127 Å²	127	61.1 Å²	61.1	56%	0.557	31%	0.311	S	S	*	.	H	α-helix	trans	-62.6	-46.8	176.4	178.7	-98.6	0	0	0	112	G372 T373 N378 F379 I380	G372-F376 PolarHBondContact O-N 3.42Å; G372-F376 VanDerWaalsContact O-N 3.16Å; T373-F376 PolarHBondContact O-N 2.86Å; F376-N378 VanDerWaalsContact C-N 3.28Å; F376-N378 PolarHBondContact O-N 3.45Å; F376-F379 WeakPolarHBondContact O-CB 3.35Å; F376-F379 PolarHBondContact O-N 2.84Å; F376-I380 HydrophobicContact CD1-CD1 4.35Å; F376-I380 HydrophobicContact CE1-CD1 3.75Å; F376-I380 HydrophobicContact CZ-CD1 4.07Å; F376-I380 PolarHBondContact O-N 2.86Å
377	I	92.9	Very high	91.6	Very high	8 Å²	8	60.7 Å²	60.7	4%	0.041	31%	0.31	C	S	.	.	H	α-helix	trans	-63.2	-39	176.6	-66.4	166.5	0	0	0	110.4	T373 A374 F379 I380 A381 F547 F551 Y555	T373-I377 VanDerWaalsContact O-CG1 3.31Å; T373-I377 WeakPolarHBondContact O-CG1 3.3Å; T373-I377 PolarHBondContact O-N 3.49Å; A374-I377 PolarHBondContact O-N 3.37Å; I377-F379 VanDerWaalsContact C-N 3.32Å; I377-F379 PolarHBondContact O-N 3.24Å; I377-I380 PolarHBondContact O-N 3.31Å; I377-A381 PolarHBondContact O-N 3.03Å; I377-F547 HydrophobicContact CG2-CE2 4.4Å; I377-F551 HydrophobicContact CG2-CB 4.36Å; I377-F551 HydrophobicContact CG2-CD2 3.63Å; I377-F551 HydrophobicContact CG2-CE2 4.35Å; I377-F551 HydrophobicContact CG2-CG 4.42Å; I377-Y555 HydrophobicContact CD1-CD2 3.61Å; I377-Y555 HydrophobicContact CD1-CE2 3.43Å; I377-Y555 VanDerWaalsContact CD1-CE2 3.43Å; I377-Y555 HydrophobicContact CG2-CE2 4.39Å
378	N	92.2	Very high	91.1	Very high	11 Å²	11	61 Å²	61	6%	0.059	31%	0.309	C	S	.	.	H	α-helix	trans	-65	-35.9	179.1	-167	69.1	0	0	0	112.6	A374 F375 F376 I380 A381 I382 A389 I390 M395	A374-N378 WeakPolarHBondContact O-CB 3.31Å; A374-N378 PolarHBondContact O-N 2.98Å; F375-N378 PolarHBondContact O-N 3.32Å; F376-N378 VanDerWaalsContact C-N 3.28Å; F376-N378 PolarHBondContact O-N 3.45Å; N378-I380 VanDerWaalsContact C-N 3.29Å; N378-I380 PolarHBondContact O-N 3.35Å; N378-A381 WeakPolarHBondContact O-CB 3.16Å; N378-A381 PolarHBondContact O-N 2.71Å; N378-I382 VanDerWaalsContact ND2-CD1 3.33Å; N378-I382 WeakPolarHBondContact ND2-CD1 3.16Å; N378-I382 WeakPolarHBondContact O-CG1 3.37Å; N378-I382 PolarHBondContact O-N 3.42Å; N378-A389 VanDerWaalsContact OD1-CA 3.29Å; N378-A389 WeakPolarHBondContact OD1-CA 3.3Å; N378-I390 PolarHBondContact OD1-N 2.98Å; N378-M395 HydrophobicContact CB-CE 3.99Å; N378-M395 WeakPolarHBondContact ND2-CE 3.32Å
379	F	92.4	Very high	90.7	Very high	143 Å²	143	59.4 Å²	59.4	63%	0.627	30%	0.296	S	S	*	.	H	α-helix	trans	-59.7	-42	173.6	-174.3	-97.1	0	0	0	111.6	F375 F376 I377 Y383	F375-F379 PolarHBondContact O-N 2.93Å; F376-F379 WeakPolarHBondContact O-CB 3.35Å; F376-F379 PolarHBondContact O-N 2.84Å; I377-F379 VanDerWaalsContact C-N 3.32Å; I377-F379 PolarHBondContact O-N 3.24Å; F379-Y383 PolarHBondContact O-N 3.47Å
380	I	92.3	Very high	90.4	Very high	19 Å²	19	58.3 Å²	58.3	10%	0.097	29%	0.291	C	S	.	.	H	α-helix	trans	-69	-39.9	174.6	-55.4	174.1	0	0	0	110.4	F376 I377 N378 I382 Y383 Y384 F547	F376-I380 HydrophobicContact CD1-CD1 4.35Å; F376-I380 HydrophobicContact CE1-CD1 3.75Å; F376-I380 HydrophobicContact CZ-CD1 4.07Å; F376-I380 PolarHBondContact O-N 2.86Å; I377-I380 PolarHBondContact O-N 3.31Å; N378-I380 VanDerWaalsContact C-N 3.29Å; N378-I380 PolarHBondContact O-N 3.35Å; I380-I382 VanDerWaalsContact C-N 3.32Å; I380-I382 PolarHBondContact O-N 3.38Å; I380-Y383 WeakPolarHBondContact O-CB 3.28Å; I380-Y383 PolarHBondContact O-N 3.5Å; I380-Y384 HydrophobicContact CG2-CD2 3.98Å; I380-Y384 HydrophobicContact CG2-CE2 4.07Å; I380-Y384 WeakPolarHBondContact O-CD2 3.41Å; I380-Y384 PolarHBondContact O-N 3.38Å; I380-Y384 VanDerWaalsContact O-N 3.12Å; I380-F547 HydrophobicContact CB-CD2 4.37Å; I380-F547 HydrophobicContact CG2-CB 4.22Å; I380-F547 HydrophobicContact CG2-CD2 3.9Å
381	A	90.7	Very high	90	Very high	1 Å²	1	58.5 Å²	58.5	1%	0.008	29%	0.294	C	S	.	.	H	α-helix	trans	-57.9	-44.3	177.2	0	0	0	0	0	112	I377 N378 Y384 H385 A386 A389 F547	I377-A381 PolarHBondContact O-N 3.03Å; N378-A381 WeakPolarHBondContact O-CB 3.16Å; N378-A381 PolarHBondContact O-N 2.71Å; A381-Y384 CarbonylContact O-C 3.51Å; A381-Y384 PolarHBondContact O-N 2.85Å; A381-H385 PolarHBondContact O-N 3.24Å; A381-H385 VanDerWaalsContact O-N 3.09Å; A381-A386 HydrophobicContact CB-CB 4.44Å; A381-A386 PolarHBondContact O-N 3.06Å; A381-A389 HydrophobicContact CB-CB 4.14Å; A381-F547 HydrophobicContact CB-CD2 4.47Å; A381-F547 HydrophobicContact CB-CE2 3.58Å; A381-F547 HydrophobicContact CB-CZ 4.05Å
382	I	90.3	Very high	89.8	Confident	94 Å²	94	63.8 Å²	63.8	48%	0.482	31%	0.311	S	S	.	.	H	α-helix	trans	-63.9	-42.4	177.4	-68.3	166.8	0	0	0	110.8	N378 I380 Y384 H385 A389	N378-I382 VanDerWaalsContact ND2-CD1 3.33Å; N378-I382 WeakPolarHBondContact ND2-CD1 3.16Å; N378-I382 WeakPolarHBondContact O-CG1 3.37Å; N378-I382 PolarHBondContact O-N 3.42Å; I380-I382 VanDerWaalsContact C-N 3.32Å; I380-I382 PolarHBondContact O-N 3.38Å; I382-Y384 PolarHBondContact O-N 3.02Å; I382-H385 PolarHBondContact O-N 3.38Å; I382-A389 HydrophobicContact CG1-CB 3.99Å
383	Y	90	Very high	89.6	Confident	176 Å²	176	64.3 Å²	64.3	69%	0.69	32%	0.317	S	S	*	.	H	α-helix	trans	-59.1	-36.5	176.9	177.7	-95.1	0	0	0	112.4	F379 I380	F379-Y383 PolarHBondContact O-N 3.47Å; I380-Y383 WeakPolarHBondContact O-CB 3.28Å; I380-Y383 PolarHBondContact O-N 3.5Å
384	Y	87.8	Confident	89.3	Confident	75 Å²	75	63.4 Å²	63.4	29%	0.294	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.5	-3.6	175.8	-83	-93.9	0	0	0	113.9	Y58 I380 A381 I382 A386 F547	Y58-Y384 WeakPolarHBondContact CE1-O 3.22Å; I380-Y384 HydrophobicContact CG2-CD2 3.98Å; I380-Y384 HydrophobicContact CG2-CE2 4.07Å; I380-Y384 WeakPolarHBondContact O-CD2 3.41Å; I380-Y384 PolarHBondContact O-N 3.38Å; I380-Y384 VanDerWaalsContact O-N 3.12Å; A381-Y384 CarbonylContact O-C 3.51Å; A381-Y384 PolarHBondContact O-N 2.85Å; I382-Y384 PolarHBondContact O-N 3.02Å; Y384-A386 PolarHBondContact O-N 3.16Å; Y384-F547 HydrophobicContact CD2-CB 4.06Å; Y384-F547 HydrophobicContact CE2-CB 4.18Å; Y384-F547 HydrophobicContact CG-CB 4.37Å
385	H	87.4	Confident	89.2	Confident	162 Å²	162	65 Å²	65	75%	0.75	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.2	33	-169.2	-59	-77	0	0	0	113.8	Y58 A381 I382	Y58-H385 WeakPolarHBondContact CD1-O 3.27Å; A381-H385 PolarHBondContact O-N 3.24Å; A381-H385 VanDerWaalsContact O-N 3.09Å; I382-H385 PolarHBondContact O-N 3.38Å
386	A	87.6	Confident	89.2	Confident	5 Å²	5	61.6 Å²	61.6	4%	0.041	31%	0.307	C	S	.	.			trans	-70.2	143.8	179.1	0	0	0	0	0	111.4	T57 A381 Y384 R388 A389 F547	T57-A386 CarbonylContact O-C 3.56Å; T57-A386 WeakPolarHBondContact O-CA 3.39Å; A381-A386 HydrophobicContact CB-CB 4.44Å; A381-A386 PolarHBondContact O-N 3.06Å; Y384-A386 PolarHBondContact O-N 3.16Å; A386-R388 PolarHBondContact O-N 3.36Å; A386-R388 VanDerWaalsContact O-N 3.16Å; A386-A389 VanDerWaalsContact O-CB 3.31Å; A386-A389 WeakPolarHBondContact O-CB 3.29Å; A386-A389 PolarHBondContact O-N 3.39Å; A386-F547 HydrophobicContact CB-CE1 4.08Å; A386-F547 HydrophobicContact CB-CZ 4.08Å
387	S	84.3	Confident	89.1	Confident	4 Å²	4	57.4 Å²	57.4	3%	0.028	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-20.4	175.8	70.1	0	0	0	0	112.8	T47 T57 G86 E88 A389	T47-S387 VanDerWaalsContact CG2-OG 3.29Å; T47-S387 WeakPolarHBondContact CG2-OG 3.37Å; T57-S387 WeakPolarHBondContact CB-OG 3.42Å; T57-S387 PolarHBondContact O-N 2.8Å; T57-S387 PolarHBondContact O-OG 2.86Å; T57-S387 PolarHBondContact OG1-OG 3.39Å; G86-S387 PolarHBondContact O-OG 3.48Å; E88-S387 WeakPolarHBondContact OE2-CA 3.41Å; E88-S387 VanDerWaalsContact OE2-CB 3.26Å; E88-S387 WeakPolarHBondContact OE2-CB 3.38Å; S387-A389 PolarHBondContact O-N 3.33Å
388	R	84.1	Confident	89.1	Confident	19 Å²	19	58.5 Å²	58.5	7%	0.072	30%	0.302	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.5	3.3	175	-154.5	-176.5	-67.5	-159.1	-16.2	114	Q55 A386 I390 Y475 F547	Q55-R388 VanDerWaalsContact CA-NH2 3.29Å; Q55-R388 VanDerWaalsContact CB-NH1 3.28Å; Q55-R388 VanDerWaalsContact O-CZ 3.28Å; Q55-R388 PolarHBondContact O-NE 3.43Å; Q55-R388 PolarHBondContact O-NH2 2.91Å; A386-R388 PolarHBondContact O-N 3.36Å; A386-R388 VanDerWaalsContact O-N 3.16Å; R388-I390 PolarHBondContact O-N 2.88Å; R388-I390 VanDerWaalsContact O-N 3.07Å; R388-Y475 PolarHBondContact NH2-OH 3.05Å; R388-F547 HydrophobicContact CB-CZ 4.45Å
389	A	86.4	Confident	89.1	Confident	27 Å²	27	60.8 Å²	60.8	22%	0.223	32%	0.319	C	S	.	.	S	Bend	trans	-61.9	113.6	166.2	0	0	0	0	0	108.6	N378 A381 I382 A386 S387 P391	N378-A389 VanDerWaalsContact OD1-CA 3.29Å; N378-A389 WeakPolarHBondContact OD1-CA 3.3Å; A381-A389 HydrophobicContact CB-CB 4.14Å; I382-A389 HydrophobicContact CG1-CB 3.99Å; A386-A389 VanDerWaalsContact O-CB 3.31Å; A386-A389 WeakPolarHBondContact O-CB 3.29Å; A386-A389 PolarHBondContact O-N 3.39Å; S387-A389 PolarHBondContact O-N 3.33Å; A389-P391 WeakPolarHBondContact O-CD 3.43Å
390	I	88	Confident	89.2	Confident	23 Å²	23	56.6 Å²	56.6	12%	0.118	31%	0.306	C	S	.	.			trans	-62.1	122.4	176.8	-60.2	174.9	0	0	0	107.7	L84 A374 N378 R388 T394 M395	L84-I390 HydrophobicContact CD2-CD1 4.42Å; L84-I390 HydrophobicContact CD2-CG2 4.18Å; A374-I390 HydrophobicContact CB-CD1 4.4Å; N378-I390 PolarHBondContact OD1-N 2.98Å; R388-I390 PolarHBondContact O-N 2.88Å; R388-I390 VanDerWaalsContact O-N 3.07Å; I390-T394 WeakPolarHBondContact CG2-OG1 3.33Å; I390-M395 HydrophobicContact CB-CE 3.85Å; I390-M395 HydrophobicContact CB-CG 4.5Å; I390-M395 HydrophobicContact CG2-CE 4.1Å; I390-M395 HydrophobicContact CG2-CG 3.75Å
391	P	87.7	Confident	89.2	Confident	60 Å²	60	57.6 Å²	57.6	39%	0.39	31%	0.312	S	S	.	.			trans	-66	149.5	-179.7	25.2	-32.5	0	0	0	110.9	A389 G393 T394 M395	A389-P391 WeakPolarHBondContact O-CD 3.43Å; P391-G393 PolarHBondContact O-N 3.33Å; P391-G393 VanDerWaalsContact O-N 3.14Å; P391-T394 WeakPolarHBondContact CD-OG1 3.47Å; P391-T394 HydrophobicContact CG-CG2 3.82Å; P391-T394 WeakPolarHBondContact CG-OG1 3.29Å; P391-T394 PolarHBondContact O-N 3.2Å; P391-T394 VanDerWaalsContact O-N 3.13Å; P391-T394 PolarHBondContact O-OG1 3.07Å; P391-M395 PolarHBondContact O-N 3.18Å
392	F	88.3	Confident	89.4	Confident	160 Å²	160	58 Å²	58	70%	0.702	31%	0.314	S	S	*	.	H	α-helix	trans	-57.3	-35.4	-176.6	178.5	-104.7	0	0	0	113	T394 M395 V396	F392-T394 PolarHBondContact O-N 3.08Å; F392-M395 WeakPolarHBondContact O-CB 3.4Å; F392-M395 PolarHBondContact O-N 2.87Å; F392-V396 HydrophobicContact CD1-CG2 4.22Å; F392-V396 HydrophobicContact CE1-CG2 3.7Å; F392-V396 HydrophobicContact CE2-CG2 4.08Å; F392-V396 HydrophobicContact CZ-CG2 3.63Å; F392-V396 WeakPolarHBondContact O-CG2 3.48Å; F392-V396 PolarHBondContact O-N 3.49Å; F392-V396 VanDerWaalsContact O-N 3.1Å
393	G	88.2	Confident	89.6	Confident	53 Å²	53	59.2 Å²	59.2	55%	0.546	32%	0.316	S	S	.	.	H	α-helix	trans	-59.8	-41.4	178.2	0	0	0	0	0	113.5	P391 V396 A397	P391-G393 PolarHBondContact O-N 3.33Å; P391-G393 VanDerWaalsContact O-N 3.14Å; G393-V396 PolarHBondContact O-N 3.26Å; G393-A397 PolarHBondContact O-N 3.38Å
394	T	89	Confident	89.8	Confident	16 Å²	16	58.5 Å²	58.5	10%	0.098	32%	0.317	C	S	.	.	H	α-helix	trans	-73.9	-32.4	179.6	56.5	0	0	0	0	111.5	L80 A83 I390 P391 F392 V396 A397 V398	L80-T394 HydrophobicContact CD1-CG2 4.25Å; A83-T394 HydrophobicContact CB-CG2 3.61Å; I390-T394 WeakPolarHBondContact CG2-OG1 3.33Å; P391-T394 WeakPolarHBondContact CD-OG1 3.47Å; P391-T394 HydrophobicContact CG-CG2 3.82Å; P391-T394 WeakPolarHBondContact CG-OG1 3.29Å; P391-T394 PolarHBondContact O-N 3.2Å; P391-T394 VanDerWaalsContact O-N 3.13Å; P391-T394 PolarHBondContact O-OG1 3.07Å; F392-T394 PolarHBondContact O-N 3.08Å; T394-V396 PolarHBondContact O-N 3.34Å; T394-A397 WeakPolarHBondContact O-CB 3.48Å; T394-A397 PolarHBondContact O-N 3.05Å; T394-V398 WeakPolarHBondContact O-CG2 3.33Å; T394-V398 PolarHBondContact O-N 2.82Å
395	M	89.9	Confident	90.1	Very high	47 Å²	47	57.9 Å²	57.9	23%	0.232	32%	0.321	C	S	.	.	H	α-helix	trans	-59	-47.8	171.1	-61.8	-171.1	168	0	0	111.6	N378 I390 P391 F392 A397 V398 C399	N378-M395 HydrophobicContact CB-CE 3.99Å; N378-M395 WeakPolarHBondContact ND2-CE 3.32Å; I390-M395 HydrophobicContact CB-CE 3.85Å; I390-M395 HydrophobicContact CB-CG 4.5Å; I390-M395 HydrophobicContact CG2-CE 4.1Å; I390-M395 HydrophobicContact CG2-CG 3.75Å; P391-M395 PolarHBondContact O-N 3.18Å; F392-M395 WeakPolarHBondContact O-CB 3.4Å; F392-M395 PolarHBondContact O-N 2.87Å; M395-A397 VanDerWaalsContact C-N 3.33Å; M395-A397 PolarHBondContact O-N 3.3Å; M395-V398 PolarHBondContact O-N 3.3Å; M395-C399 PolarHBondContact O-N 3.37Å; M395-C399 PolarHBondContact O-SG 3.26Å; M395-C399 VanDerWaalsContact O-SG 3.4Å
396	V	91.5	Very high	90.6	Very high	64 Å²	64	50.5 Å²	50.5	39%	0.388	29%	0.287	S	S	.	.	H	α-helix	trans	-62.9	-41.3	176.6	175.7	0	0	0	0	110.6	F392 G393 T394 V398 C399 C400	F392-V396 HydrophobicContact CD1-CG2 4.22Å; F392-V396 HydrophobicContact CE1-CG2 3.7Å; F392-V396 HydrophobicContact CE2-CG2 4.08Å; F392-V396 HydrophobicContact CZ-CG2 3.63Å; F392-V396 WeakPolarHBondContact O-CG2 3.48Å; F392-V396 PolarHBondContact O-N 3.49Å; F392-V396 VanDerWaalsContact O-N 3.1Å; G393-V396 PolarHBondContact O-N 3.26Å; T394-V396 PolarHBondContact O-N 3.34Å; V396-V398 PolarHBondContact O-N 2.87Å; V396-C399 PolarHBondContact O-N 2.92Å; V396-C400 PolarHBondContact O-N 3.4Å; V396-C400 PolarHBondContact O-SG 3.09Å
397	A	91.2	Very high	91	Very high	38 Å²	38	51.9 Å²	51.9	31%	0.314	29%	0.293	S	S	.	.	H	α-helix	trans	-59.3	-45.8	177	0	0	0	0	0	112.4	G393 T394 M395 C399 C400 I401	G393-A397 PolarHBondContact O-N 3.38Å; T394-A397 WeakPolarHBondContact O-CB 3.48Å; T394-A397 PolarHBondContact O-N 3.05Å; M395-A397 VanDerWaalsContact C-N 3.33Å; M395-A397 PolarHBondContact O-N 3.3Å; A397-C399 PolarHBondContact O-N 3.17Å; A397-C400 WeakPolarHBondContact O-CB 3.39Å; A397-C400 PolarHBondContact O-N 3.42Å; A397-I401 WeakPolarHBondContact O-CG1 3.45Å; A397-I401 PolarHBondContact O-N 3.5Å
398	V	91.9	Very high	91.6	Very high	31 Å²	31	54.3 Å²	54.3	19%	0.188	31%	0.309	C	S	.	.	H	α-helix	trans	-63.7	-41.3	176.8	174.1	0	0	0	0	111.3	L84 T394 M395 V396 C400 I401 C402	L84-V398 HydrophobicContact CD2-CG2 4.43Å; T394-V398 WeakPolarHBondContact O-CG2 3.33Å; T394-V398 PolarHBondContact O-N 2.82Å; M395-V398 PolarHBondContact O-N 3.3Å; V396-V398 PolarHBondContact O-N 2.87Å; V398-C400 VanDerWaalsContact C-N 3.35Å; V398-C400 PolarHBondContact O-N 2.94Å; V398-I401 PolarHBondContact O-N 3.1Å; V398-C402 PolarHBondContact O-N 3.06Å; V398-C402 PolarHBondContact O-SG 2.89Å
399	C	91.7	Very high	92.1	Very high	60 Å²	60	56.2 Å²	56.2	41%	0.405	32%	0.32	S	S	.	.	H	α-helix	trans	-60.8	-43	173.1	-69.9	0	0	0	0	111.9	M395 V396 A397 I401 C402 F403	M395-C399 PolarHBondContact O-N 3.37Å; M395-C399 PolarHBondContact O-SG 3.26Å; M395-C399 VanDerWaalsContact O-SG 3.4Å; V396-C399 PolarHBondContact O-N 2.92Å; A397-C399 PolarHBondContact O-N 3.17Å; C399-I401 PolarHBondContact O-N 3.35Å; C399-C402 WeakPolarHBondContact O-CB 3.47Å; C399-C402 PolarHBondContact O-N 3.22Å; C399-C402 VanDerWaalsContact O-N 3.12Å; C399-F403 VanDerWaalsContact O-CD2 3.22Å; C399-F403 WeakPolarHBondContact O-CD2 3.33Å; C399-F403 PolarHBondContact O-N 3.33Å
400	C	94.2	Very high	92.7	Very high	54 Å²	54	55 Å²	55	37%	0.365	31%	0.31	S	S	.	.	H	α-helix	trans	-61.2	-42	175.8	-73.5	0	0	0	0	112	V396 A397 V398 C402 F403 F404	V396-C400 PolarHBondContact O-N 3.4Å; V396-C400 PolarHBondContact O-SG 3.09Å; A397-C400 WeakPolarHBondContact O-CB 3.39Å; A397-C400 PolarHBondContact O-N 3.42Å; V398-C400 VanDerWaalsContact C-N 3.35Å; V398-C400 PolarHBondContact O-N 2.94Å; C400-C402 VanDerWaalsContact C-N 3.27Å; C400-C402 PolarHBondContact O-N 3.3Å; C400-F403 PolarHBondContact O-N 2.92Å; C400-F404 HydrophobicContact CB-CD2 4.1Å; C400-F404 WeakPolarHBondContact O-CB 3.25Å; C400-F404 WeakPolarHBondContact O-CD2 3.08Å; C400-F404 PolarHBondContact O-N 3.45Å
401	I	93.7	Very high	93.1	Very high	41 Å²	41	56.9 Å²	56.9	21%	0.21	32%	0.32	C	S	.	.	I	π-helix	trans	-58.7	-41.9	173.7	-66.9	166.2	0	0	0	110.3	L80 I329 A333 A397 V398 C399 V405 I406	L80-I401 HydrophobicContact CD2-CD1 4.16Å; I329-I401 HydrophobicContact CG2-CD1 4.32Å; A333-I401 HydrophobicContact CB-CG2 4.24Å; A397-I401 WeakPolarHBondContact O-CG1 3.45Å; A397-I401 PolarHBondContact O-N 3.5Å; V398-I401 PolarHBondContact O-N 3.1Å; C399-I401 PolarHBondContact O-N 3.35Å; I401-V405 HydrophobicContact CG2-CB 4.44Å; I401-V405 WeakPolarHBondContact O-CA 3.37Å; I401-V405 VanDerWaalsContact O-CB 3.31Å; I401-V405 WeakPolarHBondContact O-CB 3.31Å; I401-V405 PolarHBondContact O-N 2.83Å; I401-I406 HydrophobicContact CG2-CD1 4.2Å; I401-I406 HydrophobicContact CG2-CG1 4.35Å; I401-I406 PolarHBondContact O-N 3.49Å
402	C	94.1	Very high	93.6	Very high	10 Å²	10	57.7 Å²	57.7	7%	0.068	32%	0.324	C	S	.	.	I	π-helix	trans	-63.7	-46.1	178	-63.2	0	0	0	0	113.1	F364 V398 C399 C400 L407	F364-C402 HydrophobicContact CE1-CB 4.08Å; V398-C402 PolarHBondContact O-N 3.06Å; V398-C402 PolarHBondContact O-SG 2.89Å; C399-C402 WeakPolarHBondContact O-CB 3.47Å; C399-C402 PolarHBondContact O-N 3.22Å; C399-C402 VanDerWaalsContact O-N 3.12Å; C400-C402 VanDerWaalsContact C-N 3.27Å; C400-C402 PolarHBondContact O-N 3.3Å; C402-L407 WeakPolarHBondContact O-CB 3.4Å; C402-L407 PolarHBondContact O-N 3.25Å
403	F	94.1	Very high	94	Very high	119 Å²	119	50.1 Å²	50.1	52%	0.522	29%	0.291	S	S	.	.	I	π-helix	trans	-79.5	-39.4	-176.3	-76.4	-70.6	0	0	0	114	F364 C399 C400 P408	F364-F403 HydrophobicContact CE1-CD1 4.34Å; F364-F403 HydrophobicContact CE1-CE1 4.09Å; F364-F403 HydrophobicContact CE1-CZ 4.3Å; F364-F403 HydrophobicContact CE2-CE1 4.37Å; F364-F403 AromaticContact CZ-CD1 3.75Å; F364-F403 HydrophobicContact CZ-CD1 3.75Å; F364-F403 AromaticContact CZ-CE1 3.52Å; F364-F403 HydrophobicContact CZ-CE1 3.52Å; F364-F403 HydrophobicContact CZ-CZ 4.16Å; C399-F403 VanDerWaalsContact O-CD2 3.22Å; C399-F403 WeakPolarHBondContact O-CD2 3.33Å; C399-F403 PolarHBondContact O-N 3.33Å; C400-F403 PolarHBondContact O-N 2.92Å; F403-P408 WeakPolarHBondContact O-CD 3.28Å
404	F	95.3	Very high	94.4	Very high	161 Å²	161	47.6 Å²	47.6	71%	0.706	27%	0.265	S	S	*	.	I	π-helix	trans	-98.4	-20.7	-171.8	-66.2	-69.1	0	0	0	114.1	C400 P408	C400-F404 HydrophobicContact CB-CD2 4.1Å; C400-F404 WeakPolarHBondContact O-CB 3.25Å; C400-F404 WeakPolarHBondContact O-CD2 3.08Å; C400-F404 PolarHBondContact O-N 3.45Å; F404-P408 WeakPolarHBondContact O-CG 3.47Å
405	V	94.4	Very high	94.8	Very high	61 Å²	61	50.3 Å²	50.3	37%	0.37	28%	0.278	S	S	.	.	I	π-helix	trans	-112.6	-58.7	-179.5	-173.5	0	0	0	0	110.8	A333 I401 P408 L409	A333-V405 HydrophobicContact CB-CG1 3.99Å; I401-V405 HydrophobicContact CG2-CB 4.44Å; I401-V405 WeakPolarHBondContact O-CA 3.37Å; I401-V405 VanDerWaalsContact O-CB 3.31Å; I401-V405 WeakPolarHBondContact O-CB 3.31Å; I401-V405 PolarHBondContact O-N 2.83Å; V405-P408 WeakPolarHBondContact O-CD 3.3Å; V405-L409 HydrophobicContact CG1-CD1 3.81Å; V405-L409 WeakPolarHBondContact O-CB 3.38Å; V405-L409 VanDerWaalsContact O-CG 3.26Å; V405-L409 WeakPolarHBondContact O-CG 3.15Å; V405-L409 PolarHBondContact O-N 2.99Å
406	I	96.1	Very high	95.1	Very high	8 Å²	8	52.3 Å²	52.3	4%	0.041	29%	0.289	C	S	.	.	I	π-helix	trans	-64.4	-49	-174	-64.9	173.3	0	0	0	111	Y332 A333 I401 L409 N410	Y332-I406 HydrophobicContact CD1-CD1 3.92Å; Y332-I406 HydrophobicContact CE1-CD1 3.89Å; A333-I406 HydrophobicContact CB-CG1 4.1Å; I401-I406 HydrophobicContact CG2-CD1 4.2Å; I401-I406 HydrophobicContact CG2-CG1 4.35Å; I401-I406 PolarHBondContact O-N 3.49Å; I406-L409 PolarHBondContact O-N 2.83Å; I406-N410 WeakPolarHBondContact O-CB 3.33Å; I406-N410 PolarHBondContact O-N 3.35Å
407	L	96.3	Very high	95.3	Very high	34 Å²	34	49.2 Å²	49.2	18%	0.178	27%	0.27	C	S	.	.	H	α-helix	trans	-63.3	-48	-175.8	177.1	145.5	0	0	0	113.6	F360 F364 C402 N410 L411	F360-L407 HydrophobicContact CD1-CD1 4.01Å; F360-L407 HydrophobicContact CE1-CD1 3.53Å; F360-L407 HydrophobicContact CZ-CD1 4.28Å; F364-L407 HydrophobicContact CE2-CD1 3.6Å; F364-L407 HydrophobicContact CZ-CD1 3.75Å; C402-L407 WeakPolarHBondContact O-CB 3.4Å; C402-L407 PolarHBondContact O-N 3.25Å; L407-N410 PolarHBondContact O-N 2.86Å; L407-L411 PolarHBondContact O-N 3.33Å
408	P	96.7	Very high	95.4	Very high	54 Å²	54	50 Å²	50	35%	0.351	27%	0.265	S	S	.	.	H	α-helix	trans	-64	-41.3	176	-26.4	37.3	0	0	0	113.4	F403 F404 V405 N410 L411 V412	F403-P408 WeakPolarHBondContact O-CD 3.28Å; F404-P408 WeakPolarHBondContact O-CG 3.47Å; V405-P408 WeakPolarHBondContact O-CD 3.3Å; P408-N410 VanDerWaalsContact C-N 3.34Å; P408-N410 PolarHBondContact O-N 3.48Å; P408-L411 WeakPolarHBondContact O-CB 3.29Å; P408-L411 PolarHBondContact O-N 2.92Å; P408-V412 WeakPolarHBondContact O-CG2 3.27Å; P408-V412 PolarHBondContact O-N 3.22Å; P408-V412 VanDerWaalsContact O-N 3.11Å
409	L	96.4	Very high	95.5	Very high	60 Å²	60	54.4 Å²	54.4	31%	0.314	29%	0.288	S	S	.	.	H	α-helix	trans	-65.5	-38.8	177.3	-72	176.6	0	0	0	111.8	A333 P337 V405 I406 L411 V412 G413	A333-L409 VanDerWaalsContact O-CD1 3.32Å; A333-L409 WeakPolarHBondContact O-CD1 3.31Å; P337-L409 HydrophobicContact CG-CB 4.04Å; P337-L409 HydrophobicContact CG-CD2 4.38Å; V405-L409 HydrophobicContact CG1-CD1 3.81Å; V405-L409 WeakPolarHBondContact O-CB 3.38Å; V405-L409 VanDerWaalsContact O-CG 3.26Å; V405-L409 WeakPolarHBondContact O-CG 3.15Å; V405-L409 PolarHBondContact O-N 2.99Å; I406-L409 PolarHBondContact O-N 2.83Å; L409-L411 VanDerWaalsContact C-N 3.34Å; L409-V412 PolarHBondContact O-N 3.24Å; L409-G413 PolarHBondContact O-N 3.38Å; L409-G413 VanDerWaalsContact O-N 3.1Å
410	N	97.2	Very high	95.6	Very high	2 Å²	2	57.8 Å²	57.8	1%	0.011	30%	0.301	C	S	.	.	H	α-helix	trans	-66.1	-35.7	174.5	-168.7	45.2	0	0	0	112.3	S336 G340 M359 A363 I406 L407 P408 G413 T414	S336-N410 PolarHBondContact O-OD1 3.42Å; G340-N410 WeakPolarHBondContact CA-OD1 3.4Å; G340-N410 PolarHBondContact N-OD1 2.73Å; M359-N410 PolarHBondContact O-ND2 3.23Å; M359-N410 VanDerWaalsContact O-ND2 3.11Å; A363-N410 HydrophobicContact CB-CB 4.36Å; A363-N410 WeakPolarHBondContact CB-ND2 3.38Å; A363-N410 PolarHBondContact N-ND2 3Å; I406-N410 WeakPolarHBondContact O-CB 3.33Å; I406-N410 PolarHBondContact O-N 3.35Å; L407-N410 PolarHBondContact O-N 2.86Å; P408-N410 VanDerWaalsContact C-N 3.34Å; P408-N410 PolarHBondContact O-N 3.48Å; N410-G413 PolarHBondContact O-N 3.08Å; N410-T414 WeakPolarHBondContact O-CB 3.32Å; N410-T414 PolarHBondContact O-N 3.04Å; N410-T414 PolarHBondContact O-OG1 3.03Å
411	L	97.3	Very high	95.5	Very high	61 Å²	61	56.8 Å²	56.8	32%	0.319	29%	0.294	S	S	.	.	H	α-helix	trans	-60.3	-47.3	173.2	171.6	66.5	0	0	0	111.1	W355 M359 L407 P408 L409 G413 T414 I415	W355-L411 HydrophobicContact CZ3-CD1 4.11Å; M359-L411 HydrophobicContact CE-CD1 4.49Å; M359-L411 HydrophobicContact SD-CB 3.71Å; M359-L411 HydrophobicContact SD-CD1 3.35Å; M359-L411 WeakPolarHBondContact SD-CD1 3.3Å; M359-L411 HydrophobicContact SD-CG 4.11Å; L407-L411 PolarHBondContact O-N 3.33Å; P408-L411 WeakPolarHBondContact O-CB 3.29Å; P408-L411 PolarHBondContact O-N 2.92Å; L409-L411 VanDerWaalsContact C-N 3.34Å; L411-G413 PolarHBondContact O-N 2.95Å; L411-T414 PolarHBondContact O-N 3.02Å; L411-I415 HydrophobicContact CD1-CD1 3.82Å; L411-I415 HydrophobicContact CD1-CG1 4.17Å; L411-I415 HydrophobicContact CG-CD1 4Å; L411-I415 WeakPolarHBondContact O-CG1 3.23Å; L411-I415 PolarHBondContact O-N 3.43Å
412	V	97.2	Very high	95.2	Very high	77 Å²	77	55 Å²	55	47%	0.467	29%	0.287	S	S	.	.	H	α-helix	trans	-57.5	-49.5	176.7	174.1	0	0	0	0	110.6	P408 L409 T414 I415 L416	P408-V412 WeakPolarHBondContact O-CG2 3.27Å; P408-V412 PolarHBondContact O-N 3.22Å; P408-V412 VanDerWaalsContact O-N 3.11Å; L409-V412 PolarHBondContact O-N 3.24Å; V412-T414 VanDerWaalsContact C-N 3.32Å; V412-T414 PolarHBondContact O-N 3.42Å; V412-I415 PolarHBondContact O-N 3.22Å; V412-L416 HydrophobicContact CG1-CD1 3.99Å; V412-L416 WeakPolarHBondContact O-CG 3.39Å; V412-L416 PolarHBondContact O-N 3.32Å
413	G	97.1	Very high	94.9	Very high	1 Å²	1	62.2 Å²	62.2	1%	0.01	32%	0.319	C	S	.	.	H	α-helix	trans	-56.8	-44.2	175.6	0	0	0	0	0	112.9	P337 G340 Y341 L409 N410 L411 I415 L416 G417	P337-G413 VanDerWaalsContact O-CA 3.3Å; P337-G413 WeakPolarHBondContact O-CA 3.3Å; G340-G413 CarbonylContact C-O 3.56Å; Y341-G413 VanDerWaalsContact CA-O 3.23Å; Y341-G413 WeakPolarHBondContact CA-O 3.45Å; Y341-G413 PolarHBondContact N-O 3.4Å; L409-G413 PolarHBondContact O-N 3.38Å; L409-G413 VanDerWaalsContact O-N 3.1Å; N410-G413 PolarHBondContact O-N 3.08Å; L411-G413 PolarHBondContact O-N 2.95Å; G413-I415 PolarHBondContact O-N 2.97Å; G413-L416 PolarHBondContact O-N 3.4Å; G413-G417 PolarHBondContact O-N 3.43Å
414	T	97	Very high	94.4	Very high	0 Å²	0	59.6 Å²	59.6	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-62.6	-44	-179.8	-57.8	0	0	0	0	112.1	G340 W355 M359 N410 L411 V412 R418	G340-T414 WeakPolarHBondContact CA-OG1 3.22Å; G340-T414 VanDerWaalsContact O-CA 3.29Å; G340-T414 WeakPolarHBondContact O-CA 3.36Å; W355-T414 HydrophobicContact CE3-CG2 4.21Å; M359-T414 HydrophobicContact CB-CG2 4.2Å; M359-T414 HydrophobicContact CG-CG2 4.44Å; N410-T414 WeakPolarHBondContact O-CB 3.32Å; N410-T414 PolarHBondContact O-N 3.04Å; N410-T414 PolarHBondContact O-OG1 3.03Å; L411-T414 PolarHBondContact O-N 3.02Å; V412-T414 VanDerWaalsContact C-N 3.32Å; V412-T414 PolarHBondContact O-N 3.42Å; T414-R418 HydrophobicContact CG2-CG 4.44Å; T414-R418 WeakPolarHBondContact O-CB 3.38Å; T414-R418 WeakPolarHBondContact O-CG 3Å; T414-R418 PolarHBondContact O-N 3.05Å; T414-R418 VanDerWaalsContact O-N 3.08Å
415	I	96.7	Very high	93.8	Very high	74 Å²	74	57.5 Å²	57.5	38%	0.379	31%	0.31	S	S	.	.	H	α-helix	trans	-64.3	-46.5	177.7	-66.7	168.2	0	0	0	110.3	L411 V412 G413 R418 N419	L411-I415 HydrophobicContact CD1-CD1 3.82Å; L411-I415 HydrophobicContact CD1-CG1 4.17Å; L411-I415 HydrophobicContact CG-CD1 4Å; L411-I415 WeakPolarHBondContact O-CG1 3.23Å; L411-I415 PolarHBondContact O-N 3.43Å; V412-I415 PolarHBondContact O-N 3.22Å; G413-I415 PolarHBondContact O-N 2.97Å; I415-R418 PolarHBondContact O-N 3.03Å; I415-N419 WeakPolarHBondContact O-CB 3.35Å; I415-N419 PolarHBondContact O-N 3.27Å; I415-N419 VanDerWaalsContact O-N 3.09Å; I415-N419 PolarHBondContact O-ND2 2.96Å
416	L	96.5	Very high	93.3	Very high	88 Å²	88	58 Å²	58	46%	0.461	31%	0.308	S	S	.	.	H	α-helix	trans	-61.8	-46.3	178.8	-69.5	174.9	0	0	0	112.1	Y341 V412 G413 R418 N419 L420	Y341-L416 HydrophobicContact CD2-CB 4.31Å; V412-L416 HydrophobicContact CG1-CD1 3.99Å; V412-L416 WeakPolarHBondContact O-CG 3.39Å; V412-L416 PolarHBondContact O-N 3.32Å; G413-L416 PolarHBondContact O-N 3.4Å; L416-R418 PolarHBondContact O-N 3.29Å; L416-N419 PolarHBondContact O-N 3.46Å; L416-L420 VanDerWaalsContact O-CB 3.3Å; L416-L420 WeakPolarHBondContact O-CB 3.39Å; L416-L420 WeakPolarHBondContact O-CG 3.41Å; L416-L420 PolarHBondContact O-N 2.95Å
417	G	96	Very high	92.6	Very high	0 Å²	0	60.1 Å²	60.1	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-63	-41.6	179.4	0	0	0	0	0	112.8	S345 G413 S421 G422	S345-G417 VanDerWaalsContact CB-O 3.26Å; S345-G417 WeakPolarHBondContact CB-O 3.49Å; G413-G417 PolarHBondContact O-N 3.43Å; G417-S421 CarbonylContact O-C 3.59Å; G417-S421 PolarHBondContact O-N 3.45Å; G417-S421 VanDerWaalsContact O-N 3.07Å; G417-S421 PolarHBondContact O-OG 3.25Å; G417-S421 VanDerWaalsContact O-OG 3.09Å; G417-G422 PolarHBondContact O-N 3.04Å; G417-G422 VanDerWaalsContact O-N 3.13Å
418	R	94.3	Very high	91.9	Very high	55 Å²	55	59.2 Å²	59.2	21%	0.208	32%	0.319	C	S	.	.	H	α-helix	trans	-66.1	-40.7	178.3	-71.1	176.5	63.4	69.2	3.4	112.7	G344 A348 W355 T414 I415 L416 G422	G344-R418 VanDerWaalsContact O-CG 3.31Å; G344-R418 WeakPolarHBondContact O-CG 3.18Å; A348-R418 HydrophobicContact CB-CG 4.21Å; W355-R418 VanDerWaalsContact CB-NH1 3.34Å; T414-R418 HydrophobicContact CG2-CG 4.44Å; T414-R418 WeakPolarHBondContact O-CB 3.38Å; T414-R418 WeakPolarHBondContact O-CG 3Å; T414-R418 PolarHBondContact O-N 3.05Å; T414-R418 VanDerWaalsContact O-N 3.08Å; I415-R418 PolarHBondContact O-N 3.03Å; L416-R418 PolarHBondContact O-N 3.29Å; R418-G422 VanDerWaalsContact O-CA 3.25Å; R418-G422 WeakPolarHBondContact O-CA 3.22Å; R418-G422 PolarHBondContact O-N 3.45Å
419	N	93.8	Very high	91.4	Very high	123 Å²	123	67.3 Å²	67.3	66%	0.658	34%	0.342	S	S	*	.	H	α-helix	trans	-80.3	-38.4	-175.5	-69.5	-17.3	0	0	0	112.6	I415 L416	I415-N419 WeakPolarHBondContact O-CB 3.35Å; I415-N419 PolarHBondContact O-N 3.27Å; I415-N419 VanDerWaalsContact O-N 3.09Å; I415-N419 PolarHBondContact O-ND2 2.96Å; L416-N419 PolarHBondContact O-N 3.46Å
420	L	93.3	Very high	90.9	Very high	130 Å²	130	66.7 Å²	66.7	68%	0.681	34%	0.341	S	S	*	.	H	α-helix	trans	-86.3	-39.5	-175.8	-63.5	176	0	0	0	113.2	Y341 L416	Y341-L420 HydrophobicContact CE2-CD1 4.47Å; L416-L420 VanDerWaalsContact O-CB 3.3Å; L416-L420 WeakPolarHBondContact O-CB 3.39Å; L416-L420 WeakPolarHBondContact O-CG 3.41Å; L416-L420 PolarHBondContact O-N 2.95Å
421	S	90.9	Very high	90.4	Very high	33 Å²	33	70.5 Å²	70.5	23%	0.231	36%	0.361	C	S	.	.	H	α-helix	trans	-131.2	15	-171.5	54.8	0	0	0	0	113.5	Y341 S345 R349 G417	Y341-S421 PolarHBondContact OH-OG 2.93Å; S345-S421 WeakPolarHBondContact CB-OG 3.31Å; R349-S421 VanDerWaalsContact CD-O 3.29Å; R349-S421 WeakPolarHBondContact CD-O 3.16Å; R349-S421 WeakPolarHBondContact CG-O 3.49Å; G417-S421 CarbonylContact O-C 3.59Å; G417-S421 PolarHBondContact O-N 3.45Å; G417-S421 VanDerWaalsContact O-N 3.07Å; G417-S421 PolarHBondContact O-OG 3.25Å; G417-S421 VanDerWaalsContact O-OG 3.09Å
422	G	87.5	Confident	89.9	Confident	5 Å²	5	72.2 Å²	72.2	5%	0.052	38%	0.384	C	S	.	.			trans	-82.6	-11.9	-179.9	0	0	0	0	0	115.6	A348 R349 G417 R418	A348-G422 CarbonylContact C-O 3.51Å; A348-G422 VanDerWaalsContact C-O 3.28Å; R349-G422 WeakPolarHBondContact CA-O 3.34Å; R349-G422 PolarHBondContact N-O 3.44Å; G417-G422 PolarHBondContact O-N 3.04Å; G417-G422 VanDerWaalsContact O-N 3.13Å; R418-G422 VanDerWaalsContact O-CA 3.25Å; R418-G422 WeakPolarHBondContact O-CA 3.22Å; R418-G422 PolarHBondContact O-N 3.45Å
423	Q	88.4	Confident	89.5	Confident	160 Å²	160	74 Å²	74	75%	0.748	40%	0.395	S	S	*	.	S	Bend	trans	-75.7	129	179	-66.1	-62.9	-16.8	0	0	111.1	N425	Q423-N425 PolarHBondContact O-N 3.45Å
424	P	83.2	Confident	89.1	Confident	64 Å²	64	76.8 Å²	76.8	42%	0.416	41%	0.413	S	S	.	.			trans	-70.1	116.5	174.8	27	-30.8	0	0	0	110.5	F426	P424-F426 HydrophobicContact CB-CD2 3.92Å; P424-F426 HydrophobicContact CB-CE1 4.46Å; P424-F426 HydrophobicContact CB-CE2 3.43Å; P424-F426 VanDerWaalsContact CB-CE2 3.43Å; P424-F426 HydrophobicContact CB-CZ 3.74Å
425	N	83	Confident	88.5	Confident	117 Å²	117	81.2 Å²	81.2	63%	0.626	43%	0.43	S	S	*	.			trans	-114.7	78.6	170.1	-172.1	4.7	0	0	0	109	Q423	Q423-N425 PolarHBondContact O-N 3.45Å
426	F	83.7	Confident	88.1	Confident	71 Å²	71	83 Å²	83	31%	0.311	45%	0.446	S	S	.	.			trans	-88.2	135.4	179.5	-57.2	-51.1	0	0	0	110.1	F282 P424 C428	F282-F426 HydrophobicContact CB-CB 4.2Å; F282-F426 HydrophobicContact CB-CD1 3.69Å; F282-F426 HydrophobicContact CB-CD2 4.33Å; F282-F426 HydrophobicContact CB-CE1 4.1Å; F282-F426 HydrophobicContact CB-CG 3.83Å; F282-F426 AromaticContact CD1-CD1 3.68Å; F282-F426 HydrophobicContact CD1-CD1 3.68Å; F282-F426 HydrophobicContact CD1-CE1 4.25Å; F282-F426 HydrophobicContact CD1-CG 4.42Å; F282-F426 HydrophobicContact CD2-CB 4.41Å; F282-F426 HydrophobicContact CG-CB 4.14Å; F282-F426 AromaticContact CG-CD1 3.81Å; F282-F426 HydrophobicContact CG-CD1 3.81Å; F282-F426 HydrophobicContact CG-CG 4.13Å; P424-F426 HydrophobicContact CB-CD2 3.92Å; P424-F426 HydrophobicContact CB-CE1 4.46Å; P424-F426 HydrophobicContact CB-CE2 3.43Å; P424-F426 VanDerWaalsContact CB-CE2 3.43Å; P424-F426 HydrophobicContact CB-CZ 3.74Å; F426-C428 VanDerWaalsContact C-N 3.3Å; F426-C428 PolarHBondContact O-N 3.29Å
427	P	82	Confident	87.6	Confident	53 Å²	53	81.4 Å²	81.4	34%	0.344	44%	0.437	S	S	.	.	S	Bend	trans	-70.3	-27.5	-179.2	28.6	-34.3	0	0	0	113	F282 T584	F282-P427 HydrophobicContact CD2-CG 4.38Å; F282-P427 HydrophobicContact CE1-CG 4.32Å; F282-P427 HydrophobicContact CE2-CG 3.44Å; F282-P427 VanDerWaalsContact CE2-CG 3.44Å; F282-P427 VanDerWaalsContact CZ-CD 3.49Å; F282-P427 HydrophobicContact CZ-CG 3.4Å; F282-P427 VanDerWaalsContact CZ-CG 3.4Å; P427-T584 WeakPolarHBondContact CB-OG1 3.34Å
428	C	81.6	Confident	87.2	Confident	16 Å²	16	84 Å²	84	11%	0.108	45%	0.454	C	S	.	.	S	Bend	trans	-119.7	146.8	-180	-53.7	0	0	0	0	110.2	F282 F426	F282-C428 HydrophobicContact CD2-CB 4.45Å; F282-C428 HydrophobicContact CE2-CB 4.44Å; F426-C428 VanDerWaalsContact C-N 3.3Å; F426-C428 PolarHBondContact O-N 3.29Å
429	R	85.3	Confident	86.7	Confident	224 Å²	224	91 Å²	91	85%	0.845	49%	0.489	S	S	*	.	P	Polyproline II helix	trans	-67.3	135.7	171.6	-175.7	177.3	179.4	175.1	0	109.7
430	V	86.7	Confident	86.1	Confident	46 Å²	46	87.6 Å²	87.6	28%	0.279	47%	0.468	S	S	.	.	P	Polyproline II helix	trans	-84.9	128.8	176.4	-178.1	0	0	0	0	109.7	G279 F282 R283	G279-V430 CarbonylContact O-C 3.56Å; G279-V430 VanDerWaalsContact O-CA 3.26Å; G279-V430 WeakPolarHBondContact O-CA 3.3Å; F282-V430 HydrophobicContact CB-CG2 3.86Å; R283-V430 HydrophobicContact CG-CG1 3.57Å
431	N	87.4	Confident	85.7	Confident	82 Å²	82	88.4 Å²	88.4	44%	0.439	47%	0.466	S	S	.	.	P	Polyproline II helix	trans	-65.3	150.4	176.6	-74.3	-21.7	0	0	0	110.7	G279 R283	G279-N431 PolarHBondContact O-N 3.05Å; R283-N431 VanDerWaalsContact CZ-O 3.23Å; R283-N431 PolarHBondContact NH1-O 2.84Å; R283-N431 PolarHBondContact NH2-O 2.76Å
432	A	86.4	Confident	85.5	Confident	97 Å²	97	95.8 Å²	95.8	80%	0.802	49%	0.489	S	S	*	.	S	Bend	trans	-68.5	-48.8	178.1	0	0	0	0	0	111.2	R283	R283-A432 PolarHBondContact NH1-O 3.47Å; R283-A432 VanDerWaalsContact NH1-O 3.09Å
433	V	89.1	Confident	85.3	Confident	116 Å²	116	99.7 Å²	99.7	70%	0.703	51%	0.505	S	S	*	.	S	Bend	trans	-98.1	129.7	-177.5	-177.6	0	0	0	0	110.1	R283	R283-V433 PolarHBondContact NH2-O 2.99Å
434	P	88.1	Confident	85	Confident	59 Å²	59	93.9 Å²	93.9	38%	0.383	48%	0.478	S	S	.	.	P	Polyproline II helix	trans	-70.7	138.7	177.6	28.2	-33.2	0	0	0	111	R283 Y512	R283-P434 VanDerWaalsContact NH2-CA 3.32Å; R283-P434 VanDerWaalsContact NH2-N 3.12Å; P434-Y512 HydrophobicContact CB-CE1 4.41Å
435	R	85.3	Confident	85.3	Confident	93 Å²	93	95.3 Å²	95.3	35%	0.351	48%	0.479	S	S	.	.	P	Polyproline II helix	trans	-67.1	140.3	173.8	-173.6	178.6	163	153.8	-11.2	110.7	Q276 D280 E510	Q276-R435 VanDerWaalsContact OE1-NH1 3.12Å; D280-R435 VanDerWaalsContact OD2-CB 3.3Å; D280-R435 WeakPolarHBondContact OD2-CB 3.26Å; D280-R435 PolarHBondContact OD2-N 3.27Å; R435-E510 IonicContact CZ-OE2 2.72Å; R435-E510 IonicContact NE-OE2 3.8Å; R435-E510 IonicContact NH2-OE2 2.83Å; R435-E510 PolarHBondContact NH2-OE2 3.09Å
436	P	87.2	Confident	85.5	Confident	110 Å²	110	91.4 Å²	91.4	71%	0.714	46%	0.461	S	S	*	.	P	Polyproline II helix	trans	-63	135.7	170.4	26.4	-34.2	0	0	0	110.5
437	I	86.9	Confident	85.9	Confident	56 Å²	56	91 Å²	91	29%	0.287	47%	0.47	S	S	.	.	P	Polyproline II helix	trans	-81.7	126.7	-179.5	-57.8	166.6	0	0	0	107.9	D511 Y512	I437-D511 HydrophobicContact CG2-CB 4.09Å; I437-Y512 HydrophobicContact CD1-CE1 4.19Å; I437-Y512 HydrophobicContact CG1-CD1 4.41Å; I437-Y512 HydrophobicContact CG1-CE1 4.05Å
438	P	86.2	Confident	86.4	Confident	54 Å²	54	90 Å²	90	35%	0.351	46%	0.463	S	S	.	.	P	Polyproline II helix	trans	-67.4	159.7	179	29.2	-35.7	0	0	0	111.9	K440 E510	P438-K440 PolarHBondContact O-N 3.09Å; P438-E510 HydrophobicContact CG-CB 3.78Å; P438-E510 HydrophobicContact CG-CG 4.44Å
439	E	83.8	Confident	86.8	Confident	202 Å²	202	89.9 Å²	89.9	94%	0.944	46%	0.461	S	S	*	.	P	Polyproline II helix	trans	-64.2	129.9	170.5	-65.6	-175.4	-179.2	0	0	109.9
440	K	81.9	Confident	87.2	Confident	51 Å²	51	80.3 Å²	80.3	22%	0.222	43%	0.428	C	S	.	.			trans	-119	155.8	-176.8	60.2	-171.4	172.2	176.8	0	110.8	P438 M444 P446 A509 D511	P438-K440 PolarHBondContact O-N 3.09Å; K440-M444 HydrophobicContact CB-CB 4.19Å; K440-M444 HydrophobicContact CD-CB 4.19Å; K440-M444 WeakPolarHBondContact CD-O 3.27Å; K440-M444 WeakPolarHBondContact CE-O 3.44Å; K440-M444 HydrophobicContact CG-CB 4.39Å; K440-M444 PolarHBondContact NZ-O 3.07Å; K440-P446 VanDerWaalsContact NZ-CD 3.31Å; K440-A509 HydrophobicContact CB-CB 4.39Å; K440-A509 HydrophobicContact CD-CB 4.22Å; K440-D511 IonicContact NZ-OD2 3.96Å; K440-D511 PolarHBondContact NZ-OD2 2.88Å
441	K	86	Confident	87.5	Confident	147 Å²	147	81.4 Å²	81.4	64%	0.639	44%	0.437	S	S	*	.			trans	-60.8	147.7	174.2	-61.2	-176.7	-178.1	-178.8	0	109.7	F443 M444	K441-F443 HydrophobicContact CB-CD1 3.82Å; K441-F443 HydrophobicContact CB-CE1 3.49Å; K441-F443 VanDerWaalsContact CB-CE1 3.49Å; K441-F443 HydrophobicContact CB-CZ 3.96Å; K441-F443 HydrophobicContact CD-CE1 3.42Å; K441-F443 VanDerWaalsContact CD-CE1 3.42Å; K441-F443 HydrophobicContact CD-CZ 3.59Å; K441-F443 HydrophobicContact CG-CE1 4.08Å; K441-F443 HydrophobicContact CG-CZ 4.38Å; K441-F443 PolarHBondContact O-N 3.5Å; K441-M444 WeakPolarHBondContact O-CB 3.34Å; K441-M444 PolarHBondContact O-N 3.18Å
442	W	85.9	Confident	87.6	Confident	188 Å²	188	82.5 Å²	82.5	71%	0.712	44%	0.442	S	S	*	.	G	3₁₀ helix	trans	-50.7	-37.5	-176.2	75.5	-87.2	0	0	0	113.7	M444 E445 V448	W442-M444 VanDerWaalsContact C-N 3.27Å; W442-M444 PolarHBondContact O-N 2.95Å; W442-E445 WeakPolarHBondContact O-CB 3.42Å; W442-E445 WeakPolarHBondContact O-CG 3.37Å; W442-E445 PolarHBondContact O-N 3.44Å; W442-V448 HydrophobicContact CE3-CG2 4.37Å; W442-V448 HydrophobicContact CZ3-CG1 4.3Å
443	F	83.2	Confident	87.8	Confident	87 Å²	87	78 Å²	78	38%	0.382	41%	0.405	S	S	.	.	G	3₁₀ helix	trans	-73.8	-13.9	-180	64.4	-98	0	0	0	114.4	K441 E445	K441-F443 HydrophobicContact CB-CD1 3.82Å; K441-F443 HydrophobicContact CB-CE1 3.49Å; K441-F443 VanDerWaalsContact CB-CE1 3.49Å; K441-F443 HydrophobicContact CB-CZ 3.96Å; K441-F443 HydrophobicContact CD-CE1 3.42Å; K441-F443 VanDerWaalsContact CD-CE1 3.42Å; K441-F443 HydrophobicContact CD-CZ 3.59Å; K441-F443 HydrophobicContact CG-CE1 4.08Å; K441-F443 HydrophobicContact CG-CZ 4.38Å; K441-F443 PolarHBondContact O-N 3.5Å; F443-E445 VanDerWaalsContact C-N 3.33Å
444	M	82.4	Confident	88	Confident	38 Å²	38	72.4 Å²	72.4	19%	0.187	37%	0.371	C	S	.	.	G	3₁₀ helix	trans	-92.2	4.8	173.8	-63.9	-57.2	-157.9	0	0	112.3	K440 K441 W442 F505 A509	K440-M444 HydrophobicContact CB-CB 4.19Å; K440-M444 HydrophobicContact CD-CB 4.19Å; K440-M444 WeakPolarHBondContact CD-O 3.27Å; K440-M444 WeakPolarHBondContact CE-O 3.44Å; K440-M444 HydrophobicContact CG-CB 4.39Å; K440-M444 PolarHBondContact NZ-O 3.07Å; K441-M444 WeakPolarHBondContact O-CB 3.34Å; K441-M444 PolarHBondContact O-N 3.18Å; W442-M444 VanDerWaalsContact C-N 3.27Å; W442-M444 PolarHBondContact O-N 2.95Å; M444-F505 HydrophobicContact CE-CD1 3.8Å; M444-F505 HydrophobicContact SD-CB 4.18Å; M444-F505 HydrophobicContact SD-CD1 4.42Å; M444-A509 HydrophobicContact CB-CB 4.18Å
445	E	88.5	Confident	88.2	Confident	94 Å²	94	73.2 Å²	73.2	44%	0.439	37%	0.372	S	S	.	.	S	Bend	trans	-66.2	143.3	174.6	-73.7	-170.3	179.2	0	0	112.1	W442 F443 A447 V448 I449	W442-E445 WeakPolarHBondContact O-CB 3.42Å; W442-E445 WeakPolarHBondContact O-CG 3.37Å; W442-E445 PolarHBondContact O-N 3.44Å; F443-E445 VanDerWaalsContact C-N 3.33Å; E445-A447 PolarHBondContact O-N 3.47Å; E445-V448 HydrophobicContact CB-CG2 4.24Å; E445-V448 PolarHBondContact O-N 3.07Å; E445-I449 WeakPolarHBondContact O-CG1 3.49Å; E445-I449 PolarHBondContact O-N 3.02Å
446	P	89	Confident	88.5	Confident	36 Å²	36	71.7 Å²	71.7	23%	0.234	37%	0.37	C	S	.	.	H	α-helix	trans	-58.3	-38	-178.1	-24.6	38.7	0	0	0	112.1	K440 V450 L506 T517	K440-P446 VanDerWaalsContact NZ-CD 3.31Å; P446-V450 WeakPolarHBondContact O-CB 3.47Å; P446-V450 WeakPolarHBondContact O-CG2 3.38Å; P446-V450 PolarHBondContact O-N 3.39Å; P446-L506 HydrophobicContact CG-CD1 4.27Å; P446-T517 HydrophobicContact CB-CG2 3.66Å
447	A	90.3	Very high	88.8	Confident	62 Å²	62	66.5 Å²	66.5	51%	0.512	34%	0.336	S	S	.	.	H	α-helix	trans	-66	-42.9	-179.3	0	0	0	0	0	112.3	E445 V450 C451	E445-A447 PolarHBondContact O-N 3.47Å; A447-V450 PolarHBondContact O-N 3.09Å; A447-C451 PolarHBondContact O-N 3.17Å; A447-C451 PolarHBondContact O-SG 2.61Å
448	V	92.4	Very high	89.1	Confident	33 Å²	33	65.4 Å²	65.4	20%	0.2	33%	0.329	C	S	.	.	H	α-helix	trans	-67.3	-44.9	178.3	-179.3	0	0	0	0	110.4	W442 E445 V450 C451 L452	W442-V448 HydrophobicContact CE3-CG2 4.37Å; W442-V448 HydrophobicContact CZ3-CG1 4.3Å; E445-V448 HydrophobicContact CB-CG2 4.24Å; E445-V448 PolarHBondContact O-N 3.07Å; V448-V450 VanDerWaalsContact C-N 3.31Å; V448-V450 PolarHBondContact O-N 3.13Å; V448-C451 PolarHBondContact O-N 3.23Å; V448-L452 HydrophobicContact CG1-CD1 3.96Å; V448-L452 HydrophobicContact CG1-CG 4.43Å; V448-L452 WeakPolarHBondContact O-CG 3.49Å; V448-L452 PolarHBondContact O-N 2.71Å
449	I	91.4	Very high	89.3	Confident	13 Å²	13	65 Å²	65	7%	0.067	34%	0.335	C	S	.	.	H	α-helix	trans	-58.9	-44.3	175.6	-66	170.3	0	0	0	110.8	E445 C451 L452 G453 C502 L506	E445-I449 WeakPolarHBondContact O-CG1 3.49Å; E445-I449 PolarHBondContact O-N 3.02Å; I449-C451 PolarHBondContact O-N 3.4Å; I449-L452 PolarHBondContact O-N 3.49Å; I449-G453 PolarHBondContact O-N 3.24Å; I449-C502 HydrophobicContact CG2-CB 3.48Å; I449-C502 VanDerWaalsContact CG2-CB 3.48Å; I449-L506 HydrophobicContact CD1-CB 4.36Å; I449-L506 HydrophobicContact CD1-CD1 4.25Å
450	V	93.7	Very high	89.6	Confident	22 Å²	22	55.5 Å²	55.5	13%	0.133	29%	0.291	C	S	.	.	H	α-helix	trans	-60.5	-45.6	177.8	163.1	0	0	0	0	111.3	P446 A447 V448 G453 L520 S524	P446-V450 WeakPolarHBondContact O-CB 3.47Å; P446-V450 WeakPolarHBondContact O-CG2 3.38Å; P446-V450 PolarHBondContact O-N 3.39Å; A447-V450 PolarHBondContact O-N 3.09Å; V448-V450 VanDerWaalsContact C-N 3.31Å; V448-V450 PolarHBondContact O-N 3.13Å; V450-G453 PolarHBondContact O-N 2.94Å; V450-L520 HydrophobicContact CB-CB 4.47Å; V450-L520 HydrophobicContact CG1-CB 3.82Å; V450-L520 HydrophobicContact CG2-CB 3.72Å; V450-S524 VanDerWaalsContact O-CB 3.24Å; V450-S524 WeakPolarHBondContact O-CB 3.39Å; V450-S524 PolarHBondContact O-OG 2.99Å
451	C	92.7	Very high	90.1	Very high	70 Å²	70	53.4 Å²	53.4	47%	0.473	28%	0.282	S	S	.	.	H	α-helix	trans	-65.2	-42.7	179.5	-65.6	0	0	0	0	112	A447 V448 I449 Y528	A447-C451 PolarHBondContact O-N 3.17Å; A447-C451 PolarHBondContact O-SG 2.61Å; V448-C451 PolarHBondContact O-N 3.23Å; I449-C451 PolarHBondContact O-N 3.4Å; C451-Y528 WeakPolarHBondContact O-CE2 3.31Å; C451-Y528 PolarHBondContact O-OH 3.03Å
452	L	90.2	Very high	90.3	Very high	104 Å²	104	50.3 Å²	50.3	55%	0.545	27%	0.269	S	S	.	.	H	α-helix	trans	-70.7	-32.2	-179.4	-68.3	175.8	0	0	0	113	V448 I449 G454 I455	V448-L452 HydrophobicContact CG1-CD1 3.96Å; V448-L452 HydrophobicContact CG1-CG 4.43Å; V448-L452 WeakPolarHBondContact O-CG 3.49Å; V448-L452 PolarHBondContact O-N 2.71Å; I449-L452 PolarHBondContact O-N 3.49Å; L452-G454 PolarHBondContact O-N 2.66Å; L452-I455 HydrophobicContact CD2-CD1 4Å; L452-I455 PolarHBondContact O-N 2.93Å
453	G	90.6	Very high	90.5	Very high	2 Å²	2	43.4 Å²	43.4	2%	0.021	25%	0.245	C	C	.	.	H	α-helix	trans	-60.2	-29	-177.1	0	0	0	0	0	114.6	I449 V450 P457 V498 S521	I449-G453 PolarHBondContact O-N 3.24Å; V450-G453 PolarHBondContact O-N 2.94Å; G453-P457 WeakPolarHBondContact O-CD 3.28Å; G453-V498 VanDerWaalsContact O-CG1 3.23Å; G453-V498 WeakPolarHBondContact O-CG1 3.48Å; G453-S521 CarbonylContact C-O 3.48Å
454	G	92.4	Very high	90.8	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.4	-17.3	-176.4	0	0	0	0	0	115.7	L452 P457 F458 S524 T525	L452-G454 PolarHBondContact O-N 2.66Å; G454-P457 WeakPolarHBondContact O-CD 3.48Å; G454-F458 VanDerWaalsContact O-CB 3.26Å; G454-F458 WeakPolarHBondContact O-CB 3.5Å; G454-F458 PolarHBondContact O-N 2.98Å; G454-S524 WeakPolarHBondContact CA-OG 3.25Å; G454-S524 PolarHBondContact N-OG 3.29Å; G454-T525 PolarHBondContact O-OG1 3.33Å
455	I	93.1	Very high	91.1	Very high	76 Å²	76	38 Å²	38	39%	0.39	22%	0.221	S	C	.	.	H	α-helix	trans	-64.2	-45.8	-173.4	-62.3	174.9	0	0	0	110.8	L452 F458 G459 Y528	L452-I455 HydrophobicContact CD2-CD1 4Å; L452-I455 PolarHBondContact O-N 2.93Å; I455-F458 PolarHBondContact O-N 3.5Å; I455-G459 PolarHBondContact O-N 2.88Å; I455-Y528 HydrophobicContact CG1-CE1 3.85Å; I455-Y528 HydrophobicContact CG1-CE2 3.92Å; I455-Y528 WeakPolarHBondContact CG1-OH 3.41Å
456	L	90.9	Very high	91.2	Very high	61 Å²	61	36.6 Å²	36.6	32%	0.319	21%	0.212	S	C	.	.	H	α-helix	trans	-70.3	-47.4	-175.4	-62.8	170.8	0	0	0	112.6	M232 L236 F458 G459 S460 V498	M232-L456 HydrophobicContact CE-CD2 3.58Å; L236-L456 HydrophobicContact CD1-CB 4.44Å; L236-L456 HydrophobicContact CD1-CD1 4.3Å; L236-L456 HydrophobicContact CD2-CD1 3.76Å; L456-F458 VanDerWaalsContact C-N 3.3Å; L456-F458 PolarHBondContact O-N 3.16Å; L456-G459 PolarHBondContact O-N 3.26Å; L456-S460 PolarHBondContact O-N 2.98Å; L456-S460 VanDerWaalsContact O-N 3.08Å; L456-V498 HydrophobicContact CB-CG2 3.92Å; L456-V498 HydrophobicContact CD1-CG2 3.82Å
457	P	93.4	Very high	91.2	Very high	1 Å²	1	35.2 Å²	35.2	1%	0.006	20%	0.202	C	C	.	.	H	α-helix	trans	-60.8	-38.1	172.5	-18.5	27.9	0	0	0	112.7	G453 G454 S460 I461 L491 V494 T495 T525	G453-P457 WeakPolarHBondContact O-CD 3.28Å; G454-P457 WeakPolarHBondContact O-CD 3.48Å; P457-S460 PolarHBondContact O-N 3.29Å; P457-S460 PolarHBondContact O-OG 3.46Å; P457-I461 PolarHBondContact O-N 3.49Å; P457-L491 HydrophobicContact CB-CD1 3.94Å; P457-V494 HydrophobicContact CB-CG1 4.19Å; P457-V494 HydrophobicContact CG-CG1 4.06Å; P457-T495 HydrophobicContact CB-CG2 3.8Å; P457-T495 HydrophobicContact CG-CG2 3.98Å; P457-T525 HydrophobicContact CB-CG2 4.11Å; P457-T525 WeakPolarHBondContact CB-OG1 3.46Å
458	F	93.7	Very high	91.2	Very high	32 Å²	32	33.7 Å²	33.7	14%	0.14	19%	0.185	C	C	.	.	H	α-helix	trans	-61.4	-46.5	174.6	172.7	-109.6	0	0	0	111.8	G454 I455 L456 S460 I461 F462 T525 Y528 V529 Y532	G454-F458 VanDerWaalsContact O-CB 3.26Å; G454-F458 WeakPolarHBondContact O-CB 3.5Å; G454-F458 PolarHBondContact O-N 2.98Å; I455-F458 PolarHBondContact O-N 3.5Å; L456-F458 VanDerWaalsContact C-N 3.3Å; L456-F458 PolarHBondContact O-N 3.16Å; F458-S460 PolarHBondContact O-N 3.35Å; F458-I461 WeakPolarHBondContact O-CG1 3.37Å; F458-I461 PolarHBondContact O-N 3.06Å; F458-I461 VanDerWaalsContact O-N 3.12Å; F458-F462 AromaticContact CE1-CD2 3.85Å; F458-F462 HydrophobicContact CE1-CD2 3.85Å; F458-F462 HydrophobicContact CE1-CE2 4.4Å; F458-F462 HydrophobicContact CE2-CD2 4.17Å; F458-F462 AromaticContact CZ-CD2 3.5Å; F458-F462 HydrophobicContact CZ-CD2 3.5Å; F458-F462 VanDerWaalsContact CZ-CD2 3.5Å; F458-F462 HydrophobicContact CZ-CE2 4.01Å; F458-F462 PolarHBondContact O-N 3.22Å; F458-T525 HydrophobicContact CB-CG2 4.28Å; F458-Y528 HydrophobicContact CB-CG 4.28Å; F458-Y528 HydrophobicContact CD1-CG 4.38Å; F458-Y528 VanDerWaalsContact CG-CB 3.47Å; F458-Y528 HydrophobicContact CG-CG 4.27Å; F458-V529 HydrophobicContact CD2-CG2 3.81Å; F458-V529 HydrophobicContact CE2-CG2 4.14Å; F458-Y532 HydrophobicContact CE2-CG 4.48Å; F458-Y532 HydrophobicContact CZ-CD2 4.48Å; F458-Y532 HydrophobicContact CZ-CG 4.26Å
459	G	90.9	Very high	91.1	Very high	45 Å²	45	32.3 Å²	32.3	46%	0.464	18%	0.177	S	C	.	.	H	α-helix	trans	-56.6	-36.9	175.7	0	0	0	0	0	113	I455 L456 I461	I455-G459 PolarHBondContact O-N 2.88Å; L456-G459 PolarHBondContact O-N 3.26Å; G459-I461 VanDerWaalsContact C-N 3.31Å; G459-I461 PolarHBondContact O-N 3.27Å
460	S	89.9	Confident	91	Very high	3 Å²	3	32.1 Å²	32.1	2%	0.021	18%	0.176	C	C	.	.	H	α-helix	trans	-70.3	-21	179	73.3	0	0	0	0	115	S229 L456 P457 F458	S229-S460 PolarHBondContact OG-O 3.12Å; L456-S460 PolarHBondContact O-N 2.98Å; L456-S460 VanDerWaalsContact O-N 3.08Å; P457-S460 PolarHBondContact O-N 3.29Å; P457-S460 PolarHBondContact O-OG 3.46Å; F458-S460 PolarHBondContact O-N 3.35Å
461	I	91.6	Very high	90.6	Very high	7 Å²	7	31.4 Å²	31.4	4%	0.036	17%	0.172	C	C	.	.	H	α-helix	trans	-111.6	-3.9	179.9	65.7	177.8	0	0	0	112.8	P457 F458 G459 I463 E464 M465 V487 L491 T525 V529 L563	P457-I461 PolarHBondContact O-N 3.49Å; F458-I461 WeakPolarHBondContact O-CG1 3.37Å; F458-I461 PolarHBondContact O-N 3.06Å; F458-I461 VanDerWaalsContact O-N 3.12Å; G459-I461 VanDerWaalsContact C-N 3.31Å; G459-I461 PolarHBondContact O-N 3.27Å; I461-I463 PolarHBondContact O-N 3.43Å; I461-E464 PolarHBondContact O-N 3.41Å; I461-M465 HydrophobicContact CD1-CE 3.72Å; I461-M465 HydrophobicContact CG1-CE 4.36Å; I461-M465 VanDerWaalsContact O-CB 3.31Å; I461-M465 WeakPolarHBondContact O-CB 3.4Å; I461-M465 PolarHBondContact O-N 3.4Å; I461-V487 HydrophobicContact CB-CG1 4.43Å; I461-V487 HydrophobicContact CG2-CG1 3.9Å; I461-L491 HydrophobicContact CD1-CD1 4.43Å; I461-L491 HydrophobicContact CG2-CB 4.02Å; I461-L491 HydrophobicContact CG2-CD1 3.83Å; I461-L491 HydrophobicContact CG2-CD2 4.28Å; I461-L491 HydrophobicContact CG2-CG 4.25Å; I461-T525 HydrophobicContact CD1-CG2 4.21Å; I461-V529 HydrophobicContact CD1-CG2 4.23Å; I461-L563 HydrophobicContact CD1-CD2 4.18Å
462	F	91	Very high	90.3	Very high	82 Å²	82	33.9 Å²	33.9	36%	0.36	18%	0.175	S	C	.	.	H	α-helix	trans	-55.4	-46.9	-168.9	176.5	-103.8	0	0	0	113.6	F458 M465 Y466 Y532	F458-F462 AromaticContact CE1-CD2 3.85Å; F458-F462 HydrophobicContact CE1-CD2 3.85Å; F458-F462 HydrophobicContact CE1-CE2 4.4Å; F458-F462 HydrophobicContact CE2-CD2 4.17Å; F458-F462 AromaticContact CZ-CD2 3.5Å; F458-F462 HydrophobicContact CZ-CD2 3.5Å; F458-F462 VanDerWaalsContact CZ-CD2 3.5Å; F458-F462 HydrophobicContact CZ-CE2 4.01Å; F458-F462 PolarHBondContact O-N 3.22Å; F462-M465 WeakPolarHBondContact O-CB 3.49Å; F462-M465 PolarHBondContact O-N 3.08Å; F462-Y466 PolarHBondContact O-N 3.29Å; F462-Y532 HydrophobicContact CD2-CD2 4.41Å; F462-Y532 HydrophobicContact CD2-CE2 4.3Å; F462-Y532 AromaticContact CE2-CD2 3.62Å; F462-Y532 HydrophobicContact CE2-CD2 3.62Å; F462-Y532 AromaticContact CE2-CE2 3.34Å; F462-Y532 HydrophobicContact CE2-CE2 3.34Å; F462-Y532 HydrophobicContact CE2-CG 4.41Å; F462-Y532 AromaticContact CE2-CZ 3.96Å; F462-Y532 HydrophobicContact CZ-CD2 4.45Å; F462-Y532 AromaticContact CZ-CE2 3.8Å; F462-Y532 HydrophobicContact CZ-CE2 3.8Å
463	I	89.3	Confident	90.2	Very high	44 Å²	44	29.9 Å²	29.9	23%	0.226	15%	0.153	C	C	.	.	H	α-helix	trans	-67.5	-44.1	-177.1	-64	166.8	0	0	0	110.6	I221 S225 I461 M465 Y466 F467	I221-I463 HydrophobicContact CG2-CG2 4.37Å; S225-I463 WeakPolarHBondContact OG-CB 3.41Å; I461-I463 PolarHBondContact O-N 3.43Å; I463-M465 VanDerWaalsContact C-N 3.33Å; I463-M465 PolarHBondContact O-N 2.93Å; I463-Y466 WeakPolarHBondContact O-CB 3.44Å; I463-Y466 PolarHBondContact O-N 3.29Å; I463-F467 HydrophobicContact CG2-CD2 4.25Å; I463-F467 HydrophobicContact CG2-CE2 3.81Å; I463-F467 WeakPolarHBondContact O-CD2 3.31Å; I463-F467 PolarHBondContact O-N 2.82Å
464	E	88.9	Confident	89.6	Confident	4 Å²	4	31.2 Å²	31.2	2%	0.019	16%	0.164	C	C	.	.	H	α-helix	trans	-69.4	-33.3	178.1	-60.3	-58.2	141.8	0	0	112.4	H222 S225 I461 Y466 F467 I468 V487	H222-E464 IonicContact CE1-OE2 2.95Å; H222-E464 PolarHBondContact CE1-OE2 3.25Å; H222-E464 IonicContact CG-OE1 2.66Å; H222-E464 IonicContact ND1-OE1 2.77Å; H222-E464 PolarHBondContact ND1-OE1 2.66Å; H222-E464 IonicContact ND1-OE2 3.14Å; H222-E464 PolarHBondContact ND1-OE2 3.39Å; S225-E464 VanDerWaalsContact CB-OE1 3.31Å; S225-E464 WeakPolarHBondContact CB-OE1 3.47Å; S225-E464 PolarHBondContact OG-OE1 3.41Å; I461-E464 PolarHBondContact O-N 3.41Å; E464-Y466 PolarHBondContact O-N 3.08Å; E464-F467 PolarHBondContact O-N 3.3Å; E464-F467 VanDerWaalsContact O-N 3.09Å; E464-I468 WeakPolarHBondContact O-CG1 3.5Å; E464-I468 PolarHBondContact O-N 2.68Å; E464-V487 HydrophobicContact CB-CG1 4.28Å; E464-V487 HydrophobicContact CB-CG2 4.48Å; E464-V487 HydrophobicContact CG-CB 4.41Å; E464-V487 HydrophobicContact CG-CG1 4.15Å; E464-V487 HydrophobicContact CG-CG2 3.58Å
465	M	90.2	Very high	88.7	Confident	7 Å²	7	36.3 Å²	36.3	3%	0.034	18%	0.184	C	C	.	.	H	α-helix	trans	-59	-38.2	174	-168.9	62.9	69.9	0	0	111.5	I461 F462 I463 I468 F469 V529 Y532 F559 L563	I461-M465 HydrophobicContact CD1-CE 3.72Å; I461-M465 HydrophobicContact CG1-CE 4.36Å; I461-M465 VanDerWaalsContact O-CB 3.31Å; I461-M465 WeakPolarHBondContact O-CB 3.4Å; I461-M465 PolarHBondContact O-N 3.4Å; F462-M465 WeakPolarHBondContact O-CB 3.49Å; F462-M465 PolarHBondContact O-N 3.08Å; I463-M465 VanDerWaalsContact C-N 3.33Å; I463-M465 PolarHBondContact O-N 2.93Å; M465-I468 PolarHBondContact O-N 2.91Å; M465-F469 HydrophobicContact CG-CD1 4.12Å; M465-F469 HydrophobicContact CG-CE1 3.67Å; M465-F469 HydrophobicContact CG-CE2 4.3Å; M465-F469 HydrophobicContact CG-CZ 3.73Å; M465-F469 WeakPolarHBondContact O-CB 3.12Å; M465-F469 WeakPolarHBondContact O-CD1 3.15Å; M465-F469 WeakPolarHBondContact O-CG 3.26Å; M465-F469 PolarHBondContact O-N 2.85Å; M465-F469 HydrophobicContact SD-CD1 3.83Å; M465-F469 HydrophobicContact SD-CE1 3.16Å; M465-F469 WeakPolarHBondContact SD-CE1 3.35Å; M465-F469 HydrophobicContact SD-CZ 3.68Å; M465-V529 HydrophobicContact CE-CG1 3.92Å; M465-V529 HydrophobicContact CE-CG2 3.85Å; M465-V529 HydrophobicContact SD-CG1 4.13Å; M465-Y532 HydrophobicContact CG-CD1 4.21Å; M465-Y532 HydrophobicContact CG-CE1 4.34Å; M465-F559 HydrophobicContact CE-CE1 3.89Å; M465-F559 HydrophobicContact CE-CZ 4.03Å; M465-F559 HydrophobicContact SD-CE1 3.67Å; M465-F559 HydrophobicContact SD-CZ 3.95Å; M465-L563 HydrophobicContact CE-CD2 4.2Å
466	Y	90.3	Very high	88	Confident	65 Å²	65	35.5 Å²	35.5	26%	0.255	18%	0.177	S	C	.	.	H	α-helix	trans	-60.5	-46.7	173.4	174.3	-102.2	0	0	0	111.7	F216 F462 I463 E464 F469 T470 Y532 Y536 K540	F216-Y466 HydrophobicContact CZ-CE1 4.32Å; F462-Y466 PolarHBondContact O-N 3.29Å; I463-Y466 WeakPolarHBondContact O-CB 3.44Å; I463-Y466 PolarHBondContact O-N 3.29Å; E464-Y466 PolarHBondContact O-N 3.08Å; Y466-F469 PolarHBondContact O-N 3.39Å; Y466-T470 HydrophobicContact CD1-CG2 4.39Å; Y466-T470 HydrophobicContact CD2-CG2 4.28Å; Y466-T470 HydrophobicContact CE1-CG2 4.01Å; Y466-T470 HydrophobicContact CE2-CG2 3.92Å; Y466-T470 VanDerWaalsContact O-CG2 3.3Å; Y466-T470 WeakPolarHBondContact O-CG2 3.3Å; Y466-T470 PolarHBondContact O-N 2.87Å; Y466-T470 PolarHBondContact O-OG1 2.91Å; Y466-Y532 WeakPolarHBondContact CB-OH 3.49Å; Y466-Y532 VanDerWaalsContact CD2-OH 3.31Å; Y466-Y532 WeakPolarHBondContact CD2-OH 3.36Å; Y466-Y536 HydrophobicContact CD2-CD2 4.25Å; Y466-Y536 AromaticContact CD2-CE2 3.94Å; Y466-Y536 HydrophobicContact CD2-CE2 3.94Å; Y466-Y536 HydrophobicContact CE2-CD2 4.49Å; Y466-Y536 AromaticContact CE2-CE2 3.95Å; Y466-Y536 HydrophobicContact CE2-CE2 3.95Å; Y466-K540 HydrophobicContact CE2-CD 4.34Å; Y466-K540 HydrophobicContact CE2-CG 4.37Å
467	F	88.8	Confident	87.5	Confident	7 Å²	7	34.7 Å²	34.7	3%	0.031	17%	0.173	C	C	.	.	H	α-helix	trans	-62.2	-47.3	178	-73.2	-72.3	0	0	0	111.8	F216 F217 I221 H222 I463 E464 F469 T470 S471	F216-F467 HydrophobicContact CD1-CD1 4.42Å; F216-F467 AromaticContact CE1-CD1 3.71Å; F216-F467 HydrophobicContact CE1-CD1 3.71Å; F216-F467 HydrophobicContact CE1-CE1 4.11Å; F216-F467 HydrophobicContact CZ-CD1 4.01Å; F216-F467 HydrophobicContact CZ-CE1 4.21Å; F217-F467 HydrophobicContact CD1-CD1 4.21Å; F217-F467 HydrophobicContact CE1-CD1 4.28Å; I221-F467 HydrophobicContact CB-CZ 4.12Å; I221-F467 HydrophobicContact CD1-CZ 4.42Å; I221-F467 HydrophobicContact CG2-CE2 3.8Å; I221-F467 HydrophobicContact CG2-CZ 3.67Å; H222-F467 AromaticContact CE1-CD1 3.99Å; H222-F467 AromaticContact CE1-CD2 3.58Å; H222-F467 AromaticContact CE1-CE2 3.87Å; H222-F467 AromaticContact CE1-CG 3.65Å; H222-F467 AromaticContact ND1-CD2 3.97Å; I463-F467 HydrophobicContact CG2-CD2 4.25Å; I463-F467 HydrophobicContact CG2-CE2 3.81Å; I463-F467 WeakPolarHBondContact O-CD2 3.31Å; I463-F467 PolarHBondContact O-N 2.82Å; E464-F467 PolarHBondContact O-N 3.3Å; E464-F467 VanDerWaalsContact O-N 3.09Å; F467-F469 VanDerWaalsContact C-N 3.33Å; F467-F469 PolarHBondContact O-N 3.49Å; F467-T470 WeakPolarHBondContact CA-OG1 3.3Å; F467-T470 PolarHBondContact O-N 3.42Å; F467-T470 PolarHBondContact O-OG1 3.47Å; F467-S471 PolarHBondContact O-N 2.93Å; F467-S471 PolarHBondContact O-OG 3.21Å
468	I	89.3	Confident	87	Confident	30 Å²	30	35.7 Å²	35.7	15%	0.154	18%	0.177	C	C	.	.	H	α-helix	trans	-56	-49.1	175.8	-67.7	169.3	0	0	0	110.1	E464 M465 T470 S471 F472	E464-I468 WeakPolarHBondContact O-CG1 3.5Å; E464-I468 PolarHBondContact O-N 2.68Å; M465-I468 PolarHBondContact O-N 2.91Å; I468-T470 VanDerWaalsContact C-N 3.35Å; I468-T470 PolarHBondContact O-N 3.1Å; I468-S471 WeakPolarHBondContact O-CB 3.32Å; I468-S471 PolarHBondContact O-N 2.97Å; I468-F472 HydrophobicContact CG2-CD2 3.69Å; I468-F472 HydrophobicContact CG2-CE2 3.8Å; I468-F472 VanDerWaalsContact O-CD2 3.31Å; I468-F472 WeakPolarHBondContact O-CD2 3.41Å; I468-F472 PolarHBondContact O-N 3.31Å
469	F	91.1	Very high	86.5	Confident	4 Å²	4	36.5 Å²	36.5	2%	0.018	18%	0.179	C	C	.	.	H	α-helix	trans	-62.4	-42.5	-179.8	-77.2	16.1	0	0	0	111.8	M465 Y466 F467 S471 W473 V529 Y532 Y536 M556 F559	M465-F469 HydrophobicContact CG-CD1 4.12Å; M465-F469 HydrophobicContact CG-CE1 3.67Å; M465-F469 HydrophobicContact CG-CE2 4.3Å; M465-F469 HydrophobicContact CG-CZ 3.73Å; M465-F469 WeakPolarHBondContact O-CB 3.12Å; M465-F469 WeakPolarHBondContact O-CD1 3.15Å; M465-F469 WeakPolarHBondContact O-CG 3.26Å; M465-F469 PolarHBondContact O-N 2.85Å; M465-F469 HydrophobicContact SD-CD1 3.83Å; M465-F469 HydrophobicContact SD-CE1 3.16Å; M465-F469 WeakPolarHBondContact SD-CE1 3.35Å; M465-F469 HydrophobicContact SD-CZ 3.68Å; Y466-F469 PolarHBondContact O-N 3.39Å; F467-F469 VanDerWaalsContact C-N 3.33Å; F467-F469 PolarHBondContact O-N 3.49Å; F469-S471 VanDerWaalsContact C-N 3.33Å; F469-S471 PolarHBondContact O-N 3.48Å; F469-W473 VanDerWaalsContact O-CB 3.28Å; F469-W473 WeakPolarHBondContact O-CB 3.24Å; F469-W473 PolarHBondContact O-N 2.75Å; F469-V529 HydrophobicContact CZ-CG1 4.08Å; F469-Y532 AromaticContact CD2-CD1 3.93Å; F469-Y532 HydrophobicContact CD2-CD1 3.93Å; F469-Y532 AromaticContact CD2-CE1 3.8Å; F469-Y532 HydrophobicContact CD2-CE1 3.8Å; F469-Y532 AromaticContact CE2-CD1 3.48Å; F469-Y532 HydrophobicContact CE2-CD1 3.48Å; F469-Y532 VanDerWaalsContact CE2-CD1 3.48Å; F469-Y532 AromaticContact CE2-CE1 3.86Å; F469-Y532 HydrophobicContact CE2-CE1 3.86Å; F469-Y532 HydrophobicContact CZ-CD1 4.22Å; F469-Y536 HydrophobicContact CB-CD1 4.4Å; F469-Y536 HydrophobicContact CB-CD2 4.14Å; F469-Y536 HydrophobicContact CB-CE1 4.17Å; F469-Y536 HydrophobicContact CB-CE2 3.91Å; F469-Y536 HydrophobicContact CB-CG 4.39Å; F469-Y536 HydrophobicContact CD2-CD1 4.28Å; F469-Y536 HydrophobicContact CD2-CD2 4.13Å; F469-Y536 AromaticContact CD2-CG 3.9Å; F469-Y536 HydrophobicContact CD2-CG 3.9Å; F469-M556 HydrophobicContact CD1-CE 4.34Å; F469-M556 HydrophobicContact CE1-CE 3.4Å; F469-M556 HydrophobicContact CE1-SD 4.14Å; F469-M556 HydrophobicContact CE2-CE 3.77Å; F469-M556 HydrophobicContact CZ-CE 3.07Å; F469-M556 HydrophobicContact CZ-SD 4.16Å; F469-F559 HydrophobicContact CE1-CD1 4.42Å; F469-F559 HydrophobicContact CE1-CE1 4.01Å
470	T	88.6	Confident	86.1	Confident	8 Å²	8	34.8 Å²	34.8	5%	0.049	16%	0.16	C	C	.	.	H	α-helix	trans	-63.7	-38	175.9	56.1	0	0	0	0	112.5	F216 Y466 F467 I468 A474 Y536	F216-T470 VanDerWaalsContact CE1-OG1 3.28Å; F216-T470 WeakPolarHBondContact CE1-OG1 3.46Å; F216-T470 HydrophobicContact CZ-CG2 3.91Å; F216-T470 WeakPolarHBondContact CZ-OG1 3.15Å; Y466-T470 HydrophobicContact CD1-CG2 4.39Å; Y466-T470 HydrophobicContact CD2-CG2 4.28Å; Y466-T470 HydrophobicContact CE1-CG2 4.01Å; Y466-T470 HydrophobicContact CE2-CG2 3.92Å; Y466-T470 VanDerWaalsContact O-CG2 3.3Å; Y466-T470 WeakPolarHBondContact O-CG2 3.3Å; Y466-T470 PolarHBondContact O-N 2.87Å; Y466-T470 PolarHBondContact O-OG1 2.91Å; F467-T470 WeakPolarHBondContact CA-OG1 3.3Å; F467-T470 PolarHBondContact O-N 3.42Å; F467-T470 PolarHBondContact O-OG1 3.47Å; I468-T470 VanDerWaalsContact C-N 3.35Å; I468-T470 PolarHBondContact O-N 3.1Å; T470-A474 VanDerWaalsContact O-CA 3.28Å; T470-A474 WeakPolarHBondContact O-CA 3.38Å; T470-A474 WeakPolarHBondContact O-CB 3.47Å; T470-A474 PolarHBondContact O-N 2.96Å; T470-Y536 WeakPolarHBondContact CA-OH 3.43Å; T470-Y536 HydrophobicContact CG2-CE2 3.89Å; T470-Y536 WeakPolarHBondContact CG2-OH 3.32Å; T470-Y536 PolarHBondContact N-OH 3.33Å
471	S	86.8	Confident	86	Confident	8 Å²	8	35.3 Å²	35.3	6%	0.056	16%	0.161	C	C	.	.	H	α-helix	trans	-63.6	-52.5	176.9	-67.4	0	0	0	0	112.3	F217 F467 I468 F469 Y475 K476	F217-S471 VanDerWaalsContact CZ-OG 3.3Å; F217-S471 WeakPolarHBondContact CZ-OG 3.36Å; F467-S471 PolarHBondContact O-N 2.93Å; F467-S471 PolarHBondContact O-OG 3.21Å; I468-S471 WeakPolarHBondContact O-CB 3.32Å; I468-S471 PolarHBondContact O-N 2.97Å; F469-S471 VanDerWaalsContact C-N 3.33Å; F469-S471 PolarHBondContact O-N 3.48Å; S471-Y475 WeakPolarHBondContact O-CA 2.98Å; S471-Y475 PolarHBondContact O-N 3.39Å; S471-Y475 VanDerWaalsContact O-N 3.16Å; S471-K476 CarbonylContact C-O 3.55Å; S471-K476 WeakPolarHBondContact CA-O 3.14Å; S471-K476 WeakPolarHBondContact CB-O 3.32Å; S471-K476 PolarHBondContact O-N 3.45Å; S471-K476 VanDerWaalsContact O-N 3.13Å; S471-K476 PolarHBondContact OG-O 2.93Å
472	F	85.8	Confident	85.8	Confident	122 Å²	122	36.3 Å²	36.3	54%	0.535	17%	0.174	S	C	.	.	H	α-helix	trans	-67.2	-43.1	-177.9	-82.4	-80.4	0	0	0	112.7	M324 I468	M324-F472 HydrophobicContact CE-CZ 4.46Å; I468-F472 HydrophobicContact CG2-CD2 3.69Å; I468-F472 HydrophobicContact CG2-CE2 3.8Å; I468-F472 VanDerWaalsContact O-CD2 3.31Å; I468-F472 WeakPolarHBondContact O-CD2 3.41Å; I468-F472 PolarHBondContact O-N 3.31Å
473	W	87.1	Confident	85.6	Confident	19 Å²	19	33.8 Å²	33.8	7%	0.072	16%	0.162	C	C	.	.	H	α-helix	trans	-91.9	-28.4	-172	-62	117.9	0	0	0	114	Q55 F469 Y536 M543 F551 Y552 M556	Q55-W473 HydrophobicContact CG-CE3 4.28Å; Q55-W473 HydrophobicContact CG-CZ3 4.19Å; F469-W473 VanDerWaalsContact O-CB 3.28Å; F469-W473 WeakPolarHBondContact O-CB 3.24Å; F469-W473 PolarHBondContact O-N 2.75Å; W473-Y536 HydrophobicContact CB-CE1 4.32Å; W473-M543 HydrophobicContact CB-CE 3.92Å; W473-M543 HydrophobicContact CE3-CE 4.44Å; W473-M543 WeakPolarHBondContact O-CE 3.28Å; W473-F551 AromaticContact CH2-CD1 3.89Å; W473-F551 HydrophobicContact CH2-CD1 3.89Å; W473-F551 AromaticContact CH2-CE1 3.85Å; W473-F551 HydrophobicContact CH2-CE1 3.85Å; W473-F551 AromaticContact CZ3-CD1 3.64Å; W473-F551 HydrophobicContact CZ3-CD1 3.64Å; W473-F551 AromaticContact CZ3-CE1 3.67Å; W473-F551 HydrophobicContact CZ3-CE1 3.67Å; W473-Y552 AromaticContact CD1-CE2 3.58Å; W473-Y552 AromaticContact CD2-CD2 3.51Å; W473-Y552 HydrophobicContact CD2-CD2 3.51Å; W473-Y552 AromaticContact CD2-CE2 3.66Å; W473-Y552 HydrophobicContact CD2-CE2 3.66Å; W473-Y552 AromaticContact CE2-CD2 3.43Å; W473-Y552 VanDerWaalsContact CE2-CD2 3.43Å; W473-Y552 AromaticContact CE2-CE2 3.44Å; W473-Y552 VanDerWaalsContact CE2-CE2 3.44Å; W473-Y552 AromaticContact CE3-CD2 3.8Å; W473-Y552 HydrophobicContact CE3-CD2 3.8Å; W473-Y552 HydrophobicContact CE3-CE2 4.41Å; W473-Y552 HydrophobicContact CG-CD2 4.06Å; W473-Y552 AromaticContact CG-CE2 3.77Å; W473-Y552 HydrophobicContact CG-CE2 3.77Å; W473-Y552 AromaticContact CH2-CD2 3.99Å; W473-Y552 HydrophobicContact CH2-CD2 3.99Å; W473-Y552 HydrophobicContact CH2-CG 4.49Å; W473-Y552 AromaticContact CZ2-CD2 3.68Å; W473-Y552 HydrophobicContact CZ2-CD2 3.68Å; W473-Y552 HydrophobicContact CZ2-CE2 4.04Å; W473-Y552 HydrophobicContact CZ2-CG 4.37Å; W473-Y552 HydrophobicContact CZ3-CD2 4.03Å; W473-Y552 AromaticContact NE1-CD2 3.88Å; W473-Y552 AromaticContact NE1-CE2 3.36Å; W473-M556 HydrophobicContact CZ2-CG 3.84Å; W473-M556 HydrophobicContact CZ2-SD 3.75Å; W473-M556 PolarHBondContact NE1-SD 3.34Å; W473-M556 VanDerWaalsContact NE1-SD 3.42Å
474	A	78.5	Confident	85.6	Confident	31 Å²	31	34 Å²	34	26%	0.256	16%	0.163	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103	19.1	175.6	0	0	0	0	0	113.1	R54 T470 K476	R54-A474 VanDerWaalsContact NH1-C 3.3Å; R54-A474 PolarHBondContact NH1-O 2.9Å; T470-A474 VanDerWaalsContact O-CA 3.28Å; T470-A474 WeakPolarHBondContact O-CA 3.38Å; T470-A474 WeakPolarHBondContact O-CB 3.47Å; T470-A474 PolarHBondContact O-N 2.96Å; A474-K476 PolarHBondContact O-N 3.49Å
475	Y	72.8	Confident	85.7	Confident	106 Å²	106	37.2 Å²	37.2	42%	0.416	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	47.1	36.7	176.7	-79.2	-86.1	0	0	0	113.9	R54 Q55 R388 S471	R54-Y475 HydrophobicContact CB-CD2 3.65Å; R54-Y475 HydrophobicContact CB-CE2 3.54Å; R54-Y475 HydrophobicContact CG-CD2 4.36Å; R54-Y475 WeakPolarHBondContact O-CE2 3.43Å; Q55-Y475 PolarHBondContact OE1-OH 2.95Å; R388-Y475 PolarHBondContact NH2-OH 3.05Å; S471-Y475 WeakPolarHBondContact O-CA 2.98Å; S471-Y475 PolarHBondContact O-N 3.39Å; S471-Y475 VanDerWaalsContact O-N 3.16Å
476	K	78.7	Confident	85.8	Confident	60 Å²	60	40.9 Å²	40.9	26%	0.261	20%	0.198	S	C	.	.			trans	-89.6	128.4	170.3	-65	-164.8	177.1	-160.7	0	108.4	D213 F216 F217 S471 A474 Y478	D213-K476 IonicContact OD2-NZ 3.06Å; D213-K476 PolarHBondContact OD2-NZ 2.85Å; F216-K476 HydrophobicContact CB-CD 4.42Å; F216-K476 HydrophobicContact CD1-CD 3.68Å; F216-K476 HydrophobicContact CD2-CD 4.49Å; F216-K476 VanDerWaalsContact CD2-NZ 3.32Å; F216-K476 HydrophobicContact CE1-CD 4.05Å; F216-K476 HydrophobicContact CG-CD 3.94Å; F217-K476 HydrophobicContact CE2-CB 4.22Å; F217-K476 HydrophobicContact CZ-CB 4.26Å; S471-K476 CarbonylContact C-O 3.55Å; S471-K476 WeakPolarHBondContact CA-O 3.14Å; S471-K476 WeakPolarHBondContact CB-O 3.32Å; S471-K476 PolarHBondContact O-N 3.45Å; S471-K476 VanDerWaalsContact O-N 3.13Å; S471-K476 PolarHBondContact OG-O 2.93Å; A474-K476 PolarHBondContact O-N 3.49Å; K476-Y478 PolarHBondContact O-N 2.95Å; K476-Y478 VanDerWaalsContact O-N 3.13Å
477	I	81.2	Confident	85.8	Confident	44 Å²	44	38.5 Å²	38.5	23%	0.226	19%	0.191	C	C	.	.			trans	-63.9	116.8	177.9	-58	176.7	0	0	0	108.3	L212 F217 Y318 Y479	L212-I477 HydrophobicContact CD2-CB 3.94Å; L212-I477 HydrophobicContact CD2-CD1 4.48Å; L212-I477 HydrophobicContact CD2-CG2 3.7Å; F217-I477 VanDerWaalsContact CE2-O 3.23Å; F217-I477 WeakPolarHBondContact CE2-O 3.26Å; Y318-I477 HydrophobicContact CD2-CG2 4.09Å; Y318-I477 HydrophobicContact CG-CG2 4.1Å; I477-Y479 PolarHBondContact O-N 3.29Å
478	Y	82.7	Confident	86.1	Confident	22 Å²	22	39.2 Å²	39.2	9%	0.086	19%	0.194	C	C	.	.			trans	-81.7	111.7	171.9	-172.2	-88.2	0	0	0	108.5	F217 K476 V480 Y481 M484	F217-Y478 AromaticContact CE1-CD2 3.85Å; F217-Y478 HydrophobicContact CE1-CD2 3.85Å; F217-Y478 HydrophobicContact CE1-CE2 4.34Å; F217-Y478 HydrophobicContact CZ-CD2 4.4Å; K476-Y478 PolarHBondContact O-N 2.95Å; K476-Y478 VanDerWaalsContact O-N 3.13Å; Y478-V480 VanDerWaalsContact CE1-C 3.47Å; Y478-V480 HydrophobicContact CE1-CB 4.41Å; Y478-V480 VanDerWaalsContact CE1-O 3.29Å; Y478-V480 WeakPolarHBondContact CE1-O 3.4Å; Y478-V480 PolarHBondContact OH-O 2.73Å; Y478-Y481 HydrophobicContact CD1-CD1 4.13Å; Y478-Y481 AromaticContact CD1-CE1 3.96Å; Y478-Y481 HydrophobicContact CD1-CE1 3.96Å; Y478-Y481 HydrophobicContact CE1-CD1 4.17Å; Y478-Y481 HydrophobicContact CE1-CE1 4.45Å; Y478-Y481 WeakPolarHBondContact O-CE2 3.34Å; Y478-Y481 VanDerWaalsContact O-CZ 3.25Å; Y478-Y481 PolarHBondContact O-OH 3.49Å; Y478-Y481 VanDerWaalsContact O-OH 3.11Å; Y478-M484 HydrophobicContact CE1-CB 4.33Å
479	Y	82.2	Confident	86.3	Confident	49 Å²	49	41.3 Å²	41.3	19%	0.192	21%	0.208	C	C	.	.			trans	-109.3	-8.1	-179.7	68.4	-86.4	0	0	0	113.1	L212 F217 I477 Y481	L212-Y479 HydrophobicContact CB-CD1 4.31Å; L212-Y479 HydrophobicContact CB-CE1 4.39Å; L212-Y479 HydrophobicContact CD1-CD1 4.36Å; L212-Y479 HydrophobicContact CD1-CD2 4.42Å; L212-Y479 HydrophobicContact CD1-CG 4.13Å; L212-Y479 HydrophobicContact CD2-CD1 3.96Å; L212-Y479 HydrophobicContact CD2-CG 4.16Å; L212-Y479 HydrophobicContact CG-CD1 4.43Å; F217-Y479 HydrophobicContact CB-CE1 3.64Å; F217-Y479 HydrophobicContact CD2-CD1 4Å; F217-Y479 AromaticContact CD2-CE1 3.5Å; F217-Y479 HydrophobicContact CD2-CE1 3.5Å; F217-Y479 VanDerWaalsContact CD2-CE1 3.5Å; F217-Y479 HydrophobicContact CE2-CD1 4.44Å; F217-Y479 HydrophobicContact CE2-CE1 4.34Å; F217-Y479 HydrophobicContact CG-CD1 4.38Å; F217-Y479 AromaticContact CG-CE1 3.74Å; F217-Y479 HydrophobicContact CG-CE1 3.74Å; I477-Y479 PolarHBondContact O-N 3.29Å; Y479-Y481 VanDerWaalsContact C-N 3.28Å; Y479-Y481 WeakPolarHBondContact O-CD2 3.31Å; Y479-Y481 PolarHBondContact O-N 3.34Å
480	V	84.3	Confident	86.4	Confident	8 Å²	8	41.8 Å²	41.8	5%	0.048	21%	0.211	C	C	.	.			trans	-90.5	56.3	-167.4	-170	0	0	0	0	110.9	F217 Y478 G482 F483	F217-V480 HydrophobicContact CB-CG2 4.1Å; F217-V480 HydrophobicContact CD1-CG2 4.31Å; F217-V480 HydrophobicContact CG-CG2 4.32Å; Y478-V480 VanDerWaalsContact CE1-C 3.47Å; Y478-V480 HydrophobicContact CE1-CB 4.41Å; Y478-V480 VanDerWaalsContact CE1-O 3.29Å; Y478-V480 WeakPolarHBondContact CE1-O 3.4Å; Y478-V480 PolarHBondContact OH-O 2.73Å; V480-G482 PolarHBondContact O-N 2.99Å; V480-F483 HydrophobicContact CB-CD2 4.43Å; V480-F483 HydrophobicContact CG1-CB 3.91Å; V480-F483 HydrophobicContact CG1-CD2 2.98Å; V480-F483 HydrophobicContact CG1-CE2 3.56Å; V480-F483 HydrophobicContact CG1-CG 3.65Å; V480-F483 PolarHBondContact O-N 3.48Å
481	Y	86.7	Confident	86.6	Confident	14 Å²	14	41.8 Å²	41.8	6%	0.055	21%	0.211	C	C	.	.	H	α-helix	trans	-67.8	-32.8	-172.8	-65.7	-71.9	0	0	0	114.1	A312 Y318 Y478 Y479 F483 M484 M485	A312-Y481 HydrophobicContact CB-CD1 3.69Å; A312-Y481 HydrophobicContact CB-CD2 4.11Å; A312-Y481 HydrophobicContact CB-CE1 3.81Å; A312-Y481 HydrophobicContact CB-CE2 4.22Å; A312-Y481 HydrophobicContact CB-CG 3.85Å; Y318-Y481 HydrophobicContact CD1-CE2 4.08Å; Y478-Y481 HydrophobicContact CD1-CD1 4.13Å; Y478-Y481 AromaticContact CD1-CE1 3.96Å; Y478-Y481 HydrophobicContact CD1-CE1 3.96Å; Y478-Y481 HydrophobicContact CE1-CD1 4.17Å; Y478-Y481 HydrophobicContact CE1-CE1 4.45Å; Y478-Y481 WeakPolarHBondContact O-CE2 3.34Å; Y478-Y481 VanDerWaalsContact O-CZ 3.25Å; Y478-Y481 PolarHBondContact O-OH 3.49Å; Y478-Y481 VanDerWaalsContact O-OH 3.11Å; Y479-Y481 VanDerWaalsContact C-N 3.28Å; Y479-Y481 WeakPolarHBondContact O-CD2 3.31Å; Y479-Y481 PolarHBondContact O-N 3.34Å; Y481-F483 VanDerWaalsContact C-N 3.3Å; Y481-F483 PolarHBondContact O-N 3.22Å; Y481-M484 HydrophobicContact CD1-CE 3.96Å; Y481-M484 HydrophobicContact CE1-CE 4.38Å; Y481-M484 WeakPolarHBondContact O-CA 3.49Å; Y481-M484 VanDerWaalsContact O-CB 3.31Å; Y481-M484 WeakPolarHBondContact O-CB 3.31Å; Y481-M484 PolarHBondContact O-N 3.37Å; Y481-M485 PolarHBondContact O-N 3.27Å
482	G	87.2	Confident	87	Confident	29 Å²	29	42.5 Å²	42.5	30%	0.299	22%	0.215	S	C	.	.	H	α-helix	trans	-59.6	-37.1	177.2	0	0	0	0	0	113.6	V480 M485 L486	V480-G482 PolarHBondContact O-N 2.99Å; G482-M485 WeakPolarHBondContact O-CB 3.39Å; G482-M485 PolarHBondContact O-N 3.1Å; G482-L486 PolarHBondContact O-N 3.41Å
483	F	87.4	Confident	87.4	Confident	28 Å²	28	40 Å²	40	12%	0.123	21%	0.207	C	C	.	.	H	α-helix	trans	-70.4	-35.5	175.1	-68.3	-103.1	0	0	0	111.2	H219 H222 W223 I226 V480 Y481 M485 L486 V487	H219-F483 AromaticContact ND1-CE2 3.78Å; H222-F483 HydrophobicContact CB-CD1 3.39Å; H222-F483 HydrophobicContact CB-CE1 3.46Å; H222-F483 VanDerWaalsContact CB-CE1 3.46Å; H222-F483 HydrophobicContact CB-CG 4.07Å; H222-F483 HydrophobicContact CB-CZ 4.14Å; W223-F483 AromaticContact CD1-CE1 3.88Å; W223-F483 AromaticContact CD1-CZ 3.9Å; W223-F483 HydrophobicContact CD2-CE1 4.47Å; W223-F483 HydrophobicContact CG-CE1 4.21Å; W223-F483 AromaticContact NE1-CE1 3.95Å; W223-F483 AromaticContact NE1-CZ 3.78Å; I226-F483 HydrophobicContact CD1-CB 4.42Å; I226-F483 HydrophobicContact CD1-CD1 3.34Å; I226-F483 HydrophobicContact CD1-CE1 3.98Å; I226-F483 HydrophobicContact CD1-CG 4.25Å; I226-F483 HydrophobicContact CG1-CD1 4.35Å; V480-F483 HydrophobicContact CB-CD2 4.43Å; V480-F483 HydrophobicContact CG1-CB 3.91Å; V480-F483 HydrophobicContact CG1-CD2 2.98Å; V480-F483 HydrophobicContact CG1-CE2 3.56Å; V480-F483 HydrophobicContact CG1-CG 3.65Å; V480-F483 PolarHBondContact O-N 3.48Å; Y481-F483 VanDerWaalsContact C-N 3.3Å; Y481-F483 PolarHBondContact O-N 3.22Å; F483-M485 VanDerWaalsContact C-N 3.29Å; F483-M485 PolarHBondContact O-N 3.28Å; F483-L486 PolarHBondContact O-N 2.84Å; F483-V487 WeakPolarHBondContact O-CB 3.49Å; F483-V487 WeakPolarHBondContact O-CG2 3.33Å; F483-V487 PolarHBondContact O-N 3.12Å
484	M	88.7	Confident	87.8	Confident	49 Å²	49	39.2 Å²	39.2	24%	0.241	20%	0.204	C	C	.	.	H	α-helix	trans	-62.3	-38.6	176.2	-146.3	-123.1	-64.5	0	0	111.6	I309 Y478 Y481 V487 L488	I309-M484 HydrophobicContact CD1-CE 4.15Å; I309-M484 HydrophobicContact CD1-SD 3.43Å; I309-M484 WeakPolarHBondContact CD1-SD 3.16Å; I309-M484 HydrophobicContact CG1-CE 3.62Å; I309-M484 HydrophobicContact CG1-SD 3.63Å; Y478-M484 HydrophobicContact CE1-CB 4.33Å; Y481-M484 HydrophobicContact CD1-CE 3.96Å; Y481-M484 HydrophobicContact CE1-CE 4.38Å; Y481-M484 WeakPolarHBondContact O-CA 3.49Å; Y481-M484 VanDerWaalsContact O-CB 3.31Å; Y481-M484 WeakPolarHBondContact O-CB 3.31Å; Y481-M484 PolarHBondContact O-N 3.37Å; M484-V487 PolarHBondContact O-N 2.94Å; M484-L488 PolarHBondContact O-N 3.48Å
485	M	91.6	Very high	88.6	Confident	72 Å²	72	37.8 Å²	37.8	36%	0.355	19%	0.192	S	C	.	.	H	α-helix	trans	-60.8	-48.2	173.2	-169.8	-176.2	-179.4	0	0	112	I309 M313 Y481 G482 F483 V487 L488 V489	I309-M485 HydrophobicContact CG2-CB 3.7Å; I309-M485 HydrophobicContact CG2-CG 4.26Å; M313-M485 HydrophobicContact SD-CB 4.18Å; M313-M485 HydrophobicContact SD-SD 3.97Å; Y481-M485 PolarHBondContact O-N 3.27Å; G482-M485 WeakPolarHBondContact O-CB 3.39Å; G482-M485 PolarHBondContact O-N 3.1Å; F483-M485 VanDerWaalsContact C-N 3.29Å; F483-M485 PolarHBondContact O-N 3.28Å; M485-V487 VanDerWaalsContact C-N 3.28Å; M485-V487 PolarHBondContact O-N 3.39Å; M485-L488 PolarHBondContact O-N 3.29Å; M485-V489 WeakPolarHBondContact O-CG2 3.18Å; M485-V489 PolarHBondContact O-N 2.97Å; M485-V489 VanDerWaalsContact O-N 3.1Å
486	L	91.4	Very high	89.7	Confident	84 Å²	84	34.5 Å²	34.5	44%	0.44	18%	0.183	S	C	.	.	H	α-helix	trans	-61.5	-39.7	179.1	-69	177	0	0	0	111.7	I226 G482 F483 V489 I490	I226-L486 HydrophobicContact CD1-CB 4.11Å; I226-L486 HydrophobicContact CD1-CD1 3.74Å; G482-L486 PolarHBondContact O-N 3.41Å; F483-L486 PolarHBondContact O-N 2.84Å; L486-V489 PolarHBondContact O-N 3.49Å; L486-I490 WeakPolarHBondContact O-CG1 3.21Å; L486-I490 PolarHBondContact O-N 3.25Å
487	V	92	Very high	90.4	Very high	15 Å²	15	32.2 Å²	32.2	9%	0.091	18%	0.175	C	C	.	.	H	α-helix	trans	-70.1	-36.5	-179.8	174.5	0	0	0	0	111.1	I226 I461 E464 F483 M484 M485 V489 I490 L491	I226-V487 HydrophobicContact CG1-CG2 4.39Å; I461-V487 HydrophobicContact CB-CG1 4.43Å; I461-V487 HydrophobicContact CG2-CG1 3.9Å; E464-V487 HydrophobicContact CB-CG1 4.28Å; E464-V487 HydrophobicContact CB-CG2 4.48Å; E464-V487 HydrophobicContact CG-CB 4.41Å; E464-V487 HydrophobicContact CG-CG1 4.15Å; E464-V487 HydrophobicContact CG-CG2 3.58Å; F483-V487 WeakPolarHBondContact O-CB 3.49Å; F483-V487 WeakPolarHBondContact O-CG2 3.33Å; F483-V487 PolarHBondContact O-N 3.12Å; M484-V487 PolarHBondContact O-N 2.94Å; M485-V487 VanDerWaalsContact C-N 3.28Å; M485-V487 PolarHBondContact O-N 3.39Å; V487-V489 VanDerWaalsContact C-N 3.34Å; V487-V489 PolarHBondContact O-N 3.19Å; V487-I490 PolarHBondContact O-N 3.25Å; V487-L491 VanDerWaalsContact O-CB 3.3Å; V487-L491 WeakPolarHBondContact O-CB 3.09Å; V487-L491 PolarHBondContact O-N 3.22Å
488	L	93.5	Very high	90.9	Very high	21 Å²	21	30.5 Å²	30.5	11%	0.11	17%	0.166	C	C	.	.	H	α-helix	trans	-60.6	-43.2	171.4	-178.3	63.9	0	0	0	111.4	F302 L306 I309 M484 M485 L491 C492 M566	F302-L488 HydrophobicContact CD2-CD1 4.49Å; F302-L488 HydrophobicContact CE2-CD1 4.37Å; F302-L488 HydrophobicContact CE2-CD2 4.3Å; F302-L488 HydrophobicContact CE2-CG 4.31Å; L306-L488 HydrophobicContact CB-CD2 4.45Å; I309-L488 HydrophobicContact CD1-CB 4.46Å; I309-L488 HydrophobicContact CD1-CD2 3.79Å; M484-L488 PolarHBondContact O-N 3.48Å; M485-L488 PolarHBondContact O-N 3.29Å; L488-L491 PolarHBondContact O-N 3.04Å; L488-C492 PolarHBondContact O-N 3.2Å; L488-C492 PolarHBondContact O-SG 2.91Å; L488-M566 HydrophobicContact CD1-CE 3.97Å; L488-M566 HydrophobicContact CD1-SD 4.32Å
489	V	93.6	Very high	91.5	Very high	74 Å²	74	29.5 Å²	29.5	45%	0.448	16%	0.163	S	C	.	.	H	α-helix	trans	-63.6	-46.3	176.6	173.8	0	0	0	0	111.2	M485 L486 V487 L491 C492 I493	M485-V489 WeakPolarHBondContact O-CG2 3.18Å; M485-V489 PolarHBondContact O-N 2.97Å; M485-V489 VanDerWaalsContact O-N 3.1Å; L486-V489 PolarHBondContact O-N 3.49Å; V487-V489 VanDerWaalsContact C-N 3.34Å; V487-V489 PolarHBondContact O-N 3.19Å; V489-L491 PolarHBondContact O-N 3.41Å; V489-C492 WeakPolarHBondContact O-CB 3.37Å; V489-C492 PolarHBondContact O-N 3.4Å; V489-I493 HydrophobicContact CG1-CD1 4.04Å; V489-I493 WeakPolarHBondContact O-CG1 3.41Å; V489-I493 PolarHBondContact O-N 2.87Å; V489-I493 VanDerWaalsContact O-N 3.07Å
490	I	92.8	Very high	92	Very high	15 Å²	15	28.2 Å²	28.2	8%	0.077	16%	0.159	C	C	.	.	H	α-helix	trans	-59	-47.5	176.3	-71.7	168.1	0	0	0	110.4	I226 V233 L486 V487 C492 I493 V494	I226-I490 HydrophobicContact CG2-CD1 4.18Å; V233-I490 HydrophobicContact CG2-CG2 3.83Å; L486-I490 WeakPolarHBondContact O-CG1 3.21Å; L486-I490 PolarHBondContact O-N 3.25Å; V487-I490 PolarHBondContact O-N 3.25Å; I490-C492 VanDerWaalsContact C-N 3.29Å; I490-C492 PolarHBondContact O-N 2.92Å; I490-I493 PolarHBondContact O-N 2.91Å; I490-I493 VanDerWaalsContact O-N 3.14Å; I490-V494 HydrophobicContact CG2-CG2 4.19Å; I490-V494 WeakPolarHBondContact O-CG2 3.49Å; I490-V494 PolarHBondContact O-N 2.94Å
491	L	94	Very high	92.4	Very high	7 Å²	7	28.9 Å²	28.9	4%	0.037	16%	0.163	C	C	.	.	H	α-helix	trans	-57.3	-42.8	177.2	178	64.6	0	0	0	111.3	P457 I461 V487 L488 V489 I493 T495 L563 M566	P457-L491 HydrophobicContact CB-CD1 3.94Å; I461-L491 HydrophobicContact CD1-CD1 4.43Å; I461-L491 HydrophobicContact CG2-CB 4.02Å; I461-L491 HydrophobicContact CG2-CD1 3.83Å; I461-L491 HydrophobicContact CG2-CD2 4.28Å; I461-L491 HydrophobicContact CG2-CG 4.25Å; V487-L491 VanDerWaalsContact O-CB 3.3Å; V487-L491 WeakPolarHBondContact O-CB 3.09Å; V487-L491 PolarHBondContact O-N 3.22Å; L488-L491 PolarHBondContact O-N 3.04Å; V489-L491 PolarHBondContact O-N 3.41Å; L491-I493 PolarHBondContact O-N 2.99Å; L491-T495 HydrophobicContact CD1-CG2 3.79Å; L491-T495 HydrophobicContact CG-CG2 4.23Å; L491-T495 VanDerWaalsContact O-CB 3.31Å; L491-T495 WeakPolarHBondContact O-CB 3.37Å; L491-T495 WeakPolarHBondContact O-CG2 3.39Å; L491-T495 PolarHBondContact O-N 3.49Å; L491-T495 PolarHBondContact O-OG1 3.02Å; L491-L563 HydrophobicContact CD2-CD1 4.22Å; L491-M566 HydrophobicContact CD2-CE 4Å
492	C	95.4	Very high	92.6	Very high	23 Å²	23	28.9 Å²	28.9	16%	0.155	17%	0.165	C	C	.	.	H	α-helix	trans	-60.4	-46	176.4	-67.2	0	0	0	0	112	F302 L488 V489 I490 T495 V496 I570	F302-C492 WeakPolarHBondContact CE2-SG 3.2Å; L488-C492 PolarHBondContact O-N 3.2Å; L488-C492 PolarHBondContact O-SG 2.91Å; V489-C492 WeakPolarHBondContact O-CB 3.37Å; V489-C492 PolarHBondContact O-N 3.4Å; I490-C492 VanDerWaalsContact C-N 3.29Å; I490-C492 PolarHBondContact O-N 2.92Å; C492-T495 WeakPolarHBondContact CA-OG1 3.46Å; C492-T495 PolarHBondContact O-OG1 3.36Å; C492-V496 WeakPolarHBondContact O-CB 3.31Å; C492-V496 VanDerWaalsContact O-CG2 3.29Å; C492-V496 WeakPolarHBondContact O-CG2 3.34Å; C492-V496 PolarHBondContact O-N 2.95Å; C492-V496 VanDerWaalsContact O-N 3.08Å; C492-I570 HydrophobicContact CB-CG2 4.39Å
493	I	94.4	Very high	92.9	Very high	71 Å²	71	27.5 Å²	27.5	36%	0.364	15%	0.151	S	C	.	.	H	α-helix	trans	-67	-46.2	-179	-62.2	166.8	0	0	0	110.6	V233 V237 V489 I490 L491 V496 C497	V233-I493 HydrophobicContact CG1-CB 4.42Å; V233-I493 HydrophobicContact CG1-CG2 3.61Å; V237-I493 HydrophobicContact CG2-CG2 4.12Å; V489-I493 HydrophobicContact CG1-CD1 4.04Å; V489-I493 WeakPolarHBondContact O-CG1 3.41Å; V489-I493 PolarHBondContact O-N 2.87Å; V489-I493 VanDerWaalsContact O-N 3.07Å; I490-I493 PolarHBondContact O-N 2.91Å; I490-I493 VanDerWaalsContact O-N 3.14Å; L491-I493 PolarHBondContact O-N 2.99Å; I493-V496 PolarHBondContact O-N 3.15Å; I493-C497 WeakPolarHBondContact O-CB 3.41Å; I493-C497 PolarHBondContact O-N 3.4Å; I493-C497 PolarHBondContact O-SG 3.15Å
494	V	94.2	Very high	92.9	Very high	1 Å²	1	27.9 Å²	27.9	1%	0.006	15%	0.151	C	C	.	.	H	α-helix	trans	-62.3	-47.1	179.2	175.9	0	0	0	0	110.8	V233 L236 P457 I490 V496 C497 V498	V233-V494 HydrophobicContact CG2-CG2 3.38Å; L236-V494 HydrophobicContact CD1-CG1 3.82Å; P457-V494 HydrophobicContact CB-CG1 4.19Å; P457-V494 HydrophobicContact CG-CG1 4.06Å; I490-V494 HydrophobicContact CG2-CG2 4.19Å; I490-V494 WeakPolarHBondContact O-CG2 3.49Å; I490-V494 PolarHBondContact O-N 2.94Å; V494-V496 PolarHBondContact O-N 3.21Å; V494-C497 PolarHBondContact O-N 3.37Å; V494-V498 HydrophobicContact CG1-CG2 4.1Å; V494-V498 WeakPolarHBondContact O-CB 3.45Å; V494-V498 VanDerWaalsContact O-CG2 3.27Å; V494-V498 WeakPolarHBondContact O-CG2 3.31Å; V494-V498 PolarHBondContact O-N 3.09Å
495	T	95.3	Very high	92.9	Very high	1 Å²	1	29.8 Å²	29.8	1%	0.006	16%	0.159	C	C	.	.	H	α-helix	trans	-61.3	-43.3	179.6	50.7	0	0	0	0	111.9	P457 L491 C492 T499 C567	P457-T495 HydrophobicContact CB-CG2 3.8Å; P457-T495 HydrophobicContact CG-CG2 3.98Å; L491-T495 HydrophobicContact CD1-CG2 3.79Å; L491-T495 HydrophobicContact CG-CG2 4.23Å; L491-T495 VanDerWaalsContact O-CB 3.31Å; L491-T495 WeakPolarHBondContact O-CB 3.37Å; L491-T495 WeakPolarHBondContact O-CG2 3.39Å; L491-T495 PolarHBondContact O-N 3.49Å; L491-T495 PolarHBondContact O-OG1 3.02Å; C492-T495 WeakPolarHBondContact CA-OG1 3.46Å; C492-T495 PolarHBondContact O-OG1 3.36Å; T495-T499 WeakPolarHBondContact O-CB 3.29Å; T495-T499 VanDerWaalsContact O-CG2 3.27Å; T495-T499 WeakPolarHBondContact O-CG2 3.47Å; T495-T499 PolarHBondContact O-N 2.82Å; T495-T499 PolarHBondContact O-OG1 3.47Å; T495-C567 HydrophobicContact CG2-CB 4.16Å
496	V	95.5	Very high	92.9	Very high	38 Å²	38	26.4 Å²	26.4	23%	0.23	14%	0.142	C	C	.	.	H	α-helix	trans	-62.4	-46.7	174.8	170.6	0	0	0	0	111.3	C492 I493 V494 V498 T499 I500 I570	C492-V496 WeakPolarHBondContact O-CB 3.31Å; C492-V496 VanDerWaalsContact O-CG2 3.29Å; C492-V496 WeakPolarHBondContact O-CG2 3.34Å; C492-V496 PolarHBondContact O-N 2.95Å; C492-V496 VanDerWaalsContact O-N 3.08Å; I493-V496 PolarHBondContact O-N 3.15Å; V494-V496 PolarHBondContact O-N 3.21Å; V496-V498 PolarHBondContact O-N 3.48Å; V496-T499 WeakPolarHBondContact CA-OG1 3.29Å; V496-T499 PolarHBondContact O-N 2.82Å; V496-T499 PolarHBondContact O-OG1 3.02Å; V496-I500 HydrophobicContact CG1-CD1 3.69Å; V496-I500 HydrophobicContact CG1-CG1 4.44Å; V496-I500 VanDerWaalsContact O-CG1 3.25Å; V496-I500 WeakPolarHBondContact O-CG1 3.3Å; V496-I500 PolarHBondContact O-N 3.27Å; V496-I570 HydrophobicContact CG2-CG2 3.7Å
497	C	93.4	Very high	92.8	Very high	12 Å²	12	22.4 Å²	22.4	8%	0.081	12%	0.121	C	C	.	.	H	α-helix	trans	-61.8	-48.4	-179.3	-68.5	0	0	0	0	111.7	L236 V240 I493 V494 T499 I500 V501	L236-C497 HydrophobicContact CB-CB 4.09Å; V240-C497 HydrophobicContact CG2-CB 4.01Å; I493-C497 WeakPolarHBondContact O-CB 3.41Å; I493-C497 PolarHBondContact O-N 3.4Å; I493-C497 PolarHBondContact O-SG 3.15Å; V494-C497 PolarHBondContact O-N 3.37Å; C497-T499 PolarHBondContact O-N 3.47Å; C497-I500 PolarHBondContact O-N 2.84Å; C497-V501 WeakPolarHBondContact O-CG2 3.25Å; C497-V501 PolarHBondContact O-N 2.89Å
498	V	93.5	Very high	92.5	Very high	8 Å²	8	24.1 Å²	24.1	5%	0.048	13%	0.13	C	C	.	.	H	α-helix	trans	-66.1	-40.2	-177.5	177.1	0	0	0	0	111.3	L236 G453 L456 V494 V496 V501 C502	L236-V498 HydrophobicContact CD1-CG2 3.87Å; L236-V498 HydrophobicContact CD2-CG2 4.42Å; G453-V498 VanDerWaalsContact O-CG1 3.23Å; G453-V498 WeakPolarHBondContact O-CG1 3.48Å; L456-V498 HydrophobicContact CB-CG2 3.92Å; L456-V498 HydrophobicContact CD1-CG2 3.82Å; V494-V498 HydrophobicContact CG1-CG2 4.1Å; V494-V498 WeakPolarHBondContact O-CB 3.45Å; V494-V498 VanDerWaalsContact O-CG2 3.27Å; V494-V498 WeakPolarHBondContact O-CG2 3.31Å; V494-V498 PolarHBondContact O-N 3.09Å; V496-V498 PolarHBondContact O-N 3.48Å; V498-V501 PolarHBondContact O-N 2.9Å; V498-C502 WeakPolarHBondContact O-CB 3.41Å; V498-C502 PolarHBondContact O-N 3.45Å; V498-C502 PolarHBondContact O-SG 3.36Å
499	T	94.7	Very high	92.1	Very high	1 Å²	1	23.9 Å²	23.9	1%	0.006	13%	0.13	C	C	.	.	H	α-helix	trans	-67.2	-35.3	177.3	50.8	0	0	0	0	113.2	T495 V496 C497 C502 T503 S518 A522 G571 T575	T495-T499 WeakPolarHBondContact O-CB 3.29Å; T495-T499 VanDerWaalsContact O-CG2 3.27Å; T495-T499 WeakPolarHBondContact O-CG2 3.47Å; T495-T499 PolarHBondContact O-N 2.82Å; T495-T499 PolarHBondContact O-OG1 3.47Å; V496-T499 WeakPolarHBondContact CA-OG1 3.29Å; V496-T499 PolarHBondContact O-N 2.82Å; V496-T499 PolarHBondContact O-OG1 3.02Å; C497-T499 PolarHBondContact O-N 3.47Å; T499-C502 PolarHBondContact O-N 2.88Å; T499-T503 VanDerWaalsContact O-CB 3.27Å; T499-T503 WeakPolarHBondContact O-CB 3.47Å; T499-T503 PolarHBondContact O-N 2.79Å; T499-T503 PolarHBondContact O-OG1 3.09Å; T499-S518 WeakPolarHBondContact CG2-O 3.43Å; T499-A522 HydrophobicContact CG2-CB 3.44Å; T499-A522 VanDerWaalsContact CG2-CB 3.44Å; T499-G571 WeakPolarHBondContact OG1-CA 3.35Å; T499-G571 PolarHBondContact OG1-O 2.71Å; T499-T575 WeakPolarHBondContact CB-OG1 3.24Å; T499-T575 PolarHBondContact OG1-OG1 2.86Å
500	I	93.2	Very high	91.9	Very high	22 Å²	22	21.9 Å²	21.9	11%	0.113	12%	0.116	C	C	.	.	H	α-helix	trans	-62.1	-47.3	171.8	-71.5	168.5	0	0	0	110.4	V240 V496 C497 T503 Y504 F578	V240-I500 HydrophobicContact CG1-CG2 4.09Å; V496-I500 HydrophobicContact CG1-CD1 3.69Å; V496-I500 HydrophobicContact CG1-CG1 4.44Å; V496-I500 VanDerWaalsContact O-CG1 3.25Å; V496-I500 WeakPolarHBondContact O-CG1 3.3Å; V496-I500 PolarHBondContact O-N 3.27Å; C497-I500 PolarHBondContact O-N 2.84Å; I500-T503 PolarHBondContact O-N 3.29Å; I500-Y504 VanDerWaalsContact O-CB 3.26Å; I500-Y504 WeakPolarHBondContact O-CB 3.44Å; I500-Y504 PolarHBondContact O-N 3.48Å; I500-F578 HydrophobicContact CD1-CB 4.14Å; I500-F578 HydrophobicContact CG1-CB 4Å; I500-F578 HydrophobicContact CG1-CG 4.21Å; I500-F578 HydrophobicContact CG2-CD1 4Å; I500-F578 HydrophobicContact CG2-CD2 3.89Å; I500-F578 HydrophobicContact CG2-CE1 4.12Å; I500-F578 HydrophobicContact CG2-CE2 4.01Å; I500-F578 HydrophobicContact CG2-CG 3.88Å; I500-F578 HydrophobicContact CG2-CZ 4.12Å
501	V	91	Very high	91.8	Very high	21 Å²	21	21.1 Å²	21.1	13%	0.127	11%	0.112	C	C	.	.	H	α-helix	trans	-60.3	-48.6	178	175.2	0	0	0	0	111.1	L239 V240 I243 C497 V498 T503 Y504 F505	L239-V501 HydrophobicContact CD2-CG1 4.23Å; L239-V501 HydrophobicContact CD2-CG2 3.58Å; V240-V501 HydrophobicContact CG2-CG2 3.52Å; I243-V501 HydrophobicContact CD1-CG1 4.39Å; I243-V501 HydrophobicContact CD1-CG2 4.34Å; C497-V501 WeakPolarHBondContact O-CG2 3.25Å; C497-V501 PolarHBondContact O-N 2.89Å; V498-V501 PolarHBondContact O-N 2.9Å; V501-T503 VanDerWaalsContact C-N 3.34Å; V501-T503 PolarHBondContact O-N 3.32Å; V501-Y504 PolarHBondContact O-N 3.49Å; V501-F505 HydrophobicContact CG1-CD2 3.7Å; V501-F505 HydrophobicContact CG1-CE2 3.45Å; V501-F505 VanDerWaalsContact CG1-CE2 3.45Å; V501-F505 VanDerWaalsContact O-CD2 3.24Å; V501-F505 WeakPolarHBondContact O-CD2 3.36Å; V501-F505 PolarHBondContact O-N 3.25Å
502	C	92.2	Very high	91.6	Very high	15 Å²	15	23 Å²	23	10%	0.101	12%	0.119	C	C	.	.	H	α-helix	trans	-59.3	-45.4	178.9	-70	0	0	0	0	111.7	I449 V498 T499 F505 L506	I449-C502 HydrophobicContact CG2-CB 3.48Å; I449-C502 VanDerWaalsContact CG2-CB 3.48Å; V498-C502 WeakPolarHBondContact O-CB 3.41Å; V498-C502 PolarHBondContact O-N 3.45Å; V498-C502 PolarHBondContact O-SG 3.36Å; T499-C502 PolarHBondContact O-N 2.88Å; C502-F505 PolarHBondContact O-N 3.02Å; C502-L506 PolarHBondContact O-N 2.77Å
503	T	92.3	Very high	91.4	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-67.5	-39.9	179.4	-60.4	0	0	0	0	111.6	T499 I500 V501 L506 L507 W514 T575 V579	T499-T503 VanDerWaalsContact O-CB 3.27Å; T499-T503 WeakPolarHBondContact O-CB 3.47Å; T499-T503 PolarHBondContact O-N 2.79Å; T499-T503 PolarHBondContact O-OG1 3.09Å; I500-T503 PolarHBondContact O-N 3.29Å; V501-T503 VanDerWaalsContact C-N 3.34Å; V501-T503 PolarHBondContact O-N 3.32Å; T503-L506 WeakPolarHBondContact O-CB 3.12Å; T503-L506 PolarHBondContact O-N 2.88Å; T503-L507 HydrophobicContact CG2-CD1 3.97Å; T503-L507 HydrophobicContact CG2-CG 4.2Å; T503-L507 VanDerWaalsContact O-CG 3.31Å; T503-L507 WeakPolarHBondContact O-CG 3.42Å; T503-L507 PolarHBondContact O-N 2.8Å; T503-W514 HydrophobicContact CG2-CB 3.65Å; T503-W514 HydrophobicContact CG2-CD2 4.43Å; T503-W514 HydrophobicContact CG2-CE3 4.33Å; T503-W514 HydrophobicContact CG2-CG 4.18Å; T503-T575 HydrophobicContact CG2-CG2 3.48Å; T503-T575 VanDerWaalsContact CG2-CG2 3.48Å; T503-T575 WeakPolarHBondContact OG1-CG2 3.36Å; T503-V579 HydrophobicContact CG2-CG2 4.12Å
504	Y	88.9	Confident	91.4	Very high	35 Å²	35	24.9 Å²	24.9	14%	0.137	12%	0.119	C	C	.	.	H	α-helix	trans	-62.8	-42.7	176.4	177.9	-103	0	0	0	111.9	I243 T247 I500 V501 L506 L507 N508 F578	I243-Y504 HydrophobicContact CD1-CD1 4.43Å; I243-Y504 HydrophobicContact CG2-CD1 3.46Å; I243-Y504 VanDerWaalsContact CG2-CD1 3.46Å; I243-Y504 HydrophobicContact CG2-CD2 4.4Å; I243-Y504 HydrophobicContact CG2-CE1 3.34Å; I243-Y504 HydrophobicContact CG2-CE2 4.33Å; I243-Y504 HydrophobicContact CG2-CG 4.01Å; T247-Y504 HydrophobicContact CG2-CE1 4.39Å; T247-Y504 HydrophobicContact CG2-CE2 3.6Å; T247-Y504 WeakPolarHBondContact CG2-OH 3.4Å; I500-Y504 VanDerWaalsContact O-CB 3.26Å; I500-Y504 WeakPolarHBondContact O-CB 3.44Å; I500-Y504 PolarHBondContact O-N 3.48Å; V501-Y504 PolarHBondContact O-N 3.49Å; Y504-L506 VanDerWaalsContact C-N 3.33Å; Y504-L506 PolarHBondContact O-N 2.93Å; Y504-L507 PolarHBondContact O-N 3.35Å; Y504-N508 WeakPolarHBondContact CD1-ND2 3.49Å; Y504-N508 WeakPolarHBondContact CE1-ND2 3.48Å; Y504-N508 PolarHBondContact O-N 2.93Å; Y504-N508 PolarHBondContact O-ND2 2.74Å; Y504-N508 PolarHBondContact OH-ND2 2.95Å; Y504-F578 HydrophobicContact CD2-CZ 4.23Å
505	F	88.2	Confident	91.5	Very high	90 Å²	90	25.8 Å²	25.8	40%	0.395	12%	0.122	S	C	.	.	H	α-helix	trans	-61.1	-41	172.8	-79.9	-57.7	0	0	0	112.7	M444 V501 C502 N508 A509	M444-F505 HydrophobicContact CE-CD1 3.8Å; M444-F505 HydrophobicContact SD-CB 4.18Å; M444-F505 HydrophobicContact SD-CD1 4.42Å; V501-F505 HydrophobicContact CG1-CD2 3.7Å; V501-F505 HydrophobicContact CG1-CE2 3.45Å; V501-F505 VanDerWaalsContact CG1-CE2 3.45Å; V501-F505 VanDerWaalsContact O-CD2 3.24Å; V501-F505 WeakPolarHBondContact O-CD2 3.36Å; V501-F505 PolarHBondContact O-N 3.25Å; C502-F505 PolarHBondContact O-N 3.02Å; F505-N508 PolarHBondContact O-N 2.94Å; F505-A509 PolarHBondContact O-N 3.03Å
506	L	90.6	Very high	91.5	Very high	1 Å²	1	28.6 Å²	28.6	1%	0.005	13%	0.133	C	C	.	.	H	α-helix	trans	-64.6	-44.7	177.6	-174.6	72	0	0	0	112.4	P446 I449 C502 T503 Y504 N508 A509 D511 W514 T517	P446-L506 HydrophobicContact CG-CD1 4.27Å; I449-L506 HydrophobicContact CD1-CB 4.36Å; I449-L506 HydrophobicContact CD1-CD1 4.25Å; C502-L506 PolarHBondContact O-N 2.77Å; T503-L506 WeakPolarHBondContact O-CB 3.12Å; T503-L506 PolarHBondContact O-N 2.88Å; Y504-L506 VanDerWaalsContact C-N 3.33Å; Y504-L506 PolarHBondContact O-N 2.93Å; L506-N508 VanDerWaalsContact C-N 3.31Å; L506-N508 PolarHBondContact O-N 3.2Å; L506-A509 CarbonylContact O-C 3.6Å; L506-A509 WeakPolarHBondContact O-CA 3.34Å; L506-A509 WeakPolarHBondContact O-CB 3.14Å; L506-A509 PolarHBondContact O-N 3.43Å; L506-D511 HydrophobicContact CD1-CB 3.7Å; L506-D511 HydrophobicContact CG-CB 3.94Å; L506-D511 PolarHBondContact O-N 3.33Å; L506-W514 HydrophobicContact CD2-CB 4.17Å; L506-T517 HydrophobicContact CD2-CG2 3.8Å; L506-T517 WeakPolarHBondContact CD2-OG1 3.23Å
507	L	89.8	Confident	91.5	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-65.7	-35.3	178.2	-67.5	174	0	0	0	111.5	W274 V277 V281 T503 Y504 A509 E510 W514 V579 I582	W274-L507 WeakPolarHBondContact CA-O 3.49Å; W274-L507 HydrophobicContact CB-CB 3.63Å; W274-L507 PolarHBondContact N-O 3.31Å; V277-L507 HydrophobicContact CG2-CD2 4.02Å; V281-L507 HydrophobicContact CG2-CD2 4.02Å; T503-L507 HydrophobicContact CG2-CD1 3.97Å; T503-L507 HydrophobicContact CG2-CG 4.2Å; T503-L507 VanDerWaalsContact O-CG 3.31Å; T503-L507 WeakPolarHBondContact O-CG 3.42Å; T503-L507 PolarHBondContact O-N 2.8Å; Y504-L507 PolarHBondContact O-N 3.35Å; L507-A509 PolarHBondContact O-N 3.08Å; L507-E510 WeakPolarHBondContact O-CA 3.21Å; L507-E510 PolarHBondContact O-N 3.16Å; L507-W514 HydrophobicContact CD2-CB 4.4Å; L507-V579 HydrophobicContact CD1-CG2 4.3Å; L507-I582 HydrophobicContact CD1-CD1 4.21Å
508	N	85.5	Confident	91.6	Very high	51 Å²	51	26.9 Å²	26.9	27%	0.273	12%	0.122	S	C	.	.	H	α-helix	trans	-65.3	-23.2	172.2	-76	-46.4	0	0	0	113.8	W274 Y504 F505 L506 E510	W274-N508 VanDerWaalsContact CD1-OD1 3.25Å; Y504-N508 WeakPolarHBondContact CD1-ND2 3.49Å; Y504-N508 WeakPolarHBondContact CE1-ND2 3.48Å; Y504-N508 PolarHBondContact O-N 2.93Å; Y504-N508 PolarHBondContact O-ND2 2.74Å; Y504-N508 PolarHBondContact OH-ND2 2.95Å; F505-N508 PolarHBondContact O-N 2.94Å; L506-N508 VanDerWaalsContact C-N 3.31Å; L506-N508 PolarHBondContact O-N 3.2Å; N508-E510 PolarHBondContact O-N 3.01Å
509	A	86.5	Confident	91.8	Very high	15 Å²	15	26.9 Å²	26.9	12%	0.124	12%	0.122	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.1	15	171.3	0	0	0	0	0	112.4	K440 M444 F505 L506 L507 D511	K440-A509 HydrophobicContact CB-CB 4.39Å; K440-A509 HydrophobicContact CD-CB 4.22Å; M444-A509 HydrophobicContact CB-CB 4.18Å; F505-A509 PolarHBondContact O-N 3.03Å; L506-A509 CarbonylContact O-C 3.6Å; L506-A509 WeakPolarHBondContact O-CA 3.34Å; L506-A509 WeakPolarHBondContact O-CB 3.14Å; L506-A509 PolarHBondContact O-N 3.43Å; L507-A509 PolarHBondContact O-N 3.08Å; A509-D511 PolarHBondContact O-N 2.89Å; A509-D511 VanDerWaalsContact O-N 3.1Å
510	E	87.8	Confident	91.9	Very high	32 Å²	32	30.4 Å²	30.4	15%	0.15	14%	0.14	C	C	.	.	T	Hydrogen-bonded Turn	trans	57.6	22.3	179.7	-62.4	172.1	-150.6	0	0	114.1	Q276 V277 R435 P438 L507 N508	Q276-E510 PolarHBondContact OE1-OE1 3.14Å; Q276-E510 VanDerWaalsContact OE1-OE1 3.12Å; Q276-E510 PolarHBondContact OE1-OE2 3.07Å; V277-E510 HydrophobicContact CG1-CB 4.16Å; V277-E510 WeakPolarHBondContact CG1-O 3.19Å; R435-E510 IonicContact CZ-OE2 2.72Å; R435-E510 IonicContact NE-OE2 3.8Å; R435-E510 IonicContact NH2-OE2 2.83Å; R435-E510 PolarHBondContact NH2-OE2 3.09Å; P438-E510 HydrophobicContact CG-CB 3.78Å; P438-E510 HydrophobicContact CG-CG 4.44Å; L507-E510 WeakPolarHBondContact O-CA 3.21Å; L507-E510 PolarHBondContact O-N 3.16Å; N508-E510 PolarHBondContact O-N 3.01Å
511	D	90.3	Very high	92	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	14%	0.135	C	C	.	.			trans	-95	106.5	174.7	-167.1	-18.3	0	0	0	109.7	I437 K440 L506 A509 R513	I437-D511 HydrophobicContact CG2-CB 4.09Å; K440-D511 IonicContact NZ-OD2 3.96Å; K440-D511 PolarHBondContact NZ-OD2 2.88Å; L506-D511 HydrophobicContact CD1-CB 3.7Å; L506-D511 HydrophobicContact CG-CB 3.94Å; L506-D511 PolarHBondContact O-N 3.33Å; A509-D511 PolarHBondContact O-N 2.89Å; A509-D511 VanDerWaalsContact O-N 3.1Å; D511-R513 PolarHBondContact O-N 3.4Å; D511-R513 WeakPolarHBondContact OD1-CB 3.43Å; D511-R513 WeakPolarHBondContact OD1-CG 3.27Å; D511-R513 IonicContact OD1-CZ 2.7Å; D511-R513 PolarHBondContact OD1-N 2.76Å; D511-R513 VanDerWaalsContact OD1-N 3.15Å; D511-R513 IonicContact OD1-NE 3.16Å; D511-R513 PolarHBondContact OD1-NE 3.1Å; D511-R513 IonicContact OD1-NH2 3.57Å; D511-R513 IonicContact OD2-CZ 3.44Å; D511-R513 IonicContact OD2-NE 3.62Å; D511-R513 IonicContact OD2-NH2 3.35Å; D511-R513 PolarHBondContact OD2-NH2 3.41Å
512	Y	90.8	Very high	92.2	Very high	46 Å²	46	28.5 Å²	28.5	18%	0.18	13%	0.13	C	C	.	.			trans	-73.1	-7.1	-178.3	64.1	-94.9	0	0	0	113.8	D280 P434 I437 W514	D280-Y512 HydrophobicContact CB-CD1 3.92Å; D280-Y512 HydrophobicContact CB-CD2 4.11Å; D280-Y512 HydrophobicContact CB-CG 3.66Å; P434-Y512 HydrophobicContact CB-CE1 4.41Å; I437-Y512 HydrophobicContact CD1-CE1 4.19Å; I437-Y512 HydrophobicContact CG1-CD1 4.41Å; I437-Y512 HydrophobicContact CG1-CE1 4.05Å; Y512-W514 PolarHBondContact O-N 3.42Å
513	R	92.1	Very high	92.4	Very high	131 Å²	131	28.5 Å²	28.5	49%	0.494	13%	0.131	S	C	.	.			trans	-82.7	46.7	-173	-59.4	174.8	-63.1	175	1.7	113.3	D511 Q515	D511-R513 PolarHBondContact O-N 3.4Å; D511-R513 WeakPolarHBondContact OD1-CB 3.43Å; D511-R513 WeakPolarHBondContact OD1-CG 3.27Å; D511-R513 IonicContact OD1-CZ 2.7Å; D511-R513 PolarHBondContact OD1-N 2.76Å; D511-R513 VanDerWaalsContact OD1-N 3.15Å; D511-R513 IonicContact OD1-NE 3.16Å; D511-R513 PolarHBondContact OD1-NE 3.1Å; D511-R513 IonicContact OD1-NH2 3.57Å; D511-R513 IonicContact OD2-CZ 3.44Å; D511-R513 IonicContact OD2-NE 3.62Å; D511-R513 IonicContact OD2-NH2 3.35Å; D511-R513 PolarHBondContact OD2-NH2 3.41Å; R513-Q515 PolarHBondContact O-N 3.38Å
514	W	94	Very high	92.7	Very high	3 Å²	3	28.7 Å²	28.7	1%	0.011	13%	0.132	C	C	.	.	H	α-helix	trans	-73	-22.6	-171.6	66.7	-91	0	0	0	115.2	V281 T503 L506 L507 Y512 T517 S518 Y572 T575 V579	V281-W514 PolarHBondContact O-NE1 3.05Å; T503-W514 HydrophobicContact CG2-CB 3.65Å; T503-W514 HydrophobicContact CG2-CD2 4.43Å; T503-W514 HydrophobicContact CG2-CE3 4.33Å; T503-W514 HydrophobicContact CG2-CG 4.18Å; L506-W514 HydrophobicContact CD2-CB 4.17Å; L507-W514 HydrophobicContact CD2-CB 4.4Å; Y512-W514 PolarHBondContact O-N 3.42Å; W514-T517 VanDerWaalsContact C-OG1 3.23Å; W514-T517 WeakPolarHBondContact CA-OG1 3.49Å; W514-T517 PolarHBondContact O-N 3.34Å; W514-T517 PolarHBondContact O-OG1 3.22Å; W514-S518 VanDerWaalsContact O-CB 3.31Å; W514-S518 WeakPolarHBondContact O-CB 3.35Å; W514-S518 PolarHBondContact O-N 3.32Å; W514-S518 PolarHBondContact O-OG 3.46Å; W514-Y572 HydrophobicContact CH2-CD2 4.38Å; W514-Y572 AromaticContact CH2-CE2 3.74Å; W514-Y572 HydrophobicContact CH2-CE2 3.74Å; W514-Y572 AromaticContact CZ3-CD2 3.89Å; W514-Y572 HydrophobicContact CZ3-CD2 3.89Å; W514-Y572 AromaticContact CZ3-CE2 3.7Å; W514-Y572 HydrophobicContact CZ3-CE2 3.7Å; W514-T575 HydrophobicContact CE3-CG2 3.6Å; W514-T575 HydrophobicContact CZ3-CG2 3.72Å; W514-V579 HydrophobicContact CD2-CG2 4.09Å; W514-V579 HydrophobicContact CE3-CG2 4.21Å; W514-V579 HydrophobicContact CH2-CB 4.47Å; W514-V579 HydrophobicContact CH2-CG2 4.42Å; W514-V579 HydrophobicContact CZ2-CB 4.24Å; W514-V579 HydrophobicContact CZ2-CG1 3.96Å; W514-V579 HydrophobicContact CZ2-CG2 4.3Å; W514-V579 HydrophobicContact CZ3-CG2 4.38Å
515	Q	95.1	Very high	93	Very high	19 Å²	19	27 Å²	27	9%	0.089	13%	0.125	C	C	.	.	H	α-helix	trans	-62.4	-52.8	-170.4	-62.9	175.7	0.4	0	0	111.4	R283 F291 R513 S518 F519 Y572	R283-Q515 PolarHBondContact O-NE2 2.98Å; F291-Q515 HydrophobicContact CE1-CB 4.27Å; F291-Q515 HydrophobicContact CZ-CB 3.91Å; R513-Q515 PolarHBondContact O-N 3.38Å; Q515-S518 PolarHBondContact O-N 3.43Å; Q515-S518 PolarHBondContact O-OG 3.39Å; Q515-F519 PolarHBondContact O-N 3.22Å; Q515-Y572 HydrophobicContact CB-CE2 4.15Å; Q515-Y572 HydrophobicContact CG-CE2 4.16Å
516	W	95.9	Very high	93.4	Very high	61 Å²	61	23.2 Å²	23.2	23%	0.231	11%	0.111	C	C	.	.	H	α-helix	trans	-68.4	-37.9	177.5	-85.4	107.8	0	0	0	112.8	S286 I290 F291 L294 S518 F519 L520	S286-W516 PolarHBondContact O-NE1 3.39Å; I290-W516 HydrophobicContact CG2-CH2 4.43Å; F291-W516 HydrophobicContact CB-CH2 4.14Å; F291-W516 HydrophobicContact CB-CZ2 3.6Å; F291-W516 AromaticContact CD2-CD2 3.7Å; F291-W516 HydrophobicContact CD2-CD2 3.7Å; F291-W516 AromaticContact CD2-CE2 3.59Å; F291-W516 AromaticContact CD2-CE3 3.87Å; F291-W516 HydrophobicContact CD2-CE3 3.87Å; F291-W516 HydrophobicContact CD2-CG 4.34Å; F291-W516 AromaticContact CD2-CH2 3.92Å; F291-W516 HydrophobicContact CD2-CH2 3.92Å; F291-W516 AromaticContact CD2-CZ2 3.74Å; F291-W516 HydrophobicContact CD2-CZ2 3.74Å; F291-W516 AromaticContact CD2-CZ3 3.98Å; F291-W516 HydrophobicContact CD2-CZ3 3.98Å; F291-W516 HydrophobicContact CE2-CD2 4.16Å; F291-W516 HydrophobicContact CE2-CE3 4.27Å; F291-W516 HydrophobicContact CE2-CG 4.49Å; F291-W516 HydrophobicContact CG-CZ2 4.12Å; L294-W516 HydrophobicContact CD1-CH2 3.85Å; L294-W516 HydrophobicContact CD1-CZ3 3.99Å; W516-S518 VanDerWaalsContact C-N 3.34Å; W516-S518 PolarHBondContact O-N 3.21Å; W516-F519 HydrophobicContact CE3-CD1 4.22Å; W516-F519 HydrophobicContact CZ3-CD1 4.13Å; W516-F519 HydrophobicContact CZ3-CE1 4.46Å; W516-F519 PolarHBondContact O-N 3.05Å; W516-L520 HydrophobicContact CE3-CD1 4.39Å; W516-L520 HydrophobicContact CE3-CG 4.29Å; W516-L520 VanDerWaalsContact O-CB 3.31Å; W516-L520 WeakPolarHBondContact O-CB 3.37Å; W516-L520 VanDerWaalsContact O-CG 3.3Å; W516-L520 WeakPolarHBondContact O-CG 3.31Å; W516-L520 PolarHBondContact O-N 3.47Å
517	T	94.9	Very high	93.7	Very high	14 Å²	14	28 Å²	28	9%	0.086	14%	0.135	C	C	.	.	H	α-helix	trans	-66.6	-37.4	178.7	53.2	0	0	0	0	111.9	P446 L506 W514 S521	P446-T517 HydrophobicContact CB-CG2 3.66Å; L506-T517 HydrophobicContact CD2-CG2 3.8Å; L506-T517 WeakPolarHBondContact CD2-OG1 3.23Å; W514-T517 VanDerWaalsContact C-OG1 3.23Å; W514-T517 WeakPolarHBondContact CA-OG1 3.49Å; W514-T517 PolarHBondContact O-N 3.34Å; W514-T517 PolarHBondContact O-OG1 3.22Å; T517-S521 WeakPolarHBondContact O-CB 3.27Å; T517-S521 PolarHBondContact O-N 2.85Å; T517-S521 PolarHBondContact O-OG 3.06Å
518	S	95.8	Very high	94	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-65.3	-39.5	174.5	69.4	0	0	0	0	111.9	T499 W514 Q515 W516 S521	T499-S518 WeakPolarHBondContact CG2-O 3.43Å; W514-S518 VanDerWaalsContact O-CB 3.31Å; W514-S518 WeakPolarHBondContact O-CB 3.35Å; W514-S518 PolarHBondContact O-N 3.32Å; W514-S518 PolarHBondContact O-OG 3.46Å; Q515-S518 PolarHBondContact O-N 3.43Å; Q515-S518 PolarHBondContact O-OG 3.39Å; W516-S518 VanDerWaalsContact C-N 3.34Å; W516-S518 PolarHBondContact O-N 3.21Å; S518-S521 PolarHBondContact O-OG 2.88Å; S518-S521 VanDerWaalsContact O-OG 3.1Å
519	F	97.4	Very high	94.5	Very high	8 Å²	8	27.8 Å²	27.8	4%	0.035	13%	0.131	C	C	.	.	H	α-helix	trans	-68.1	-50.7	176.5	177.4	-93.3	0	0	0	111	F291 L294 I295 Q515 W516 A522 A523 G568	F291-F519 HydrophobicContact CE2-CB 3.89Å; F291-F519 HydrophobicContact CE2-CG 4.31Å; L294-F519 HydrophobicContact CB-CE2 4.12Å; L294-F519 HydrophobicContact CB-CZ 3.86Å; L294-F519 HydrophobicContact CD1-CE1 4.08Å; L294-F519 HydrophobicContact CD1-CZ 4.13Å; L294-F519 HydrophobicContact CD2-CZ 4.32Å; L294-F519 HydrophobicContact CG-CZ 4.35Å; I295-F519 HydrophobicContact CD1-CD2 3.45Å; I295-F519 VanDerWaalsContact CD1-CD2 3.45Å; I295-F519 HydrophobicContact CD1-CE2 3.92Å; I295-F519 HydrophobicContact CD1-CG 4.45Å; Q515-F519 PolarHBondContact O-N 3.22Å; W516-F519 HydrophobicContact CE3-CD1 4.22Å; W516-F519 HydrophobicContact CZ3-CD1 4.13Å; W516-F519 HydrophobicContact CZ3-CE1 4.46Å; W516-F519 PolarHBondContact O-N 3.05Å; F519-A522 PolarHBondContact O-N 3.44Å; F519-A523 HydrophobicContact CE1-CB 4.27Å; F519-A523 VanDerWaalsContact O-CB 3.27Å; F519-A523 WeakPolarHBondContact O-CB 3.23Å; F519-A523 PolarHBondContact O-N 3.37Å; F519-G568 WeakPolarHBondContact CD2-O 3.18Å; F519-G568 WeakPolarHBondContact O-CA 3.45Å
520	L	97	Very high	95	Very high	75 Å²	75	30.6 Å²	30.6	39%	0.393	14%	0.139	S	C	.	.	H	α-helix	trans	-70	-35.1	-175.9	-69.7	173.1	0	0	0	112.7	V450 W516 A522 A523 S524	V450-L520 HydrophobicContact CB-CB 4.47Å; V450-L520 HydrophobicContact CG1-CB 3.82Å; V450-L520 HydrophobicContact CG2-CB 3.72Å; W516-L520 HydrophobicContact CE3-CD1 4.39Å; W516-L520 HydrophobicContact CE3-CG 4.29Å; W516-L520 VanDerWaalsContact O-CB 3.31Å; W516-L520 WeakPolarHBondContact O-CB 3.37Å; W516-L520 VanDerWaalsContact O-CG 3.3Å; W516-L520 WeakPolarHBondContact O-CG 3.31Å; W516-L520 PolarHBondContact O-N 3.47Å; L520-A522 VanDerWaalsContact C-N 3.33Å; L520-A522 PolarHBondContact O-N 3.3Å; L520-A523 PolarHBondContact O-N 2.85Å; L520-S524 WeakPolarHBondContact O-CB 3.29Å; L520-S524 PolarHBondContact O-N 3.5Å
521	S	95.3	Very high	95.4	Very high	1 Å²	1	33.9 Å²	33.9	1%	0.007	16%	0.155	C	C	.	.	H	α-helix	trans	-62	-41.1	176.3	52.2	0	0	0	0	111.7	G453 T517 S518 S524	G453-S521 CarbonylContact C-O 3.48Å; T517-S521 WeakPolarHBondContact O-CB 3.27Å; T517-S521 PolarHBondContact O-N 2.85Å; T517-S521 PolarHBondContact O-OG 3.06Å; S518-S521 PolarHBondContact O-OG 2.88Å; S518-S521 VanDerWaalsContact O-OG 3.1Å; S521-S524 PolarHBondContact O-OG 3.07Å
522	A	96.2	Very high	95.6	Very high	1 Å²	1	34.7 Å²	34.7	1%	0.008	16%	0.159	C	C	.	.	H	α-helix	trans	-73.7	-40.1	173	0	0	0	0	0	112.4	T499 F519 L520 S524 T525 C567	T499-A522 HydrophobicContact CG2-CB 3.44Å; T499-A522 VanDerWaalsContact CG2-CB 3.44Å; F519-A522 PolarHBondContact O-N 3.44Å; L520-A522 VanDerWaalsContact C-N 3.33Å; L520-A522 PolarHBondContact O-N 3.3Å; A522-S524 PolarHBondContact O-N 2.91Å; A522-T525 WeakPolarHBondContact O-CB 3.49Å; A522-T525 PolarHBondContact O-N 3.49Å; A522-T525 PolarHBondContact O-OG1 2.84Å; A522-C567 HydrophobicContact CB-CB 4.3Å; A522-C567 WeakPolarHBondContact CB-O 3.43Å; A522-C567 WeakPolarHBondContact O-CB 3.26Å
523	A	96.9	Very high	95.8	Very high	16 Å²	16	32.5 Å²	32.5	13%	0.132	15%	0.15	C	C	.	.	H	α-helix	trans	-65.9	-24.6	178.7	0	0	0	0	0	112.8	F519 L520 T525 A526 G564	F519-A523 HydrophobicContact CE1-CB 4.27Å; F519-A523 VanDerWaalsContact O-CB 3.27Å; F519-A523 WeakPolarHBondContact O-CB 3.23Å; F519-A523 PolarHBondContact O-N 3.37Å; L520-A523 PolarHBondContact O-N 2.85Å; A523-T525 PolarHBondContact O-N 2.9Å; A523-T525 VanDerWaalsContact O-N 3.1Å; A523-A526 WeakPolarHBondContact O-CB 3.49Å; A523-A526 PolarHBondContact O-N 3.42Å; A523-G564 WeakPolarHBondContact CA-O 2.91Å; A523-G564 VanDerWaalsContact CB-O 3.26Å; A523-G564 WeakPolarHBondContact CB-O 2.88Å
524	S	96.9	Very high	95.9	Very high	3 Å²	3	30.2 Å²	30.2	2%	0.021	14%	0.144	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-20.5	178.2	74.1	0	0	0	0	113.4	V450 G454 L520 S521 A522 A526 I527 Y528	V450-S524 VanDerWaalsContact O-CB 3.24Å; V450-S524 WeakPolarHBondContact O-CB 3.39Å; V450-S524 PolarHBondContact O-OG 2.99Å; G454-S524 WeakPolarHBondContact CA-OG 3.25Å; G454-S524 PolarHBondContact N-OG 3.29Å; L520-S524 WeakPolarHBondContact O-CB 3.29Å; L520-S524 PolarHBondContact O-N 3.5Å; S521-S524 PolarHBondContact O-OG 3.07Å; A522-S524 PolarHBondContact O-N 2.91Å; S524-A526 PolarHBondContact O-N 3.19Å; S524-A526 VanDerWaalsContact O-N 3.17Å; S524-I527 WeakPolarHBondContact O-CB 3.19Å; S524-I527 PolarHBondContact O-N 2.99Å; S524-Y528 VanDerWaalsContact O-CD2 3.3Å; S524-Y528 WeakPolarHBondContact O-CD2 3.48Å; S524-Y528 PolarHBondContact O-N 3.33Å
525	T	95.9	Very high	95.9	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-52.6	-34.4	168.9	-58.1	0	0	0	0	112	G454 P457 F458 I461 A522 A523 I527 Y528 V529	G454-T525 PolarHBondContact O-OG1 3.33Å; P457-T525 HydrophobicContact CB-CG2 4.11Å; P457-T525 WeakPolarHBondContact CB-OG1 3.46Å; F458-T525 HydrophobicContact CB-CG2 4.28Å; I461-T525 HydrophobicContact CD1-CG2 4.21Å; A522-T525 WeakPolarHBondContact O-CB 3.49Å; A522-T525 PolarHBondContact O-N 3.49Å; A522-T525 PolarHBondContact O-OG1 2.84Å; A523-T525 PolarHBondContact O-N 2.9Å; A523-T525 VanDerWaalsContact O-N 3.1Å; T525-I527 VanDerWaalsContact C-N 3.3Å; T525-I527 PolarHBondContact O-N 3.41Å; T525-Y528 PolarHBondContact O-N 2.98Å; T525-V529 WeakPolarHBondContact O-CG2 3.42Å; T525-V529 PolarHBondContact O-N 3.49Å
526	A	96.7	Very high	95.8	Very high	11 Å²	11	34.6 Å²	34.6	9%	0.091	16%	0.16	C	C	.	.	H	α-helix	trans	-60.6	-35.8	174.4	0	0	0	0	0	113.5	A523 S524 V529 Y530 S560	A523-A526 WeakPolarHBondContact O-CB 3.49Å; A523-A526 PolarHBondContact O-N 3.42Å; S524-A526 PolarHBondContact O-N 3.19Å; S524-A526 VanDerWaalsContact O-N 3.17Å; A526-V529 PolarHBondContact O-N 3.35Å; A526-Y530 WeakPolarHBondContact O-CB 3.43Å; A526-Y530 PolarHBondContact O-N 3.17Å; A526-S560 WeakPolarHBondContact CB-O 3.43Å
527	I	96.2	Very high	95.7	Very high	100 Å²	100	32.6 Å²	32.6	51%	0.513	15%	0.153	S	C	.	.	H	α-helix	trans	-65.2	-44.6	180	-57.6	173.2	0	0	0	109.2	S524 T525 Y530 M531	S524-I527 WeakPolarHBondContact O-CB 3.19Å; S524-I527 PolarHBondContact O-N 2.99Å; T525-I527 VanDerWaalsContact C-N 3.3Å; T525-I527 PolarHBondContact O-N 3.41Å; I527-Y530 PolarHBondContact O-N 3.42Å; I527-M531 HydrophobicContact CG2-CE 4.21Å; I527-M531 WeakPolarHBondContact O-CG 3.39Å; I527-M531 PolarHBondContact O-N 2.93Å
528	Y	96.3	Very high	95.5	Very high	48 Å²	48	38.6 Å²	38.6	19%	0.188	18%	0.178	C	C	.	.	H	α-helix	trans	-64.4	-42.2	176.5	-65.8	-75.6	0	0	0	112.5	C451 I455 F458 S524 T525 Y530 M531 Y532	C451-Y528 WeakPolarHBondContact O-CE2 3.31Å; C451-Y528 PolarHBondContact O-OH 3.03Å; I455-Y528 HydrophobicContact CG1-CE1 3.85Å; I455-Y528 HydrophobicContact CG1-CE2 3.92Å; I455-Y528 WeakPolarHBondContact CG1-OH 3.41Å; F458-Y528 HydrophobicContact CB-CG 4.28Å; F458-Y528 HydrophobicContact CD1-CG 4.38Å; F458-Y528 VanDerWaalsContact CG-CB 3.47Å; F458-Y528 HydrophobicContact CG-CG 4.27Å; S524-Y528 VanDerWaalsContact O-CD2 3.3Å; S524-Y528 WeakPolarHBondContact O-CD2 3.48Å; S524-Y528 PolarHBondContact O-N 3.33Å; T525-Y528 PolarHBondContact O-N 2.98Å; Y528-Y530 VanDerWaalsContact C-N 3.34Å; Y528-Y530 PolarHBondContact O-N 3.02Å; Y528-M531 HydrophobicContact CD1-CE 3.42Å; Y528-M531 VanDerWaalsContact CD1-CE 3.42Å; Y528-M531 HydrophobicContact CE1-CE 3.8Å; Y528-M531 HydrophobicContact CG-CE 4.12Å; Y528-M531 PolarHBondContact O-N 2.66Å; Y528-Y532 WeakPolarHBondContact O-CB 3.3Å; Y528-Y532 PolarHBondContact O-N 3Å
529	V	96.3	Very high	95.4	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-62.5	-41.5	174.5	173.4	0	0	0	0	111.4	F458 I461 M465 F469 T525 A526 Y532 S533 F559 L563	F458-V529 HydrophobicContact CD2-CG2 3.81Å; F458-V529 HydrophobicContact CE2-CG2 4.14Å; I461-V529 HydrophobicContact CD1-CG2 4.23Å; M465-V529 HydrophobicContact CE-CG1 3.92Å; M465-V529 HydrophobicContact CE-CG2 3.85Å; M465-V529 HydrophobicContact SD-CG1 4.13Å; F469-V529 HydrophobicContact CZ-CG1 4.08Å; T525-V529 WeakPolarHBondContact O-CG2 3.42Å; T525-V529 PolarHBondContact O-N 3.49Å; A526-V529 PolarHBondContact O-N 3.35Å; V529-Y532 WeakPolarHBondContact O-CB 3.35Å; V529-Y532 PolarHBondContact O-N 3.24Å; V529-S533 PolarHBondContact O-N 3.15Å; V529-F559 HydrophobicContact CG1-CD1 4.27Å; V529-F559 HydrophobicContact CG1-CE1 3.95Å; V529-L563 HydrophobicContact CB-CD2 4.41Å; V529-L563 HydrophobicContact CG1-CD2 4.45Å; V529-L563 HydrophobicContact CG2-CD2 3.78Å
530	Y	96.7	Very high	94.9	Very high	73 Å²	73	50.5 Å²	50.5	29%	0.286	23%	0.23	S	C	.	.	H	α-helix	trans	-68.4	-41.7	177.7	-167.1	-115.9	0	0	0	112	A526 I527 Y528 Y532 S533 F534 M556 A557	A526-Y530 WeakPolarHBondContact O-CB 3.43Å; A526-Y530 PolarHBondContact O-N 3.17Å; I527-Y530 PolarHBondContact O-N 3.42Å; Y528-Y530 VanDerWaalsContact C-N 3.34Å; Y528-Y530 PolarHBondContact O-N 3.02Å; Y530-Y532 VanDerWaalsContact C-N 3.29Å; Y530-Y532 PolarHBondContact O-N 2.93Å; Y530-S533 WeakPolarHBondContact O-CB 3.31Å; Y530-S533 PolarHBondContact O-N 3.02Å; Y530-S533 PolarHBondContact O-OG 2.82Å; Y530-F534 AromaticContact CD1-CE2 3.94Å; Y530-F534 HydrophobicContact CD1-CE2 3.94Å; Y530-F534 HydrophobicContact CE1-CD2 4.49Å; Y530-F534 AromaticContact CE1-CE2 3.49Å; Y530-F534 HydrophobicContact CE1-CE2 3.49Å; Y530-F534 VanDerWaalsContact CE1-CE2 3.49Å; Y530-F534 HydrophobicContact CE1-CZ 4.19Å; Y530-F534 AromaticContact CZ-CE2 3.84Å; Y530-F534 WeakPolarHBondContact O-CD2 3.27Å; Y530-F534 PolarHBondContact O-N 3.48Å; Y530-M556 HydrophobicContact CE2-CB 4.37Å; Y530-A557 HydrophobicContact CD2-CB 4.49Å; Y530-A557 HydrophobicContact CE2-CB 3.79Å
531	M	95.9	Very high	94.5	Very high	101 Å²	101	48 Å²	48	50%	0.498	22%	0.218	S	C	.	.	H	α-helix	trans	-59.8	-40	171.5	-72.7	-171.4	-61.5	0	0	112	I527 Y528 S533 F534 Y535	I527-M531 HydrophobicContact CG2-CE 4.21Å; I527-M531 WeakPolarHBondContact O-CG 3.39Å; I527-M531 PolarHBondContact O-N 2.93Å; Y528-M531 HydrophobicContact CD1-CE 3.42Å; Y528-M531 VanDerWaalsContact CD1-CE 3.42Å; Y528-M531 HydrophobicContact CE1-CE 3.8Å; Y528-M531 HydrophobicContact CG-CE 4.12Å; Y528-M531 PolarHBondContact O-N 2.66Å; M531-S533 PolarHBondContact O-N 2.69Å; M531-F534 WeakPolarHBondContact O-CB 3.26Å; M531-F534 PolarHBondContact O-N 3.39Å; M531-Y535 PolarHBondContact O-N 2.8Å
532	Y	95.2	Very high	94	Very high	17 Å²	17	55.8 Å²	55.8	7%	0.067	25%	0.252	C	S	.	.	H	α-helix	trans	-63	-32.9	174.9	-177.8	-111.4	0	0	0	112.3	F458 F462 M465 Y466 F469 Y528 V529 Y530 F534 Y535 Y536	F458-Y532 HydrophobicContact CE2-CG 4.48Å; F458-Y532 HydrophobicContact CZ-CD2 4.48Å; F458-Y532 HydrophobicContact CZ-CG 4.26Å; F462-Y532 HydrophobicContact CD2-CD2 4.41Å; F462-Y532 HydrophobicContact CD2-CE2 4.3Å; F462-Y532 AromaticContact CE2-CD2 3.62Å; F462-Y532 HydrophobicContact CE2-CD2 3.62Å; F462-Y532 AromaticContact CE2-CE2 3.34Å; F462-Y532 HydrophobicContact CE2-CE2 3.34Å; F462-Y532 HydrophobicContact CE2-CG 4.41Å; F462-Y532 AromaticContact CE2-CZ 3.96Å; F462-Y532 HydrophobicContact CZ-CD2 4.45Å; F462-Y532 AromaticContact CZ-CE2 3.8Å; F462-Y532 HydrophobicContact CZ-CE2 3.8Å; M465-Y532 HydrophobicContact CG-CD1 4.21Å; M465-Y532 HydrophobicContact CG-CE1 4.34Å; Y466-Y532 WeakPolarHBondContact CB-OH 3.49Å; Y466-Y532 VanDerWaalsContact CD2-OH 3.31Å; Y466-Y532 WeakPolarHBondContact CD2-OH 3.36Å; F469-Y532 AromaticContact CD2-CD1 3.93Å; F469-Y532 HydrophobicContact CD2-CD1 3.93Å; F469-Y532 AromaticContact CD2-CE1 3.8Å; F469-Y532 HydrophobicContact CD2-CE1 3.8Å; F469-Y532 AromaticContact CE2-CD1 3.48Å; F469-Y532 HydrophobicContact CE2-CD1 3.48Å; F469-Y532 VanDerWaalsContact CE2-CD1 3.48Å; F469-Y532 AromaticContact CE2-CE1 3.86Å; F469-Y532 HydrophobicContact CE2-CE1 3.86Å; F469-Y532 HydrophobicContact CZ-CD1 4.22Å; Y528-Y532 WeakPolarHBondContact O-CB 3.3Å; Y528-Y532 PolarHBondContact O-N 3Å; V529-Y532 WeakPolarHBondContact O-CB 3.35Å; V529-Y532 PolarHBondContact O-N 3.24Å; Y530-Y532 VanDerWaalsContact C-N 3.29Å; Y530-Y532 PolarHBondContact O-N 2.93Å; Y532-F534 VanDerWaalsContact C-N 3.32Å; Y532-F534 PolarHBondContact O-N 3.03Å; Y532-Y535 AromaticContact CD2-CD1 3.95Å; Y532-Y535 HydrophobicContact CD2-CD1 3.95Å; Y532-Y535 AromaticContact CE2-CD1 3.67Å; Y532-Y535 HydrophobicContact CE2-CD1 3.67Å; Y532-Y535 HydrophobicContact CE2-CE1 4.07Å; Y532-Y535 PolarHBondContact O-N 2.95Å; Y532-Y536 WeakPolarHBondContact O-CB 3.35Å; Y532-Y536 PolarHBondContact O-N 3.04Å
533	S	94.5	Very high	93.6	Very high	0 Å²	0	56.7 Å²	56.7	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-62.2	-37	175.3	83.1	0	0	0	0	112.8	V529 Y530 M531 Y536 Y537 Y552	V529-S533 PolarHBondContact O-N 3.15Å; Y530-S533 WeakPolarHBondContact O-CB 3.31Å; Y530-S533 PolarHBondContact O-N 3.02Å; Y530-S533 PolarHBondContact O-OG 2.82Å; M531-S533 PolarHBondContact O-N 2.69Å; S533-Y536 PolarHBondContact O-N 3.18Å; S533-Y537 WeakPolarHBondContact O-CB 3.41Å; S533-Y537 PolarHBondContact O-N 3.06Å; S533-Y552 WeakPolarHBondContact CA-OH 3.47Å; S533-Y552 PolarHBondContact O-OH 3.48Å
534	F	95.1	Very high	93.2	Very high	83 Å²	83	61.2 Å²	61.2	36%	0.364	27%	0.271	S	S	.	.	H	α-helix	trans	-62.9	-47.3	172.1	-78.3	-89.2	0	0	0	112.2	Y530 M531 Y532 Y536 Y537 F538 F553	Y530-F534 AromaticContact CD1-CE2 3.94Å; Y530-F534 HydrophobicContact CD1-CE2 3.94Å; Y530-F534 HydrophobicContact CE1-CD2 4.49Å; Y530-F534 AromaticContact CE1-CE2 3.49Å; Y530-F534 HydrophobicContact CE1-CE2 3.49Å; Y530-F534 VanDerWaalsContact CE1-CE2 3.49Å; Y530-F534 HydrophobicContact CE1-CZ 4.19Å; Y530-F534 AromaticContact CZ-CE2 3.84Å; Y530-F534 WeakPolarHBondContact O-CD2 3.27Å; Y530-F534 PolarHBondContact O-N 3.48Å; M531-F534 WeakPolarHBondContact O-CB 3.26Å; M531-F534 PolarHBondContact O-N 3.39Å; Y532-F534 VanDerWaalsContact C-N 3.32Å; Y532-F534 PolarHBondContact O-N 3.03Å; F534-Y536 VanDerWaalsContact C-N 3.31Å; F534-Y536 PolarHBondContact O-N 3.22Å; F534-Y537 PolarHBondContact O-N 3.46Å; F534-F538 HydrophobicContact CD1-CE2 4.24Å; F534-F538 WeakPolarHBondContact O-CD2 3.39Å; F534-F538 PolarHBondContact O-N 3.38Å; F534-F538 VanDerWaalsContact O-N 3.12Å; F534-F553 AromaticContact CD1-CE1 3.47Å; F534-F553 HydrophobicContact CD1-CE1 3.47Å; F534-F553 VanDerWaalsContact CD1-CE1 3.47Å; F534-F553 AromaticContact CD1-CZ 3.64Å; F534-F553 HydrophobicContact CD1-CZ 3.64Å; F534-F553 AromaticContact CD2-CE1 3.98Å; F534-F553 HydrophobicContact CD2-CE1 3.98Å; F534-F553 HydrophobicContact CE1-CD1 4.11Å; F534-F553 AromaticContact CE1-CE1 3.42Å; F534-F553 HydrophobicContact CE1-CE1 3.42Å; F534-F553 VanDerWaalsContact CE1-CE1 3.42Å; F534-F553 AromaticContact CE1-CZ 3.7Å; F534-F553 HydrophobicContact CE1-CZ 3.7Å; F534-F553 HydrophobicContact CE2-CD1 4.25Å; F534-F553 AromaticContact CE2-CE1 3.94Å; F534-F553 HydrophobicContact CE2-CE1 3.94Å; F534-F553 AromaticContact CG-CE1 3.76Å; F534-F553 HydrophobicContact CG-CE1 3.76Å; F534-F553 HydrophobicContact CG-CZ 4.28Å; F534-F553 AromaticContact CZ-CD1 3.96Å; F534-F553 HydrophobicContact CZ-CD1 3.96Å; F534-F553 AromaticContact CZ-CE1 3.67Å; F534-F553 HydrophobicContact CZ-CE1 3.67Å; F534-F553 HydrophobicContact CZ-CZ 4.38Å
535	Y	94	Very high	92.7	Very high	106 Å²	106	63 Å²	63	42%	0.416	29%	0.29	S	S	.	.	H	α-helix	trans	-58.3	-46.1	176	167.9	-96.4	0	0	0	111.3	M531 Y532 Y537 F538 F539	M531-Y535 PolarHBondContact O-N 2.8Å; Y532-Y535 AromaticContact CD2-CD1 3.95Å; Y532-Y535 HydrophobicContact CD2-CD1 3.95Å; Y532-Y535 AromaticContact CE2-CD1 3.67Å; Y532-Y535 HydrophobicContact CE2-CD1 3.67Å; Y532-Y535 HydrophobicContact CE2-CE1 4.07Å; Y532-Y535 PolarHBondContact O-N 2.95Å; Y535-Y537 VanDerWaalsContact C-N 3.35Å; Y535-Y537 PolarHBondContact O-N 3.22Å; Y535-F538 PolarHBondContact O-N 3.4Å; Y535-F539 HydrophobicContact CD2-CB 4.43Å; Y535-F539 AromaticContact CD2-CD2 3.29Å; Y535-F539 HydrophobicContact CD2-CD2 3.29Å; Y535-F539 AromaticContact CD2-CE2 3.78Å; Y535-F539 HydrophobicContact CD2-CE2 3.78Å; Y535-F539 HydrophobicContact CD2-CG 4.11Å; Y535-F539 HydrophobicContact CE2-CB 4.04Å; Y535-F539 AromaticContact CE2-CD2 3.47Å; Y535-F539 HydrophobicContact CE2-CD2 3.47Å; Y535-F539 VanDerWaalsContact CE2-CD2 3.47Å; Y535-F539 HydrophobicContact CE2-CE2 4.08Å; Y535-F539 AromaticContact CE2-CG 3.84Å; Y535-F539 HydrophobicContact CE2-CG 3.84Å; Y535-F539 HydrophobicContact CG-CD2 4.13Å; Y535-F539 WeakPolarHBondContact O-CB 3.38Å; Y535-F539 WeakPolarHBondContact O-CD2 3.36Å; Y535-F539 PolarHBondContact O-N 3.18Å
536	Y	93.3	Very high	92.4	Very high	8 Å²	8	67.9 Å²	67.9	3%	0.031	32%	0.315	C	S	.	.	H	α-helix	trans	-61.9	-43.1	179.5	-172.4	-87.3	0	0	0	111.8	Y466 F469 T470 W473 Y532 S533 F534 K540 T541 Y552	Y466-Y536 HydrophobicContact CD2-CD2 4.25Å; Y466-Y536 AromaticContact CD2-CE2 3.94Å; Y466-Y536 HydrophobicContact CD2-CE2 3.94Å; Y466-Y536 HydrophobicContact CE2-CD2 4.49Å; Y466-Y536 AromaticContact CE2-CE2 3.95Å; Y466-Y536 HydrophobicContact CE2-CE2 3.95Å; F469-Y536 HydrophobicContact CB-CD1 4.4Å; F469-Y536 HydrophobicContact CB-CD2 4.14Å; F469-Y536 HydrophobicContact CB-CE1 4.17Å; F469-Y536 HydrophobicContact CB-CE2 3.91Å; F469-Y536 HydrophobicContact CB-CG 4.39Å; F469-Y536 HydrophobicContact CD2-CD1 4.28Å; F469-Y536 HydrophobicContact CD2-CD2 4.13Å; F469-Y536 AromaticContact CD2-CG 3.9Å; F469-Y536 HydrophobicContact CD2-CG 3.9Å; T470-Y536 WeakPolarHBondContact CA-OH 3.43Å; T470-Y536 HydrophobicContact CG2-CE2 3.89Å; T470-Y536 WeakPolarHBondContact CG2-OH 3.32Å; T470-Y536 PolarHBondContact N-OH 3.33Å; W473-Y536 HydrophobicContact CB-CE1 4.32Å; Y532-Y536 WeakPolarHBondContact O-CB 3.35Å; Y532-Y536 PolarHBondContact O-N 3.04Å; S533-Y536 PolarHBondContact O-N 3.18Å; F534-Y536 VanDerWaalsContact C-N 3.31Å; F534-Y536 PolarHBondContact O-N 3.22Å; Y536-K540 HydrophobicContact CD1-CB 4.45Å; Y536-K540 HydrophobicContact CD2-CB 3.84Å; Y536-K540 HydrophobicContact CD2-CG 4Å; Y536-K540 HydrophobicContact CE1-CB 4.41Å; Y536-K540 HydrophobicContact CE2-CB 3.78Å; Y536-K540 HydrophobicContact CE2-CG 4.15Å; Y536-K540 HydrophobicContact CG-CB 4.17Å; Y536-K540 WeakPolarHBondContact O-CA 3.34Å; Y536-K540 VanDerWaalsContact O-CB 3.32Å; Y536-K540 WeakPolarHBondContact O-CB 3.32Å; Y536-K540 PolarHBondContact O-N 3.01Å; Y536-T541 HydrophobicContact CD1-CG2 3.72Å; Y536-T541 HydrophobicContact CE1-CG2 3.38Å; Y536-T541 PolarHBondContact O-N 3.1Å; Y536-Y552 HydrophobicContact CD1-CE2 4.38Å
537	Y	92.5	Very high	92.1	Very high	19 Å²	19	67.4 Å²	67.4	8%	0.075	31%	0.311	C	S	.	.	H	α-helix	trans	-58.1	-50.4	176.7	-176	-91.9	0	0	0	112.3	S533 F534 Y535 T541 M543 T549 Y552 F553	S533-Y537 WeakPolarHBondContact O-CB 3.41Å; S533-Y537 PolarHBondContact O-N 3.06Å; F534-Y537 PolarHBondContact O-N 3.46Å; Y535-Y537 VanDerWaalsContact C-N 3.35Å; Y535-Y537 PolarHBondContact O-N 3.22Å; Y537-T541 PolarHBondContact O-OG1 2.83Å; Y537-M543 HydrophobicContact CE2-CB 3.78Å; Y537-M543 PolarHBondContact OH-O 3.47Å; Y537-T549 HydrophobicContact CE1-CG2 4.35Å; Y537-T549 HydrophobicContact CE2-CG2 4.15Å; Y537-T549 WeakPolarHBondContact OH-CG2 3.45Å; Y537-Y552 AromaticContact CD2-CD1 3.58Å; Y537-Y552 HydrophobicContact CD2-CD1 3.58Å; Y537-Y552 HydrophobicContact CD2-CD2 4.28Å; Y537-Y552 AromaticContact CD2-CE1 3.91Å; Y537-Y552 HydrophobicContact CD2-CE1 3.91Å; Y537-Y552 AromaticContact CD2-CG 3.81Å; Y537-Y552 HydrophobicContact CD2-CG 3.81Å; Y537-Y552 HydrophobicContact CE2-CD1 4.41Å; Y537-Y552 HydrophobicContact CE2-CG 4.38Å; Y537-Y552 HydrophobicContact CG-CD1 4.22Å; Y537-Y552 HydrophobicContact CG-CE1 4.2Å; Y537-F553 HydrophobicContact CD1-CE2 4.17Å; Y537-F553 HydrophobicContact CD1-CZ 4.09Å; Y537-F553 HydrophobicContact CD2-CE2 4.22Å; Y537-F553 HydrophobicContact CD2-CZ 4.38Å; Y537-F553 HydrophobicContact CE1-CE2 4.48Å; Y537-F553 HydrophobicContact CE2-CE2 4.49Å; Y537-F553 HydrophobicContact CG-CE2 4.08Å; Y537-F553 AromaticContact CG-CZ 3.89Å; Y537-F553 HydrophobicContact CG-CZ 3.89Å
538	F	92.4	Very high	91.8	Very high	140 Å²	140	62.7 Å²	62.7	61%	0.614	29%	0.287	S	S	*	.	H	α-helix	trans	-77.8	-33.3	-175	-71.1	-65.2	0	0	0	114.4	F534 Y535	F534-F538 HydrophobicContact CD1-CE2 4.24Å; F534-F538 WeakPolarHBondContact O-CD2 3.39Å; F534-F538 PolarHBondContact O-N 3.38Å; F534-F538 VanDerWaalsContact O-N 3.12Å; Y535-F538 PolarHBondContact O-N 3.4Å
539	F	91.8	Very high	91.6	Very high	149 Å²	149	62 Å²	62	65%	0.654	29%	0.288	S	S	*	.	H	α-helix	trans	-106.1	-18.6	-171.1	-67.1	-78.1	0	0	0	114.6	Y535	Y535-F539 HydrophobicContact CD2-CB 4.43Å; Y535-F539 AromaticContact CD2-CD2 3.29Å; Y535-F539 HydrophobicContact CD2-CD2 3.29Å; Y535-F539 AromaticContact CD2-CE2 3.78Å; Y535-F539 HydrophobicContact CD2-CE2 3.78Å; Y535-F539 HydrophobicContact CD2-CG 4.11Å; Y535-F539 HydrophobicContact CE2-CB 4.04Å; Y535-F539 AromaticContact CE2-CD2 3.47Å; Y535-F539 HydrophobicContact CE2-CD2 3.47Å; Y535-F539 VanDerWaalsContact CE2-CD2 3.47Å; Y535-F539 HydrophobicContact CE2-CE2 4.08Å; Y535-F539 AromaticContact CE2-CG 3.84Å; Y535-F539 HydrophobicContact CE2-CG 3.84Å; Y535-F539 HydrophobicContact CG-CD2 4.13Å; Y535-F539 WeakPolarHBondContact O-CB 3.38Å; Y535-F539 WeakPolarHBondContact O-CD2 3.36Å; Y535-F539 PolarHBondContact O-N 3.18Å
540	K	88.7	Confident	91.4	Very high	109 Å²	109	63.3 Å²	63.3	47%	0.474	30%	0.296	S	S	.	.	H	α-helix	trans	-117.6	-22.6	-176.2	-62.7	-63.4	-176.3	-178.7	0	113.9	Y466 Y536	Y466-K540 HydrophobicContact CE2-CD 4.34Å; Y466-K540 HydrophobicContact CE2-CG 4.37Å; Y536-K540 HydrophobicContact CD1-CB 4.45Å; Y536-K540 HydrophobicContact CD2-CB 3.84Å; Y536-K540 HydrophobicContact CD2-CG 4Å; Y536-K540 HydrophobicContact CE1-CB 4.41Å; Y536-K540 HydrophobicContact CE2-CB 3.78Å; Y536-K540 HydrophobicContact CE2-CG 4.15Å; Y536-K540 HydrophobicContact CG-CB 4.17Å; Y536-K540 WeakPolarHBondContact O-CA 3.34Å; Y536-K540 VanDerWaalsContact O-CB 3.32Å; Y536-K540 WeakPolarHBondContact O-CB 3.32Å; Y536-K540 PolarHBondContact O-N 3.01Å
541	T	87.2	Confident	91.2	Very high	22 Å²	22	60.7 Å²	60.7	14%	0.135	29%	0.287	C	S	.	.			trans	-106.2	154.4	174.1	81.4	0	0	0	0	111	Y536 Y537 M543	Y536-T541 HydrophobicContact CD1-CG2 3.72Å; Y536-T541 HydrophobicContact CE1-CG2 3.38Å; Y536-T541 PolarHBondContact O-N 3.1Å; Y537-T541 PolarHBondContact O-OG1 2.83Å; T541-M543 HydrophobicContact CG2-CE 4.18Å; T541-M543 HydrophobicContact CG2-SD 4.08Å
542	K	86	Confident	91.1	Very high	166 Å²	166	55.9 Å²	55.9	72%	0.722	26%	0.263	S	S	*	.			trans	-106.8	28.3	170.4	-64.7	-175.8	178.2	-178	0	110.7	Y544	K542-Y544 WeakPolarHBondContact O-CD1 3.3Å
543	M	86.7	Confident	91.1	Very high	20 Å²	20	56.8 Å²	56.8	10%	0.099	27%	0.267	C	S	.	.			trans	-73.6	139	-175.4	-71.8	172.4	-177.3	0	0	110.2	W473 Y537 T541 Q548 Y552	W473-M543 HydrophobicContact CB-CE 3.92Å; W473-M543 HydrophobicContact CE3-CE 4.44Å; W473-M543 WeakPolarHBondContact O-CE 3.28Å; Y537-M543 HydrophobicContact CE2-CB 3.78Å; Y537-M543 PolarHBondContact OH-O 3.47Å; T541-M543 HydrophobicContact CG2-CE 4.18Å; T541-M543 HydrophobicContact CG2-SD 4.08Å; M543-Q548 HydrophobicContact CB-CG 3.69Å; M543-Q548 HydrophobicContact CG-CG 3.88Å; M543-Q548 HydrophobicContact SD-CG 4.18Å; M543-Q548 PolarHBondContact SD-NE2 2.84Å; M543-Y552 HydrophobicContact SD-CD2 4.33Å
544	Y	87.9	Confident	91.2	Very high	111 Å²	111	57.6 Å²	57.6	44%	0.435	28%	0.276	S	S	.	.			trans	-142.4	167.1	175.5	60.2	-91.6	0	0	0	110.9	H52 N53 K542 Q548	H52-Y544 HydrophobicContact CB-CE1 3.92Å; N53-Y544 VanDerWaalsContact CG-O 3.29Å; N53-Y544 WeakPolarHBondContact ND2-CE2 3.26Å; N53-Y544 PolarHBondContact ND2-O 3Å; N53-Y544 PolarHBondContact OD1-N 2.97Å; N53-Y544 PolarHBondContact OD1-O 3.01Å; K542-Y544 WeakPolarHBondContact O-CD1 3.3Å; Y544-Q548 WeakPolarHBondContact O-CB 2.99Å
545	G	87.5	Confident	91.1	Very high	41 Å²	41	57.1 Å²	57.1	42%	0.423	27%	0.272	S	S	.	.	S	Bend	trans	94.9	152.3	178.3	0	0	0	0	0	114	T549	G545-T549 WeakPolarHBondContact O-CB 3.45Å; G545-T549 VanDerWaalsContact O-CG2 3.22Å; G545-T549 WeakPolarHBondContact O-CG2 3.4Å; G545-T549 PolarHBondContact O-N 3.38Å; G545-T549 PolarHBondContact O-OG1 3.28Å
546	L	89.8	Confident	91.2	Very high	101 Å²	101	52.4 Å²	52.4	53%	0.529	25%	0.254	S	S	.	.	H	α-helix	trans	-65.9	-40.3	-174	-178.4	65.4	0	0	0	112.4	T549 S550	L546-T549 VanDerWaalsContact CA-OG1 3.31Å; L546-T549 WeakPolarHBondContact CA-OG1 3.2Å; L546-T549 PolarHBondContact O-OG1 3.47Å; L546-S550 VanDerWaalsContact O-CB 3.25Å; L546-S550 WeakPolarHBondContact O-CB 3.2Å; L546-S550 PolarHBondContact O-N 2.93Å; L546-S550 PolarHBondContact O-OG 3.28Å
547	F	90	Very high	91.3	Very high	2 Å²	2	53.3 Å²	53.3	1%	0.009	26%	0.263	C	S	.	.	H	α-helix	trans	-65.1	-52.7	179.8	177.5	-117	0	0	0	111.4	Q55 E56 I377 I380 A381 Y384 A386 R388 T549 S550 F551	Q55-F547 WeakPolarHBondContact O-CE1 3.47Å; E56-F547 HydrophobicContact CB-CD1 4.1Å; E56-F547 HydrophobicContact CB-CE1 4.48Å; E56-F547 HydrophobicContact CG-CD1 4.2Å; I377-F547 HydrophobicContact CG2-CE2 4.4Å; I380-F547 HydrophobicContact CB-CD2 4.37Å; I380-F547 HydrophobicContact CG2-CB 4.22Å; I380-F547 HydrophobicContact CG2-CD2 3.9Å; A381-F547 HydrophobicContact CB-CD2 4.47Å; A381-F547 HydrophobicContact CB-CE2 3.58Å; A381-F547 HydrophobicContact CB-CZ 4.05Å; Y384-F547 HydrophobicContact CD2-CB 4.06Å; Y384-F547 HydrophobicContact CE2-CB 4.18Å; Y384-F547 HydrophobicContact CG-CB 4.37Å; A386-F547 HydrophobicContact CB-CE1 4.08Å; A386-F547 HydrophobicContact CB-CZ 4.08Å; R388-F547 HydrophobicContact CB-CZ 4.45Å; F547-T549 PolarHBondContact O-N 2.86Å; F547-S550 PolarHBondContact O-N 3.25Å; F547-F551 VanDerWaalsContact O-CB 3.3Å; F547-F551 WeakPolarHBondContact O-CB 3.45Å; F547-F551 PolarHBondContact O-N 3.5Å
548	Q	89.8	Confident	91.5	Very high	0 Å²	0	53.4 Å²	53.4	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-60	-43.4	179.6	-176	69	43.6	0	0	112.5	Q55 M543 Y544 Y552	Q55-Q548 VanDerWaalsContact N-OE1 3.13Å; M543-Q548 HydrophobicContact CB-CG 3.69Å; M543-Q548 HydrophobicContact CG-CG 3.88Å; M543-Q548 HydrophobicContact SD-CG 4.18Å; M543-Q548 PolarHBondContact SD-NE2 2.84Å; Y544-Q548 WeakPolarHBondContact O-CB 2.99Å; Q548-Y552 WeakPolarHBondContact O-CB 3.26Å; Q548-Y552 PolarHBondContact O-N 3.45Å
549	T	92.4	Very high	91.6	Very high	35 Å²	35	50.3 Å²	50.3	22%	0.215	25%	0.252	C	S	.	.	H	α-helix	trans	-64.3	-47.8	177.1	46.5	0	0	0	0	112	Y537 G545 L546 F547 F551 Y552 F553	Y537-T549 HydrophobicContact CE1-CG2 4.35Å; Y537-T549 HydrophobicContact CE2-CG2 4.15Å; Y537-T549 WeakPolarHBondContact OH-CG2 3.45Å; G545-T549 WeakPolarHBondContact O-CB 3.45Å; G545-T549 VanDerWaalsContact O-CG2 3.22Å; G545-T549 WeakPolarHBondContact O-CG2 3.4Å; G545-T549 PolarHBondContact O-N 3.38Å; G545-T549 PolarHBondContact O-OG1 3.28Å; L546-T549 VanDerWaalsContact CA-OG1 3.31Å; L546-T549 WeakPolarHBondContact CA-OG1 3.2Å; L546-T549 PolarHBondContact O-OG1 3.47Å; F547-T549 PolarHBondContact O-N 2.86Å; T549-F551 VanDerWaalsContact C-N 3.33Å; T549-F551 PolarHBondContact O-N 3.5Å; T549-Y552 PolarHBondContact O-N 3.35Å; T549-F553 WeakPolarHBondContact O-CD2 2.93Å; T549-F553 PolarHBondContact O-N 3.02Å
550	S	92.8	Very high	91.9	Very high	26 Å²	26	43.5 Å²	43.5	18%	0.182	22%	0.223	C	C	.	.	H	α-helix	trans	-64.2	-40.6	179.8	-57.6	0	0	0	0	111.4	L546 F547 G554	L546-S550 VanDerWaalsContact O-CB 3.25Å; L546-S550 WeakPolarHBondContact O-CB 3.2Å; L546-S550 PolarHBondContact O-N 2.93Å; L546-S550 PolarHBondContact O-OG 3.28Å; F547-S550 PolarHBondContact O-N 3.25Å; S550-G554 WeakPolarHBondContact O-CA 3.44Å; S550-G554 PolarHBondContact O-N 2.85Å
551	F	92.1	Very high	92.2	Very high	18 Å²	18	41.2 Å²	41.2	8%	0.079	22%	0.218	C	C	.	.	H	α-helix	trans	-60.6	-52.3	173.7	-171.2	-79.2	0	0	0	110.7	Q55 I377 W473 F547 T549 Y555	Q55-F551 HydrophobicContact CB-CD1 4.31Å; Q55-F551 HydrophobicContact CG-CD1 4.28Å; Q55-F551 HydrophobicContact CG-CE1 4.49Å; I377-F551 HydrophobicContact CG2-CB 4.36Å; I377-F551 HydrophobicContact CG2-CD2 3.63Å; I377-F551 HydrophobicContact CG2-CE2 4.35Å; I377-F551 HydrophobicContact CG2-CG 4.42Å; W473-F551 AromaticContact CH2-CD1 3.89Å; W473-F551 HydrophobicContact CH2-CD1 3.89Å; W473-F551 AromaticContact CH2-CE1 3.85Å; W473-F551 HydrophobicContact CH2-CE1 3.85Å; W473-F551 AromaticContact CZ3-CD1 3.64Å; W473-F551 HydrophobicContact CZ3-CD1 3.64Å; W473-F551 AromaticContact CZ3-CE1 3.67Å; W473-F551 HydrophobicContact CZ3-CE1 3.67Å; F547-F551 VanDerWaalsContact O-CB 3.3Å; F547-F551 WeakPolarHBondContact O-CB 3.45Å; F547-F551 PolarHBondContact O-N 3.5Å; T549-F551 VanDerWaalsContact C-N 3.33Å; T549-F551 PolarHBondContact O-N 3.5Å; F551-Y555 AromaticContact CD1-CD2 3.88Å; F551-Y555 HydrophobicContact CD1-CD2 3.88Å; F551-Y555 HydrophobicContact CD1-CE2 4.34Å; F551-Y555 AromaticContact CD2-CD2 3.95Å; F551-Y555 HydrophobicContact CD2-CD2 3.95Å; F551-Y555 AromaticContact CD2-CE2 3.62Å; F551-Y555 HydrophobicContact CD2-CE2 3.62Å; F551-Y555 AromaticContact CE1-CD2 3.56Å; F551-Y555 HydrophobicContact CE1-CD2 3.56Å; F551-Y555 AromaticContact CE1-CE2 3.92Å; F551-Y555 HydrophobicContact CE1-CE2 3.92Å; F551-Y555 HydrophobicContact CE1-CG 4.34Å; F551-Y555 AromaticContact CE2-CD2 3.63Å; F551-Y555 HydrophobicContact CE2-CD2 3.63Å; F551-Y555 AromaticContact CE2-CE2 3.09Å; F551-Y555 HydrophobicContact CE2-CE2 3.09Å; F551-Y555 AromaticContact CE2-CZ 3.94Å; F551-Y555 HydrophobicContact CG-CD2 4.03Å; F551-Y555 HydrophobicContact CG-CE2 4.18Å; F551-Y555 AromaticContact CZ-CD2 3.39Å; F551-Y555 HydrophobicContact CZ-CD2 3.39Å; F551-Y555 AromaticContact CZ-CE2 3.24Å; F551-Y555 HydrophobicContact CZ-CE2 3.24Å; F551-Y555 HydrophobicContact CZ-CG 4.29Å; F551-Y555 AromaticContact CZ-CZ 3.99Å; F551-Y555 WeakPolarHBondContact O-CD2 3.41Å; F551-Y555 PolarHBondContact O-N 2.83Å; F551-Y555 VanDerWaalsContact O-N 3.11Å
552	Y	93.8	Very high	92.7	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-55.9	-60	179.8	180	-91.1	0	0	0	111.8	W473 S533 Y536 Y537 M543 Q548 T549 G554 M556	W473-Y552 AromaticContact CD1-CE2 3.58Å; W473-Y552 AromaticContact CD2-CD2 3.51Å; W473-Y552 HydrophobicContact CD2-CD2 3.51Å; W473-Y552 AromaticContact CD2-CE2 3.66Å; W473-Y552 HydrophobicContact CD2-CE2 3.66Å; W473-Y552 AromaticContact CE2-CD2 3.43Å; W473-Y552 VanDerWaalsContact CE2-CD2 3.43Å; W473-Y552 AromaticContact CE2-CE2 3.44Å; W473-Y552 VanDerWaalsContact CE2-CE2 3.44Å; W473-Y552 AromaticContact CE3-CD2 3.8Å; W473-Y552 HydrophobicContact CE3-CD2 3.8Å; W473-Y552 HydrophobicContact CE3-CE2 4.41Å; W473-Y552 HydrophobicContact CG-CD2 4.06Å; W473-Y552 AromaticContact CG-CE2 3.77Å; W473-Y552 HydrophobicContact CG-CE2 3.77Å; W473-Y552 AromaticContact CH2-CD2 3.99Å; W473-Y552 HydrophobicContact CH2-CD2 3.99Å; W473-Y552 HydrophobicContact CH2-CG 4.49Å; W473-Y552 AromaticContact CZ2-CD2 3.68Å; W473-Y552 HydrophobicContact CZ2-CD2 3.68Å; W473-Y552 HydrophobicContact CZ2-CE2 4.04Å; W473-Y552 HydrophobicContact CZ2-CG 4.37Å; W473-Y552 HydrophobicContact CZ3-CD2 4.03Å; W473-Y552 AromaticContact NE1-CD2 3.88Å; W473-Y552 AromaticContact NE1-CE2 3.36Å; S533-Y552 WeakPolarHBondContact CA-OH 3.47Å; S533-Y552 PolarHBondContact O-OH 3.48Å; Y536-Y552 HydrophobicContact CD1-CE2 4.38Å; Y537-Y552 AromaticContact CD2-CD1 3.58Å; Y537-Y552 HydrophobicContact CD2-CD1 3.58Å; Y537-Y552 HydrophobicContact CD2-CD2 4.28Å; Y537-Y552 AromaticContact CD2-CE1 3.91Å; Y537-Y552 HydrophobicContact CD2-CE1 3.91Å; Y537-Y552 AromaticContact CD2-CG 3.81Å; Y537-Y552 HydrophobicContact CD2-CG 3.81Å; Y537-Y552 HydrophobicContact CE2-CD1 4.41Å; Y537-Y552 HydrophobicContact CE2-CG 4.38Å; Y537-Y552 HydrophobicContact CG-CD1 4.22Å; Y537-Y552 HydrophobicContact CG-CE1 4.2Å; M543-Y552 HydrophobicContact SD-CD2 4.33Å; Q548-Y552 WeakPolarHBondContact O-CB 3.26Å; Q548-Y552 PolarHBondContact O-N 3.45Å; T549-Y552 PolarHBondContact O-N 3.35Å; Y552-G554 VanDerWaalsContact C-N 3.34Å; Y552-G554 PolarHBondContact O-N 2.9Å; Y552-M556 HydrophobicContact CD1-CG 4.21Å; Y552-M556 HydrophobicContact CD2-CG 4.47Å; Y552-M556 HydrophobicContact CE1-CG 3.86Å; Y552-M556 HydrophobicContact CE2-CG 4.17Å; Y552-M556 HydrophobicContact CG-CG 4.48Å; Y552-M556 VanDerWaalsContact O-CB 3.27Å; Y552-M556 WeakPolarHBondContact O-CB 3.48Å; Y552-M556 WeakPolarHBondContact O-CG 3.24Å; Y552-M556 PolarHBondContact O-N 2.85Å
553	F	95.4	Very high	93.2	Very high	36 Å²	36	34.3 Å²	34.3	16%	0.158	19%	0.192	C	C	.	.	H	α-helix	trans	-69	-32.3	-174.5	-75.4	-67.2	0	0	0	113	F534 Y537 T549 A557	F534-F553 AromaticContact CD1-CE1 3.47Å; F534-F553 HydrophobicContact CD1-CE1 3.47Å; F534-F553 VanDerWaalsContact CD1-CE1 3.47Å; F534-F553 AromaticContact CD1-CZ 3.64Å; F534-F553 HydrophobicContact CD1-CZ 3.64Å; F534-F553 AromaticContact CD2-CE1 3.98Å; F534-F553 HydrophobicContact CD2-CE1 3.98Å; F534-F553 HydrophobicContact CE1-CD1 4.11Å; F534-F553 AromaticContact CE1-CE1 3.42Å; F534-F553 HydrophobicContact CE1-CE1 3.42Å; F534-F553 VanDerWaalsContact CE1-CE1 3.42Å; F534-F553 AromaticContact CE1-CZ 3.7Å; F534-F553 HydrophobicContact CE1-CZ 3.7Å; F534-F553 HydrophobicContact CE2-CD1 4.25Å; F534-F553 AromaticContact CE2-CE1 3.94Å; F534-F553 HydrophobicContact CE2-CE1 3.94Å; F534-F553 AromaticContact CG-CE1 3.76Å; F534-F553 HydrophobicContact CG-CE1 3.76Å; F534-F553 HydrophobicContact CG-CZ 4.28Å; F534-F553 AromaticContact CZ-CD1 3.96Å; F534-F553 HydrophobicContact CZ-CD1 3.96Å; F534-F553 AromaticContact CZ-CE1 3.67Å; F534-F553 HydrophobicContact CZ-CE1 3.67Å; F534-F553 HydrophobicContact CZ-CZ 4.38Å; Y537-F553 HydrophobicContact CD1-CE2 4.17Å; Y537-F553 HydrophobicContact CD1-CZ 4.09Å; Y537-F553 HydrophobicContact CD2-CE2 4.22Å; Y537-F553 HydrophobicContact CD2-CZ 4.38Å; Y537-F553 HydrophobicContact CE1-CE2 4.48Å; Y537-F553 HydrophobicContact CE2-CE2 4.49Å; Y537-F553 HydrophobicContact CG-CE2 4.08Å; Y537-F553 AromaticContact CG-CZ 3.89Å; Y537-F553 HydrophobicContact CG-CZ 3.89Å; T549-F553 WeakPolarHBondContact O-CD2 2.93Å; T549-F553 PolarHBondContact O-N 3.02Å; F553-A557 VanDerWaalsContact O-CB 3.3Å; F553-A557 WeakPolarHBondContact O-CB 3.18Å; F553-A557 PolarHBondContact O-N 3.04Å
554	G	95.1	Very high	93.7	Very high	18 Å²	18	33.6 Å²	33.6	19%	0.186	19%	0.189	C	C	.	.	H	α-helix	trans	-65.3	-51	177.5	0	0	0	0	0	112.3	S550 Y552 A557 V558	S550-G554 WeakPolarHBondContact O-CA 3.44Å; S550-G554 PolarHBondContact O-N 2.85Å; Y552-G554 VanDerWaalsContact C-N 3.34Å; Y552-G554 PolarHBondContact O-N 2.9Å; G554-A557 PolarHBondContact O-N 3.09Å; G554-V558 WeakPolarHBondContact O-CG2 3.35Å; G554-V558 PolarHBondContact O-N 2.61Å; G554-V558 VanDerWaalsContact O-N 3.15Å
555	Y	94.2	Very high	94.2	Very high	73 Å²	73	29 Å²	29	29%	0.286	17%	0.172	S	C	.	.	H	α-helix	trans	-69.8	-34.1	176.8	-78.4	-79.6	0	0	0	112.5	I377 F551 A557 V558 F559	I377-Y555 HydrophobicContact CD1-CD2 3.61Å; I377-Y555 HydrophobicContact CD1-CE2 3.43Å; I377-Y555 VanDerWaalsContact CD1-CE2 3.43Å; I377-Y555 HydrophobicContact CG2-CE2 4.39Å; F551-Y555 AromaticContact CD1-CD2 3.88Å; F551-Y555 HydrophobicContact CD1-CD2 3.88Å; F551-Y555 HydrophobicContact CD1-CE2 4.34Å; F551-Y555 AromaticContact CD2-CD2 3.95Å; F551-Y555 HydrophobicContact CD2-CD2 3.95Å; F551-Y555 AromaticContact CD2-CE2 3.62Å; F551-Y555 HydrophobicContact CD2-CE2 3.62Å; F551-Y555 AromaticContact CE1-CD2 3.56Å; F551-Y555 HydrophobicContact CE1-CD2 3.56Å; F551-Y555 AromaticContact CE1-CE2 3.92Å; F551-Y555 HydrophobicContact CE1-CE2 3.92Å; F551-Y555 HydrophobicContact CE1-CG 4.34Å; F551-Y555 AromaticContact CE2-CD2 3.63Å; F551-Y555 HydrophobicContact CE2-CD2 3.63Å; F551-Y555 AromaticContact CE2-CE2 3.09Å; F551-Y555 HydrophobicContact CE2-CE2 3.09Å; F551-Y555 AromaticContact CE2-CZ 3.94Å; F551-Y555 HydrophobicContact CG-CD2 4.03Å; F551-Y555 HydrophobicContact CG-CE2 4.18Å; F551-Y555 AromaticContact CZ-CD2 3.39Å; F551-Y555 HydrophobicContact CZ-CD2 3.39Å; F551-Y555 AromaticContact CZ-CE2 3.24Å; F551-Y555 HydrophobicContact CZ-CE2 3.24Å; F551-Y555 HydrophobicContact CZ-CG 4.29Å; F551-Y555 AromaticContact CZ-CZ 3.99Å; F551-Y555 WeakPolarHBondContact O-CD2 3.41Å; F551-Y555 PolarHBondContact O-N 2.83Å; F551-Y555 VanDerWaalsContact O-N 3.11Å; Y555-A557 VanDerWaalsContact C-N 3.31Å; Y555-A557 PolarHBondContact O-N 3.47Å; Y555-V558 PolarHBondContact O-N 2.93Å; Y555-F559 WeakPolarHBondContact O-CB 3.34Å; Y555-F559 PolarHBondContact O-N 3.5Å
556	M	95	Very high	94.7	Very high	6 Å²	6	27.4 Å²	27.4	3%	0.03	15%	0.153	C	C	.	.	H	α-helix	trans	-63	-37.4	173.3	-75.3	-48.9	-48.2	0	0	112.5	F469 W473 Y530 Y552 F559 S560	F469-M556 HydrophobicContact CD1-CE 4.34Å; F469-M556 HydrophobicContact CE1-CE 3.4Å; F469-M556 HydrophobicContact CE1-SD 4.14Å; F469-M556 HydrophobicContact CE2-CE 3.77Å; F469-M556 HydrophobicContact CZ-CE 3.07Å; F469-M556 HydrophobicContact CZ-SD 4.16Å; W473-M556 HydrophobicContact CZ2-CG 3.84Å; W473-M556 HydrophobicContact CZ2-SD 3.75Å; W473-M556 PolarHBondContact NE1-SD 3.34Å; W473-M556 VanDerWaalsContact NE1-SD 3.42Å; Y530-M556 HydrophobicContact CE2-CB 4.37Å; Y552-M556 HydrophobicContact CD1-CG 4.21Å; Y552-M556 HydrophobicContact CD2-CG 4.47Å; Y552-M556 HydrophobicContact CE1-CG 3.86Å; Y552-M556 HydrophobicContact CE2-CG 4.17Å; Y552-M556 HydrophobicContact CG-CG 4.48Å; Y552-M556 VanDerWaalsContact O-CB 3.27Å; Y552-M556 WeakPolarHBondContact O-CB 3.48Å; Y552-M556 WeakPolarHBondContact O-CG 3.24Å; Y552-M556 PolarHBondContact O-N 2.85Å; M556-F559 HydrophobicContact CE-CD1 3.86Å; M556-F559 PolarHBondContact O-N 2.87Å; M556-S560 WeakPolarHBondContact O-CB 3.33Å; M556-S560 PolarHBondContact O-N 2.7Å; M556-S560 PolarHBondContact O-OG 3.48Å; M556-S560 VanDerWaalsContact O-OG 3.08Å
557	A	96.1	Very high	95	Very high	28 Å²	28	22.6 Å²	22.6	23%	0.231	13%	0.128	C	C	.	.	H	α-helix	trans	-67.3	-40.1	175.3	0	0	0	0	0	112.2	Y530 F553 G554 Y555 S560 T561	Y530-A557 HydrophobicContact CD2-CB 4.49Å; Y530-A557 HydrophobicContact CE2-CB 3.79Å; F553-A557 VanDerWaalsContact O-CB 3.3Å; F553-A557 WeakPolarHBondContact O-CB 3.18Å; F553-A557 PolarHBondContact O-N 3.04Å; G554-A557 PolarHBondContact O-N 3.09Å; Y555-A557 VanDerWaalsContact C-N 3.31Å; Y555-A557 PolarHBondContact O-N 3.47Å; A557-S560 WeakPolarHBondContact CA-OG 3.42Å; A557-S560 PolarHBondContact O-OG 2.99Å; A557-S560 VanDerWaalsContact O-OG 3.07Å; A557-T561 VanDerWaalsContact O-CB 3.25Å; A557-T561 WeakPolarHBondContact O-CB 3.09Å; A557-T561 PolarHBondContact O-N 3.36Å; A557-T561 PolarHBondContact O-OG1 3.36Å
558	V	96.6	Very high	95.4	Very high	20 Å²	20	22.5 Å²	22.5	12%	0.121	13%	0.128	C	C	.	.	H	α-helix	trans	-61.9	-48.9	173.5	174.1	0	0	0	0	110.4	V370 T373 G554 Y555 T561 A562	V370-V558 HydrophobicContact CG2-CG1 3.86Å; T373-V558 HydrophobicContact CG2-CG2 3.69Å; T373-V558 WeakPolarHBondContact OG1-CG2 3.2Å; G554-V558 WeakPolarHBondContact O-CG2 3.35Å; G554-V558 PolarHBondContact O-N 2.61Å; G554-V558 VanDerWaalsContact O-N 3.15Å; Y555-V558 PolarHBondContact O-N 2.93Å; V558-T561 PolarHBondContact O-N 2.72Å; V558-A562 WeakPolarHBondContact O-CB 3.38Å; V558-A562 PolarHBondContact O-N 3.12Å
559	F	95.5	Very high	95.8	Very high	75 Å²	75	22.5 Å²	22.5	33%	0.329	13%	0.128	S	C	.	.	H	α-helix	trans	-59.4	-50	179.7	173.7	-100.8	0	0	0	111.8	M465 F469 V529 Y555 M556 T561 A562 L563	M465-F559 HydrophobicContact CE-CE1 3.89Å; M465-F559 HydrophobicContact CE-CZ 4.03Å; M465-F559 HydrophobicContact SD-CE1 3.67Å; M465-F559 HydrophobicContact SD-CZ 3.95Å; F469-F559 HydrophobicContact CE1-CD1 4.42Å; F469-F559 HydrophobicContact CE1-CE1 4.01Å; V529-F559 HydrophobicContact CG1-CD1 4.27Å; V529-F559 HydrophobicContact CG1-CE1 3.95Å; Y555-F559 WeakPolarHBondContact O-CB 3.34Å; Y555-F559 PolarHBondContact O-N 3.5Å; M556-F559 HydrophobicContact CE-CD1 3.86Å; M556-F559 PolarHBondContact O-N 2.87Å; F559-T561 VanDerWaalsContact C-N 3.34Å; F559-T561 PolarHBondContact O-N 3.16Å; F559-A562 PolarHBondContact O-N 3.46Å; F559-L563 WeakPolarHBondContact O-CB 3.48Å; F559-L563 PolarHBondContact O-N 2.81Å
560	S	96.5	Very high	96	Very high	7 Å²	7	21.7 Å²	21.7	5%	0.049	12%	0.122	C	C	.	.	H	α-helix	trans	-62.9	-41.8	178.7	61.5	0	0	0	0	111.4	A526 M556 A557 L563 G564	A526-S560 WeakPolarHBondContact CB-O 3.43Å; M556-S560 WeakPolarHBondContact O-CB 3.33Å; M556-S560 PolarHBondContact O-N 2.7Å; M556-S560 PolarHBondContact O-OG 3.48Å; M556-S560 VanDerWaalsContact O-OG 3.08Å; A557-S560 WeakPolarHBondContact CA-OG 3.42Å; A557-S560 PolarHBondContact O-OG 2.99Å; A557-S560 VanDerWaalsContact O-OG 3.07Å; S560-L563 PolarHBondContact O-N 3.44Å; S560-G564 PolarHBondContact O-N 3.09Å
561	T	96.8	Very high	96.2	Very high	60 Å²	60	20.5 Å²	20.5	37%	0.368	11%	0.114	S	C	.	.	H	α-helix	trans	-65.2	-43.5	179.3	-55.1	0	0	0	0	111.5	M369 A557 V558 F559 L563 G564 I565	M369-T561 HydrophobicContact CE-CG2 4.19Å; M369-T561 HydrophobicContact SD-CG2 3.51Å; M369-T561 VanDerWaalsContact SD-CG2 3.51Å; A557-T561 VanDerWaalsContact O-CB 3.25Å; A557-T561 WeakPolarHBondContact O-CB 3.09Å; A557-T561 PolarHBondContact O-N 3.36Å; A557-T561 PolarHBondContact O-OG1 3.36Å; V558-T561 PolarHBondContact O-N 2.72Å; F559-T561 VanDerWaalsContact C-N 3.34Å; F559-T561 PolarHBondContact O-N 3.16Å; T561-L563 PolarHBondContact O-N 3.02Å; T561-G564 PolarHBondContact O-N 3.29Å; T561-I565 HydrophobicContact CG2-CD1 4.01Å; T561-I565 HydrophobicContact CG2-CG1 4.49Å; T561-I565 VanDerWaalsContact O-CG1 3.29Å; T561-I565 WeakPolarHBondContact O-CG1 3.43Å; T561-I565 PolarHBondContact O-N 3.43Å
562	A	96.9	Very high	96.5	Very high	23 Å²	23	20.3 Å²	20.3	19%	0.19	11%	0.113	C	C	.	.	H	α-helix	trans	-61.2	-44.5	175.5	0	0	0	0	0	111.9	I301 V558 F559 G564 I565 M566	I301-A562 HydrophobicContact CD1-CB 4.18Å; V558-A562 WeakPolarHBondContact O-CB 3.38Å; V558-A562 PolarHBondContact O-N 3.12Å; F559-A562 PolarHBondContact O-N 3.46Å; A562-G564 VanDerWaalsContact C-N 3.34Å; A562-G564 PolarHBondContact O-N 2.9Å; A562-I565 PolarHBondContact O-N 2.85Å; A562-M566 WeakPolarHBondContact O-CB 3.45Å; A562-M566 PolarHBondContact O-N 2.82Å
563	L	96.4	Very high	96.6	Very high	21 Å²	21	24.4 Å²	24.4	11%	0.11	13%	0.133	C	C	.	.	H	α-helix	trans	-60.4	-43.2	174.5	-173.7	75.1	0	0	0	111.5	I461 M465 L491 V529 F559 S560 T561 M566 C567	I461-L563 HydrophobicContact CD1-CD2 4.18Å; M465-L563 HydrophobicContact CE-CD2 4.2Å; L491-L563 HydrophobicContact CD2-CD1 4.22Å; V529-L563 HydrophobicContact CB-CD2 4.41Å; V529-L563 HydrophobicContact CG1-CD2 4.45Å; V529-L563 HydrophobicContact CG2-CD2 3.78Å; F559-L563 WeakPolarHBondContact O-CB 3.48Å; F559-L563 PolarHBondContact O-N 2.81Å; S560-L563 PolarHBondContact O-N 3.44Å; T561-L563 PolarHBondContact O-N 3.02Å; L563-M566 HydrophobicContact CD1-CE 3.66Å; L563-M566 WeakPolarHBondContact O-CB 3.47Å; L563-M566 PolarHBondContact O-N 3.36Å; L563-C567 WeakPolarHBondContact O-CB 3.41Å; L563-C567 PolarHBondContact O-N 2.83Å; L563-C567 PolarHBondContact O-SG 3.43Å; L563-C567 VanDerWaalsContact O-SG 3.35Å
564	G	97.3	Very high	96.6	Very high	4 Å²	4	23.4 Å²	23.4	4%	0.041	13%	0.132	C	C	.	.	H	α-helix	trans	-63.1	-43.1	177.9	0	0	0	0	0	113	A523 S560 T561 A562 M566 G568	A523-G564 WeakPolarHBondContact CA-O 2.91Å; A523-G564 VanDerWaalsContact CB-O 3.26Å; A523-G564 WeakPolarHBondContact CB-O 2.88Å; S560-G564 PolarHBondContact O-N 3.09Å; T561-G564 PolarHBondContact O-N 3.29Å; A562-G564 VanDerWaalsContact C-N 3.34Å; A562-G564 PolarHBondContact O-N 2.9Å; G564-M566 VanDerWaalsContact C-N 3.34Å; G564-G568 PolarHBondContact O-N 3.48Å
565	I	97.9	Very high	96.6	Very high	14 Å²	14	22.5 Å²	22.5	7%	0.072	12%	0.124	C	C	.	.	H	α-helix	trans	-64.7	-41.3	176.6	-66.4	170.6	0	0	0	110.5	L294 G298 I301 I366 M369 T561 A562 A569	L294-I565 HydrophobicContact CD2-CD1 4.02Å; L294-I565 HydrophobicContact CD2-CG1 3.98Å; L294-I565 HydrophobicContact CD2-CG2 4.5Å; L294-I565 WeakPolarHBondContact O-CG2 3.33Å; G298-I565 WeakPolarHBondContact CA-O 3.16Å; I301-I565 HydrophobicContact CD1-CB 4.37Å; I301-I565 HydrophobicContact CD1-CG2 4.23Å; I366-I565 HydrophobicContact CD1-CD1 3.6Å; M369-I565 HydrophobicContact CE-CD1 4.5Å; T561-I565 HydrophobicContact CG2-CD1 4.01Å; T561-I565 HydrophobicContact CG2-CG1 4.49Å; T561-I565 VanDerWaalsContact O-CG1 3.29Å; T561-I565 WeakPolarHBondContact O-CG1 3.43Å; T561-I565 PolarHBondContact O-N 3.43Å; A562-I565 PolarHBondContact O-N 2.85Å; I565-A569 WeakPolarHBondContact O-CB 3.27Å; I565-A569 PolarHBondContact O-N 3.26Å
566	M	97.5	Very high	96.6	Very high	8 Å²	8	19.9 Å²	19.9	4%	0.039	12%	0.116	C	C	.	.	H	α-helix	trans	-61.8	-55.4	175.4	-174.9	-172.7	76.5	0	0	111.9	I301 F302 L488 L491 A562 L563 G564 G568 A569 I570	I301-M566 HydrophobicContact CB-CB 4.34Å; I301-M566 HydrophobicContact CG2-CB 3.89Å; I301-M566 HydrophobicContact CG2-CG 4.2Å; I301-M566 HydrophobicContact CG2-SD 4.16Å; F302-M566 HydrophobicContact CB-CG 3.89Å; F302-M566 HydrophobicContact CB-SD 4.44Å; F302-M566 HydrophobicContact CD2-CG 4.47Å; F302-M566 HydrophobicContact CD2-SD 4.39Å; L488-M566 HydrophobicContact CD1-CE 3.97Å; L488-M566 HydrophobicContact CD1-SD 4.32Å; L491-M566 HydrophobicContact CD2-CE 4Å; A562-M566 WeakPolarHBondContact O-CB 3.45Å; A562-M566 PolarHBondContact O-N 2.82Å; L563-M566 HydrophobicContact CD1-CE 3.66Å; L563-M566 WeakPolarHBondContact O-CB 3.47Å; L563-M566 PolarHBondContact O-N 3.36Å; G564-M566 VanDerWaalsContact C-N 3.34Å; M566-G568 VanDerWaalsContact C-N 3.3Å; M566-G568 PolarHBondContact O-N 2.79Å; M566-A569 PolarHBondContact O-N 3.31Å; M566-I570 HydrophobicContact CG-CD1 3.98Å; M566-I570 WeakPolarHBondContact O-CG1 3.47Å; M566-I570 PolarHBondContact O-N 3.19Å; M566-I570 VanDerWaalsContact O-N 3.08Å
567	C	97.6	Very high	96.5	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-58.7	-43.3	177.9	-69.5	0	0	0	0	111.2	T495 A522 L563 A569 I570 G571	T495-C567 HydrophobicContact CG2-CB 4.16Å; A522-C567 HydrophobicContact CB-CB 4.3Å; A522-C567 WeakPolarHBondContact CB-O 3.43Å; A522-C567 WeakPolarHBondContact O-CB 3.26Å; L563-C567 WeakPolarHBondContact O-CB 3.41Å; L563-C567 PolarHBondContact O-N 2.83Å; L563-C567 PolarHBondContact O-SG 3.43Å; L563-C567 VanDerWaalsContact O-SG 3.35Å; C567-A569 VanDerWaalsContact C-N 3.35Å; C567-A569 PolarHBondContact O-N 3.46Å; C567-I570 PolarHBondContact O-N 3.04Å; C567-G571 PolarHBondContact O-N 2.72Å
568	G	97.8	Very high	96.2	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-58.4	-43.5	178	0	0	0	0	0	112.8	F519 G564 M566 Y572	F519-G568 WeakPolarHBondContact CD2-O 3.18Å; F519-G568 WeakPolarHBondContact O-CA 3.45Å; G564-G568 PolarHBondContact O-N 3.48Å; M566-G568 VanDerWaalsContact C-N 3.3Å; M566-G568 PolarHBondContact O-N 2.79Å; G568-Y572 WeakPolarHBondContact O-CB 3.27Å; G568-Y572 PolarHBondContact O-N 3.46Å
569	A	97.9	Very high	96	Very high	0 Å²	0	21.7 Å²	21.7	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-65.1	-45.9	176.3	0	0	0	0	0	112.2	I295 I565 M566 C567 G571 Y572 M573	I295-A569 HydrophobicContact CD1-CB 4.34Å; I565-A569 WeakPolarHBondContact O-CB 3.27Å; I565-A569 PolarHBondContact O-N 3.26Å; M566-A569 PolarHBondContact O-N 3.31Å; C567-A569 VanDerWaalsContact C-N 3.35Å; C567-A569 PolarHBondContact O-N 3.46Å; A569-G571 PolarHBondContact O-N 3.45Å; A569-Y572 PolarHBondContact O-N 3.35Å; A569-M573 WeakPolarHBondContact O-CB 3.15Å; A569-M573 VanDerWaalsContact O-CG 3.29Å; A569-M573 WeakPolarHBondContact O-CG 3.17Å; A569-M573 PolarHBondContact O-N 3.28Å
570	I	97.7	Very high	95.7	Very high	19 Å²	19	22.3 Å²	22.3	10%	0.097	13%	0.128	C	C	.	.	H	α-helix	trans	-60.2	-47.5	177.6	-66.7	161.3	0	0	0	110.8	F302 C492 V496 M566 C567 M573 G574	F302-I570 HydrophobicContact CD2-CD1 3.73Å; F302-I570 HydrophobicContact CD2-CG1 4.42Å; F302-I570 HydrophobicContact CE2-CD1 4.23Å; F302-I570 HydrophobicContact CG-CD1 4.25Å; C492-I570 HydrophobicContact CB-CG2 4.39Å; V496-I570 HydrophobicContact CG2-CG2 3.7Å; M566-I570 HydrophobicContact CG-CD1 3.98Å; M566-I570 WeakPolarHBondContact O-CG1 3.47Å; M566-I570 PolarHBondContact O-N 3.19Å; M566-I570 VanDerWaalsContact O-N 3.08Å; C567-I570 PolarHBondContact O-N 3.04Å; I570-M573 PolarHBondContact O-N 3.38Å; I570-G574 PolarHBondContact O-N 2.99Å
571	G	96.9	Very high	95.3	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-61.6	-44.5	178.5	0	0	0	0	0	113	T499 C567 A569 T575	T499-G571 WeakPolarHBondContact OG1-CA 3.35Å; T499-G571 PolarHBondContact OG1-O 2.71Å; C567-G571 PolarHBondContact O-N 2.72Å; A569-G571 PolarHBondContact O-N 3.45Å; G571-T575 VanDerWaalsContact O-CB 3.23Å; G571-T575 WeakPolarHBondContact O-CB 3.21Å; G571-T575 PolarHBondContact O-N 2.88Å; G571-T575 PolarHBondContact O-OG1 2.84Å
572	Y	97.2	Very high	94.7	Very high	15 Å²	15	26.3 Å²	26.3	6%	0.059	14%	0.141	C	C	.	.	H	α-helix	trans	-63.4	-42.9	174.4	172.1	-102.4	0	0	0	112.3	F291 I295 L346 W514 Q515 G568 A569 T575 S576	F291-Y572 HydrophobicContact CE1-CD2 4.18Å; F291-Y572 HydrophobicContact CE1-CE1 4.3Å; F291-Y572 AromaticContact CE1-CE2 3.75Å; F291-Y572 HydrophobicContact CE1-CE2 3.75Å; F291-Y572 AromaticContact CE1-CZ 3.81Å; F291-Y572 AromaticContact CZ-CD2 3.58Å; F291-Y572 HydrophobicContact CZ-CD2 3.58Å; F291-Y572 AromaticContact CZ-CE2 3.58Å; F291-Y572 HydrophobicContact CZ-CE2 3.58Å; F291-Y572 HydrophobicContact CZ-CG 4.06Å; I295-Y572 HydrophobicContact CD1-CD1 3.6Å; I295-Y572 HydrophobicContact CD1-CE1 4.48Å; I295-Y572 HydrophobicContact CD1-CG 3.74Å; I295-Y572 HydrophobicContact CG1-CD1 3.96Å; I295-Y572 HydrophobicContact CG1-CE1 4.39Å; I295-Y572 HydrophobicContact CG1-CG 4.45Å; I295-Y572 HydrophobicContact CG2-CD1 4.14Å; L346-Y572 HydrophobicContact CD1-CE1 4.22Å; L346-Y572 VanDerWaalsContact CD1-OH 3.31Å; L346-Y572 WeakPolarHBondContact CD1-OH 3.48Å; L346-Y572 HydrophobicContact CD2-CE1 3.75Å; W514-Y572 HydrophobicContact CH2-CD2 4.38Å; W514-Y572 AromaticContact CH2-CE2 3.74Å; W514-Y572 HydrophobicContact CH2-CE2 3.74Å; W514-Y572 AromaticContact CZ3-CD2 3.89Å; W514-Y572 HydrophobicContact CZ3-CD2 3.89Å; W514-Y572 AromaticContact CZ3-CE2 3.7Å; W514-Y572 HydrophobicContact CZ3-CE2 3.7Å; Q515-Y572 HydrophobicContact CB-CE2 4.15Å; Q515-Y572 HydrophobicContact CG-CE2 4.16Å; G568-Y572 WeakPolarHBondContact O-CB 3.27Å; G568-Y572 PolarHBondContact O-N 3.46Å; A569-Y572 PolarHBondContact O-N 3.35Å; Y572-T575 PolarHBondContact O-N 2.9Å; Y572-S576 WeakPolarHBondContact O-CB 3.35Å; Y572-S576 PolarHBondContact O-N 2.96Å
573	M	96.3	Very high	94.2	Very high	85 Å²	85	25.3 Å²	25.3	42%	0.419	13%	0.132	S	C	.	.	H	α-helix	trans	-62.3	-47.6	178.9	-75.2	-179.2	70.5	0	0	111.8	C299 F342 A569 I570 S576 A577	C299-M573 PolarHBondContact SG-SD 2.61Å; F342-M573 HydrophobicContact CD1-CE 4.5Å; F342-M573 HydrophobicContact CE1-CE 3.86Å; F342-M573 HydrophobicContact CZ-CE 4.44Å; A569-M573 WeakPolarHBondContact O-CB 3.15Å; A569-M573 VanDerWaalsContact O-CG 3.29Å; A569-M573 WeakPolarHBondContact O-CG 3.17Å; A569-M573 PolarHBondContact O-N 3.28Å; I570-M573 PolarHBondContact O-N 3.38Å; M573-S576 PolarHBondContact O-N 2.78Å; M573-A577 PolarHBondContact O-N 3.24Å; M573-A577 VanDerWaalsContact O-N 3.1Å
574	G	95.2	Very high	93.6	Very high	15 Å²	15	28.6 Å²	28.6	16%	0.155	15%	0.153	C	C	.	.	H	α-helix	trans	-61.8	-45.3	176.5	0	0	0	0	0	112.2	I570 A577 F578	I570-G574 PolarHBondContact O-N 2.99Å; G574-A577 PolarHBondContact O-N 3.33Å; G574-F578 PolarHBondContact O-N 2.98Å
575	T	95.2	Very high	92.5	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-65.1	-41.3	177.3	-59.7	0	0	0	0	112.1	T499 T503 W514 G571 Y572 A577 F578 V579	T499-T575 WeakPolarHBondContact CB-OG1 3.24Å; T499-T575 PolarHBondContact OG1-OG1 2.86Å; T503-T575 HydrophobicContact CG2-CG2 3.48Å; T503-T575 VanDerWaalsContact CG2-CG2 3.48Å; T503-T575 WeakPolarHBondContact OG1-CG2 3.36Å; W514-T575 HydrophobicContact CE3-CG2 3.6Å; W514-T575 HydrophobicContact CZ3-CG2 3.72Å; G571-T575 VanDerWaalsContact O-CB 3.23Å; G571-T575 WeakPolarHBondContact O-CB 3.21Å; G571-T575 PolarHBondContact O-N 2.88Å; G571-T575 PolarHBondContact O-OG1 2.84Å; Y572-T575 PolarHBondContact O-N 2.9Å; T575-A577 VanDerWaalsContact C-N 3.31Å; T575-A577 PolarHBondContact O-N 3.14Å; T575-F578 WeakPolarHBondContact O-CB 3.17Å; T575-F578 PolarHBondContact O-N 3.43Å; T575-V579 HydrophobicContact CG2-CG2 4.03Å; T575-V579 WeakPolarHBondContact O-CB 3.02Å; T575-V579 VanDerWaalsContact O-CG2 3.3Å; T575-V579 WeakPolarHBondContact O-CG2 3.43Å; T575-V579 PolarHBondContact O-N 3.33Å
576	S	94.2	Very high	91.3	Very high	17 Å²	17	33 Å²	33	12%	0.119	18%	0.176	C	C	.	.	H	α-helix	trans	-62.5	-39.3	178.4	-174.6	0	0	0	0	111.7	Y572 M573 R580	Y572-S576 WeakPolarHBondContact O-CB 3.35Å; Y572-S576 PolarHBondContact O-N 2.96Å; M573-S576 PolarHBondContact O-N 2.78Å; S576-R580 WeakPolarHBondContact O-CB 3.15Å; S576-R580 VanDerWaalsContact O-CG 3.26Å; S576-R580 WeakPolarHBondContact O-CG 3.14Å; S576-R580 PolarHBondContact O-N 3.41Å
577	A	92.1	Very high	89.5	Confident	62 Å²	62	40.7 Å²	40.7	51%	0.512	21%	0.209	S	C	.	.	H	α-helix	trans	-63.8	-44.9	173.3	0	0	0	0	0	111.6	M573 G574 T575 K581	M573-A577 PolarHBondContact O-N 3.24Å; M573-A577 VanDerWaalsContact O-N 3.1Å; G574-A577 PolarHBondContact O-N 3.33Å; T575-A577 VanDerWaalsContact C-N 3.31Å; T575-A577 PolarHBondContact O-N 3.14Å; A577-K581 WeakPolarHBondContact O-CB 3.38Å; A577-K581 PolarHBondContact O-N 3.07Å
578	F	91.4	Very high	87.6	Confident	30 Å²	30	44.1 Å²	44.1	13%	0.132	23%	0.227	C	C	.	.	H	α-helix	trans	-59.9	-52	175.6	169.2	-102.1	0	0	0	112.3	L244 I500 Y504 G574 T575 R580 K581 I582	L244-F578 HydrophobicContact CD1-CE2 4.31Å; I500-F578 HydrophobicContact CD1-CB 4.14Å; I500-F578 HydrophobicContact CG1-CB 4Å; I500-F578 HydrophobicContact CG1-CG 4.21Å; I500-F578 HydrophobicContact CG2-CD1 4Å; I500-F578 HydrophobicContact CG2-CD2 3.89Å; I500-F578 HydrophobicContact CG2-CE1 4.12Å; I500-F578 HydrophobicContact CG2-CE2 4.01Å; I500-F578 HydrophobicContact CG2-CG 3.88Å; I500-F578 HydrophobicContact CG2-CZ 4.12Å; Y504-F578 HydrophobicContact CD2-CZ 4.23Å; G574-F578 PolarHBondContact O-N 2.98Å; T575-F578 WeakPolarHBondContact O-CB 3.17Å; T575-F578 PolarHBondContact O-N 3.43Å; F578-R580 VanDerWaalsContact C-N 3.34Å; F578-R580 PolarHBondContact O-N 3.41Å; F578-K581 WeakPolarHBondContact O-CB 3.35Å; F578-K581 PolarHBondContact O-N 2.95Å; F578-I582 HydrophobicContact CD1-CD1 4.45Å; F578-I582 HydrophobicContact CD2-CG2 4.08Å; F578-I582 HydrophobicContact CE1-CD1 3.87Å; F578-I582 HydrophobicContact CE1-CG2 4.27Å; F578-I582 HydrophobicContact CE2-CG2 3.6Å; F578-I582 HydrophobicContact CZ-CD1 4.17Å; F578-I582 HydrophobicContact CZ-CG2 3.71Å; F578-I582 PolarHBondContact O-N 3.41Å
579	V	91.7	Very high	85.1	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-58.1	-46.4	179.9	170.4	0	0	0	0	110.6	V281 F282 T503 L507 W514 T575 K581 I582 Y583	V281-V579 HydrophobicContact CG1-CG1 3.3Å; F282-V579 HydrophobicContact CE1-CG1 4.12Å; F282-V579 HydrophobicContact CZ-CG1 4.18Å; T503-V579 HydrophobicContact CG2-CG2 4.12Å; L507-V579 HydrophobicContact CD1-CG2 4.3Å; W514-V579 HydrophobicContact CD2-CG2 4.09Å; W514-V579 HydrophobicContact CE3-CG2 4.21Å; W514-V579 HydrophobicContact CH2-CB 4.47Å; W514-V579 HydrophobicContact CH2-CG2 4.42Å; W514-V579 HydrophobicContact CZ2-CB 4.24Å; W514-V579 HydrophobicContact CZ2-CG1 3.96Å; W514-V579 HydrophobicContact CZ2-CG2 4.3Å; W514-V579 HydrophobicContact CZ3-CG2 4.38Å; T575-V579 HydrophobicContact CG2-CG2 4.03Å; T575-V579 WeakPolarHBondContact O-CB 3.02Å; T575-V579 VanDerWaalsContact O-CG2 3.3Å; T575-V579 WeakPolarHBondContact O-CG2 3.43Å; T575-V579 PolarHBondContact O-N 3.33Å; V579-K581 VanDerWaalsContact C-N 3.3Å; V579-K581 PolarHBondContact O-N 3.02Å; V579-I582 WeakPolarHBondContact O-CG1 3.47Å; V579-I582 PolarHBondContact O-N 2.9Å; V579-Y583 HydrophobicContact CG1-CD2 3.83Å; V579-Y583 HydrophobicContact CG1-CE2 3.95Å; V579-Y583 WeakPolarHBondContact O-CD2 3.41Å; V579-Y583 PolarHBondContact O-N 3Å
580	R	90.3	Very high	84.5	Confident	89 Å²	89	57.3 Å²	57.3	34%	0.336	30%	0.297	S	S	.	.	H	α-helix	trans	-59.4	-43.5	175.2	-71.8	176.1	76.1	-161.8	3	111.5	F282 S576 F578 Y583 T584	F282-R580 HydrophobicContact CE1-CG 3.9Å; F282-R580 HydrophobicContact CZ-CG 4.41Å; S576-R580 WeakPolarHBondContact O-CB 3.15Å; S576-R580 VanDerWaalsContact O-CG 3.26Å; S576-R580 WeakPolarHBondContact O-CG 3.14Å; S576-R580 PolarHBondContact O-N 3.41Å; F578-R580 VanDerWaalsContact C-N 3.34Å; F578-R580 PolarHBondContact O-N 3.41Å; R580-Y583 PolarHBondContact O-N 3.09Å; R580-T584 WeakPolarHBondContact O-CB 3.5Å; R580-T584 PolarHBondContact O-N 3.22Å; R580-T584 PolarHBondContact O-OG1 3.09Å
581	K	87.3	Confident	83.8	Confident	134 Å²	134	59.3 Å²	59.3	58%	0.583	31%	0.307	S	S	*	.	H	α-helix	trans	-65	-42.2	-177.8	-172.1	57.4	169	172.4	0	112.9	A577 F578 V579	A577-K581 WeakPolarHBondContact O-CB 3.38Å; A577-K581 PolarHBondContact O-N 3.07Å; F578-K581 WeakPolarHBondContact O-CB 3.35Å; F578-K581 PolarHBondContact O-N 2.95Å; V579-K581 VanDerWaalsContact C-N 3.3Å; V579-K581 PolarHBondContact O-N 3.02Å
582	I	84.6	Confident	83	Confident	17 Å²	17	62.6 Å²	62.6	9%	0.087	32%	0.324	C	S	.	.	H	α-helix	trans	-67	-41.7	179.3	63.5	176.5	0	0	0	111.4	W274 L507 F578 V579 N585 V586	W274-I582 HydrophobicContact CE3-CD1 3.82Å; W274-I582 HydrophobicContact CE3-CG1 4.39Å; W274-I582 HydrophobicContact CH2-CB 4.08Å; W274-I582 HydrophobicContact CZ3-CB 3.93Å; W274-I582 HydrophobicContact CZ3-CD1 3.88Å; W274-I582 HydrophobicContact CZ3-CG1 3.95Å; L507-I582 HydrophobicContact CD1-CD1 4.21Å; F578-I582 HydrophobicContact CD1-CD1 4.45Å; F578-I582 HydrophobicContact CD2-CG2 4.08Å; F578-I582 HydrophobicContact CE1-CD1 3.87Å; F578-I582 HydrophobicContact CE1-CG2 4.27Å; F578-I582 HydrophobicContact CE2-CG2 3.6Å; F578-I582 HydrophobicContact CZ-CD1 4.17Å; F578-I582 HydrophobicContact CZ-CG2 3.71Å; F578-I582 PolarHBondContact O-N 3.41Å; V579-I582 WeakPolarHBondContact O-CG1 3.47Å; V579-I582 PolarHBondContact O-N 2.9Å; I582-N585 PolarHBondContact O-N 2.92Å; I582-V586 WeakPolarHBondContact O-CG2 3.45Å
583	Y	86.7	Confident	82.2	Confident	2 Å²	2	65.4 Å²	65.4	1%	0.008	34%	0.34	C	S	.	.	H	α-helix	trans	-79.6	-24.4	-177.9	-73.4	-71.3	0	0	0	114.1	W274 V277 H278 V281 F282 V579 R580 N585 V586	W274-Y583 AromaticContact CE3-CE1 3.89Å; W274-Y583 HydrophobicContact CE3-CE1 3.89Å; W274-Y583 HydrophobicContact CE3-CE2 4.42Å; W274-Y583 AromaticContact CE3-CZ 3.75Å; W274-Y583 HydrophobicContact CZ3-CD1 4.24Å; W274-Y583 AromaticContact CZ3-CE1 3.93Å; W274-Y583 HydrophobicContact CZ3-CE1 3.93Å; W274-Y583 PolarHBondContact O-OH 3.08Å; V277-Y583 WeakPolarHBondContact CG2-OH 3.28Å; H278-Y583 HydrophobicContact CB-CD1 3.77Å; H278-Y583 HydrophobicContact CB-CE1 3.71Å; V281-Y583 HydrophobicContact CB-CE2 4.04Å; V281-Y583 HydrophobicContact CG1-CD2 3.93Å; V281-Y583 HydrophobicContact CG1-CE2 3.57Å; V281-Y583 HydrophobicContact CG2-CE1 4.34Å; V281-Y583 HydrophobicContact CG2-CE2 3.69Å; V281-Y583 VanDerWaalsContact CG2-OH 3.28Å; V281-Y583 WeakPolarHBondContact CG2-OH 3.32Å; F282-Y583 HydrophobicContact CE2-CD2 4.22Å; F282-Y583 HydrophobicContact CE2-CG 4.17Å; F282-Y583 HydrophobicContact CZ-CD2 4.14Å; F282-Y583 HydrophobicContact CZ-CG 4.4Å; V579-Y583 HydrophobicContact CG1-CD2 3.83Å; V579-Y583 HydrophobicContact CG1-CE2 3.95Å; V579-Y583 WeakPolarHBondContact O-CD2 3.41Å; V579-Y583 PolarHBondContact O-N 3Å; R580-Y583 PolarHBondContact O-N 3.09Å; Y583-N585 PolarHBondContact O-N 2.94Å; Y583-V586 HydrophobicContact CD1-CG2 4.29Å; Y583-V586 PolarHBondContact O-N 3.4Å
584	T	82.9	Confident	81.3	Confident	89 Å²	89	64.1 Å²	64.1	55%	0.546	34%	0.335	S	S	.	.	H	α-helix	trans	-64	-27	169	-62.4	0	0	0	0	112.4	P427 R580	P427-T584 WeakPolarHBondContact CB-OG1 3.34Å; R580-T584 WeakPolarHBondContact O-CB 3.5Å; R580-T584 PolarHBondContact O-N 3.22Å; R580-T584 PolarHBondContact O-OG1 3.09Å
585	N	74.6	Confident	80.4	Confident	93 Å²	93	67.4 Å²	67.4	50%	0.497	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.2	-8.9	-179.3	-69.8	-10.9	0	0	0	113.4	I582 Y583 K587	I582-N585 PolarHBondContact O-N 2.92Å; Y583-N585 PolarHBondContact O-N 2.94Å; N585-K587 PolarHBondContact O-N 3.14Å
586	V	72	Confident	79.3	Confident	17 Å²	17	72.2 Å²	72.2	10%	0.103	37%	0.372	C	S	.	.			trans	-79	110.8	175.7	-171.5	0	0	0	0	107.5	W274 I582 Y583 I588	W274-V586 HydrophobicContact CH2-CG2 3.82Å; W274-V586 HydrophobicContact CZ3-CG2 3.86Å; I582-V586 WeakPolarHBondContact O-CG2 3.45Å; Y583-V586 HydrophobicContact CD1-CG2 4.29Å; Y583-V586 PolarHBondContact O-N 3.4Å; V586-I588 HydrophobicContact CB-CD1 4.41Å; V586-I588 HydrophobicContact CB-CG1 4.23Å; V586-I588 HydrophobicContact CG1-CD1 3.96Å; V586-I588 HydrophobicContact CG1-CG1 3.52Å; V586-I588 PolarHBondContact O-N 3.23Å
587	K	61.1	Low	78.2	Confident	171 Å²	171	76.5 Å²	76.5	74%	0.743	39%	0.391	S	S	*	.			trans	-70.6	110.7	165.7	-69.4	-175.3	179.5	-178.5	0	107.4	N585	N585-K587 PolarHBondContact O-N 3.14Å
588	I	57.6	Low	77	Confident	71 Å²	71	77.7 Å²	77.7	36%	0.364	38%	0.381	S	S	.	.			trans	-119.3	87.4	171.1	-51.6	167.7	0	0	0	103.2	H278 V586	H278-I588 HydrophobicContact CB-CD1 3.68Å; H278-I588 WeakPolarHBondContact ND1-CD1 3.1Å; V586-I588 HydrophobicContact CB-CD1 4.41Å; V586-I588 HydrophobicContact CB-CG1 4.23Å; V586-I588 HydrophobicContact CG1-CD1 3.96Å; V586-I588 HydrophobicContact CG1-CG1 3.52Å; V586-I588 PolarHBondContact O-N 3.23Å
589	D	44.5	Very low	75.7	Confident	219 Å²	219	82 Å²	82	100%	1.171	40%	0.404	S	S	*	.			trans	-85.7	0	169.1	-73.6	-29.5	0	0	0	108.9

Retrieved 589 of 589 residues in 2928.9 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).