A0A087Y327_POEFO Loading...

Post-glycosylphosphatidylinositol attachment to proteins 6

AlphaFold DB , UniProt , Accession A0A087Y327, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 755 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	40.1	Very low	41.9	Very low	225 Å²	225	133 Å²	133	100%	1.108	66%	0.657	S	S	*	*				0	-28.1	0	-112.4	170.7	-82.2	0	0	112.5
2	E	38.7	Very low	42.2	Very low	170 Å²	170	128.1 Å²	128.1	79%	0.794	64%	0.64	S	S	*	*	H	α-helix	trans	-77.8	-27.6	-175.7	-63	-176.8	155.3	0	0	115.5	C4 F5	E2-C4 PolarHBondContact O-N 3.2Å; E2-F5 PolarHBondContact O-N 2.98Å
3	A	38.3	Very low	41.9	Very low	80 Å²	80	122.4 Å²	122.4	66%	0.661	63%	0.625	S	S	*	*	H	α-helix	trans	-74.4	-21.5	-179.4	0	0	0	0	0	114.7
4	C	42.2	Very low	41.6	Very low	104 Å²	104	123.1 Å²	123.1	70%	0.703	63%	0.63	S	S	*	*	H	α-helix	trans	-76.1	-34.3	175.2	-81	0	0	0	0	111.8	E2 W8	E2-C4 PolarHBondContact O-N 3.2Å; C4-W8 PolarHBondContact O-N 2.81Å; C4-W8 VanDerWaalsContact O-N 3.14Å
5	F	41.2	Very low	41.4	Very low	143 Å²	143	120.5 Å²	120.5	63%	0.627	62%	0.622	S	S	*	*	H	α-helix	trans	-70.2	-40.5	-178	-137.2	-94.1	0	0	0	111.4	E2 W8 L9	E2-F5 PolarHBondContact O-N 2.98Å; F5-W8 PolarHBondContact O-N 3.31Å; F5-L9 HydrophobicContact CD1-CD1 4.06Å; F5-L9 PolarHBondContact O-N 3.14Å
6	L	40.2	Very low	40.7	Very low	117 Å²	117	117 Å²	117	61%	0.613	61%	0.611	S	S	*	*	H	α-helix	trans	-67.3	-36	176.8	-118.7	85.9	0	0	0	113.3	W8 L9 L10	L6-W8 VanDerWaalsContact C-N 3.35Å; L6-L9 PolarHBondContact O-N 3.35Å; L6-L10 PolarHBondContact O-N 3.22Å
7	R	44.9	Very low	40.1	Very low	140 Å²	140	124.6 Å²	124.6	53%	0.528	63%	0.63	S	S	.	*	H	α-helix	trans	-69.7	-33.1	174.7	-82.5	-170.9	178.7	-154.3	3.7	112.4	F11	R7-F11 PolarHBondContact O-N 3.44Å; R7-F11 VanDerWaalsContact O-N 3.09Å
8	W	44.5	Very low	39.8	Very low	170 Å²	170	122.3 Å²	122.3	64%	0.644	63%	0.633	S	S	*	*	H	α-helix	trans	-67.4	-43.2	174.8	-151.3	69	0	0	0	110.8	C4 F5 L6 F11 V12	C4-W8 PolarHBondContact O-N 2.81Å; C4-W8 VanDerWaalsContact O-N 3.14Å; F5-W8 PolarHBondContact O-N 3.31Å; L6-W8 VanDerWaalsContact C-N 3.35Å; W8-F11 PolarHBondContact O-N 2.92Å; W8-V12 VanDerWaalsContact O-CG2 3.27Å; W8-V12 WeakPolarHBondContact O-CG2 3.22Å; W8-V12 PolarHBondContact O-N 2.66Å
9	L	41.5	Very low	39.8	Very low	97 Å²	97	122.6 Å²	122.6	51%	0.508	64%	0.635	S	S	.	*	H	α-helix	trans	-63.7	-40.8	174.5	-85.6	155.4	0	0	0	113.4	F5 L6 V12 A13	F5-L9 HydrophobicContact CD1-CD1 4.06Å; F5-L9 PolarHBondContact O-N 3.14Å; L6-L9 PolarHBondContact O-N 3.35Å; L9-V12 PolarHBondContact O-N 2.91Å; L9-A13 VanDerWaalsContact O-CB 3.27Å; L9-A13 WeakPolarHBondContact O-CB 3.35Å; L9-A13 PolarHBondContact O-N 2.95Å
10	L	44.9	Very low	39.7	Very low	104 Å²	104	118.4 Å²	118.4	55%	0.545	62%	0.624	S	S	.	*	H	α-helix	trans	-68	-33.7	175.8	-103.4	138.2	0	0	0	112.8	L6 L14	L6-L10 PolarHBondContact O-N 3.22Å; L10-L14 HydrophobicContact CD2-CD1 4.3Å; L10-L14 WeakPolarHBondContact O-CB 3.43Å; L10-L14 PolarHBondContact O-N 3.26Å
11	F	44.2	Very low	39.6	Very low	113 Å²	113	119.3 Å²	119.3	50%	0.496	63%	0.629	S	S	.	*	H	α-helix	trans	-68.5	-39.6	173.2	-120.9	-90.2	0	0	0	111.8	R7 W8 T15 L65	R7-F11 PolarHBondContact O-N 3.44Å; R7-F11 VanDerWaalsContact O-N 3.09Å; W8-F11 PolarHBondContact O-N 2.92Å; F11-T15 VanDerWaalsContact O-CG2 3.28Å; F11-T15 WeakPolarHBondContact O-CG2 3.4Å; F11-T15 PolarHBondContact O-N 2.68Å; F11-T15 VanDerWaalsContact O-N 3.17Å; F11-T15 PolarHBondContact O-OG1 3.28Å; F11-T15 VanDerWaalsContact O-OG1 3.13Å; F11-L65 HydrophobicContact CE2-CD2 4.1Å; F11-L65 HydrophobicContact CZ-CD2 3.92Å
12	V	46.3	Very low	40	Very low	74 Å²	74	109.8 Å²	109.8	45%	0.448	58%	0.582	S	S	.	*	H	α-helix	trans	-72.3	-32.1	177.2	174.8	0	0	0	0	112.2	W8 L9 T15 S16	W8-V12 VanDerWaalsContact O-CG2 3.27Å; W8-V12 WeakPolarHBondContact O-CG2 3.22Å; W8-V12 PolarHBondContact O-N 2.66Å; L9-V12 PolarHBondContact O-N 2.91Å; V12-T15 WeakPolarHBondContact CA-OG1 3.45Å; V12-T15 PolarHBondContact O-OG1 2.7Å; V12-S16 PolarHBondContact O-N 3.22Å; V12-S16 PolarHBondContact O-OG 2.88Å
13	A	38	Very low	40.6	Very low	54 Å²	54	105.1 Å²	105.1	45%	0.446	58%	0.58	S	S	.	*	H	α-helix	trans	-76.1	-32.5	177	0	0	0	0	0	113	L9 S16	L9-A13 VanDerWaalsContact O-CB 3.27Å; L9-A13 WeakPolarHBondContact O-CB 3.35Å; L9-A13 PolarHBondContact O-N 2.95Å; A13-S16 WeakPolarHBondContact CA-OG 3.28Å; A13-S16 PolarHBondContact O-OG 3.02Å
14	L	37.3	Very low	41.6	Very low	133 Å²	133	105.6 Å²	105.6	70%	0.696	57%	0.569	S	S	*	*	H	α-helix	trans	-79.9	-22.4	174.8	-80.9	157.9	0	0	0	113	L10	L10-L14 HydrophobicContact CD2-CD1 4.3Å; L10-L14 WeakPolarHBondContact O-CB 3.43Å; L10-L14 PolarHBondContact O-N 3.26Å
15	T	38.5	Very low	43	Very low	83 Å²	83	102 Å²	102	51%	0.509	54%	0.543	S	S	.	.	H	α-helix	trans	-78.5	-21.2	172.4	51.8	0	0	0	0	113.1	F11 V12 L19	F11-T15 VanDerWaalsContact O-CG2 3.28Å; F11-T15 WeakPolarHBondContact O-CG2 3.4Å; F11-T15 PolarHBondContact O-N 2.68Å; F11-T15 VanDerWaalsContact O-N 3.17Å; F11-T15 PolarHBondContact O-OG1 3.28Å; F11-T15 VanDerWaalsContact O-OG1 3.13Å; V12-T15 WeakPolarHBondContact CA-OG1 3.45Å; V12-T15 PolarHBondContact O-OG1 2.7Å; T15-L19 WeakPolarHBondContact O-CD1 3.37Å
16	S	30.7	Very low	45	Very low	65 Å²	65	99 Å²	99	46%	0.455	54%	0.536	S	S	.	.	G	3₁₀ helix	trans	-80.8	-15	-176.2	30.5	0	0	0	0	114.8	V12 A13	V12-S16 PolarHBondContact O-N 3.22Å; V12-S16 PolarHBondContact O-OG 2.88Å; A13-S16 WeakPolarHBondContact CA-OG 3.28Å; A13-S16 PolarHBondContact O-OG 3.02Å
17	W	30.3	Very low	47.2	Very low	246 Å²	246	95.4 Å²	95.4	93%	0.932	52%	0.516	S	S	*	.	G	3₁₀ helix	trans	-97.2	12.7	-176.4	-82.7	53	0	0	0	115
18	A	34.6	Very low	49.3	Very low	83 Å²	83	93.8 Å²	93.8	69%	0.686	52%	0.515	S	S	*	.	G	3₁₀ helix	trans	-140.3	32.5	171.9	0	0	0	0	0	112.9	G20	A18-G20 PolarHBondContact O-N 2.87Å
19	L	40.7	Very low	51.5	Low	128 Å²	128	90.3 Å²	90.3	67%	0.67	52%	0.516	S	S	*	.			trans	-84.8	86.9	170	-81.6	104.3	0	0	0	110.1	T15 D21	T15-L19 WeakPolarHBondContact O-CD1 3.37Å; L19-D21 PolarHBondContact O-N 2.85Å
20	G	36.5	Very low	53.9	Low	39 Å²	39	89.5 Å²	89.5	40%	0.402	51%	0.51	S	S	.	.			trans	-69.6	114.5	148.8	0	0	0	0	0	108.3	A18 D22	A18-G20 PolarHBondContact O-N 2.87Å; G20-D22 PolarHBondContact O-N 2.83Å
21	D	38.5	Very low	56.2	Low	138 Å²	138	89.7 Å²	89.7	74%	0.738	51%	0.511	S	S	*	.			trans	-73.4	105.3	167	-168.4	22.8	0	0	0	107.8	L19 G23 R188	L19-D21 PolarHBondContact O-N 2.85Å; D21-G23 PolarHBondContact O-N 2.74Å; D21-R188 PolarHBondContact O-NH1 3.14Å; D21-R188 PolarHBondContact O-NH2 2.87Å
22	D	48.4	Very low	58.5	Low	24 Å²	24	86.4 Å²	86.4	13%	0.128	50%	0.502	C	S	.	.			trans	-81.1	91.5	175.6	-71.6	-10.5	0	0	0	107.3	G20 Q24 V25 F27 R188	G20-D22 PolarHBondContact O-N 2.83Å; D22-Q24 PolarHBondContact O-N 2.86Å; D22-V25 PolarHBondContact O-N 3.36Å; D22-F27 HydrophobicContact CB-CE2 3.98Å; D22-R188 VanDerWaalsContact OD1-CD 3.22Å; D22-R188 WeakPolarHBondContact OD1-CD 3Å; D22-R188 WeakPolarHBondContact OD1-CG 3.32Å; D22-R188 IonicContact OD1-CZ 3.81Å; D22-R188 IonicContact OD1-NE 3.14Å; D22-R188 PolarHBondContact OD1-NE 3.01Å; D22-R188 VanDerWaalsContact OD1-NE 3.14Å
23	G	50.3	Low	60.7	Low	72 Å²	72	85.6 Å²	85.6	74%	0.742	50%	0.5	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61	25.8	-171.6	0	0	0	0	0	118.3	D21	D21-G23 PolarHBondContact O-N 2.74Å
24	Q	60.6	Low	63.3	Low	91 Å²	91	85.5 Å²	85.5	43%	0.425	49%	0.489	S	S	.	.	T	Hydrogen-bonded Turn	trans	-126.3	-20.4	175.7	-162.9	167.9	13.6	0	0	113.9	D22 T183	D22-Q24 PolarHBondContact O-N 2.86Å; Q24-T183 VanDerWaalsContact CD-OG1 3.27Å; Q24-T183 PolarHBondContact NE2-OG1 3.25Å; Q24-T183 PolarHBondContact OE1-O 3.44Å; Q24-T183 PolarHBondContact OE1-OG1 3.5Å
25	V	70.8	Confident	65.9	Low	27 Å²	27	82.6 Å²	82.6	16%	0.164	48%	0.478	C	S	.	.	S	Bend	trans	-143.7	127.8	-178.8	-170.3	0	0	0	0	111.3	D22 F27 A168	D22-V25 PolarHBondContact O-N 3.36Å; V25-F27 WeakPolarHBondContact O-CD2 3.3Å; V25-A168 HydrophobicContact CG1-CB 3.69Å
26	T	82.7	Confident	68.4	Low	80 Å²	80	81.1 Å²	81.1	49%	0.491	47%	0.474	S	S	.	.			trans	-72	132.5	177.5	-42.4	0	0	0	0	111	A169 D170	T26-A169 PolarHBondContact O-N 2.98Å; T26-D170 VanDerWaalsContact CB-OD2 3.3Å; T26-D170 WeakPolarHBondContact CB-OD2 3.27Å; T26-D170 PolarHBondContact OG1-OD2 3.07Å
27	F	86.5	Confident	71.4	Confident	43 Å²	43	80 Å²	80	19%	0.189	46%	0.462	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	132.8	178.3	-73.7	-76.2	0	0	0	112.6	D22 V25 A60 R166 R167 A168	D22-F27 HydrophobicContact CB-CE2 3.98Å; V25-F27 WeakPolarHBondContact O-CD2 3.3Å; F27-A60 HydrophobicContact CE1-CB 3.7Å; F27-R166 HydrophobicContact CB-CG 4.09Å; F27-R166 HydrophobicContact CD1-CG 3.72Å; F27-R166 HydrophobicContact CE1-CG 4.49Å; F27-R166 HydrophobicContact CG-CG 4.14Å; F27-R166 VanDerWaalsContact CG-NE 3.28Å; F27-R167 CarbonylContact C-O 3.21Å; F27-R167 VanDerWaalsContact CA-O 3.3Å; F27-R167 WeakPolarHBondContact CA-O 3.46Å; F27-R167 WeakPolarHBondContact CD1-O 2.63Å; F27-A168 HydrophobicContact CD1-CB 4.43Å; F27-A168 HydrophobicContact CE1-CB 4.09Å
28	E	89.1	Confident	74.3	Confident	106 Å²	106	73.2 Å²	73.2	50%	0.495	44%	0.439	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	144.1	171.1	-64.8	-175	159.5	0	0	109.7	R166 R167 A169	E28-R166 CarbonylContact O-C 3.55Å; E28-R166 WeakPolarHBondContact O-CA 3.5Å; E28-R167 PolarHBondContact N-O 2.84Å; E28-R167 PolarHBondContact O-N 3.42Å; E28-A169 HydrophobicContact CG-CB 4.49Å
29	S	90.8	Very high	77	Confident	96 Å²	96	69.6 Å²	69.6	67%	0.671	41%	0.408	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-112.9	128.4	177.8	-63.4	0	0	0	0	110.4	V165	S29-V165 CarbonylContact C-O 3.58Å; S29-V165 VanDerWaalsContact CA-O 3.31Å; S29-V165 WeakPolarHBondContact CA-O 3.42Å
30	E	91.6	Very high	79.3	Confident	81 Å²	81	65 Å²	65	38%	0.379	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	138.1	174.8	-64.7	177.6	-155.1	0	0	109.4	P56 S164 V165	E30-P56 WeakPolarHBondContact OE2-CG 3.38Å; E30-S164 WeakPolarHBondContact O-CA 3.44Å; E30-V165 HydrophobicContact CB-CB 4.31Å; E30-V165 PolarHBondContact N-O 2.78Å; E30-V165 PolarHBondContact O-N 3.48Å
31	L	93.6	Very high	81.8	Confident	107 Å²	107	65.3 Å²	65.3	56%	0.56	38%	0.377	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-121.4	127.5	177.6	-172.4	72.5	0	0	0	109.8
32	S	92.4	Very high	84.2	Confident	45 Å²	45	59.5 Å²	59.5	32%	0.315	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	133.8	176.6	-168.4	0	0	0	0	110.2	Q162 L163	S32-Q162 CarbonylContact O-C 3.54Å; S32-Q162 WeakPolarHBondContact O-CA 3.41Å; S32-L163 PolarHBondContact N-O 3.06Å; S32-L163 PolarHBondContact O-N 2.98Å
33	S	92.9	Very high	86	Confident	57 Å²	57	61 Å²	61	40%	0.399	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	138.1	174.7	-175.7	0	0	0	0	109.5	Q160 Q162	S33-Q160 PolarHBondContact OG-NE2 3.33Å; S33-Q162 PolarHBondContact OG-NE2 2.82Å
34	K	92.8	Very high	87.8	Confident	51 Å²	51	61 Å²	61	22%	0.222	34%	0.344	C	S	.	.	P	Polyproline II helix	trans	-97.1	152.9	166.5	-59	-60.2	-178.8	178.8	0	109.3	Q51 R52 F53 Q160 P161	K34-Q51 HydrophobicContact CG-CB 4.45Å; K34-Q51 VanDerWaalsContact CG-OE1 3.26Å; K34-R52 WeakPolarHBondContact CE-O 3.47Å; K34-R52 PolarHBondContact NZ-O 2.83Å; K34-F53 HydrophobicContact CB-CZ 4.43Å; K34-F53 HydrophobicContact CG-CE1 3.88Å; K34-F53 HydrophobicContact CG-CE2 4.11Å; K34-F53 HydrophobicContact CG-CZ 3.51Å; K34-Q160 WeakPolarHBondContact O-CG 3.02Å; K34-P161 HydrophobicContact CB-CG 4.25Å; K34-P161 PolarHBondContact N-O 3.21Å
35	P	91.4	Very high	89.2	Confident	72 Å²	72	57.1 Å²	57.1	47%	0.468	33%	0.325	S	S	.	.	P	Polyproline II helix	trans	-70.7	154.8	178.8	31.5	-36.2	0	0	0	110.5	Q37 Y491	P35-Q37 PolarHBondContact O-N 2.87Å; P35-Y491 WeakPolarHBondContact CD-OH 3.31Å; P35-Y491 HydrophobicContact CG-CE1 4.38Å; P35-Y491 WeakPolarHBondContact CG-OH 3.16Å
36	A	92.1	Very high	90.1	Very high	52 Å²	52	56.7 Å²	56.7	43%	0.43	33%	0.325	S	S	.	.	P	Polyproline II helix	trans	-66.5	126.1	177.7	0	0	0	0	0	110.6	F159 Q160	A36-F159 CarbonylContact C-O 3.55Å; A36-F159 WeakPolarHBondContact CA-O 3.03Å; A36-Q160 HydrophobicContact CB-CB 3.99Å; A36-Q160 HydrophobicContact CB-CG 4.4Å
37	Q	92.3	Very high	90.4	Very high	43 Å²	43	53.5 Å²	53.5	20%	0.201	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	140.1	179.5	-69.4	-175	-30.8	0	0	111.1	P35 L39 R49 Y158 F159 Y491	P35-Q37 PolarHBondContact O-N 2.87Å; Q37-L39 PolarHBondContact O-N 2.86Å; Q37-R49 HydrophobicContact CB-CG 4.23Å; Q37-Y158 CarbonylContact O-C 3.56Å; Q37-Y158 WeakPolarHBondContact O-CA 3.35Å; Q37-F159 PolarHBondContact N-O 3.37Å; Q37-F159 PolarHBondContact O-N 3.4Å; Q37-Y491 PolarHBondContact NE2-OH 2.99Å; Q37-Y491 VanDerWaalsContact NE2-OH 3.08Å
38	K	91.5	Very high	90.7	Very high	103 Å²	103	51.6 Å²	51.6	45%	0.448	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	122.3	174.3	-174.7	-178.2	176	-176.4	0	109.8	R49 Y157 Y158	K38-R49 PolarHBondContact O-NE 3.13Å; K38-R49 PolarHBondContact O-NH2 3.3Å; K38-R49 VanDerWaalsContact O-NH2 3.07Å; K38-Y157 CarbonylContact C-O 3.49Å; K38-Y157 WeakPolarHBondContact CA-O 2.98Å; K38-Y158 HydrophobicContact CB-CD1 4.18Å; K38-Y158 HydrophobicContact CB-CE1 3.87Å
39	L	91.3	Very high	91	Very high	6 Å²	6	49.7 Å²	49.7	3%	0.031	29%	0.286	C	S	.	.			trans	-73.9	150.2	173.4	-64.4	178.3	0	0	0	111.1	Q37 R49 V81 A138 L140 Y157 F159	Q37-L39 PolarHBondContact O-N 2.86Å; L39-R49 HydrophobicContact CD2-CB 4.24Å; L39-R49 HydrophobicContact CD2-CG 3.95Å; L39-V81 HydrophobicContact CD1-CB 4.33Å; L39-V81 HydrophobicContact CD1-CG1 3.68Å; L39-V81 HydrophobicContact CD1-CG2 3.6Å; L39-A138 HydrophobicContact CD2-CB 3.92Å; L39-L140 HydrophobicContact CB-CD1 3.93Å; L39-L140 HydrophobicContact CB-CG 3.93Å; L39-L140 HydrophobicContact CD1-CG 4.34Å; L39-Y157 PolarHBondContact N-O 2.84Å; L39-F159 HydrophobicContact CD1-CB 4Å; L39-F159 HydrophobicContact CD2-CB 3.64Å; L39-F159 HydrophobicContact CD2-CG 4.36Å; L39-F159 HydrophobicContact CG-CB 3.8Å
40	S	89.2	Confident	91.2	Very high	33 Å²	33	45.2 Å²	45.2	23%	0.231	26%	0.255	C	S	.	.			trans	-118	153.1	172	23.4	0	0	0	0	109.8	S47 R49 L140	S40-S47 PolarHBondContact OG-O 3.41Å; S40-R49 PolarHBondContact OG-NH1 2.9Å; S40-R49 PolarHBondContact OG-NH2 3.43Å; S40-L140 WeakPolarHBondContact O-CB 3.41Å; S40-L140 PolarHBondContact O-N 3.31Å
41	K	88.6	Confident	91.3	Very high	45 Å²	45	41.4 Å²	41.4	20%	0.196	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.3	147	166.2	-61.2	-175.6	-165.2	171	0	109.5	G43 S47 L140 P141 D143 D144	K41-G43 PolarHBondContact O-N 3.24Å; K41-S47 VanDerWaalsContact O-CB 3.3Å; K41-S47 WeakPolarHBondContact O-CB 3.31Å; K41-L140 HydrophobicContact CG-CB 4.38Å; K41-P141 CarbonylContact C-O 3.55Å; K41-P141 VanDerWaalsContact CA-O 3.31Å; K41-P141 WeakPolarHBondContact CA-O 3.27Å; K41-P141 WeakPolarHBondContact CB-O 3.37Å; K41-D143 HydrophobicContact CB-CB 3.96Å; K41-D143 HydrophobicContact CD-CB 4.24Å; K41-D143 WeakPolarHBondContact CD-OD1 2.96Å; K41-D143 IonicContact NZ-OD1 3.02Å; K41-D143 PolarHBondContact NZ-OD1 2.95Å; K41-D144 WeakPolarHBondContact CD-OD1 3.46Å; K41-D144 VanDerWaalsContact CE-OD1 3.27Å; K41-D144 WeakPolarHBondContact CE-OD1 3.37Å; K41-D144 IonicContact NZ-OD1 3.58Å; K41-D144 PolarHBondContact NZ-OD1 3.18Å; K41-D144 IonicContact NZ-OD2 2.74Å; K41-D144 PolarHBondContact NZ-OD2 3.01Å
42	Y	89.4	Confident	91.3	Very high	15 Å²	15	39.7 Å²	39.7	6%	0.059	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	111.7	-175.1	-174.1	-89	0	0	0	110.6	V48 I93 P95 T96 H139 L140 P141 E142 D143	Y42-V48 HydrophobicContact CD2-CG2 3.9Å; Y42-V48 HydrophobicContact CE2-CG2 3.71Å; Y42-I93 HydrophobicContact CE2-CD1 3.85Å; Y42-I93 HydrophobicContact CE2-CG1 4.33Å; Y42-P95 HydrophobicContact CD1-CG 3.43Å; Y42-P95 VanDerWaalsContact CD1-CG 3.43Å; Y42-P95 HydrophobicContact CD2-CG 3.87Å; Y42-P95 HydrophobicContact CE1-CG 3.29Å; Y42-P95 HydrophobicContact CE2-CG 3.75Å; Y42-P95 HydrophobicContact CG-CG 3.71Å; Y42-P95 VanDerWaalsContact CZ-CG 3.44Å; Y42-T96 HydrophobicContact CD1-CG2 4.02Å; Y42-T96 HydrophobicContact CE1-CG2 4.2Å; Y42-H139 HydrophobicContact CD2-CB 4.3Å; Y42-H139 AromaticContact CD2-CG 3.93Å; Y42-H139 AromaticContact CD2-ND1 3.9Å; Y42-L140 WeakPolarHBondContact CB-O 3.38Å; Y42-L140 PolarHBondContact N-O 3.25Å; Y42-P141 PolarHBondContact N-O 2.95Å; Y42-E142 WeakPolarHBondContact O-CA 3.33Å; Y42-D143 PolarHBondContact O-N 3.19Å
43	G	85.7	Confident	91.4	Very high	56 Å²	56	37.6 Å²	37.6	58%	0.577	21%	0.208	S	C	*	.	S	Bend	trans	-112	-32.9	166.5	0	0	0	0	0	113.2	K41 S47	K41-G43 PolarHBondContact O-N 3.24Å; G43-S47 PolarHBondContact N-OG 2.87Å
44	W	87.9	Confident	91.4	Very high	71 Å²	71	40.3 Å²	40.3	27%	0.269	21%	0.214	S	C	.	.	S	Bend	trans	-161.9	173.6	-179.6	66.1	-65.5	0	0	0	109.1	A46 S47 R486 L488 A497 V499	W44-A46 VanDerWaalsContact C-N 3.28Å; W44-A46 HydrophobicContact CD2-CB 3.73Å; W44-A46 VanDerWaalsContact CE2-CB 3.44Å; W44-A46 HydrophobicContact CE3-CB 3.73Å; W44-A46 HydrophobicContact CH2-CB 3.24Å; W44-A46 HydrophobicContact CZ2-CB 3.23Å; W44-A46 HydrophobicContact CZ3-CB 3.48Å; W44-A46 VanDerWaalsContact CZ3-CB 3.48Å; W44-A46 PolarHBondContact O-N 2.02Å; W44-A46 VanDerWaalsContact O-N 3.12Å; W44-S47 PolarHBondContact N-OG 2.8Å; W44-S47 WeakPolarHBondContact O-CB 3.3Å; W44-S47 PolarHBondContact O-N 2.84Å; W44-S47 PolarHBondContact O-OG 2.93Å; W44-S47 VanDerWaalsContact O-OG 3.04Å; W44-R486 HydrophobicContact CH2-CB 4.41Å; W44-R486 HydrophobicContact CZ3-CB 4.44Å; W44-L488 HydrophobicContact CH2-CD2 3.95Å; W44-L488 HydrophobicContact CZ3-CD1 4.17Å; W44-L488 HydrophobicContact CZ3-CD2 4.34Å; W44-A497 HydrophobicContact CE3-CB 4.28Å; W44-A497 HydrophobicContact CZ3-CB 4.3Å; W44-V499 HydrophobicContact CD2-CG2 3.89Å; W44-V499 HydrophobicContact CE3-CG2 3.49Å; W44-V499 VanDerWaalsContact CE3-CG2 3.49Å; W44-V499 HydrophobicContact CH2-CG2 3.22Å; W44-V499 HydrophobicContact CZ2-CG2 3.64Å; W44-V499 HydrophobicContact CZ3-CB 4.48Å; W44-V499 HydrophobicContact CZ3-CG2 3.15Å
45	Y	91.5	Very high	91.5	Very high	10 Å²	10	37.9 Å²	37.9	4%	0.039	20%	0.203	C	C	.	.	G	3₁₀ helix	trans	-60.2	-29.5	-170.2	-162.3	-96	0	0	0	114.5	S47 V48 P90 P91 I93 F439 Y495 A497 W507	Y45-S47 PolarHBondContact O-N 3.33Å; Y45-V48 WeakPolarHBondContact O-CB 3.44Å; Y45-V48 VanDerWaalsContact O-CG2 3.29Å; Y45-V48 WeakPolarHBondContact O-CG2 3.33Å; Y45-V48 PolarHBondContact O-N 2.88Å; Y45-V48 VanDerWaalsContact O-N 3.13Å; Y45-P90 WeakPolarHBondContact OH-CB 3.41Å; Y45-P91 WeakPolarHBondContact CE2-O 3.41Å; Y45-P91 PolarHBondContact OH-O 2.78Å; Y45-I93 HydrophobicContact CD2-CG1 4.16Å; Y45-I93 HydrophobicContact CE2-CD1 4.46Å; Y45-I93 HydrophobicContact CE2-CG1 4.01Å; Y45-F439 HydrophobicContact CD1-CE2 4.27Å; Y45-F439 HydrophobicContact CD1-CZ 4.19Å; Y45-F439 AromaticContact CE1-CE2 3.59Å; Y45-F439 HydrophobicContact CE1-CE2 3.59Å; Y45-F439 AromaticContact CE1-CZ 3.76Å; Y45-F439 HydrophobicContact CE1-CZ 3.76Å; Y45-F439 AromaticContact CE2-CE2 3.86Å; Y45-F439 HydrophobicContact CE2-CE2 3.86Å; Y45-F439 AromaticContact CZ-CE2 3.36Å; Y45-F439 WeakPolarHBondContact OH-CE2 3.48Å; Y45-Y495 AromaticContact CD1-CD2 3.98Å; Y45-Y495 HydrophobicContact CD1-CD2 3.98Å; Y45-Y495 AromaticContact CD1-CE2 3.7Å; Y45-Y495 HydrophobicContact CD1-CE2 3.7Å; Y45-Y495 AromaticContact CE1-CD2 3.8Å; Y45-Y495 HydrophobicContact CE1-CD2 3.8Å; Y45-Y495 AromaticContact CE1-CE2 3.68Å; Y45-Y495 HydrophobicContact CE1-CE2 3.68Å; Y45-A497 HydrophobicContact CD1-CB 4.27Å; Y45-A497 HydrophobicContact CG-CB 4.35Å; Y45-W507 HydrophobicContact CD2-CZ2 4.16Å; Y45-W507 HydrophobicContact CE2-CZ2 4.19Å
46	A	88.6	Confident	91.5	Very high	18 Å²	18	35.1 Å²	35.1	15%	0.149	19%	0.185	C	C	.	.	G	3₁₀ helix	trans	-70.5	-14.1	175.3	0	0	0	0	0	114.5	W44 V48 R49 L488	W44-A46 VanDerWaalsContact C-N 3.28Å; W44-A46 HydrophobicContact CD2-CB 3.73Å; W44-A46 VanDerWaalsContact CE2-CB 3.44Å; W44-A46 HydrophobicContact CE3-CB 3.73Å; W44-A46 HydrophobicContact CH2-CB 3.24Å; W44-A46 HydrophobicContact CZ2-CB 3.23Å; W44-A46 HydrophobicContact CZ3-CB 3.48Å; W44-A46 VanDerWaalsContact CZ3-CB 3.48Å; W44-A46 PolarHBondContact O-N 2.02Å; W44-A46 VanDerWaalsContact O-N 3.12Å; A46-V48 PolarHBondContact O-N 2.9Å; A46-R49 PolarHBondContact O-NH1 3.37Å; A46-L488 HydrophobicContact CB-CD1 3.49Å; A46-L488 VanDerWaalsContact CB-CD1 3.49Å; A46-L488 HydrophobicContact CB-CD2 3.67Å; A46-L488 HydrophobicContact CB-CG 4.24Å
47	S	90.1	Very high	91.4	Very high	14 Å²	14	37.1 Å²	37.1	10%	0.098	19%	0.186	C	C	.	.	G	3₁₀ helix	trans	-67.3	-19.1	173.2	-52.9	0	0	0	0	111.5	S40 K41 G43 W44 Y45	S40-S47 PolarHBondContact OG-O 3.41Å; K41-S47 VanDerWaalsContact O-CB 3.3Å; K41-S47 WeakPolarHBondContact O-CB 3.31Å; G43-S47 PolarHBondContact N-OG 2.87Å; W44-S47 PolarHBondContact N-OG 2.8Å; W44-S47 WeakPolarHBondContact O-CB 3.3Å; W44-S47 PolarHBondContact O-N 2.84Å; W44-S47 PolarHBondContact O-OG 2.93Å; W44-S47 VanDerWaalsContact O-OG 3.04Å; Y45-S47 PolarHBondContact O-N 3.33Å
48	V	92.7	Very high	91.2	Very high	2 Å²	2	36.2 Å²	36.2	1%	0.012	18%	0.182	C	C	.	.	S	Bend	trans	-77.7	137.6	178.2	-176.3	0	0	0	0	110.3	Y42 Y45 A46 L50 I93 A137 H139	Y42-V48 HydrophobicContact CD2-CG2 3.9Å; Y42-V48 HydrophobicContact CE2-CG2 3.71Å; Y45-V48 WeakPolarHBondContact O-CB 3.44Å; Y45-V48 VanDerWaalsContact O-CG2 3.29Å; Y45-V48 WeakPolarHBondContact O-CG2 3.33Å; Y45-V48 PolarHBondContact O-N 2.88Å; Y45-V48 VanDerWaalsContact O-N 3.13Å; A46-V48 PolarHBondContact O-N 2.9Å; V48-L50 PolarHBondContact O-N 3.22Å; V48-I93 HydrophobicContact CG2-CD1 3.66Å; V48-A137 HydrophobicContact CG1-CB 3.37Å; V48-H139 HydrophobicContact CG2-CB 4.31Å
49	R	94.3	Very high	91.2	Very high	66 Å²	66	31.3 Å²	31.3	25%	0.249	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	95.8	167.5	-63.7	-59.6	172.7	-100.6	-10.6	109.3	Q37 K38 L39 S40 A46 A137 A138	Q37-R49 HydrophobicContact CB-CG 4.23Å; K38-R49 PolarHBondContact O-NE 3.13Å; K38-R49 PolarHBondContact O-NH2 3.3Å; K38-R49 VanDerWaalsContact O-NH2 3.07Å; L39-R49 HydrophobicContact CD2-CB 4.24Å; L39-R49 HydrophobicContact CD2-CG 3.95Å; S40-R49 PolarHBondContact OG-NH1 2.9Å; S40-R49 PolarHBondContact OG-NH2 3.43Å; A46-R49 PolarHBondContact O-NH1 3.37Å; R49-A137 WeakPolarHBondContact O-CA 3.28Å; R49-A138 PolarHBondContact N-O 2.76Å; R49-A138 PolarHBondContact O-N 2.77Å
50	L	95	Very high	91.1	Very high	3 Å²	3	31 Å²	31	2%	0.016	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	132.1	176.7	-175.3	68.5	0	0	0	110.6	V48 P90 F135 V136 A137 S490 Y493 Y495	V48-L50 PolarHBondContact O-N 3.22Å; L50-P90 HydrophobicContact CD1-CB 4.08Å; L50-P90 HydrophobicContact CD2-CB 4.08Å; L50-P90 HydrophobicContact CD2-CG 4.03Å; L50-F135 HydrophobicContact CD1-CB 4.11Å; L50-F135 HydrophobicContact CD1-CD1 4.1Å; L50-F135 HydrophobicContact CD2-CD1 4.32Å; L50-F135 HydrophobicContact CG-CD1 4.3Å; L50-V136 CarbonylContact C-O 3.47Å; L50-V136 WeakPolarHBondContact CA-O 3.44Å; L50-A137 HydrophobicContact CD1-CB 4.29Å; L50-S490 WeakPolarHBondContact O-CB 3.3Å; L50-S490 PolarHBondContact O-OG 3.39Å; L50-Y493 HydrophobicContact CD2-CD1 4.15Å; L50-Y493 HydrophobicContact CD2-CE1 4.18Å; L50-Y495 HydrophobicContact CD2-CD1 3.94Å; L50-Y495 HydrophobicContact CD2-CD2 4.46Å; L50-Y495 HydrophobicContact CD2-CE1 3.91Å; L50-Y495 HydrophobicContact CD2-CE2 4.42Å; L50-Y495 HydrophobicContact CD2-CG 4.22Å
51	Q	94.3	Very high	91.3	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	135.8	179.7	-56.4	-167.6	10.3	0	0	111	K34 F53 F135 V136	K34-Q51 HydrophobicContact CG-CB 4.45Å; K34-Q51 VanDerWaalsContact CG-OE1 3.26Å; Q51-F53 HydrophobicContact CB-CE2 4.38Å; Q51-F135 WeakPolarHBondContact O-CA 3.27Å; Q51-V136 PolarHBondContact N-O 2.91Å; Q51-V136 PolarHBondContact O-N 2.74Å
52	R	93.9	Very high	91.5	Very high	71 Å²	71	28.7 Å²	28.7	27%	0.268	15%	0.147	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	127.9	-177.1	-171.3	178.5	69.7	87.4	2.6	111.3	K34 D133 W134 F135	K34-R52 WeakPolarHBondContact CE-O 3.47Å; K34-R52 PolarHBondContact NZ-O 2.83Å; R52-D133 WeakPolarHBondContact CD-OD2 3.22Å; R52-D133 HydrophobicContact CG-CB 4.24Å; R52-D133 IonicContact CZ-OD2 2.72Å; R52-D133 IonicContact NE-OD2 3.23Å; R52-D133 IonicContact NH1-OD1 3.74Å; R52-D133 PolarHBondContact NH1-OD1 3.28Å; R52-D133 IonicContact NH1-OD2 3.89Å; R52-D133 PolarHBondContact NH1-OD2 3.04Å; R52-W134 WeakPolarHBondContact CA-O 3.43Å; R52-F135 HydrophobicContact CB-CD1 4.18Å; R52-F135 HydrophobicContact CB-CE1 3.99Å; R52-F135 HydrophobicContact CG-CD1 4.26Å; R52-F135 HydrophobicContact CG-CE1 3.79Å; R52-F135 HydrophobicContact CG-CZ 3.94Å
53	F	94.1	Very high	91.8	Very high	1 Å²	1	33.8 Å²	33.8	0%	0.004	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	141	171.7	-69.2	-89.2	0	0	0	109.3	K34 Q51 D133 W134 V136 P161 L163	K34-F53 HydrophobicContact CB-CZ 4.43Å; K34-F53 HydrophobicContact CG-CE1 3.88Å; K34-F53 HydrophobicContact CG-CE2 4.11Å; K34-F53 HydrophobicContact CG-CZ 3.51Å; Q51-F53 HydrophobicContact CB-CE2 4.38Å; F53-D133 CarbonylContact O-C 3.6Å; F53-D133 WeakPolarHBondContact O-CA 3.47Å; F53-W134 PolarHBondContact N-O 3.21Å; F53-W134 PolarHBondContact O-N 3.46Å; F53-V136 HydrophobicContact CD2-CG2 3.87Å; F53-V136 HydrophobicContact CE2-CG2 3.91Å; F53-P161 HydrophobicContact CE2-CB 4.11Å; F53-P161 HydrophobicContact CE2-CG 4Å; F53-P161 HydrophobicContact CZ-CB 3.93Å; F53-P161 HydrophobicContact CZ-CG 3.86Å; F53-L163 HydrophobicContact CB-CD2 3.77Å; F53-L163 HydrophobicContact CD1-CB 3.61Å; F53-L163 HydrophobicContact CD1-CD2 3.76Å; F53-L163 HydrophobicContact CD1-CG 4.33Å; F53-L163 HydrophobicContact CE1-CB 3.73Å; F53-L163 HydrophobicContact CG-CB 4.38Å; F53-L163 HydrophobicContact CG-CD2 4.03Å
54	H	93.6	Very high	92.3	Very high	114 Å²	114	31.2 Å²	31.2	53%	0.528	14%	0.139	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	127.1	174.3	-175.3	73.5	0	0	0	108.4	D133	H54-D133 IonicContact CG-OD1 3.3Å; H54-D133 IonicContact ND1-OD1 3Å; H54-D133 PolarHBondContact ND1-OD1 2.94Å
55	I	93.4	Very high	92.7	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	115.8	173.5	-63.6	-166.3	0	0	0	108.2	T59 A62 W64 P129 G132 W134 L163	I55-T59 HydrophobicContact CG2-CG2 3.98Å; I55-T59 VanDerWaalsContact CG2-OG1 3.32Å; I55-T59 WeakPolarHBondContact CG2-OG1 3.37Å; I55-A62 HydrophobicContact CD1-CB 4Å; I55-W64 HydrophobicContact CD1-CH2 3.7Å; I55-W64 HydrophobicContact CD1-CZ2 3.79Å; I55-P129 HydrophobicContact CD1-CB 3.94Å; I55-P129 HydrophobicContact CD1-CG 4.18Å; I55-P129 HydrophobicContact CG2-CB 4.49Å; I55-P129 HydrophobicContact CG2-CG 4.02Å; I55-G132 PolarHBondContact N-O 3.12Å; I55-G132 PolarHBondContact O-N 3.09Å; I55-W134 HydrophobicContact CD1-CD2 4.1Å; I55-W134 HydrophobicContact CD1-CG 3.86Å; I55-W134 VanDerWaalsContact CD1-NE1 3.3Å; I55-W134 VanDerWaalsContact CG1-CD1 3.49Å; I55-W134 HydrophobicContact CG1-CG 4.18Å; I55-L163 HydrophobicContact CG1-CD2 4.43Å
56	P	92.4	Very high	92.9	Very high	14 Å²	14	28.8 Å²	28.8	9%	0.091	13%	0.132	C	C	.	.			trans	-59.2	154.7	175.3	-21.9	31.8	0	0	0	112.4	E30 T59	E30-P56 WeakPolarHBondContact OE2-CG 3.38Å; P56-T59 PolarHBondContact O-N 3.42Å; P56-T59 PolarHBondContact O-OG1 3.01Å
57	E	89.7	Confident	93.2	Very high	95 Å²	95	28.5 Å²	28.5	44%	0.444	13%	0.129	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.5	153	166.1	-64.8	-171.2	175.9	0	0	111.5	T59 P131 R167	E57-T59 PolarHBondContact O-N 3.03Å; E57-P131 HydrophobicContact CG-CB 4.16Å; E57-R167 PolarHBondContact O-NE 2.87Å
58	Q	88.3	Confident	93.3	Very high	23 Å²	23	27.8 Å²	27.8	11%	0.107	12%	0.124	C	C	.	.	T	Hydrogen-bonded Turn	trans	62.8	18.9	178.1	-55.2	157.4	44	0	0	114.4	A60 R167 A168 T171 K193 R260	Q58-A60 PolarHBondContact O-N 3.48Å; Q58-R167 HydrophobicContact CB-CG 4.44Å; Q58-A168 WeakPolarHBondContact CB-O 3.49Å; Q58-A168 PolarHBondContact O-N 2.92Å; Q58-A168 PolarHBondContact OE1-O 2.94Å; Q58-T171 PolarHBondContact OE1-OG1 3.02Å; Q58-K193 HydrophobicContact CG-CD 4.44Å; Q58-R260 VanDerWaalsContact N-NH2 3.15Å
59	T	91.1	Very high	93.1	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.8	119.6	168.2	-64.8	0	0	0	0	111.1	I55 P56 E57 A62 P129 V165 R260	I55-T59 HydrophobicContact CG2-CG2 3.98Å; I55-T59 VanDerWaalsContact CG2-OG1 3.32Å; I55-T59 WeakPolarHBondContact CG2-OG1 3.37Å; P56-T59 PolarHBondContact O-N 3.42Å; P56-T59 PolarHBondContact O-OG1 3.01Å; E57-T59 PolarHBondContact O-N 3.03Å; T59-A62 HydrophobicContact CG2-CB 4.48Å; T59-P129 HydrophobicContact CG2-CG 3.41Å; T59-P129 VanDerWaalsContact CG2-CG 3.41Å; T59-P129 WeakPolarHBondContact O-CD 3.22Å; T59-V165 HydrophobicContact CG2-CG1 3.59Å; T59-V165 WeakPolarHBondContact OG1-CG1 2.77Å; T59-R260 PolarHBondContact O-NH1 2.82Å; T59-R260 PolarHBondContact O-NH2 3.06Å
60	A	89.9	Confident	92.7	Very high	1 Å²	1	30.8 Å²	30.8	1%	0.008	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	-38.4	175.4	0	0	0	0	0	112.4	F27 Q58 D128 R166	F27-A60 HydrophobicContact CE1-CB 3.7Å; Q58-A60 PolarHBondContact O-N 3.48Å; A60-D128 PolarHBondContact O-N 2.85Å; A60-R166 PolarHBondContact N-O 2.87Å
61	V	92.1	Very high	91.9	Very high	29 Å²	29	32.7 Å²	32.7	18%	0.176	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143	132.7	179.3	-176	0	0	0	0	110.3	R63 R166	V61-R63 HydrophobicContact CG1-CG 3.91Å; V61-R166 HydrophobicContact CB-CB 4.46Å; V61-R166 PolarHBondContact N-O 3.04Å; V61-R166 PolarHBondContact O-N 2.84Å
62	A	94.6	Very high	90.7	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	131.1	167.6	0	0	0	0	0	110.1	I55 T59 W64 N125 L126 P129 L163	I55-A62 HydrophobicContact CD1-CB 4Å; T59-A62 HydrophobicContact CG2-CB 4.48Å; A62-W64 HydrophobicContact CB-CE3 4.3Å; A62-W64 HydrophobicContact CB-CH2 3.77Å; A62-W64 HydrophobicContact CB-CZ2 4.49Å; A62-W64 HydrophobicContact CB-CZ3 3.64Å; A62-N125 WeakPolarHBondContact O-CA 3.2Å; A62-L126 PolarHBondContact N-O 2.69Å; A62-L126 PolarHBondContact O-N 2.79Å; A62-P129 HydrophobicContact CB-CB 4.36Å; A62-P129 HydrophobicContact CB-CG 3.87Å; A62-L163 HydrophobicContact CB-CD1 4.03Å
63	R	95.8	Very high	89	Confident	121 Å²	121	39.6 Å²	39.6	46%	0.457	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	114.4	178.3	-58.2	-165	177.2	109.5	-4.2	109.9	V61 N125 L163 S164	V61-R63 HydrophobicContact CG1-CG 3.91Å; R63-N125 WeakPolarHBondContact CB-OD1 3.47Å; R63-N125 WeakPolarHBondContact CD-OD1 3.47Å; R63-N125 HydrophobicContact CG-CB 4.42Å; R63-N125 WeakPolarHBondContact CG-OD1 3.49Å; R63-L163 WeakPolarHBondContact O-CA 3.32Å; R63-S164 PolarHBondContact N-O 3.09Å; R63-S164 PolarHBondContact O-N 3.07Å
64	W	95.8	Very high	87.2	Confident	2 Å²	2	46.8 Å²	46.8	1%	0.008	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	134.9	172	-69.4	-94	0	0	0	110.5	I55 A62 F66 L85 T123 F124 L126 W134 Q162 L163	I55-W64 HydrophobicContact CD1-CH2 3.7Å; I55-W64 HydrophobicContact CD1-CZ2 3.79Å; A62-W64 HydrophobicContact CB-CE3 4.3Å; A62-W64 HydrophobicContact CB-CH2 3.77Å; A62-W64 HydrophobicContact CB-CZ2 4.49Å; A62-W64 HydrophobicContact CB-CZ3 3.64Å; W64-F66 HydrophobicContact CB-CE1 3.89Å; W64-F66 HydrophobicContact CB-CE2 3.91Å; W64-F66 HydrophobicContact CB-CZ 3.44Å; W64-F66 VanDerWaalsContact CB-CZ 3.44Å; W64-F66 HydrophobicContact CG-CE1 4.27Å; W64-F66 AromaticContact CG-CZ 3.85Å; W64-F66 HydrophobicContact CG-CZ 3.85Å; W64-L85 HydrophobicContact CD2-CD2 4.24Å; W64-T123 CarbonylContact O-C 3.56Å; W64-T123 WeakPolarHBondContact O-CA 3.42Å; W64-F124 HydrophobicContact CB-CB 4.43Å; W64-F124 HydrophobicContact CD2-CD1 4.21Å; W64-F124 AromaticContact CE3-CD1 3.44Å; W64-F124 HydrophobicContact CE3-CD1 3.44Å; W64-F124 VanDerWaalsContact CE3-CD1 3.44Å; W64-F124 AromaticContact CE3-CE1 3.84Å; W64-F124 HydrophobicContact CE3-CE1 3.84Å; W64-F124 AromaticContact CZ3-CD1 3.82Å; W64-F124 HydrophobicContact CZ3-CD1 3.82Å; W64-F124 AromaticContact CZ3-CE1 3.7Å; W64-F124 HydrophobicContact CZ3-CE1 3.7Å; W64-F124 PolarHBondContact N-O 2.8Å; W64-F124 PolarHBondContact O-N 3.35Å; W64-L126 HydrophobicContact CH2-CD2 4.48Å; W64-L126 HydrophobicContact CZ3-CB 3.92Å; W64-L126 HydrophobicContact CZ3-CD2 4.42Å; W64-W134 HydrophobicContact CH2-CD2 4.09Å; W64-W134 AromaticContact CH2-CE3 3.94Å; W64-W134 HydrophobicContact CH2-CE3 3.94Å; W64-W134 HydrophobicContact CH2-CZ3 4.21Å; W64-W134 HydrophobicContact CZ2-CB 4.29Å; W64-W134 HydrophobicContact CZ2-CD2 4.05Å; W64-W134 HydrophobicContact CZ2-CE3 4Å; W64-W134 HydrophobicContact CZ2-CG 4.19Å; W64-Q162 CarbonylContact C-O 3.56Å; W64-Q162 VanDerWaalsContact CA-O 3.27Å; W64-Q162 WeakPolarHBondContact CA-O 3.41Å; W64-L163 HydrophobicContact CD2-CD1 3.88Å; W64-L163 HydrophobicContact CE3-CD1 4.41Å; W64-L163 HydrophobicContact CG-CD1 4.17Å; W64-L163 HydrophobicContact CZ2-CD1 4.14Å
65	L	96.1	Very high	85.7	Confident	30 Å²	30	48.5 Å²	48.5	16%	0.157	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	115.8	167.3	175.1	66.1	0	0	0	108.4	F11 T123 P161 Q162	F11-L65 HydrophobicContact CE2-CD2 4.1Å; F11-L65 HydrophobicContact CZ-CD2 3.92Å; L65-T123 HydrophobicContact CD1-CG2 3.63Å; L65-P161 WeakPolarHBondContact O-CA 3.37Å; L65-Q162 HydrophobicContact CB-CB 4.44Å; L65-Q162 PolarHBondContact N-O 3.02Å; L65-Q162 PolarHBondContact O-N 3.32Å
66	F	95.6	Very high	84.4	Confident	0 Å²	0	49.4 Å²	49.4	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	118.9	176.1	-60	-50.4	0	0	0	109.2	W64 I83 L85 L112 S121 T122 F124 V136 F159 P161	W64-F66 HydrophobicContact CB-CE1 3.89Å; W64-F66 HydrophobicContact CB-CE2 3.91Å; W64-F66 HydrophobicContact CB-CZ 3.44Å; W64-F66 VanDerWaalsContact CB-CZ 3.44Å; W64-F66 HydrophobicContact CG-CE1 4.27Å; W64-F66 AromaticContact CG-CZ 3.85Å; W64-F66 HydrophobicContact CG-CZ 3.85Å; F66-I83 HydrophobicContact CB-CD1 3.78Å; F66-I83 HydrophobicContact CD1-CG2 4.43Å; F66-I83 HydrophobicContact CD2-CD1 4.18Å; F66-I83 HydrophobicContact CD2-CG2 4.38Å; F66-I83 HydrophobicContact CE1-CG2 4.42Å; F66-I83 HydrophobicContact CE2-CG2 4.35Å; F66-I83 HydrophobicContact CG-CD1 3.95Å; F66-I83 HydrophobicContact CG-CG2 4.44Å; F66-I83 HydrophobicContact CZ-CG2 4.39Å; F66-L85 HydrophobicContact CE2-CD1 3.9Å; F66-L85 HydrophobicContact CZ-CD1 3.61Å; F66-L85 HydrophobicContact CZ-CD2 3.95Å; F66-L85 HydrophobicContact CZ-CG 4.28Å; F66-L112 HydrophobicContact CD2-CD1 4.17Å; F66-L112 HydrophobicContact CE2-CD1 3.88Å; F66-S121 CarbonylContact O-C 3.58Å; F66-S121 WeakPolarHBondContact O-CA 3.21Å; F66-S121 WeakPolarHBondContact O-CB 3.23Å; F66-T122 HydrophobicContact CB-CG2 3.94Å; F66-T122 HydrophobicContact CD2-CG2 4.05Å; F66-T122 PolarHBondContact N-O 2.84Å; F66-T122 PolarHBondContact O-N 2.91Å; F66-F124 HydrophobicContact CE2-CB 4Å; F66-V136 HydrophobicContact CE1-CG1 3.79Å; F66-V136 HydrophobicContact CE1-CG2 4.34Å; F66-V136 HydrophobicContact CZ-CG1 4.3Å; F66-F159 HydrophobicContact CB-CE2 4.02Å; F66-F159 AromaticContact CD1-CE2 3.98Å; F66-F159 HydrophobicContact CD1-CE2 3.98Å; F66-F159 AromaticContact CD1-CZ 3.75Å; F66-F159 HydrophobicContact CD1-CZ 3.75Å; F66-F159 HydrophobicContact CE1-CZ 4.39Å; F66-F159 HydrophobicContact CG-CE2 4.3Å; F66-F159 HydrophobicContact CG-CZ 4.46Å; F66-P161 HydrophobicContact CD1-CB 3.72Å; F66-P161 HydrophobicContact CE1-CB 3.88Å
67	S	93.7	Very high	83.2	Confident	12 Å²	12	50.9 Å²	50.9	8%	0.084	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	131.7	177.6	-65.8	0	0	0	0	110.7	Q160	S67-Q160 PolarHBondContact N-O 3.39Å; S67-Q160 PolarHBondContact O-N 3.17Å
68	V	92.4	Very high	82.3	Confident	0 Å²	0	53.8 Å²	53.8	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	129.3	170.5	-178.6	0	0	0	0	109.5	V81 L114 V116 Q119 S120 Y158 F159	V68-V81 HydrophobicContact CG1-CG2 4.27Å; V68-V81 HydrophobicContact CG2-CB 4.38Å; V68-V81 HydrophobicContact CG2-CG1 4.22Å; V68-V81 HydrophobicContact CG2-CG2 4.31Å; V68-L114 HydrophobicContact CB-CD2 4.14Å; V68-L114 HydrophobicContact CG2-CD2 3.72Å; V68-V116 HydrophobicContact CB-CG2 4.09Å; V68-V116 HydrophobicContact CG1-CB 4.48Å; V68-V116 HydrophobicContact CG1-CG1 3.89Å; V68-V116 HydrophobicContact CG1-CG2 3.68Å; V68-Q119 WeakPolarHBondContact O-CA 3.32Å; V68-S120 PolarHBondContact N-O 2.81Å; V68-S120 PolarHBondContact O-N 2.76Å; V68-Y158 CarbonylContact C-O 3.58Å; V68-Y158 VanDerWaalsContact CA-O 3.32Å; V68-Y158 WeakPolarHBondContact CA-O 3.2Å; V68-F159 HydrophobicContact CG2-CD2 3.83Å
69	K	89.6	Confident	82	Confident	82 Å²	82	55.6 Å²	55.6	36%	0.357	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	133.9	176.5	-69.9	179.1	-179.5	175.5	0	110.4	Q119 Y158	K69-Q119 HydrophobicContact CG-CG 4.03Å; K69-Y158 PolarHBondContact N-O 2.86Å; K69-Y158 PolarHBondContact O-N 2.84Å
70	K	86.3	Confident	81.9	Confident	49 Å²	49	59.3 Å²	59.3	21%	0.213	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	128	170.3	-172.4	175	178.1	175.1	0	109.2	H72 C76 T117 S118 Y157	K70-H72 VanDerWaalsContact CE-O 3.23Å; K70-H72 WeakPolarHBondContact CE-O 3.27Å; K70-H72 WeakPolarHBondContact CG-O 3.45Å; K70-C76 VanDerWaalsContact CE-SG 3.5Å; K70-C76 PolarHBondContact NZ-O 2.93Å; K70-T117 WeakPolarHBondContact CD-O 3.42Å; K70-S118 WeakPolarHBondContact CB-O 3.49Å; K70-S118 PolarHBondContact N-O 3.25Å; K70-Y157 HydrophobicContact CG-CE1 4.24Å
71	G	76.8	Confident	82	Confident	42 Å²	42	59.3 Å²	59.3	43%	0.433	32%	0.315	S	S	.	.	S	Bend	trans	-78.5	-58.7	-177.7	0	0	0	0	0	112.9	S156	G71-S156 WeakPolarHBondContact CA-OG 3.07Å; G71-S156 PolarHBondContact N-O 2.76Å
72	H	69.1	Low	82.1	Confident	115 Å²	115	59.2 Å²	59.2	53%	0.532	32%	0.316	S	S	.	.			trans	-108.1	137.2	176.5	-86.6	-70.2	0	0	0	111.9	K70	K70-H72 VanDerWaalsContact CE-O 3.23Å; K70-H72 WeakPolarHBondContact CE-O 3.27Å; K70-H72 WeakPolarHBondContact CG-O 3.45Å
73	S	59.5	Low	82.1	Confident	102 Å²	102	59.2 Å²	59.2	71%	0.713	32%	0.316	S	S	*	.			trans	-89.9	-9.7	-173.4	51.1	0	0	0	0	115	N75	S73-N75 PolarHBondContact O-N 3.29Å
74	F	56.6	Low	82.1	Confident	151 Å²	151	54.2 Å²	54.2	66%	0.662	30%	0.298	S	S	*	.	S	Bend	trans	-77.7	109.5	-172.5	-128.5	-94.9	0	0	0	111.6	C76	F74-C76 PolarHBondContact O-N 3.18Å
75	N	60.9	Low	82	Confident	151 Å²	151	54.2 Å²	54.2	81%	0.807	30%	0.298	S	S	*	.	S	Bend	trans	52.8	32.1	168	-70.4	-6.2	0	0	0	118.6	S73	S73-N75 PolarHBondContact O-N 3.29Å
76	C	66.6	Low	81.8	Confident	18 Å²	18	53.6 Å²	53.6	12%	0.122	29%	0.294	C	S	.	.	P	Polyproline II helix	trans	-84	130.2	167.7	-42.6	0	0	0	0	111.3	K70 F74 C155 Y157	K70-C76 VanDerWaalsContact CE-SG 3.5Å; K70-C76 PolarHBondContact NZ-O 2.93Å; F74-C76 PolarHBondContact O-N 3.18Å; C76-C155 WeakPolarHBondContact CA-SG 3.28Å; C76-C155 HydrophobicContact CB-CB 3.63Å; C76-C155 WeakPolarHBondContact CB-SG 3.36Å; C76-C155 WeakPolarHBondContact SG-CA 3.24Å; C76-C155 WeakPolarHBondContact SG-CB 3.02Å; C76-C155 CovalentContact SG-SG 2Å; C76-C155 PolarHBondContact SG-SG 3.2Å; C76-Y157 WeakPolarHBondContact CB-OH 3.42Å
77	G	66.3	Low	81.6	Confident	46 Å²	46	54.5 Å²	54.5	47%	0.474	30%	0.297	S	S	.	.	P	Polyproline II helix	trans	-60	170.7	167.9	0	0	0	0	0	112.4	H79 Y157	G77-H79 PolarHBondContact O-CD2 3.44Å; G77-H79 VanDerWaalsContact O-CD2 3.31Å; G77-Y157 PolarHBondContact O-OH 2.79Å
78	Q	71.3	Confident	81.4	Confident	155 Å²	155	54.5 Å²	54.5	72%	0.724	30%	0.3	S	S	*	.	P	Polyproline II helix	trans	-76.5	125.3	170.8	-70.8	-178.3	-10.9	0	0	108.8
79	H	81.3	Confident	81.3	Confident	61 Å²	61	54.5 Å²	54.5	28%	0.282	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	144.2	173.3	-65.8	-94.8	0	0	0	109.8	G77 V116 L140 Y157	G77-H79 PolarHBondContact O-CD2 3.44Å; G77-H79 VanDerWaalsContact O-CD2 3.31Å; H79-V116 WeakPolarHBondContact O-CB 3.35Å; H79-V116 PolarHBondContact O-N 2.8Å; H79-L140 HydrophobicContact CB-CD2 4.13Å; H79-Y157 AromaticContact CD2-CZ 3.84Å; H79-Y157 PolarHBondContact CD2-OH 2.89Å
80	N	88.8	Confident	81.5	Confident	79 Å²	79	50.6 Å²	50.6	42%	0.422	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	124	174.6	-69.6	-12.4	0	0	0	108.9	I113 P115 P141	N80-I113 HydrophobicContact CB-CG2 3.74Å; N80-P115 WeakPolarHBondContact OD1-CA 3.44Å; N80-P141 WeakPolarHBondContact O-CD 3.45Å
81	V	92.1	Very high	81.9	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	125.1	173.2	172.5	0	0	0	0	108.4	L39 V68 I83 L114 V116 A138 L140	L39-V81 HydrophobicContact CD1-CB 4.33Å; L39-V81 HydrophobicContact CD1-CG1 3.68Å; L39-V81 HydrophobicContact CD1-CG2 3.6Å; V68-V81 HydrophobicContact CG1-CG2 4.27Å; V68-V81 HydrophobicContact CG2-CB 4.38Å; V68-V81 HydrophobicContact CG2-CG1 4.22Å; V68-V81 HydrophobicContact CG2-CG2 4.31Å; V81-I83 HydrophobicContact CG1-CG1 4.12Å; V81-L114 PolarHBondContact N-O 3.39Å; V81-L114 PolarHBondContact O-N 3.3Å; V81-V116 HydrophobicContact CB-CG2 4.23Å; V81-V116 HydrophobicContact CG2-CG2 3.54Å; V81-A138 HydrophobicContact CG1-CB 4.5Å; V81-L140 HydrophobicContact CG2-CD2 3.82Å
82	S	94.5	Very high	82.6	Confident	28 Å²	28	46.6 Å²	46.6	20%	0.196	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	129.9	175.1	-61.6	0	0	0	0	109.5	A138 H139	S82-A138 WeakPolarHBondContact O-CA 3.49Å; S82-H139 PolarHBondContact N-O 2.84Å; S82-H139 VanDerWaalsContact N-O 3.15Å; S82-H139 PolarHBondContact O-N 2.9Å; S82-H139 VanDerWaalsContact O-N 3.12Å
83	I	95.4	Very high	83.7	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	127.4	-178.6	-53.8	167	0	0	0	107.9	F66 V81 L85 S111 L112 L114 V136 A137 A138 F159	F66-I83 HydrophobicContact CB-CD1 3.78Å; F66-I83 HydrophobicContact CD1-CG2 4.43Å; F66-I83 HydrophobicContact CD2-CD1 4.18Å; F66-I83 HydrophobicContact CD2-CG2 4.38Å; F66-I83 HydrophobicContact CE1-CG2 4.42Å; F66-I83 HydrophobicContact CE2-CG2 4.35Å; F66-I83 HydrophobicContact CG-CD1 3.95Å; F66-I83 HydrophobicContact CG-CG2 4.44Å; F66-I83 HydrophobicContact CZ-CG2 4.39Å; V81-I83 HydrophobicContact CG1-CG1 4.12Å; I83-L85 HydrophobicContact CG2-CD1 3.83Å; I83-S111 CarbonylContact O-C 3.59Å; I83-S111 WeakPolarHBondContact O-CA 3.39Å; I83-L112 HydrophobicContact CB-CB 4.37Å; I83-L112 PolarHBondContact N-O 2.71Å; I83-L112 PolarHBondContact O-N 2.78Å; I83-L114 HydrophobicContact CD1-CB 4.37Å; I83-V136 HydrophobicContact CG2-CG1 3.82Å; I83-A137 CarbonylContact C-O 3.57Å; I83-A137 VanDerWaalsContact CA-O 3.32Å; I83-A137 WeakPolarHBondContact CA-O 3.42Å; I83-A138 HydrophobicContact CG1-CB 4.39Å; I83-F159 HydrophobicContact CD1-CE2 3.81Å; I83-F159 HydrophobicContact CD1-CZ 4.49Å; I83-F159 HydrophobicContact CG1-CE2 4.09Å; I83-F159 HydrophobicContact CG1-CZ 4.49Å; I83-F159 HydrophobicContact CG2-CZ 4.25Å
84	H	95.1	Very high	85.1	Confident	16 Å²	16	38.7 Å²	38.7	7%	0.074	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	133.5	-177.2	-52.9	-86.9	0	0	0	110.8	P91 I93 L110 S111 V136 A137 H139	H84-P91 HydrophobicContact CB-CB 3.99Å; H84-P91 HydrophobicContact CB-CG 4.01Å; H84-I93 HydrophobicContact CB-CG2 3.98Å; H84-L110 CarbonylContact C-O 3.54Å; H84-L110 VanDerWaalsContact CA-O 3.25Å; H84-L110 WeakPolarHBondContact CA-O 3.37Å; H84-S111 PolarHBondContact CE1-OG 2.89Å; H84-S111 PolarHBondContact ND1-OG 2.86Å; H84-V136 CarbonylContact O-C 3.57Å; H84-V136 WeakPolarHBondContact O-CA 3.43Å; H84-A137 HydrophobicContact CB-CB 4.22Å; H84-A137 PolarHBondContact N-O 2.91Å; H84-A137 PolarHBondContact O-N 3.44Å; H84-H139 AromaticContact CD2-CD2 3.93Å; H84-H139 AromaticContact CD2-NE2 3.83Å; H84-H139 AromaticContact NE2-CD2 3.7Å; H84-H139 AromaticContact NE2-NE2 3.12Å; H84-H139 PolarHBondContact NE2-NE2 3.3Å; H84-H139 VanDerWaalsContact NE2-NE2 3.12Å
85	L	93.9	Very high	86.6	Confident	2 Å²	2	34.2 Å²	34.2	1%	0.01	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	134.4	-179.7	-83.4	84.1	0	0	0	111.4	W64 F66 I83 S109 L110 F124 F135 V136 L232	W64-L85 HydrophobicContact CD2-CD2 4.24Å; F66-L85 HydrophobicContact CE2-CD1 3.9Å; F66-L85 HydrophobicContact CZ-CD1 3.61Å; F66-L85 HydrophobicContact CZ-CD2 3.95Å; F66-L85 HydrophobicContact CZ-CG 4.28Å; I83-L85 HydrophobicContact CG2-CD1 3.83Å; L85-S109 WeakPolarHBondContact O-CB 2.99Å; L85-L110 HydrophobicContact CB-CB 4.3Å; L85-L110 PolarHBondContact N-O 3.49Å; L85-L110 PolarHBondContact O-N 3.18Å; L85-F124 HydrophobicContact CD2-CD1 3.87Å; L85-F124 HydrophobicContact CD2-CE1 4.21Å; L85-F135 WeakPolarHBondContact CA-O 3.3Å; L85-V136 HydrophobicContact CD1-CG1 4.22Å; L85-V136 HydrophobicContact CD2-CG2 4.4Å; L85-V136 HydrophobicContact CG-CG2 4.11Å; L85-L232 HydrophobicContact CB-CD1 4.42Å
86	R	92.8	Very high	87.7	Confident	17 Å²	17	29 Å²	29	6%	0.064	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	142.2	174.1	-171.7	176.9	179.2	-144	-0.3	111.3	P90 P91 F135 F439	R86-P90 WeakPolarHBondContact CD-O 3.26Å; R86-P90 PolarHBondContact NH1-O 2.8Å; R86-P91 HydrophobicContact CB-CB 4.02Å; R86-F135 PolarHBondContact N-O 3.14Å; R86-F135 VanDerWaalsContact N-O 3.07Å; R86-F135 PolarHBondContact O-N 2.87Å; R86-F439 PolarHBondContact NH1-O 2.87Å; R86-F439 PolarHBondContact NH2-O 2.82Å
87	W	91.4	Very high	88.7	Confident	18 Å²	18	36.6 Å²	36.6	7%	0.068	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	143.1	174.6	169	68.2	0	0	0	111.5	A89 A130 P131 W134 H234 W402 F419	W87-A89 PolarHBondContact O-N 3.37Å; W87-A89 VanDerWaalsContact O-N 3.12Å; W87-A130 HydrophobicContact CD2-CB 3.87Å; W87-A130 HydrophobicContact CG-CB 4.07Å; W87-A130 HydrophobicContact CZ2-CB 3.98Å; W87-P131 PolarHBondContact NE1-O 2.92Å; W87-W134 HydrophobicContact CB-CD2 3.97Å; W87-W134 HydrophobicContact CB-CE3 4.2Å; W87-W134 HydrophobicContact CB-CH2 4.04Å; W87-W134 HydrophobicContact CB-CZ2 3.8Å; W87-W134 HydrophobicContact CB-CZ3 4.24Å; W87-W134 AromaticContact CD1-CD1 3.72Å; W87-W134 AromaticContact CD1-CE2 3.64Å; W87-W134 AromaticContact CD1-NE1 3.25Å; W87-W134 AromaticContact CG-CE2 3.98Å; W87-W134 HydrophobicContact CG-CZ2 4.12Å; W87-H234 AromaticContact CE3-CE1 3.76Å; W87-H234 AromaticContact CE3-ND1 3.86Å; W87-H234 AromaticContact CZ3-CE1 3.59Å; W87-H234 AromaticContact CZ3-ND1 3.76Å; W87-W402 AromaticContact CH2-CE2 3.85Å; W87-W402 AromaticContact CH2-CZ2 3.65Å; W87-W402 HydrophobicContact CH2-CZ2 3.65Å; W87-W402 AromaticContact CH2-NE1 3.76Å; W87-W402 AromaticContact CZ2-CZ2 3.83Å; W87-W402 HydrophobicContact CZ2-CZ2 3.83Å; W87-F419 AromaticContact CH2-CE1 3.81Å; W87-F419 HydrophobicContact CH2-CE1 3.81Å; W87-F419 HydrophobicContact CH2-CZ 4.28Å; W87-F419 AromaticContact CZ3-CE1 3.8Å; W87-F419 HydrophobicContact CZ3-CE1 3.8Å
88	G	88.9	Confident	89.7	Confident	13 Å²	13	35 Å²	35	13%	0.134	18%	0.182	C	C	.	.	S	Bend	trans	80.1	-22.6	172.4	0	0	0	0	0	115.5	D133	G88-D133 WeakPolarHBondContact CA-O 3.36Å; G88-D133 PolarHBondContact N-O 3.25Å
89	A	90.3	Very high	90.4	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	17%	0.173	C	C	.	.	S	Bend	trans	-158.5	161.9	-179.9	0	0	0	0	0	112.2	W87 F135 F439 P440	W87-A89 PolarHBondContact O-N 3.37Å; W87-A89 VanDerWaalsContact O-N 3.12Å; A89-F135 VanDerWaalsContact O-CD2 3.32Å; A89-F135 WeakPolarHBondContact O-CD2 3.5Å; A89-F439 HydrophobicContact CB-CB 4.22Å; A89-F439 WeakPolarHBondContact CB-O 3.31Å; A89-P440 WeakPolarHBondContact CB-O 3.47Å
90	P	93.8	Very high	90.7	Very high	0 Å²	0	30 Å²	30	0%	0	16%	0.164	C	C	.	.			trans	-54.5	145.5	172.6	-24.8	32	0	0	0	112.8	Y45 L50 R86 V92 F135 F439 Y493	Y45-P90 WeakPolarHBondContact OH-CB 3.41Å; L50-P90 HydrophobicContact CD1-CB 4.08Å; L50-P90 HydrophobicContact CD2-CB 4.08Å; L50-P90 HydrophobicContact CD2-CG 4.03Å; R86-P90 WeakPolarHBondContact CD-O 3.26Å; R86-P90 PolarHBondContact NH1-O 2.8Å; P90-V92 PolarHBondContact O-N 2.02Å; P90-F135 HydrophobicContact CB-CD1 4.41Å; P90-F135 HydrophobicContact CG-CD1 3.9Å; P90-F135 HydrophobicContact CG-CE1 3.98Å; P90-F135 HydrophobicContact CG-CG 4.27Å; P90-F135 HydrophobicContact CG-CZ 4.41Å; P90-F439 HydrophobicContact CB-CB 4.34Å; P90-F439 HydrophobicContact CB-CD2 3.68Å; P90-F439 HydrophobicContact CB-CE2 4.09Å; P90-F439 HydrophobicContact CB-CG 3.96Å; P90-F439 HydrophobicContact CG-CB 4.49Å; P90-F439 HydrophobicContact CG-CD1 4.48Å; P90-F439 HydrophobicContact CG-CD2 4.39Å; P90-F439 HydrophobicContact CG-CG 4.21Å; P90-Y493 WeakPolarHBondContact CD-OH 3.42Å; P90-Y493 HydrophobicContact CG-CE1 3.51Å; P90-Y493 VanDerWaalsContact CG-OH 3.27Å; P90-Y493 WeakPolarHBondContact CG-OH 3.35Å
91	P	93.9	Very high	90.5	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	15%	0.146	C	C	.	.			trans	-68.8	131.6	177.4	27	-31.8	0	0	0	110.6	Y45 H84 R86 I93 A137	Y45-P91 WeakPolarHBondContact CE2-O 3.41Å; Y45-P91 PolarHBondContact OH-O 2.78Å; H84-P91 HydrophobicContact CB-CB 3.99Å; H84-P91 HydrophobicContact CB-CG 4.01Å; R86-P91 HydrophobicContact CB-CB 4.02Å; P91-I93 HydrophobicContact CB-CG2 4.05Å; P91-I93 HydrophobicContact CG-CG2 4.48Å; P91-A137 HydrophobicContact CG-CB 3.42Å; P91-A137 VanDerWaalsContact CG-CB 3.42Å
92	V	92.7	Very high	90.2	Very high	6 Å²	6	33.5 Å²	33.5	4%	0.036	18%	0.183	C	C	.	.			trans	-84	114.2	169.4	178.8	0	0	0	0	107	P90 F100 W106 P438 F439 W507	P90-V92 PolarHBondContact O-N 2.02Å; V92-F100 HydrophobicContact CG1-CE1 3.85Å; V92-F100 HydrophobicContact CG1-CZ 3.94Å; V92-W106 HydrophobicContact CB-CB 3.94Å; V92-W106 HydrophobicContact CB-CG 4.33Å; V92-W106 HydrophobicContact CG1-CB 3.69Å; V92-W106 HydrophobicContact CG1-CG 3.79Å; V92-W106 HydrophobicContact CG2-CB 4.16Å; V92-P438 HydrophobicContact CG1-CG 4.25Å; V92-P438 HydrophobicContact CG2-CB 4.18Å; V92-P438 HydrophobicContact CG2-CG 3.98Å; V92-P438 WeakPolarHBondContact CG2-O 3.42Å; V92-F439 HydrophobicContact CG2-CB 4.3Å; V92-F439 HydrophobicContact CG2-CD2 4.03Å; V92-W507 HydrophobicContact CB-CZ2 4.19Å; V92-W507 HydrophobicContact CG1-CH2 4.25Å; V92-W507 HydrophobicContact CG1-CZ2 3.68Å; V92-W507 HydrophobicContact CG2-CH2 4.19Å; V92-W507 HydrophobicContact CG2-CZ2 4.23Å
93	I	91.7	Very high	89.9	Confident	6 Å²	6	34.3 Å²	34.3	3%	0.031	19%	0.192	C	C	.	.			trans	-121.6	148.3	-174.7	69.2	176.2	0	0	0	110.8	Y42 Y45 V48 H84 P91 W507	Y42-I93 HydrophobicContact CE2-CD1 3.85Å; Y42-I93 HydrophobicContact CE2-CG1 4.33Å; Y45-I93 HydrophobicContact CD2-CG1 4.16Å; Y45-I93 HydrophobicContact CE2-CD1 4.46Å; Y45-I93 HydrophobicContact CE2-CG1 4.01Å; V48-I93 HydrophobicContact CG2-CD1 3.66Å; H84-I93 HydrophobicContact CB-CG2 3.98Å; P91-I93 HydrophobicContact CB-CG2 4.05Å; P91-I93 HydrophobicContact CG-CG2 4.48Å; I93-W507 PolarHBondContact O-NE1 2.98Å
94	N	89.6	Confident	89.6	Confident	45 Å²	45	34.7 Å²	34.7	24%	0.241	19%	0.194	C	C	.	.			trans	-140.6	67.7	175.8	-172.9	21	0	0	0	110.7	T96 E97 T98 F100	N94-T96 PolarHBondContact O-N 2.79Å; N94-E97 PolarHBondContact O-N 3.28Å; N94-E97 PolarHBondContact OD1-N 2.83Å; N94-T98 PolarHBondContact ND2-N 2.82Å; N94-T98 PolarHBondContact ND2-O 2.93Å; N94-T98 PolarHBondContact OD1-N 2.85Å; N94-T98 PolarHBondContact OD1-OG1 2.83Å; N94-F100 HydrophobicContact CB-CE2 3.66Å; N94-F100 HydrophobicContact CB-CZ 3.9Å
95	P	87.3	Confident	89.3	Confident	58 Å²	58	37.4 Å²	37.4	38%	0.377	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-16.2	-174.5	30.1	-36.7	0	0	0	113.7	Y42	Y42-P95 HydrophobicContact CD1-CG 3.43Å; Y42-P95 VanDerWaalsContact CD1-CG 3.43Å; Y42-P95 HydrophobicContact CD2-CG 3.87Å; Y42-P95 HydrophobicContact CE1-CG 3.29Å; Y42-P95 HydrophobicContact CE2-CG 3.75Å; Y42-P95 HydrophobicContact CG-CG 3.71Å; Y42-P95 VanDerWaalsContact CZ-CG 3.44Å
96	T	85.1	Confident	88.8	Confident	41 Å²	41	42.7 Å²	42.7	25%	0.252	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102.4	10.7	179.1	54.3	0	0	0	0	112.8	Y42 N94 T98 E142	Y42-T96 HydrophobicContact CD1-CG2 4.02Å; Y42-T96 HydrophobicContact CE1-CG2 4.2Å; N94-T96 PolarHBondContact O-N 2.79Å; T96-T98 PolarHBondContact O-N 2.85Å; T96-T98 VanDerWaalsContact O-N 3.09Å; T96-T98 WeakPolarHBondContact OG1-CG2 3.46Å; T96-E142 HydrophobicContact CG2-CB 4.24Å; T96-E142 HydrophobicContact CG2-CG 4Å
97	E	87.3	Confident	87.9	Confident	178 Å²	178	42.4 Å²	42.4	83%	0.832	23%	0.231	S	C	*	.			trans	52.5	33.7	176.9	-59.9	-175.4	179.1	0	0	114.8	N94	N94-E97 PolarHBondContact O-N 3.28Å; N94-E97 PolarHBondContact OD1-N 2.83Å
98	T	86.3	Confident	87.1	Confident	12 Å²	12	46 Å²	46	7%	0.074	26%	0.256	C	S	.	.	P	Polyproline II helix	trans	-76.4	157.7	-179.7	53.4	0	0	0	0	112.8	N94 T96 K505 G506 D511	N94-T98 PolarHBondContact ND2-N 2.82Å; N94-T98 PolarHBondContact ND2-O 2.93Å; N94-T98 PolarHBondContact OD1-N 2.85Å; N94-T98 PolarHBondContact OD1-OG1 2.83Å; T96-T98 PolarHBondContact O-N 2.85Å; T96-T98 VanDerWaalsContact O-N 3.09Å; T96-T98 WeakPolarHBondContact OG1-CG2 3.46Å; T98-K505 HydrophobicContact CG2-CB 3.83Å; T98-K505 HydrophobicContact CG2-CD 4.43Å; T98-G506 WeakPolarHBondContact OG1-CA 3.5Å; T98-D511 WeakPolarHBondContact CA-OD2 3.26Å; T98-D511 WeakPolarHBondContact CB-OD2 3.37Å
99	V	86	Confident	87	Confident	88 Å²	88	46.6 Å²	46.6	53%	0.533	26%	0.259	S	S	.	.	P	Polyproline II helix	trans	-74.2	128.3	-178.9	-177.1	0	0	0	0	111.2	D511	V99-D511 HydrophobicContact CB-CB 4.46Å; V99-D511 PolarHBondContact N-OD2 3.32Å
100	F	87.1	Confident	87	Confident	22 Å²	22	48.8 Å²	48.8	10%	0.096	27%	0.27	C	S	.	.	P	Polyproline II helix	trans	-77.6	149.1	169.6	-78.1	-93	0	0	0	111.1	V92 N94 T104 W106 W507	V92-F100 HydrophobicContact CG1-CE1 3.85Å; V92-F100 HydrophobicContact CG1-CZ 3.94Å; N94-F100 HydrophobicContact CB-CE2 3.66Å; N94-F100 HydrophobicContact CB-CZ 3.9Å; F100-T104 HydrophobicContact CD1-CG2 4.08Å; F100-W106 HydrophobicContact CB-CH2 4.14Å; F100-W106 HydrophobicContact CB-CZ3 3.77Å; F100-W106 HydrophobicContact CD1-CE3 4.06Å; F100-W106 HydrophobicContact CD1-CZ3 4.02Å; F100-W106 HydrophobicContact CD2-CE3 4.2Å; F100-W106 AromaticContact CD2-CH2 3.27Å; F100-W106 HydrophobicContact CD2-CH2 3.27Å; F100-W106 AromaticContact CD2-CZ2 3.66Å; F100-W106 HydrophobicContact CD2-CZ2 3.66Å; F100-W106 AromaticContact CD2-CZ3 3.57Å; F100-W106 HydrophobicContact CD2-CZ3 3.57Å; F100-W106 HydrophobicContact CE1-CD2 4.35Å; F100-W106 HydrophobicContact CE1-CE3 4.23Å; F100-W106 HydrophobicContact CE1-CZ3 4.49Å; F100-W106 HydrophobicContact CE2-CD2 4.25Å; F100-W106 AromaticContact CE2-CE2 3.83Å; F100-W106 HydrophobicContact CE2-CE3 4.34Å; F100-W106 AromaticContact CE2-CH2 3.69Å; F100-W106 HydrophobicContact CE2-CH2 3.69Å; F100-W106 AromaticContact CE2-CZ2 3.54Å; F100-W106 HydrophobicContact CE2-CZ2 3.54Å; F100-W106 HydrophobicContact CE2-CZ3 4.08Å; F100-W106 HydrophobicContact CG-CE3 4.04Å; F100-W106 AromaticContact CG-CH2 3.75Å; F100-W106 HydrophobicContact CG-CH2 3.75Å; F100-W106 HydrophobicContact CG-CZ2 4.43Å; F100-W106 AromaticContact CG-CZ3 3.51Å; F100-W106 HydrophobicContact CG-CZ3 3.51Å; F100-W106 HydrophobicContact CZ-CD2 4.15Å; F100-W106 HydrophobicContact CZ-CE3 4.36Å; F100-W106 HydrophobicContact CZ-CH2 4.48Å; F100-W106 HydrophobicContact CZ-CZ2 4.25Å; F100-W507 HydrophobicContact CD1-CB 3.83Å; F100-W507 AromaticContact CD1-CG 3.93Å; F100-W507 HydrophobicContact CD1-CG 3.93Å; F100-W507 HydrophobicContact CE1-CB 3.89Å; F100-W507 AromaticContact CE1-CD1 3.38Å; F100-W507 AromaticContact CE1-CD2 3.9Å; F100-W507 HydrophobicContact CE1-CD2 3.9Å; F100-W507 AromaticContact CE1-CG 3.45Å; F100-W507 HydrophobicContact CE1-CG 3.45Å; F100-W507 VanDerWaalsContact CE1-CG 3.45Å; F100-W507 AromaticContact CE1-NE1 3.77Å; F100-W507 AromaticContact CZ-CD1 3.72Å; F100-W507 HydrophobicContact CZ-CG 4.24Å; F100-W507 AromaticContact CZ-NE1 3.98Å
101	P	85.2	Confident	86.9	Confident	9 Å²	9	52 Å²	52	6%	0.058	29%	0.292	C	S	.	.	P	Polyproline II helix	trans	-56.5	150.8	172.9	-24.8	35.6	0	0	0	112.2	T104 V476 T510	P101-T104 WeakPolarHBondContact O-CB 3.42Å; P101-T104 PolarHBondContact O-N 2.92Å; P101-T104 PolarHBondContact O-OG1 2.88Å; P101-V476 HydrophobicContact CB-CG1 3.96Å; P101-V476 HydrophobicContact CG-CG1 3.75Å; P101-T510 HydrophobicContact CB-CG2 4.34Å; P101-T510 HydrophobicContact CG-CG2 4.06Å
102	N	85.8	Confident	86.8	Confident	144 Å²	144	54 Å²	54	77%	0.77	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.4	146	-179.8	-71.3	-18.3	0	0	0	111.8	T104 R436	N102-T104 PolarHBondContact O-N 2.89Å; N102-T104 VanDerWaalsContact O-N 3.12Å; N102-R436 PolarHBondContact O-NH1 3.14Å
103	A	87.8	Confident	86.7	Confident	45 Å²	45	59.3 Å²	59.3	37%	0.372	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.7	15.5	-179.4	0	0	0	0	0	115.7	M434 R436	A103-M434 HydrophobicContact CB-CB 4.41Å; A103-M434 VanDerWaalsContact CB-O 3.3Å; A103-M434 WeakPolarHBondContact CB-O 3.28Å; A103-R436 PolarHBondContact O-N 2.91Å
104	T	90	Very high	86.6	Confident	8 Å²	8	59.6 Å²	59.6	5%	0.049	33%	0.331	C	S	.	.	B	Isolated β-bridge	trans	-83.1	124.2	171.6	-50.4	0	0	0	0	109.7	F100 P101 N102 W106 R436 P438	F100-T104 HydrophobicContact CD1-CG2 4.08Å; P101-T104 WeakPolarHBondContact O-CB 3.42Å; P101-T104 PolarHBondContact O-N 2.92Å; P101-T104 PolarHBondContact O-OG1 2.88Å; N102-T104 PolarHBondContact O-N 2.89Å; N102-T104 VanDerWaalsContact O-N 3.12Å; T104-W106 HydrophobicContact CG2-CE3 4.33Å; T104-W106 WeakPolarHBondContact O-CZ3 3.43Å; T104-R436 WeakPolarHBondContact CA-O 3.4Å; T104-P438 HydrophobicContact CG2-CG 3.85Å
105	L	88.7	Confident	86.5	Confident	74 Å²	74	61.1 Å²	61.1	39%	0.387	34%	0.344	S	S	.	.			trans	-120.2	137.1	177.3	-57.7	176.1	0	0	0	109	Y422 V435 R436 L437 P438	L105-Y422 HydrophobicContact CB-CD1 4.39Å; L105-Y422 HydrophobicContact CB-CE1 3.97Å; L105-Y422 HydrophobicContact CD1-CD1 3.45Å; L105-Y422 VanDerWaalsContact CD1-CD1 3.45Å; L105-Y422 HydrophobicContact CD1-CE1 3.89Å; L105-Y422 HydrophobicContact CD1-CG 4.33Å; L105-V435 HydrophobicContact CD1-CG1 3.94Å; L105-R436 PolarHBondContact N-O 3.3Å; L105-L437 HydrophobicContact CB-CD2 3.83Å; L105-L437 WeakPolarHBondContact O-CD2 3.4Å; L105-P438 WeakPolarHBondContact O-CD 3.34Å
106	W	84.3	Confident	86.2	Confident	113 Å²	113	58.4 Å²	58.4	43%	0.428	33%	0.326	S	S	.	.			trans	-139.7	149.6	179.5	63.4	95.8	0	0	0	111.2	V92 F100 T104 P438	V92-W106 HydrophobicContact CB-CB 3.94Å; V92-W106 HydrophobicContact CB-CG 4.33Å; V92-W106 HydrophobicContact CG1-CB 3.69Å; V92-W106 HydrophobicContact CG1-CG 3.79Å; V92-W106 HydrophobicContact CG2-CB 4.16Å; F100-W106 HydrophobicContact CB-CH2 4.14Å; F100-W106 HydrophobicContact CB-CZ3 3.77Å; F100-W106 HydrophobicContact CD1-CE3 4.06Å; F100-W106 HydrophobicContact CD1-CZ3 4.02Å; F100-W106 HydrophobicContact CD2-CE3 4.2Å; F100-W106 AromaticContact CD2-CH2 3.27Å; F100-W106 HydrophobicContact CD2-CH2 3.27Å; F100-W106 AromaticContact CD2-CZ2 3.66Å; F100-W106 HydrophobicContact CD2-CZ2 3.66Å; F100-W106 AromaticContact CD2-CZ3 3.57Å; F100-W106 HydrophobicContact CD2-CZ3 3.57Å; F100-W106 HydrophobicContact CE1-CD2 4.35Å; F100-W106 HydrophobicContact CE1-CE3 4.23Å; F100-W106 HydrophobicContact CE1-CZ3 4.49Å; F100-W106 HydrophobicContact CE2-CD2 4.25Å; F100-W106 AromaticContact CE2-CE2 3.83Å; F100-W106 HydrophobicContact CE2-CE3 4.34Å; F100-W106 AromaticContact CE2-CH2 3.69Å; F100-W106 HydrophobicContact CE2-CH2 3.69Å; F100-W106 AromaticContact CE2-CZ2 3.54Å; F100-W106 HydrophobicContact CE2-CZ2 3.54Å; F100-W106 HydrophobicContact CE2-CZ3 4.08Å; F100-W106 HydrophobicContact CG-CE3 4.04Å; F100-W106 AromaticContact CG-CH2 3.75Å; F100-W106 HydrophobicContact CG-CH2 3.75Å; F100-W106 HydrophobicContact CG-CZ2 4.43Å; F100-W106 AromaticContact CG-CZ3 3.51Å; F100-W106 HydrophobicContact CG-CZ3 3.51Å; F100-W106 HydrophobicContact CZ-CD2 4.15Å; F100-W106 HydrophobicContact CZ-CE3 4.36Å; F100-W106 HydrophobicContact CZ-CH2 4.48Å; F100-W106 HydrophobicContact CZ-CZ2 4.25Å; T104-W106 HydrophobicContact CG2-CE3 4.33Å; T104-W106 WeakPolarHBondContact O-CZ3 3.43Å; W106-P438 HydrophobicContact CB-CG 4.38Å
107	G	73.6	Confident	85.9	Confident	10 Å²	10	60.1 Å²	60.1	10%	0.103	34%	0.336	C	S	.	.			trans	-79.3	144.6	171.2	0	0	0	0	0	110.7
108	P	74.8	Confident	85.3	Confident	93 Å²	93	55.6 Å²	55.6	60%	0.604	33%	0.325	S	S	*	.			trans	-55.2	168	170.2	-0.7	-2.7	0	0	0	112.7	Q233	P108-Q233 VanDerWaalsContact CA-NE2 3.29Å; P108-Q233 VanDerWaalsContact CB-NE2 3.3Å; P108-Q233 PolarHBondContact O-NE2 2.69Å; P108-Q233 PolarHBondContact O-OE1 3.19Å
109	S	86.8	Confident	85.2	Confident	27 Å²	27	59 Å²	59	19%	0.189	34%	0.34	C	S	.	.			trans	-131.6	156.2	168.2	60.4	0	0	0	0	109.2	L85 S111	L85-S109 WeakPolarHBondContact O-CB 2.99Å; S109-S111 PolarHBondContact O-N 2.91Å
110	L	90.4	Very high	85.3	Confident	46 Å²	46	55.5 Å²	55.5	24%	0.241	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74	117.2	173	171.5	72.4	0	0	0	108.1	H84 L85 L112 F124 L232	H84-L110 CarbonylContact C-O 3.54Å; H84-L110 VanDerWaalsContact CA-O 3.25Å; H84-L110 WeakPolarHBondContact CA-O 3.37Å; L85-L110 HydrophobicContact CB-CB 4.3Å; L85-L110 PolarHBondContact N-O 3.49Å; L85-L110 PolarHBondContact O-N 3.18Å; L110-L112 HydrophobicContact CD1-CD2 4.45Å; L110-L112 HydrophobicContact CG-CD2 4.48Å; L110-L112 HydrophobicContact CG-CG 4.41Å; L110-F124 HydrophobicContact CD2-CD1 4.26Å; L110-F124 HydrophobicContact CD2-CD2 3.77Å; L110-F124 HydrophobicContact CD2-CE1 4.01Å; L110-F124 HydrophobicContact CD2-CE2 3.49Å; L110-F124 VanDerWaalsContact CD2-CE2 3.49Å; L110-F124 HydrophobicContact CD2-CG 4.18Å; L110-F124 HydrophobicContact CD2-CZ 3.66Å; L110-L232 HydrophobicContact CB-CD1 3.63Å; L110-L232 HydrophobicContact CB-CD2 4.27Å; L110-L232 HydrophobicContact CB-CG 4.46Å; L110-L232 HydrophobicContact CD2-CD1 4.03Å; L110-L232 HydrophobicContact CD2-CD2 3.95Å; L110-L232 HydrophobicContact CG-CD1 4.46Å
111	S	91.3	Very high	85.5	Confident	67 Å²	67	57.9 Å²	57.9	47%	0.469	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	130	176.6	-55.8	0	0	0	0	110.8	I83 H84 S109	I83-S111 CarbonylContact O-C 3.59Å; I83-S111 WeakPolarHBondContact O-CA 3.39Å; H84-S111 PolarHBondContact CE1-OG 2.89Å; H84-S111 PolarHBondContact ND1-OG 2.86Å; S109-S111 PolarHBondContact O-N 2.91Å
112	L	91.3	Very high	85.9	Confident	42 Å²	42	59.6 Å²	59.6	22%	0.22	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	138.5	175.2	-59.1	172.2	0	0	0	108.6	F66 I83 L110 F124	F66-L112 HydrophobicContact CD2-CD1 4.17Å; F66-L112 HydrophobicContact CE2-CD1 3.88Å; I83-L112 HydrophobicContact CB-CB 4.37Å; I83-L112 PolarHBondContact N-O 2.71Å; I83-L112 PolarHBondContact O-N 2.78Å; L110-L112 HydrophobicContact CD1-CD2 4.45Å; L110-L112 HydrophobicContact CG-CD2 4.48Å; L110-L112 HydrophobicContact CG-CG 4.41Å; L112-F124 HydrophobicContact CD1-CB 4.21Å
113	I	90.9	Very high	86.2	Confident	117 Å²	117	57 Å²	57	60%	0.6	34%	0.339	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-112	123	177.5	-58.4	176	0	0	0	108.3	N80	N80-I113 HydrophobicContact CB-CG2 3.74Å
114	L	90.1	Very high	86.5	Confident	12 Å²	12	56.4 Å²	56.4	6%	0.063	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	108.1	178.9	-174.8	65	0	0	0	109.9	V68 V81 I83 V116 S120 T122	V68-L114 HydrophobicContact CB-CD2 4.14Å; V68-L114 HydrophobicContact CG2-CD2 3.72Å; V81-L114 PolarHBondContact N-O 3.39Å; V81-L114 PolarHBondContact O-N 3.3Å; I83-L114 HydrophobicContact CD1-CB 4.37Å; L114-V116 PolarHBondContact O-N 2.89Å; L114-S120 WeakPolarHBondContact CG-OG 3.27Å; L114-T122 HydrophobicContact CD1-CG2 4Å; L114-T122 HydrophobicContact CD2-CG2 4.41Å
115	P	86.6	Confident	86.6	Confident	77 Å²	77	60.3 Å²	60.3	50%	0.5	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	129.2	172.4	27.5	-32.3	0	0	0	109.9	N80 S120	N80-P115 WeakPolarHBondContact OD1-CA 3.44Å; P115-S120 WeakPolarHBondContact O-CB 3.32Å; P115-S120 PolarHBondContact O-OG 2.72Å
116	V	81.1	Confident	86.8	Confident	2 Å²	2	57.7 Å²	57.7	1%	0.012	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	120	-176.1	-171.5	0	0	0	0	111	V68 H79 V81 L114 Y157	V68-V116 HydrophobicContact CB-CG2 4.09Å; V68-V116 HydrophobicContact CG1-CB 4.48Å; V68-V116 HydrophobicContact CG1-CG1 3.89Å; V68-V116 HydrophobicContact CG1-CG2 3.68Å; H79-V116 WeakPolarHBondContact O-CB 3.35Å; H79-V116 PolarHBondContact O-N 2.8Å; V81-V116 HydrophobicContact CB-CG2 4.23Å; V81-V116 HydrophobicContact CG2-CG2 3.54Å; L114-V116 PolarHBondContact O-N 2.89Å; V116-Y157 HydrophobicContact CB-CD1 4.35Å; V116-Y157 HydrophobicContact CB-CE1 4.26Å; V116-Y157 HydrophobicContact CG1-CD1 3.83Å; V116-Y157 HydrophobicContact CG1-CE1 3.9Å
117	T	78.3	Confident	87.1	Confident	76 Å²	76	55.5 Å²	55.5	47%	0.466	34%	0.337	S	S	.	.	S	Bend	trans	-99.7	-80.4	172.2	53.2	0	0	0	0	110.7	K70	K70-T117 WeakPolarHBondContact CD-O 3.42Å
118	S	76.1	Confident	87.7	Confident	84 Å²	84	55.2 Å²	55.2	59%	0.587	33%	0.333	S	S	*	.	S	Bend	trans	-125.9	-52.1	176.8	54.9	0	0	0	0	111.2	K70	K70-S118 WeakPolarHBondContact CB-O 3.49Å; K70-S118 PolarHBondContact N-O 3.25Å
119	Q	83.6	Confident	88.6	Confident	84 Å²	84	50.8 Å²	50.8	39%	0.393	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	117.8	167.5	-178.9	-177.2	-24.8	0	0	107.4	V68 K69	V68-Q119 WeakPolarHBondContact O-CA 3.32Å; K69-Q119 HydrophobicContact CG-CG 4.03Å
120	S	87.8	Confident	88.8	Confident	14 Å²	14	49.7 Å²	49.7	10%	0.098	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	147.1	174.3	55.2	0	0	0	0	109.8	V68 L114 P115	V68-S120 PolarHBondContact N-O 2.81Å; V68-S120 PolarHBondContact O-N 2.76Å; L114-S120 WeakPolarHBondContact CG-OG 3.27Å; P115-S120 WeakPolarHBondContact O-CB 3.32Å; P115-S120 PolarHBondContact O-OG 2.72Å
121	S	91.9	Very high	88.9	Confident	72 Å²	72	49.7 Å²	49.7	50%	0.503	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	145	175.2	56.5	0	0	0	0	111	F66	F66-S121 CarbonylContact O-C 3.58Å; F66-S121 WeakPolarHBondContact O-CA 3.21Å; F66-S121 WeakPolarHBondContact O-CB 3.23Å
122	T	93	Very high	88.9	Confident	45 Å²	45	47.5 Å²	47.5	28%	0.276	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	150.9	173.7	-174.9	0	0	0	0	109.9	F66 L114	F66-T122 HydrophobicContact CB-CG2 3.94Å; F66-T122 HydrophobicContact CD2-CG2 4.05Å; F66-T122 PolarHBondContact N-O 2.84Å; F66-T122 PolarHBondContact O-N 2.91Å; L114-T122 HydrophobicContact CD1-CG2 4Å; L114-T122 HydrophobicContact CD2-CG2 4.41Å
123	T	93.1	Very high	88.9	Confident	90 Å²	90	47.2 Å²	47.2	55%	0.552	29%	0.286	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-115.7	137.8	-179.4	52.9	0	0	0	0	110.6	W64 L65	W64-T123 CarbonylContact O-C 3.56Å; W64-T123 WeakPolarHBondContact O-CA 3.42Å; L65-T123 HydrophobicContact CD1-CG2 3.63Å
124	F	92.9	Very high	89.1	Confident	32 Å²	32	41.7 Å²	41.7	14%	0.14	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	123.6	172.4	173.5	-109.2	0	0	0	109.1	W64 F66 L85 L110 L112 L126 L232	W64-F124 HydrophobicContact CB-CB 4.43Å; W64-F124 HydrophobicContact CD2-CD1 4.21Å; W64-F124 AromaticContact CE3-CD1 3.44Å; W64-F124 HydrophobicContact CE3-CD1 3.44Å; W64-F124 VanDerWaalsContact CE3-CD1 3.44Å; W64-F124 AromaticContact CE3-CE1 3.84Å; W64-F124 HydrophobicContact CE3-CE1 3.84Å; W64-F124 AromaticContact CZ3-CD1 3.82Å; W64-F124 HydrophobicContact CZ3-CD1 3.82Å; W64-F124 AromaticContact CZ3-CE1 3.7Å; W64-F124 HydrophobicContact CZ3-CE1 3.7Å; W64-F124 PolarHBondContact N-O 2.8Å; W64-F124 PolarHBondContact O-N 3.35Å; F66-F124 HydrophobicContact CE2-CB 4Å; L85-F124 HydrophobicContact CD2-CD1 3.87Å; L85-F124 HydrophobicContact CD2-CE1 4.21Å; L110-F124 HydrophobicContact CD2-CD1 4.26Å; L110-F124 HydrophobicContact CD2-CD2 3.77Å; L110-F124 HydrophobicContact CD2-CE1 4.01Å; L110-F124 HydrophobicContact CD2-CE2 3.49Å; L110-F124 VanDerWaalsContact CD2-CE2 3.49Å; L110-F124 HydrophobicContact CD2-CG 4.18Å; L110-F124 HydrophobicContact CD2-CZ 3.66Å; L112-F124 HydrophobicContact CD1-CB 4.21Å; F124-L126 HydrophobicContact CE1-CB 4.1Å; F124-L126 HydrophobicContact CZ-CB 4.16Å; F124-L126 HydrophobicContact CZ-CD1 4.4Å; F124-L232 HydrophobicContact CE2-CD2 4.37Å; F124-L232 HydrophobicContact CZ-CD2 3.76Å
125	N	93.1	Very high	89.3	Confident	89 Å²	89	41.2 Å²	41.2	48%	0.476	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	135.9	-177.3	-64.6	-18.8	0	0	0	109.6	A62 R63	A62-N125 WeakPolarHBondContact O-CA 3.2Å; R63-N125 WeakPolarHBondContact CB-OD1 3.47Å; R63-N125 WeakPolarHBondContact CD-OD1 3.47Å; R63-N125 HydrophobicContact CG-CB 4.42Å; R63-N125 WeakPolarHBondContact CG-OD1 3.49Å
126	L	91.6	Very high	89.7	Confident	19 Å²	19	37.6 Å²	37.6	10%	0.099	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	122.4	177.9	-171.9	60.3	0	0	0	109.7	A62 W64 F124 P129 W134 A230	A62-L126 PolarHBondContact N-O 2.69Å; A62-L126 PolarHBondContact O-N 2.79Å; W64-L126 HydrophobicContact CH2-CD2 4.48Å; W64-L126 HydrophobicContact CZ3-CB 3.92Å; W64-L126 HydrophobicContact CZ3-CD2 4.42Å; F124-L126 HydrophobicContact CE1-CB 4.1Å; F124-L126 HydrophobicContact CZ-CB 4.16Å; F124-L126 HydrophobicContact CZ-CD1 4.4Å; L126-P129 HydrophobicContact CD2-CB 3.83Å; L126-P129 HydrophobicContact CG-CB 4.14Å; L126-W134 HydrophobicContact CD2-CH2 3.28Å; L126-W134 HydrophobicContact CD2-CZ2 3.78Å; L126-W134 HydrophobicContact CD2-CZ3 4.04Å; L126-A230 HydrophobicContact CD1-CB 3.84Å; L126-A230 HydrophobicContact CG-CB 4.25Å
127	S	89.9	Confident	90.4	Very high	68 Å²	68	37.5 Å²	37.5	48%	0.476	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	144.5	170.2	50.4	0	0	0	0	110.3	A230	S127-A230 WeakPolarHBondContact O-CB 3.46Å
128	D	88.2	Confident	91.2	Very high	4 Å²	4	33.9 Å²	33.9	2%	0.021	21%	0.209	C	C	.	.	S	Bend	trans	46.6	51.6	178.1	-53.6	-67.7	0	0	0	114.3	A60 R191 A230 R260	A60-D128 PolarHBondContact O-N 2.85Å; D128-R191 IonicContact OD1-NE 3.37Å; D128-R191 PolarHBondContact OD1-NE 2.84Å; D128-A230 PolarHBondContact O-N 3.32Å; D128-R260 VanDerWaalsContact CA-NH1 3.32Å; D128-R260 IonicContact OD1-NH1 3.96Å
129	P	92.4	Very high	92	Very high	0 Å²	0	30 Å²	30	0%	0	18%	0.182	C	C	.	.	B	Isolated β-bridge	trans	-65.2	149.8	-175.6	30.2	-38.7	0	0	0	112.3	I55 T59 A62 L126 W134 A230	I55-P129 HydrophobicContact CD1-CB 3.94Å; I55-P129 HydrophobicContact CD1-CG 4.18Å; I55-P129 HydrophobicContact CG2-CB 4.49Å; I55-P129 HydrophobicContact CG2-CG 4.02Å; T59-P129 HydrophobicContact CG2-CG 3.41Å; T59-P129 VanDerWaalsContact CG2-CG 3.41Å; T59-P129 WeakPolarHBondContact O-CD 3.22Å; A62-P129 HydrophobicContact CB-CB 4.36Å; A62-P129 HydrophobicContact CB-CG 3.87Å; L126-P129 HydrophobicContact CD2-CB 3.83Å; L126-P129 HydrophobicContact CG-CB 4.14Å; P129-W134 HydrophobicContact CB-CZ2 4.23Å; P129-A230 CarbonylContact C-O 3.58Å; P129-A230 WeakPolarHBondContact CA-O 3.44Å
130	A	91.5	Very high	92.4	Very high	4 Å²	4	26.6 Å²	26.6	3%	0.033	17%	0.166	C	C	.	.	P	Polyproline II helix	trans	-61.5	131.5	172.2	0	0	0	0	0	111.1	W87 W134 S229 A230	W87-A130 HydrophobicContact CD2-CB 3.87Å; W87-A130 HydrophobicContact CG-CB 4.07Å; W87-A130 HydrophobicContact CZ2-CB 3.98Å; A130-W134 HydrophobicContact CB-CZ2 4.46Å; A130-W134 PolarHBondContact O-NE1 2.88Å; A130-S229 VanDerWaalsContact CA-CB 3.45Å; A130-A230 PolarHBondContact N-O 3.03Å
131	P	91.5	Very high	92.4	Very high	45 Å²	45	28.5 Å²	28.5	29%	0.292	18%	0.178	S	C	.	.	S	Bend	trans	-69.8	160.9	179.9	30.7	-35.4	0	0	0	111.5	E57 W87	E57-P131 HydrophobicContact CG-CB 4.16Å; W87-P131 PolarHBondContact NE1-O 2.92Å
132	G	91.6	Very high	92.1	Very high	22 Å²	22	29.5 Å²	29.5	23%	0.227	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	99.9	-156	-179.8	0	0	0	0	0	113.1	I55	I55-G132 PolarHBondContact N-O 3.12Å; I55-G132 PolarHBondContact O-N 3.09Å
133	D	92.4	Very high	91.1	Very high	36 Å²	36	30.7 Å²	30.7	19%	0.193	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	134.6	-168.8	-73.3	-12.3	0	0	0	112.8	R52 F53 H54 G88 F135	R52-D133 WeakPolarHBondContact CD-OD2 3.22Å; R52-D133 HydrophobicContact CG-CB 4.24Å; R52-D133 IonicContact CZ-OD2 2.72Å; R52-D133 IonicContact NE-OD2 3.23Å; R52-D133 IonicContact NH1-OD1 3.74Å; R52-D133 PolarHBondContact NH1-OD1 3.28Å; R52-D133 IonicContact NH1-OD2 3.89Å; R52-D133 PolarHBondContact NH1-OD2 3.04Å; F53-D133 CarbonylContact O-C 3.6Å; F53-D133 WeakPolarHBondContact O-CA 3.47Å; H54-D133 IonicContact CG-OD1 3.3Å; H54-D133 IonicContact ND1-OD1 3Å; H54-D133 PolarHBondContact ND1-OD1 2.94Å; G88-D133 WeakPolarHBondContact CA-O 3.36Å; G88-D133 PolarHBondContact N-O 3.25Å; D133-F135 HydrophobicContact CB-CE2 3.91Å; D133-F135 HydrophobicContact CB-CZ 4.37Å
134	W	93.5	Very high	89.9	Confident	1 Å²	1	31.5 Å²	31.5	0%	0.004	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	133	175.2	-76.7	72	0	0	0	109.7	R52 F53 I55 W64 W87 L126 P129 A130 L232	R52-W134 WeakPolarHBondContact CA-O 3.43Å; F53-W134 PolarHBondContact N-O 3.21Å; F53-W134 PolarHBondContact O-N 3.46Å; I55-W134 HydrophobicContact CD1-CD2 4.1Å; I55-W134 HydrophobicContact CD1-CG 3.86Å; I55-W134 VanDerWaalsContact CD1-NE1 3.3Å; I55-W134 VanDerWaalsContact CG1-CD1 3.49Å; I55-W134 HydrophobicContact CG1-CG 4.18Å; W64-W134 HydrophobicContact CH2-CD2 4.09Å; W64-W134 AromaticContact CH2-CE3 3.94Å; W64-W134 HydrophobicContact CH2-CE3 3.94Å; W64-W134 HydrophobicContact CH2-CZ3 4.21Å; W64-W134 HydrophobicContact CZ2-CB 4.29Å; W64-W134 HydrophobicContact CZ2-CD2 4.05Å; W64-W134 HydrophobicContact CZ2-CE3 4Å; W64-W134 HydrophobicContact CZ2-CG 4.19Å; W87-W134 HydrophobicContact CB-CD2 3.97Å; W87-W134 HydrophobicContact CB-CE3 4.2Å; W87-W134 HydrophobicContact CB-CH2 4.04Å; W87-W134 HydrophobicContact CB-CZ2 3.8Å; W87-W134 HydrophobicContact CB-CZ3 4.24Å; W87-W134 AromaticContact CD1-CD1 3.72Å; W87-W134 AromaticContact CD1-CE2 3.64Å; W87-W134 AromaticContact CD1-NE1 3.25Å; W87-W134 AromaticContact CG-CE2 3.98Å; W87-W134 HydrophobicContact CG-CZ2 4.12Å; L126-W134 HydrophobicContact CD2-CH2 3.28Å; L126-W134 HydrophobicContact CD2-CZ2 3.78Å; L126-W134 HydrophobicContact CD2-CZ3 4.04Å; P129-W134 HydrophobicContact CB-CZ2 4.23Å; A130-W134 HydrophobicContact CB-CZ2 4.46Å; A130-W134 PolarHBondContact O-NE1 2.88Å; W134-L232 HydrophobicContact CH2-CD1 4.28Å; W134-L232 HydrophobicContact CH2-CG 4.4Å; W134-L232 HydrophobicContact CZ3-CD1 3.74Å; W134-L232 HydrophobicContact CZ3-CG 4.34Å
135	F	94.2	Very high	88.6	Confident	2 Å²	2	30.9 Å²	30.9	1%	0.009	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	130.6	-176.5	-67.2	-94.8	0	0	0	110.6	L50 Q51 R52 L85 R86 A89 P90 D133 Y493	L50-F135 HydrophobicContact CD1-CB 4.11Å; L50-F135 HydrophobicContact CD1-CD1 4.1Å; L50-F135 HydrophobicContact CD2-CD1 4.32Å; L50-F135 HydrophobicContact CG-CD1 4.3Å; Q51-F135 WeakPolarHBondContact O-CA 3.27Å; R52-F135 HydrophobicContact CB-CD1 4.18Å; R52-F135 HydrophobicContact CB-CE1 3.99Å; R52-F135 HydrophobicContact CG-CD1 4.26Å; R52-F135 HydrophobicContact CG-CE1 3.79Å; R52-F135 HydrophobicContact CG-CZ 3.94Å; L85-F135 WeakPolarHBondContact CA-O 3.3Å; R86-F135 PolarHBondContact N-O 3.14Å; R86-F135 VanDerWaalsContact N-O 3.07Å; R86-F135 PolarHBondContact O-N 2.87Å; A89-F135 VanDerWaalsContact O-CD2 3.32Å; A89-F135 WeakPolarHBondContact O-CD2 3.5Å; P90-F135 HydrophobicContact CB-CD1 4.41Å; P90-F135 HydrophobicContact CG-CD1 3.9Å; P90-F135 HydrophobicContact CG-CE1 3.98Å; P90-F135 HydrophobicContact CG-CG 4.27Å; P90-F135 HydrophobicContact CG-CZ 4.41Å; D133-F135 HydrophobicContact CB-CE2 3.91Å; D133-F135 HydrophobicContact CB-CZ 4.37Å; F135-Y493 HydrophobicContact CD1-CE1 4.49Å; F135-Y493 AromaticContact CE1-CD1 3.81Å; F135-Y493 HydrophobicContact CE1-CD1 3.81Å; F135-Y493 HydrophobicContact CE1-CD2 4Å; F135-Y493 AromaticContact CE1-CE1 3.64Å; F135-Y493 HydrophobicContact CE1-CE1 3.64Å; F135-Y493 AromaticContact CE1-CE2 3.86Å; F135-Y493 HydrophobicContact CE1-CE2 3.86Å; F135-Y493 AromaticContact CE1-CG 3.97Å; F135-Y493 HydrophobicContact CE1-CG 3.97Å; F135-Y493 AromaticContact CE1-CZ 3.68Å; F135-Y493 HydrophobicContact CZ-CD2 4.07Å; F135-Y493 HydrophobicContact CZ-CE1 4.2Å; F135-Y493 AromaticContact CZ-CE2 3.67Å; F135-Y493 HydrophobicContact CZ-CE2 3.67Å; F135-Y493 AromaticContact CZ-CZ 3.74Å
136	V	95.4	Very high	87.3	Confident	1 Å²	1	34.9 Å²	34.9	1%	0.006	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	123.4	176.6	-174.1	0	0	0	0	108.3	L50 Q51 F53 F66 I83 H84 L85 F159	L50-V136 CarbonylContact C-O 3.47Å; L50-V136 WeakPolarHBondContact CA-O 3.44Å; Q51-V136 PolarHBondContact N-O 2.91Å; Q51-V136 PolarHBondContact O-N 2.74Å; F53-V136 HydrophobicContact CD2-CG2 3.87Å; F53-V136 HydrophobicContact CE2-CG2 3.91Å; F66-V136 HydrophobicContact CE1-CG1 3.79Å; F66-V136 HydrophobicContact CE1-CG2 4.34Å; F66-V136 HydrophobicContact CZ-CG1 4.3Å; I83-V136 HydrophobicContact CG2-CG1 3.82Å; H84-V136 CarbonylContact O-C 3.57Å; H84-V136 WeakPolarHBondContact O-CA 3.43Å; L85-V136 HydrophobicContact CD1-CG1 4.22Å; L85-V136 HydrophobicContact CD2-CG2 4.4Å; L85-V136 HydrophobicContact CG-CG2 4.11Å; V136-F159 HydrophobicContact CG1-CE1 4.28Å; V136-F159 HydrophobicContact CG1-CZ 4.05Å
137	A	95.3	Very high	85.8	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	129.8	178.2	0	0	0	0	0	109.9	V48 R49 L50 I83 H84 P91	V48-A137 HydrophobicContact CG1-CB 3.37Å; R49-A137 WeakPolarHBondContact O-CA 3.28Å; L50-A137 HydrophobicContact CD1-CB 4.29Å; I83-A137 CarbonylContact C-O 3.57Å; I83-A137 VanDerWaalsContact CA-O 3.32Å; I83-A137 WeakPolarHBondContact CA-O 3.42Å; H84-A137 HydrophobicContact CB-CB 4.22Å; H84-A137 PolarHBondContact N-O 2.91Å; H84-A137 PolarHBondContact O-N 3.44Å; P91-A137 HydrophobicContact CG-CB 3.42Å; P91-A137 VanDerWaalsContact CG-CB 3.42Å
138	A	95.6	Very high	84.6	Confident	0 Å²	0	39 Å²	39	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	140.5	175.8	0	0	0	0	0	112.3	L39 R49 V81 S82 I83 F159	L39-A138 HydrophobicContact CD2-CB 3.92Å; R49-A138 PolarHBondContact N-O 2.76Å; R49-A138 PolarHBondContact O-N 2.77Å; V81-A138 HydrophobicContact CG1-CB 4.5Å; S82-A138 WeakPolarHBondContact O-CA 3.49Å; I83-A138 HydrophobicContact CG1-CB 4.39Å; A138-F159 HydrophobicContact CB-CD1 3.56Å; A138-F159 HydrophobicContact CB-CD2 4.14Å; A138-F159 HydrophobicContact CB-CE1 3.58Å; A138-F159 HydrophobicContact CB-CE2 4.16Å; A138-F159 HydrophobicContact CB-CG 3.84Å; A138-F159 HydrophobicContact CB-CZ 3.89Å
139	H	94.2	Very high	83.2	Confident	3 Å²	3	40.5 Å²	40.5	1%	0.014	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.3	161.8	177.6	67.2	91.1	0	0	0	112.2	Y42 V48 S82 H84	Y42-H139 HydrophobicContact CD2-CB 4.3Å; Y42-H139 AromaticContact CD2-CG 3.93Å; Y42-H139 AromaticContact CD2-ND1 3.9Å; V48-H139 HydrophobicContact CG2-CB 4.31Å; S82-H139 PolarHBondContact N-O 2.84Å; S82-H139 VanDerWaalsContact N-O 3.15Å; S82-H139 PolarHBondContact O-N 2.9Å; S82-H139 VanDerWaalsContact O-N 3.12Å; H84-H139 AromaticContact CD2-CD2 3.93Å; H84-H139 AromaticContact CD2-NE2 3.83Å; H84-H139 AromaticContact NE2-CD2 3.7Å; H84-H139 AromaticContact NE2-NE2 3.12Å; H84-H139 PolarHBondContact NE2-NE2 3.3Å; H84-H139 VanDerWaalsContact NE2-NE2 3.12Å
140	L	91.3	Very high	81.6	Confident	11 Å²	11	46 Å²	46	6%	0.058	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	167.8	166.5	-70.4	162.6	0	0	0	110	L39 S40 K41 Y42 H79 V81 Y157	L39-L140 HydrophobicContact CB-CD1 3.93Å; L39-L140 HydrophobicContact CB-CG 3.93Å; L39-L140 HydrophobicContact CD1-CG 4.34Å; S40-L140 WeakPolarHBondContact O-CB 3.41Å; S40-L140 PolarHBondContact O-N 3.31Å; K41-L140 HydrophobicContact CG-CB 4.38Å; Y42-L140 WeakPolarHBondContact CB-O 3.38Å; Y42-L140 PolarHBondContact N-O 3.25Å; H79-L140 HydrophobicContact CB-CD2 4.13Å; V81-L140 HydrophobicContact CG2-CD2 3.82Å; L140-Y157 HydrophobicContact CD1-CD2 3.7Å; L140-Y157 HydrophobicContact CD1-CE2 4.45Å; L140-Y157 HydrophobicContact CD1-CG 4.39Å; L140-Y157 HydrophobicContact CD2-CD2 3.86Å; L140-Y157 HydrophobicContact CD2-CE2 4.34Å; L140-Y157 HydrophobicContact CD2-CG 4.1Å; L140-Y157 HydrophobicContact CG-CD2 4.42Å
141	P	88.4	Confident	79.9	Confident	54 Å²	54	48.3 Å²	48.3	35%	0.351	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.9	172.5	176.2	-24.7	36.3	0	0	0	113.6	K41 Y42 N80	K41-P141 CarbonylContact C-O 3.55Å; K41-P141 VanDerWaalsContact CA-O 3.31Å; K41-P141 WeakPolarHBondContact CA-O 3.27Å; K41-P141 WeakPolarHBondContact CB-O 3.37Å; Y42-P141 PolarHBondContact N-O 2.95Å; N80-P141 WeakPolarHBondContact O-CD 3.45Å
142	E	83.9	Confident	78.4	Confident	94 Å²	94	51.4 Å²	51.4	44%	0.439	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-53.4	146	179.8	-169.4	174.3	-170.7	0	0	111.8	Y42 T96 D144 K505	Y42-E142 WeakPolarHBondContact O-CA 3.33Å; T96-E142 HydrophobicContact CG2-CB 4.24Å; T96-E142 HydrophobicContact CG2-CG 4Å; E142-D144 PolarHBondContact O-N 3Å; E142-K505 IonicContact OE1-NZ 2.69Å; E142-K505 PolarHBondContact OE1-NZ 3Å
143	D	72.1	Confident	76.8	Confident	69 Å²	69	54.6 Å²	54.6	37%	0.369	28%	0.284	S	S	.	.	P	Polyproline II helix	trans	-68.5	124.4	178.4	-158.1	-11.1	0	0	0	111.5	K41 Y42 G145	K41-D143 HydrophobicContact CB-CB 3.96Å; K41-D143 HydrophobicContact CD-CB 4.24Å; K41-D143 WeakPolarHBondContact CD-OD1 2.96Å; K41-D143 IonicContact NZ-OD1 3.02Å; K41-D143 PolarHBondContact NZ-OD1 2.95Å; Y42-D143 PolarHBondContact O-N 3.19Å; D143-G145 PolarHBondContact O-N 2.72Å; D143-G145 VanDerWaalsContact O-N 3.08Å; D143-G145 PolarHBondContact OD1-N 3.44Å
144	D	69	Low	75.7	Confident	108 Å²	108	54.9 Å²	54.9	58%	0.578	29%	0.289	S	S	*	.			trans	-70.9	7.6	177.5	26.9	-53.3	0	0	0	113.7	K41 E142 R146	K41-D144 WeakPolarHBondContact CD-OD1 3.46Å; K41-D144 VanDerWaalsContact CE-OD1 3.27Å; K41-D144 WeakPolarHBondContact CE-OD1 3.37Å; K41-D144 IonicContact NZ-OD1 3.58Å; K41-D144 PolarHBondContact NZ-OD1 3.18Å; K41-D144 IonicContact NZ-OD2 2.74Å; K41-D144 PolarHBondContact NZ-OD2 3.01Å; E142-D144 PolarHBondContact O-N 3Å; D144-R146 PolarHBondContact O-N 3.04Å
145	G	64.6	Low	74.9	Confident	18 Å²	18	56.8 Å²	56.8	19%	0.186	30%	0.302	C	S	.	.			trans	68.1	16.5	172.3	0	0	0	0	0	114.1	D143 E692	D143-G145 PolarHBondContact O-N 2.72Å; D143-G145 VanDerWaalsContact O-N 3.08Å; D143-G145 PolarHBondContact OD1-N 3.44Å; G145-E692 WeakPolarHBondContact O-CG 3.37Å; G145-E692 PolarHBondContact O-N 3.17Å; G145-E692 VanDerWaalsContact O-N 3.14Å
146	R	67.3	Low	74.5	Confident	173 Å²	173	57.1 Å²	57.1	65%	0.653	30%	0.304	S	S	*	.			trans	-91	122.8	179.3	-171.4	179.8	-177	-180	1.5	109.5	D144 E148	D144-R146 PolarHBondContact O-N 3.04Å; R146-E148 PolarHBondContact O-N 3.15Å; R146-E148 VanDerWaalsContact O-N 3.17Å
147	I	60.4	Low	74.2	Confident	71 Å²	71	57.3 Å²	57.3	36%	0.364	31%	0.305	S	S	.	.			trans	-74.7	108.6	175.5	-60.9	169.6	0	0	0	108.1	E690 E692 Y695	I147-E690 HydrophobicContact CD1-CG 4.12Å; I147-E692 HydrophobicContact CD1-CG 4.29Å; I147-E692 HydrophobicContact CG1-CG 3.9Å; I147-Y695 HydrophobicContact CD1-CD2 4.46Å
148	E	64.6	Low	74	Confident	102 Å²	102	61.8 Å²	61.8	48%	0.477	32%	0.322	S	S	.	.			trans	-85.6	123.2	174.6	-69.5	-174.4	179.8	0	0	110.7	R146 K150 S154	R146-E148 PolarHBondContact O-N 3.15Å; R146-E148 VanDerWaalsContact O-N 3.17Å; E148-K150 PolarHBondContact O-N 2.94Å; E148-S154 WeakPolarHBondContact OE2-CB 3.5Å; E148-S154 PolarHBondContact OE2-OG 3.44Å
149	Q	58.6	Low	73.9	Confident	37 Å²	37	61.8 Å²	61.8	17%	0.173	32%	0.322	C	S	.	.			trans	-77.3	122.1	179.1	-148.4	174.7	33	0	0	110.6	G151 F152 Y686	Q149-G151 PolarHBondContact O-N 3.36Å; Q149-F152 HydrophobicContact CB-CD2 4.19Å; Q149-F152 PolarHBondContact O-N 3.33Å; Q149-Y686 VanDerWaalsContact NE2-CD1 3.34Å
150	K	58.6	Low	74	Confident	116 Å²	116	63.9 Å²	63.9	50%	0.504	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.9	115.6	-177.1	-172.2	-178.6	179.4	-172	0	110.3	E148 D628 K630 L632	E148-K150 PolarHBondContact O-N 2.94Å; K150-D628 WeakPolarHBondContact CD-OD2 3.39Å; K150-D628 WeakPolarHBondContact CE-OD2 3.32Å; K150-D628 IonicContact NZ-OD1 2.98Å; K150-D628 PolarHBondContact NZ-OD1 3.09Å; K150-D628 IonicContact NZ-OD2 3.55Å; K150-D628 PolarHBondContact NZ-OD2 2.93Å; K150-K630 HydrophobicContact CB-CB 4.41Å; K150-K630 WeakPolarHBondContact CB-O 3.39Å; K150-K630 HydrophobicContact CD-CB 4.27Å; K150-L632 WeakPolarHBondContact O-CB 3.17Å; K150-L632 PolarHBondContact O-N 2.92Å
151	G	56.1	Low	74.2	Confident	51 Å²	51	63.3 Å²	63.3	53%	0.526	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	127.6	-16.3	-177.9	0	0	0	0	0	114.1	Q149	Q149-G151 PolarHBondContact O-N 3.36Å
152	F	59.1	Low	74.6	Confident	111 Å²	111	63.1 Å²	63.1	49%	0.487	32%	0.324	S	S	.	.	S	Bend	trans	-83.6	150.1	163.1	-76.2	-83.3	0	0	0	110.6	Q149 S154 L632	Q149-F152 HydrophobicContact CB-CD2 4.19Å; Q149-F152 PolarHBondContact O-N 3.33Å; F152-S154 PolarHBondContact O-N 3.3Å; F152-L632 HydrophobicContact CD2-CD2 3.91Å; F152-L632 HydrophobicContact CE2-CD1 4.45Å; F152-L632 HydrophobicContact CE2-CD2 3.42Å; F152-L632 VanDerWaalsContact CE2-CD2 3.42Å; F152-L632 HydrophobicContact CZ-CD2 3.9Å
153	P	59.3	Low	75.2	Confident	88 Å²	88	58.7 Å²	58.7	57%	0.571	30%	0.303	S	S	*	.			trans	-63.5	105.2	176.1	24.4	-30.9	0	0	0	109.6
154	S	67.9	Low	76.3	Confident	42 Å²	42	57.2 Å²	57.2	29%	0.294	30%	0.298	S	S	.	.			trans	-105.5	155.5	172.7	75.4	0	0	0	0	112.2	E148 F152 S156	E148-S154 WeakPolarHBondContact OE2-CB 3.5Å; E148-S154 PolarHBondContact OE2-OG 3.44Å; F152-S154 PolarHBondContact O-N 3.3Å; S154-S156 PolarHBondContact O-N 2.9Å
155	C	78.1	Confident	77.5	Confident	41 Å²	41	52.3 Å²	52.3	28%	0.277	27%	0.272	S	S	.	.			trans	-73.7	110.9	-173.6	-62	0	0	0	0	110.4	C76 Y157	C76-C155 WeakPolarHBondContact CA-SG 3.28Å; C76-C155 HydrophobicContact CB-CB 3.63Å; C76-C155 WeakPolarHBondContact CB-SG 3.36Å; C76-C155 WeakPolarHBondContact SG-CA 3.24Å; C76-C155 WeakPolarHBondContact SG-CB 3.02Å; C76-C155 CovalentContact SG-SG 2Å; C76-C155 PolarHBondContact SG-SG 3.2Å; C155-Y157 HydrophobicContact CB-CE2 3.9Å
156	S	84.8	Confident	78.9	Confident	9 Å²	9	54.4 Å²	54.4	6%	0.063	27%	0.274	C	S	.	.			trans	-105.8	133.3	176.8	54.9	0	0	0	0	110.8	G71 S154	G71-S156 WeakPolarHBondContact CA-OG 3.07Å; G71-S156 PolarHBondContact N-O 2.76Å; S154-S156 PolarHBondContact O-N 2.9Å
157	Y	88.4	Confident	80	Confident	6 Å²	6	49.5 Å²	49.5	2%	0.024	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	129.6	176.9	-60.3	-85.4	0	0	0	108.5	K38 L39 K70 C76 G77 H79 V116 L140 C155	K38-Y157 CarbonylContact C-O 3.49Å; K38-Y157 WeakPolarHBondContact CA-O 2.98Å; L39-Y157 PolarHBondContact N-O 2.84Å; K70-Y157 HydrophobicContact CG-CE1 4.24Å; C76-Y157 WeakPolarHBondContact CB-OH 3.42Å; G77-Y157 PolarHBondContact O-OH 2.79Å; H79-Y157 AromaticContact CD2-CZ 3.84Å; H79-Y157 PolarHBondContact CD2-OH 2.89Å; V116-Y157 HydrophobicContact CB-CD1 4.35Å; V116-Y157 HydrophobicContact CB-CE1 4.26Å; V116-Y157 HydrophobicContact CG1-CD1 3.83Å; V116-Y157 HydrophobicContact CG1-CE1 3.9Å; L140-Y157 HydrophobicContact CD1-CD2 3.7Å; L140-Y157 HydrophobicContact CD1-CE2 4.45Å; L140-Y157 HydrophobicContact CD1-CG 4.39Å; L140-Y157 HydrophobicContact CD2-CD2 3.86Å; L140-Y157 HydrophobicContact CD2-CE2 4.34Å; L140-Y157 HydrophobicContact CD2-CG 4.1Å; L140-Y157 HydrophobicContact CG-CD2 4.42Å; C155-Y157 HydrophobicContact CB-CE2 3.9Å
158	Y	91.9	Very high	81.3	Confident	93 Å²	93	46.2 Å²	46.2	37%	0.365	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	120.7	-178.7	-68	-93	0	0	0	109.7	Q37 K38 V68 K69	Q37-Y158 CarbonylContact O-C 3.56Å; Q37-Y158 WeakPolarHBondContact O-CA 3.35Å; K38-Y158 HydrophobicContact CB-CD1 4.18Å; K38-Y158 HydrophobicContact CB-CE1 3.87Å; V68-Y158 CarbonylContact C-O 3.58Å; V68-Y158 VanDerWaalsContact CA-O 3.32Å; V68-Y158 WeakPolarHBondContact CA-O 3.2Å; K69-Y158 PolarHBondContact N-O 2.86Å; K69-Y158 PolarHBondContact O-N 2.84Å
159	F	94.4	Very high	82.3	Confident	0 Å²	0	43 Å²	43	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	130	178.5	174.3	-111.2	0	0	0	110.7	A36 Q37 L39 F66 V68 I83 V136 A138 P161	A36-F159 CarbonylContact C-O 3.55Å; A36-F159 WeakPolarHBondContact CA-O 3.03Å; Q37-F159 PolarHBondContact N-O 3.37Å; Q37-F159 PolarHBondContact O-N 3.4Å; L39-F159 HydrophobicContact CD1-CB 4Å; L39-F159 HydrophobicContact CD2-CB 3.64Å; L39-F159 HydrophobicContact CD2-CG 4.36Å; L39-F159 HydrophobicContact CG-CB 3.8Å; F66-F159 HydrophobicContact CB-CE2 4.02Å; F66-F159 AromaticContact CD1-CE2 3.98Å; F66-F159 HydrophobicContact CD1-CE2 3.98Å; F66-F159 AromaticContact CD1-CZ 3.75Å; F66-F159 HydrophobicContact CD1-CZ 3.75Å; F66-F159 HydrophobicContact CE1-CZ 4.39Å; F66-F159 HydrophobicContact CG-CE2 4.3Å; F66-F159 HydrophobicContact CG-CZ 4.46Å; V68-F159 HydrophobicContact CG2-CD2 3.83Å; I83-F159 HydrophobicContact CD1-CE2 3.81Å; I83-F159 HydrophobicContact CD1-CZ 4.49Å; I83-F159 HydrophobicContact CG1-CE2 4.09Å; I83-F159 HydrophobicContact CG1-CZ 4.49Å; I83-F159 HydrophobicContact CG2-CZ 4.25Å; V136-F159 HydrophobicContact CG1-CE1 4.28Å; V136-F159 HydrophobicContact CG1-CZ 4.05Å; A138-F159 HydrophobicContact CB-CD1 3.56Å; A138-F159 HydrophobicContact CB-CD2 4.14Å; A138-F159 HydrophobicContact CB-CE1 3.58Å; A138-F159 HydrophobicContact CB-CE2 4.16Å; A138-F159 HydrophobicContact CB-CG 3.84Å; A138-F159 HydrophobicContact CB-CZ 3.89Å; F159-P161 HydrophobicContact CD1-CG 4.4Å; F159-P161 HydrophobicContact CE1-CB 4.05Å; F159-P161 HydrophobicContact CE1-CG 3.69Å; F159-P161 HydrophobicContact CZ-CB 3.89Å; F159-P161 HydrophobicContact CZ-CG 4.06Å
160	Q	95.3	Very high	83.6	Confident	47 Å²	47	46.1 Å²	46.1	22%	0.22	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	110.8	177.2	-171.8	179.9	1.4	0	0	109.8	S33 K34 A36 S67	S33-Q160 PolarHBondContact OG-NE2 3.33Å; K34-Q160 WeakPolarHBondContact O-CG 3.02Å; A36-Q160 HydrophobicContact CB-CB 3.99Å; A36-Q160 HydrophobicContact CB-CG 4.4Å; S67-Q160 PolarHBondContact N-O 3.39Å; S67-Q160 PolarHBondContact O-N 3.17Å
161	P	95.6	Very high	84.9	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	144.7	170.3	34.6	-31.1	0	0	0	111.7	K34 F53 L65 F66 F159	K34-P161 HydrophobicContact CB-CG 4.25Å; K34-P161 PolarHBondContact N-O 3.21Å; F53-P161 HydrophobicContact CE2-CB 4.11Å; F53-P161 HydrophobicContact CE2-CG 4Å; F53-P161 HydrophobicContact CZ-CB 3.93Å; F53-P161 HydrophobicContact CZ-CG 3.86Å; L65-P161 WeakPolarHBondContact O-CA 3.37Å; F66-P161 HydrophobicContact CD1-CB 3.72Å; F66-P161 HydrophobicContact CE1-CB 3.88Å; F159-P161 HydrophobicContact CD1-CG 4.4Å; F159-P161 HydrophobicContact CE1-CB 4.05Å; F159-P161 HydrophobicContact CE1-CG 3.69Å; F159-P161 HydrophobicContact CZ-CB 3.89Å; F159-P161 HydrophobicContact CZ-CG 4.06Å
162	Q	96.2	Very high	86.6	Confident	49 Å²	49	40.7 Å²	40.7	23%	0.229	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	147.1	174.9	-50.8	-173.7	-73.6	0	0	108.5	S32 S33 W64 L65	S32-Q162 CarbonylContact O-C 3.54Å; S32-Q162 WeakPolarHBondContact O-CA 3.41Å; S33-Q162 PolarHBondContact OG-NE2 2.82Å; W64-Q162 CarbonylContact C-O 3.56Å; W64-Q162 VanDerWaalsContact CA-O 3.27Å; W64-Q162 WeakPolarHBondContact CA-O 3.41Å; L65-Q162 HydrophobicContact CB-CB 4.44Å; L65-Q162 PolarHBondContact N-O 3.02Å; L65-Q162 PolarHBondContact O-N 3.32Å
163	L	96.1	Very high	88.2	Confident	2 Å²	2	38.2 Å²	38.2	1%	0.01	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	126.7	-179.5	169.3	62	0	0	0	108.7	S32 F53 I55 A62 R63 W64 V165	S32-L163 PolarHBondContact N-O 3.06Å; S32-L163 PolarHBondContact O-N 2.98Å; F53-L163 HydrophobicContact CB-CD2 3.77Å; F53-L163 HydrophobicContact CD1-CB 3.61Å; F53-L163 HydrophobicContact CD1-CD2 3.76Å; F53-L163 HydrophobicContact CD1-CG 4.33Å; F53-L163 HydrophobicContact CE1-CB 3.73Å; F53-L163 HydrophobicContact CG-CB 4.38Å; F53-L163 HydrophobicContact CG-CD2 4.03Å; I55-L163 HydrophobicContact CG1-CD2 4.43Å; A62-L163 HydrophobicContact CB-CD1 4.03Å; R63-L163 WeakPolarHBondContact O-CA 3.32Å; W64-L163 HydrophobicContact CD2-CD1 3.88Å; W64-L163 HydrophobicContact CE3-CD1 4.41Å; W64-L163 HydrophobicContact CG-CD1 4.17Å; W64-L163 HydrophobicContact CZ2-CD1 4.14Å; L163-V165 HydrophobicContact CD1-CG2 3.98Å; L163-V165 HydrophobicContact CD2-CG2 3.87Å; L163-V165 HydrophobicContact CG-CG2 3.79Å
164	S	95.9	Very high	89.7	Confident	38 Å²	38	34.1 Å²	34.1	27%	0.266	18%	0.182	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	127.1	166.7	175.4	0	0	0	0	109	E30 R63	E30-S164 WeakPolarHBondContact O-CA 3.44Å; R63-S164 PolarHBondContact N-O 3.09Å; R63-S164 PolarHBondContact O-N 3.07Å
165	V	94.7	Very high	90.8	Very high	5 Å²	5	37.7 Å²	37.7	3%	0.03	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	134.3	179.8	171.1	0	0	0	0	108	S29 E30 T59 L163	S29-V165 CarbonylContact C-O 3.58Å; S29-V165 VanDerWaalsContact CA-O 3.31Å; S29-V165 WeakPolarHBondContact CA-O 3.42Å; E30-V165 HydrophobicContact CB-CB 4.31Å; E30-V165 PolarHBondContact N-O 2.78Å; E30-V165 PolarHBondContact O-N 3.48Å; T59-V165 HydrophobicContact CG2-CG1 3.59Å; T59-V165 WeakPolarHBondContact OG1-CG1 2.77Å; L163-V165 HydrophobicContact CD1-CG2 3.98Å; L163-V165 HydrophobicContact CD2-CG2 3.87Å; L163-V165 HydrophobicContact CG-CG2 3.79Å
166	R	92.9	Very high	91.1	Very high	61 Å²	61	38.9 Å²	38.9	23%	0.23	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	114.5	167.7	-172.3	176.5	175	177.6	-0.8	108.4	F27 E28 A60 V61	F27-R166 HydrophobicContact CB-CG 4.09Å; F27-R166 HydrophobicContact CD1-CG 3.72Å; F27-R166 HydrophobicContact CE1-CG 4.49Å; F27-R166 HydrophobicContact CG-CG 4.14Å; F27-R166 VanDerWaalsContact CG-NE 3.28Å; E28-R166 CarbonylContact O-C 3.55Å; E28-R166 WeakPolarHBondContact O-CA 3.5Å; A60-R166 PolarHBondContact N-O 2.87Å; V61-R166 HydrophobicContact CB-CB 4.46Å; V61-R166 PolarHBondContact N-O 3.04Å; V61-R166 PolarHBondContact O-N 2.84Å
167	R	90.6	Very high	91	Very high	71 Å²	71	41.7 Å²	41.7	27%	0.268	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	138.4	-175	-178.6	-177.8	174.9	178.9	-2.8	110.9	F27 E28 E57 Q58	F27-R167 CarbonylContact C-O 3.21Å; F27-R167 VanDerWaalsContact CA-O 3.3Å; F27-R167 WeakPolarHBondContact CA-O 3.46Å; F27-R167 WeakPolarHBondContact CD1-O 2.63Å; E28-R167 PolarHBondContact N-O 2.84Å; E28-R167 PolarHBondContact O-N 3.42Å; E57-R167 PolarHBondContact O-NE 2.87Å; Q58-R167 HydrophobicContact CB-CG 4.44Å
168	A	89.4	Confident	91	Very high	1 Å²	1	44.3 Å²	44.3	1%	0.008	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	115.5	169.7	0	0	0	0	0	109.4	V25 F27 Q58 T171	V25-A168 HydrophobicContact CG1-CB 3.69Å; F27-A168 HydrophobicContact CD1-CB 4.43Å; F27-A168 HydrophobicContact CE1-CB 4.09Å; Q58-A168 WeakPolarHBondContact CB-O 3.49Å; Q58-A168 PolarHBondContact O-N 2.92Å; Q58-A168 PolarHBondContact OE1-O 2.94Å; A168-T171 WeakPolarHBondContact CB-OG1 3.31Å; A168-T171 PolarHBondContact O-OG1 2.98Å
169	A	84.6	Confident	90.9	Very high	34 Å²	34	44.2 Å²	44.2	28%	0.281	26%	0.258	S	S	.	.	S	Bend	trans	-75.2	-44.1	-177.3	0	0	0	0	0	112.2	T26 E28 T171	T26-A169 PolarHBondContact O-N 2.98Å; E28-A169 HydrophobicContact CG-CB 4.49Å; A169-T171 PolarHBondContact O-N 2.79Å
170	D	85.2	Confident	90.8	Very high	103 Å²	103	46.7 Å²	46.7	55%	0.551	27%	0.27	S	S	*	.	S	Bend	trans	-104.5	49.6	-170.6	-55.8	-51.4	0	0	0	112.2	T26 P172	T26-D170 VanDerWaalsContact CB-OD2 3.3Å; T26-D170 WeakPolarHBondContact CB-OD2 3.27Å; T26-D170 PolarHBondContact OG1-OD2 3.07Å; D170-P172 VanDerWaalsContact O-CD 3.28Å; D170-P172 WeakPolarHBondContact O-CD 3.42Å
171	T	87.6	Confident	90.6	Very high	17 Å²	17	48.9 Å²	48.9	10%	0.104	29%	0.287	C	S	.	.	P	Polyproline II helix	trans	-71.4	117.7	-177.4	-54.3	0	0	0	0	110.9	Q58 A168 A169 K193	Q58-T171 PolarHBondContact OE1-OG1 3.02Å; A168-T171 WeakPolarHBondContact CB-OG1 3.31Å; A168-T171 PolarHBondContact O-OG1 2.98Å; A169-T171 PolarHBondContact O-N 2.79Å; T171-K193 HydrophobicContact CG2-CB 4.39Å; T171-K193 HydrophobicContact CG2-CD 4.47Å; T171-K193 HydrophobicContact CG2-CG 4.27Å
172	P	90.2	Very high	90.3	Very high	37 Å²	37	50.2 Å²	50.2	24%	0.24	29%	0.293	C	S	.	.	P	Polyproline II helix	trans	-65.6	143.9	-178.4	25.7	-34.8	0	0	0	112.7	D170 R191 L192 K193	D170-P172 VanDerWaalsContact O-CD 3.28Å; D170-P172 WeakPolarHBondContact O-CD 3.42Å; P172-R191 WeakPolarHBondContact CD-O 3.5Å; P172-L192 HydrophobicContact CG-CD2 4.21Å; P172-L192 HydrophobicContact CG-CG 4.03Å; P172-L192 WeakPolarHBondContact O-CA 3.27Å; P172-K193 PolarHBondContact O-N 2.9Å
173	V	92.4	Very high	89.9	Confident	58 Å²	58	50.4 Å²	50.4	35%	0.352	30%	0.298	S	S	.	.	B	Isolated β-bridge	trans	-95.3	121	179.4	-180	0	0	0	0	110.2	Q175 K193 W258	V173-Q175 HydrophobicContact CG1-CG 4.34Å; V173-Q175 PolarHBondContact O-N 3.31Å; V173-K193 CarbonylContact C-O 3.55Å; V173-K193 WeakPolarHBondContact CA-O 3.43Å; V173-K193 HydrophobicContact CG2-CD 4.31Å; V173-K193 HydrophobicContact CG2-CG 4.02Å; V173-W258 HydrophobicContact CG1-CH2 4.39Å; V173-W258 HydrophobicContact CG1-CZ3 4.07Å; V173-W258 HydrophobicContact CG2-CZ3 4.36Å
174	L	92	Very high	89.5	Confident	2 Å²	2	50.4 Å²	50.4	1%	0.01	30%	0.298	C	S	.	.			trans	-84.8	96	174.7	-174.8	64	0	0	0	109.9	L180 L192 K193 L194 V205 I276	L174-L180 HydrophobicContact CD1-CD1 3.9Å; L174-L180 HydrophobicContact CD1-CG 4.27Å; L174-L192 HydrophobicContact CB-CD2 4.42Å; L174-K193 PolarHBondContact N-O 2.86Å; L174-L194 HydrophobicContact CB-CB 4.36Å; L174-V205 HydrophobicContact CD2-CG1 4.27Å; L174-I276 HydrophobicContact CD1-CG1 4.42Å; L174-I276 HydrophobicContact CD1-CG2 4.24Å; L174-I276 HydrophobicContact CD2-CD1 4.22Å; L174-I276 HydrophobicContact CD2-CG1 3.95Å
175	Q	89.7	Confident	88.9	Confident	117 Å²	117	49 Å²	49	55%	0.547	29%	0.288	S	S	.	.			trans	-73.8	142.4	177.7	-69.6	-177.8	-12.3	0	0	111.7	V173 G177 T178	V173-Q175 HydrophobicContact CG1-CG 4.34Å; V173-Q175 PolarHBondContact O-N 3.31Å; Q175-G177 PolarHBondContact O-N 2.93Å; Q175-T178 PolarHBondContact O-N 2.98Å
176	P	86.3	Confident	88.3	Confident	67 Å²	67	51.3 Å²	51.3	44%	0.435	30%	0.304	S	S	.	.	B	Isolated β-bridge	trans	-57.8	136	177.4	-16.7	26.2	0	0	0	111.8	T178 F280	P176-T178 PolarHBondContact O-N 2.74Å; P176-T178 VanDerWaalsContact O-N 3.12Å; P176-F280 HydrophobicContact CB-CD1 3.99Å; P176-F280 HydrophobicContact CB-CE1 3.61Å; P176-F280 HydrophobicContact CB-CZ 4.36Å; P176-F280 HydrophobicContact CG-CD1 3.86Å; P176-F280 HydrophobicContact CG-CE1 3.27Å; P176-F280 HydrophobicContact CG-CZ 4.22Å
177	G	82.3	Confident	87.7	Confident	68 Å²	68	53.8 Å²	53.8	70%	0.701	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.7	-3.2	178.8	0	0	0	0	0	115.2	Q175 S278	Q175-G177 PolarHBondContact O-N 2.93Å; G177-S278 PolarHBondContact N-O 2.76Å
178	T	88.2	Confident	87.3	Confident	60 Å²	60	55.2 Å²	55.2	37%	0.368	33%	0.327	S	S	.	.			trans	-100.2	136.1	176.1	-54.9	0	0	0	0	109.8	Q175 P176	Q175-T178 PolarHBondContact O-N 2.98Å; P176-T178 PolarHBondContact O-N 2.74Å; P176-T178 VanDerWaalsContact O-N 3.12Å
179	V	90.4	Very high	87.3	Confident	92 Å²	92	55.8 Å²	55.8	56%	0.558	33%	0.331	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.3	124.2	178.3	-176.8	0	0	0	0	109.3	R275 I276	V179-R275 HydrophobicContact CG1-CB 3.69Å; V179-R275 HydrophobicContact CG1-CG 4.31Å; V179-I276 CarbonylContact C-O 3.54Å; V179-I276 WeakPolarHBondContact CA-O 3.3Å
180	L	90.9	Very high	87.5	Confident	51 Å²	51	54.4 Å²	54.4	27%	0.267	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	143.4	177.3	-65.9	173.2	0	0	0	110.3	L174 L192 R275 I276	L174-L180 HydrophobicContact CD1-CD1 3.9Å; L174-L180 HydrophobicContact CD1-CG 4.27Å; L180-L192 HydrophobicContact CD1-CD2 4.21Å; L180-R275 CarbonylContact O-C 3.59Å; L180-R275 VanDerWaalsContact O-CA 3.32Å; L180-R275 WeakPolarHBondContact O-CA 3.42Å; L180-I276 HydrophobicContact CB-CG2 4.15Å; L180-I276 PolarHBondContact N-O 3.39Å; L180-I276 PolarHBondContact O-N 3.42Å
181	T	90.7	Very high	87.8	Confident	93 Å²	93	51 Å²	51	57%	0.571	30%	0.299	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.1	126.1	173	-55.4	0	0	0	0	109	F274	T181-F274 CarbonylContact C-O 3.56Å; T181-F274 WeakPolarHBondContact CA-O 3.32Å
182	Q	90	Very high	88	Confident	28 Å²	28	50.2 Å²	50.2	13%	0.131	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	166.2	-175.2	-69.9	-70.8	75.7	0	0	111.3	A190 L192 T273 F274 I276	Q182-A190 HydrophobicContact CB-CB 4.46Å; Q182-L192 HydrophobicContact CG-CD2 4.16Å; Q182-T273 CarbonylContact O-C 3.49Å; Q182-T273 WeakPolarHBondContact O-CA 3.42Å; Q182-F274 HydrophobicContact CB-CD2 4.49Å; Q182-F274 HydrophobicContact CB-CE1 4.07Å; Q182-F274 HydrophobicContact CB-CE2 3.82Å; Q182-F274 HydrophobicContact CB-CZ 3.57Å; Q182-F274 PolarHBondContact N-O 3.42Å; Q182-F274 PolarHBondContact O-N 3.09Å; Q182-I276 HydrophobicContact CG-CG2 4.3Å
183	T	88.6	Confident	88.1	Confident	54 Å²	54	50.4 Å²	50.4	33%	0.331	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	133.5	179.3	35.3	0	0	0	0	109.8	Q24 V272 T273	Q24-T183 VanDerWaalsContact CD-OG1 3.27Å; Q24-T183 PolarHBondContact NE2-OG1 3.25Å; Q24-T183 PolarHBondContact OE1-O 3.44Å; Q24-T183 PolarHBondContact OE1-OG1 3.5Å; T183-V272 WeakPolarHBondContact CA-O 3.4Å; T183-T273 HydrophobicContact CG2-CG2 3.38Å
184	A	86.9	Confident	88.1	Confident	2 Å²	2	47.8 Å²	47.8	2%	0.017	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	143	175.2	0	0	0	0	0	111.3	A190 L223 V263 T271 V272 F274	A184-A190 HydrophobicContact CB-CB 4.16Å; A184-L223 HydrophobicContact CB-CD2 4.45Å; A184-V263 VanDerWaalsContact CB-O 3.31Å; A184-V263 WeakPolarHBondContact CB-O 3.09Å; A184-T271 WeakPolarHBondContact O-CA 3.43Å; A184-V272 PolarHBondContact N-O 2.87Å; A184-V272 PolarHBondContact O-N 2.76Å; A184-F274 HydrophobicContact CB-CE1 3.71Å
185	A	83.9	Confident	88.1	Confident	7 Å²	7	51.7 Å²	51.7	6%	0.058	29%	0.292	C	S	.	.			trans	-128.7	166.5	169.3	0	0	0	0	0	109.6	D187 R188 T271	A185-D187 VanDerWaalsContact C-N 3.33Å; A185-D187 PolarHBondContact O-N 3.46Å; A185-R188 HydrophobicContact CB-CB 4Å; A185-R188 HydrophobicContact CB-CG 4.32Å; A185-R188 PolarHBondContact N-O 3.01Å; A185-R188 CarbonylContact O-C 3.5Å; A185-R188 PolarHBondContact O-N 1.98Å; A185-T271 HydrophobicContact CB-CG2 4.02Å
186	P	80.8	Confident	88.3	Confident	55 Å²	55	46.1 Å²	46.1	36%	0.357	27%	0.266	S	S	.	.	S	Bend	trans	-62	-36.9	179.5	-24.4	36	0	0	0	114	Q267	P186-Q267 WeakPolarHBondContact CG-O 3.34Å
187	D	80	Confident	88.4	Confident	113 Å²	113	44.9 Å²	44.9	60%	0.604	26%	0.258	S	S	*	.	S	Bend	trans	-90.3	-16.3	176.8	61.4	-37.8	0	0	0	112.7	A185 P189	A185-D187 VanDerWaalsContact C-N 3.33Å; A185-D187 PolarHBondContact O-N 3.46Å; D187-P189 WeakPolarHBondContact O-CD 3.4Å
188	R	82.8	Confident	88.6	Confident	100 Å²	100	46 Å²	46	38%	0.377	25%	0.245	S	C	.	.	S	Bend	trans	-126.3	73.7	-177.3	-43.8	-167.4	173.3	-174	-14.8	111.1	D21 D22 A185	D21-R188 PolarHBondContact O-NH1 3.14Å; D21-R188 PolarHBondContact O-NH2 2.87Å; D22-R188 VanDerWaalsContact OD1-CD 3.22Å; D22-R188 WeakPolarHBondContact OD1-CD 3Å; D22-R188 WeakPolarHBondContact OD1-CG 3.32Å; D22-R188 IonicContact OD1-CZ 3.81Å; D22-R188 IonicContact OD1-NE 3.14Å; D22-R188 PolarHBondContact OD1-NE 3.01Å; D22-R188 VanDerWaalsContact OD1-NE 3.14Å; A185-R188 HydrophobicContact CB-CB 4Å; A185-R188 HydrophobicContact CB-CG 4.32Å; A185-R188 PolarHBondContact N-O 3.01Å; A185-R188 CarbonylContact O-C 3.5Å; A185-R188 PolarHBondContact O-N 1.98Å
189	P	88.8	Confident	88.4	Confident	13 Å²	13	46 Å²	46	8%	0.084	24%	0.24	C	C	.	.			trans	-72.2	139.9	-179.9	32	-36.5	0	0	0	110.4	D187 R191 V262 V263 E264	D187-P189 WeakPolarHBondContact O-CD 3.4Å; P189-R191 VanDerWaalsContact CG-NH2 3.3Å; P189-R191 PolarHBondContact O-N 2.84Å; P189-R191 PolarHBondContact O-NH1 2.93Å; P189-V262 HydrophobicContact CB-CG1 3.84Å; P189-V262 HydrophobicContact CG-CG1 4.42Å; P189-V263 CarbonylContact C-O 3.51Å; P189-V263 WeakPolarHBondContact CA-O 3.45Å; P189-E264 HydrophobicContact CB-CB 4.16Å; P189-E264 HydrophobicContact CB-CG 3.59Å
190	A	90.1	Very high	88.3	Confident	5 Å²	5	41.7 Å²	41.7	4%	0.041	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	117.9	176	0	0	0	0	0	109.2	Q182 A184 L192 V262 V263 F274	Q182-A190 HydrophobicContact CB-CB 4.46Å; A184-A190 HydrophobicContact CB-CB 4.16Å; A190-L192 HydrophobicContact CB-CD1 4.33Å; A190-V262 WeakPolarHBondContact O-CA 3.27Å; A190-V263 HydrophobicContact CB-CB 4.36Å; A190-V263 PolarHBondContact N-O 2.93Å; A190-V263 PolarHBondContact O-N 3.37Å; A190-F274 HydrophobicContact CB-CE1 4.28Å; A190-F274 HydrophobicContact CB-CZ 3.85Å
191	R	91.1	Very high	88.1	Confident	33 Å²	33	41.1 Å²	41.1	13%	0.125	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	123.8	-179.7	-64.7	179.5	179.3	85.2	-1.9	109.6	D128 P172 P189 V262	D128-R191 IonicContact OD1-NE 3.37Å; D128-R191 PolarHBondContact OD1-NE 2.84Å; P172-R191 WeakPolarHBondContact CD-O 3.5Å; P189-R191 VanDerWaalsContact CG-NH2 3.3Å; P189-R191 PolarHBondContact O-N 2.84Å; P189-R191 PolarHBondContact O-NH1 2.93Å; R191-V262 HydrophobicContact CG-CG2 4.46Å
192	L	91.8	Very high	88	Confident	0 Å²	0	38.4 Å²	38.4	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	162.7	176.4	-57.4	98.2	0	0	0	110.1	P172 L174 L180 Q182 A190 V261 I276	P172-L192 HydrophobicContact CG-CD2 4.21Å; P172-L192 HydrophobicContact CG-CG 4.03Å; P172-L192 WeakPolarHBondContact O-CA 3.27Å; L174-L192 HydrophobicContact CB-CD2 4.42Å; L180-L192 HydrophobicContact CD1-CD2 4.21Å; Q182-L192 HydrophobicContact CG-CD2 4.16Å; A190-L192 HydrophobicContact CB-CD1 4.33Å; L192-V261 HydrophobicContact CB-CB 4.3Å; L192-V261 PolarHBondContact N-O 2.91Å; L192-V261 PolarHBondContact O-N 2.78Å; L192-V261 VanDerWaalsContact O-O 3.12Å; L192-I276 HydrophobicContact CD1-CD1 4.45Å; L192-I276 HydrophobicContact CD2-CG2 4.11Å
193	K	92	Very high	88.1	Confident	40 Å²	40	37.2 Å²	37.2	17%	0.174	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	145.9	171.2	65.1	-176.9	-178.8	-178.4	0	111	Q58 T171 P172 V173 L174 W258 L259	Q58-K193 HydrophobicContact CG-CD 4.44Å; T171-K193 HydrophobicContact CG2-CB 4.39Å; T171-K193 HydrophobicContact CG2-CD 4.47Å; T171-K193 HydrophobicContact CG2-CG 4.27Å; P172-K193 PolarHBondContact O-N 2.9Å; V173-K193 CarbonylContact C-O 3.55Å; V173-K193 WeakPolarHBondContact CA-O 3.43Å; V173-K193 HydrophobicContact CG2-CD 4.31Å; V173-K193 HydrophobicContact CG2-CG 4.02Å; L174-K193 PolarHBondContact N-O 2.86Å; K193-W258 HydrophobicContact CB-CE3 4.14Å; K193-W258 HydrophobicContact CD-CE3 3.94Å; K193-W258 HydrophobicContact CD-CZ3 4.1Å; K193-W258 HydrophobicContact CG-CE3 3.95Å; K193-W258 HydrophobicContact CG-CZ3 4Å; K193-L259 WeakPolarHBondContact CA-O 3.46Å
194	L	93.1	Very high	88.3	Confident	4 Å²	4	36.3 Å²	36.3	2%	0.021	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	145.7	171.3	68.5	90.1	0	0	0	109.1	L174 V196 L203 V205 W258 L259 V261	L174-L194 HydrophobicContact CB-CB 4.36Å; L194-V196 HydrophobicContact CD1-CG2 3.58Å; L194-L203 HydrophobicContact CD1-CD1 4.04Å; L194-L203 HydrophobicContact CD1-CD2 3.63Å; L194-L203 HydrophobicContact CD2-CD1 4.41Å; L194-L203 HydrophobicContact CD2-CD2 4.02Å; L194-L203 HydrophobicContact CG-CD2 4.47Å; L194-V205 HydrophobicContact CD2-CG2 3.86Å; L194-W258 CarbonylContact O-C 3.51Å; L194-W258 WeakPolarHBondContact O-CA 3.49Å; L194-L259 HydrophobicContact CD1-CB 3.81Å; L194-L259 HydrophobicContact CD1-CD2 4.19Å; L194-L259 HydrophobicContact CD2-CD2 4.35Å; L194-L259 HydrophobicContact CG-CB 3.99Å; L194-L259 HydrophobicContact CG-CD2 4.44Å; L194-L259 PolarHBondContact N-O 2.8Å; L194-L259 PolarHBondContact O-N 2.81Å; L194-V261 HydrophobicContact CD2-CG2 3.48Å; L194-V261 VanDerWaalsContact CD2-CG2 3.48Å; L194-V261 HydrophobicContact CG-CG2 4.28Å
195	F	92.8	Very high	88.6	Confident	83 Å²	83	36.2 Å²	36.2	36%	0.364	19%	0.189	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	131.8	176	-178.4	-103.7	0	0	0	109.7	P197 D256 W258	F195-P197 HydrophobicContact CE1-CB 4.46Å; F195-D256 VanDerWaalsContact CZ-OD1 3.28Å; F195-D256 WeakPolarHBondContact CZ-OD1 3.27Å; F195-W258 HydrophobicContact CB-CD2 4.16Å; F195-W258 HydrophobicContact CB-CE3 3.85Å; F195-W258 HydrophobicContact CB-CH2 3.9Å; F195-W258 HydrophobicContact CB-CZ2 4.18Å; F195-W258 HydrophobicContact CB-CZ3 3.73Å; F195-W258 HydrophobicContact CD2-CD2 4.01Å; F195-W258 AromaticContact CD2-CE2 3.79Å; F195-W258 HydrophobicContact CD2-CG 4.28Å; F195-W258 HydrophobicContact CD2-CZ2 4.19Å; F195-W258 AromaticContact CD2-NE1 3.9Å; F195-W258 HydrophobicContact CG-CZ2 4.47Å
196	V	91.9	Very high	89	Confident	1 Å²	1	38.2 Å²	38.2	1%	0.006	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	110.2	177.4	-177.5	0	0	0	0	108.7	L194 T200 L203 P253 P254 D256 S257 L259	L194-V196 HydrophobicContact CD1-CG2 3.58Å; V196-T200 HydrophobicContact CG1-CG2 4.28Å; V196-L203 HydrophobicContact CG2-CD2 4.28Å; V196-P253 HydrophobicContact CG1-CB 3.96Å; V196-P253 HydrophobicContact CG1-CG 3.8Å; V196-P253 HydrophobicContact CG2-CB 4.48Å; V196-P254 VanDerWaalsContact CB-O 3.23Å; V196-P254 WeakPolarHBondContact CB-O 3.43Å; V196-P254 WeakPolarHBondContact CG1-O 3.34Å; V196-D256 WeakPolarHBondContact O-CA 3.47Å; V196-D256 PolarHBondContact O-N 3.03Å; V196-S257 PolarHBondContact N-O 3.04Å; V196-S257 PolarHBondContact O-N 3.36Å; V196-L259 HydrophobicContact CG2-CB 4.03Å
197	P	90.4	Very high	89.6	Confident	40 Å²	40	35.6 Å²	35.6	26%	0.26	19%	0.185	S	C	.	.			trans	-71.5	158.5	177.2	29.3	-32.2	0	0	0	111.4	F195 T200 F280	F195-P197 HydrophobicContact CE1-CB 4.46Å; P197-T200 WeakPolarHBondContact CG-OG1 3.37Å; P197-T200 WeakPolarHBondContact O-CB 3.5Å; P197-T200 PolarHBondContact O-OG1 2.84Å; P197-F280 HydrophobicContact CG-CE1 4.23Å; P197-F280 HydrophobicContact CG-CZ 4.31Å
198	E	85.9	Confident	90	Very high	93 Å²	93	32 Å²	32	44%	0.435	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.2	153.7	172.5	-63.7	-166.7	140.1	0	0	112.1	T200 W255 D256	E198-T200 PolarHBondContact O-N 3.31Å; E198-W255 HydrophobicContact CG-CB 4.38Å; E198-D256 HydrophobicContact CG-CB 4.12Å
199	F	83.6	Confident	90.2	Very high	59 Å²	59	29.7 Å²	29.7	26%	0.259	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	66.2	12.3	-179.1	-41.8	-67	0	0	0	115.1	S201 W255 G283 P286	F199-S201 PolarHBondContact O-N 2.88Å; F199-W255 AromaticContact CD1-CH2 3.83Å; F199-W255 HydrophobicContact CD1-CH2 3.83Å; F199-W255 HydrophobicContact CD1-CZ2 4.46Å; F199-W255 HydrophobicContact CD1-CZ3 4.01Å; F199-W255 HydrophobicContact CE1-CH2 4.36Å; F199-W255 HydrophobicContact CE1-CZ3 4.14Å; F199-G283 WeakPolarHBondContact O-CA 3.09Å; F199-G283 PolarHBondContact O-N 3.44Å; F199-P286 HydrophobicContact CD1-CG 4.08Å; F199-P286 VanDerWaalsContact CE1-CD 3.46Å; F199-P286 HydrophobicContact CE1-CG 3.46Å; F199-P286 VanDerWaalsContact CE1-CG 3.46Å; F199-P286 HydrophobicContact CZ-CG 3.83Å
200	T	87.6	Confident	90.1	Very high	2 Å²	2	30.4 Å²	30.4	1%	0.012	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	125.8	172.4	-58.2	0	0	0	0	110.2	V196 P197 E198 P253 W255 F280	V196-T200 HydrophobicContact CG1-CG2 4.28Å; P197-T200 WeakPolarHBondContact CG-OG1 3.37Å; P197-T200 WeakPolarHBondContact O-CB 3.5Å; P197-T200 PolarHBondContact O-OG1 2.84Å; E198-T200 PolarHBondContact O-N 3.31Å; T200-P253 HydrophobicContact CG2-CG 3.54Å; T200-W255 PolarHBondContact O-NE1 3.45Å; T200-F280 HydrophobicContact CG2-CB 3.9Å
201	S	86.4	Confident	89.8	Confident	38 Å²	38	33.3 Å²	33.3	27%	0.266	20%	0.203	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	-35.3	178.5	57.3	0	0	0	0	113	F199 N252 T281 G283	F199-S201 PolarHBondContact O-N 2.88Å; S201-N252 PolarHBondContact O-N 3.12Å; S201-T281 PolarHBondContact N-O 2.78Å; S201-T281 PolarHBondContact OG-O 2.89Å; S201-T281 PolarHBondContact OG-OG1 2.84Å; S201-G283 WeakPolarHBondContact OG-CA 3.34Å; S201-G283 PolarHBondContact OG-N 3.42Å
202	S	89.9	Confident	89	Confident	36 Å²	36	33.3 Å²	33.3	25%	0.252	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-146	141.4	177	-172.1	0	0	0	0	110.3	L250 F280 T281	S202-L250 WeakPolarHBondContact CA-O 3.25Å; S202-F280 WeakPolarHBondContact O-CA 2.92Å; S202-T281 WeakPolarHBondContact CB-OG1 3.46Å; S202-T281 PolarHBondContact N-OG1 2.97Å; S202-T281 PolarHBondContact O-N 2.91Å; S202-T281 PolarHBondContact O-OG1 3.23Å
203	L	91.6	Very high	87.7	Confident	4 Å²	4	36.5 Å²	36.5	2%	0.021	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	132.3	173.7	170.7	70.7	0	0	0	108.4	L194 V196 S249 L250 P253 L259 F280	L194-L203 HydrophobicContact CD1-CD1 4.04Å; L194-L203 HydrophobicContact CD1-CD2 3.63Å; L194-L203 HydrophobicContact CD2-CD1 4.41Å; L194-L203 HydrophobicContact CD2-CD2 4.02Å; L194-L203 HydrophobicContact CG-CD2 4.47Å; V196-L203 HydrophobicContact CG2-CD2 4.28Å; L203-S249 CarbonylContact O-C 3.56Å; L203-S249 VanDerWaalsContact O-CA 3.27Å; L203-S249 WeakPolarHBondContact O-CA 3.4Å; L203-L250 HydrophobicContact CB-CB 4.37Å; L203-L250 PolarHBondContact N-O 3.03Å; L203-L250 PolarHBondContact O-N 2.74Å; L203-P253 HydrophobicContact CB-CB 4.26Å; L203-P253 HydrophobicContact CB-CG 4.13Å; L203-L259 HydrophobicContact CD2-CD2 3.33Å; L203-F280 HydrophobicContact CD1-CB 4.33Å
204	S	92.8	Very high	85.9	Confident	35 Å²	35	44.6 Å²	44.6	25%	0.245	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	133.7	174.9	62.2	0	0	0	0	110.7	A248 S278 N279	S204-A248 CarbonylContact C-O 3.56Å; S204-A248 WeakPolarHBondContact CA-O 3.35Å; S204-S278 CarbonylContact O-C 3.54Å; S204-S278 WeakPolarHBondContact O-CA 3.46Å; S204-N279 PolarHBondContact N-O 2.96Å; S204-N279 PolarHBondContact O-N 2.9Å; S204-N279 VanDerWaalsContact O-O 3.09Å; S204-N279 PolarHBondContact OG-O 3.13Å
205	V	93.6	Very high	83.8	Confident	0 Å²	0	47.3 Å²	47.3	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	120.8	174	179.7	0	0	0	0	107.6	L174 L194 L225 L227 T247 A248 V261 I276 G277	L174-V205 HydrophobicContact CD2-CG1 4.27Å; L194-V205 HydrophobicContact CD2-CG2 3.86Å; V205-L225 HydrophobicContact CG1-CD1 4.37Å; V205-L225 HydrophobicContact CG1-CD2 4.3Å; V205-L227 HydrophobicContact CB-CD2 4.23Å; V205-L227 HydrophobicContact CG2-CD1 4.45Å; V205-L227 HydrophobicContact CG2-CD2 3.91Å; V205-T247 CarbonylContact O-C 3.57Å; V205-T247 WeakPolarHBondContact O-CA 3.24Å; V205-A248 PolarHBondContact N-O 2.89Å; V205-A248 PolarHBondContact O-N 2.87Å; V205-V261 HydrophobicContact CG1-CG1 4.37Å; V205-I276 HydrophobicContact CG1-CD1 3.77Å; V205-I276 HydrophobicContact CG1-CG1 3.95Å; V205-G277 WeakPolarHBondContact CA-O 3.28Å
206	S	92.4	Very high	81.9	Confident	49 Å²	49	51.7 Å²	51.7	34%	0.343	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	140.8	-178	61.2	0	0	0	0	111.5	C246 I276 G277	S206-C246 CarbonylContact C-O 3.58Å; S206-C246 VanDerWaalsContact CA-O 3.3Å; S206-C246 WeakPolarHBondContact CA-O 3.39Å; S206-I276 CarbonylContact O-C 3.56Å; S206-I276 VanDerWaalsContact O-CA 3.32Å; S206-I276 WeakPolarHBondContact O-CA 3.32Å; S206-G277 PolarHBondContact N-O 3.31Å; S206-G277 PolarHBondContact O-N 2.8Å
207	V	92	Very high	79.9	Confident	0 Å²	0	59.8 Å²	59.8	0%	0	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	131.9	174.5	-179.4	0	0	0	0	108.6	L223 L225 S245 C246 F274 R275 I276	V207-L223 HydrophobicContact CG1-CD1 3.77Å; V207-L225 HydrophobicContact CG2-CD2 4.39Å; V207-S245 CarbonylContact O-C 3.58Å; V207-S245 VanDerWaalsContact O-CA 3.26Å; V207-S245 WeakPolarHBondContact O-CA 3.31Å; V207-C246 PolarHBondContact N-O 3.45Å; V207-C246 PolarHBondContact O-N 2.78Å; V207-F274 HydrophobicContact CG1-CB 3.88Å; V207-F274 HydrophobicContact CG1-CD2 3.65Å; V207-F274 HydrophobicContact CG1-CG 3.98Å; V207-R275 CarbonylContact C-O 3.54Å; V207-R275 VanDerWaalsContact CA-O 3.31Å; V207-R275 WeakPolarHBondContact CA-O 3.36Å; V207-I276 HydrophobicContact CG2-CB 4.36Å; V207-I276 HydrophobicContact CG2-CD1 4.05Å; V207-I276 HydrophobicContact CG2-CG1 4.12Å
208	A	90.1	Very high	78.2	Confident	38 Å²	38	63.8 Å²	63.8	31%	0.314	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151	170.7	-177.3	0	0	0	0	0	111.9	R275	A208-R275 PolarHBondContact N-O 2.9Å; A208-R275 WeakPolarHBondContact O-CB 3.28Å; A208-R275 PolarHBondContact O-N 3.18Å
209	G	85.8	Confident	76.9	Confident	50 Å²	50	62.6 Å²	62.6	52%	0.515	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	63.1	45.7	172	0	0	0	0	0	113
210	C	86.6	Confident	76.2	Confident	29 Å²	29	61.2 Å²	61.2	20%	0.196	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	136.7	179.5	-60.9	0	0	0	0	111.4	C221 V272 T273	C210-C221 HydrophobicContact CB-CB 3.89Å; C210-C221 WeakPolarHBondContact CB-SG 3.4Å; C210-C221 VanDerWaalsContact SG-CA 3.58Å; C210-C221 WeakPolarHBondContact SG-CB 3.37Å; C210-C221 CovalentContact SG-SG 2.02Å; C210-C221 PolarHBondContact SG-SG 2.68Å; C210-V272 HydrophobicContact CB-CG1 3.97Å; C210-T273 CarbonylContact C-O 3.57Å; C210-T273 VanDerWaalsContact CA-O 3.28Å; C210-T273 WeakPolarHBondContact CA-O 3.29Å
211	S	83.9	Confident	75.7	Confident	65 Å²	65	61.2 Å²	61.2	46%	0.455	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	134.1	168.6	46.1	0	0	0	0	110.3	T273	S211-T273 PolarHBondContact N-O 3.15Å; S211-T273 PolarHBondContact O-N 3Å; S211-T273 PolarHBondContact O-OG1 2.76Å; S211-T273 PolarHBondContact OG-OG1 3.4Å
212	S	74.9	Confident	75.7	Confident	33 Å²	33	60.8 Å²	60.8	23%	0.231	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	139.9	167.7	54.2	0	0	0	0	108.5	E214	S212-E214 PolarHBondContact O-N 2.89Å
213	G	63.5	Low	75.6	Confident	68 Å²	68	59.1 Å²	59.1	70%	0.701	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.2	124.6	177.7	0	0	0	0	0	110.7
214	E	54.9	Low	75.5	Confident	210 Å²	210	60.4 Å²	60.4	98%	0.981	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	96.8	1.3	174.1	-55.6	-169.6	159.5	0	0	120.1	S212	S212-E214 PolarHBondContact O-N 2.89Å
215	A	50	Low	75.5	Confident	61 Å²	61	58.8 Å²	58.8	50%	0.504	39%	0.385	S	S	.	.			trans	-117	106.6	170.9	0	0	0	0	0	112.9
216	L	50.9	Low	75.3	Confident	174 Å²	174	61.1 Å²	61.1	91%	0.911	39%	0.393	S	S	*	.			trans	-68.8	125.5	157.4	-130.1	81.8	0	0	0	106.5
217	E	51.3	Low	75.3	Confident	172 Å²	172	58.8 Å²	58.8	80%	0.804	38%	0.377	S	S	*	.	S	Bend	trans	104.3	102.7	176.3	-56.6	-175.5	170.6	0	0	116.7	A219	E217-A219 PolarHBondContact O-N 2.76Å
218	S	54.8	Low	75.1	Confident	124 Å²	124	58.8 Å²	58.8	87%	0.867	38%	0.378	S	S	*	.			trans	10.5	67.3	158.9	63.1	0	0	0	0	119.6
219	A	58.1	Low	75.1	Confident	68 Å²	68	58.3 Å²	58.3	56%	0.562	37%	0.372	S	S	*	.			trans	-88.5	131	160.8	0	0	0	0	0	109.5	E217	E217-A219 PolarHBondContact O-N 2.76Å
220	G	68.8	Low	75.1	Confident	30 Å²	30	56.4 Å²	56.4	31%	0.309	35%	0.351	S	S	.	.			trans	-54.8	153.3	-177.5	0	0	0	0	0	114	S222 G243	G220-S222 PolarHBondContact O-N 3.28Å; G220-G243 CarbonylContact C-O 3.56Å; G220-G243 WeakPolarHBondContact CA-O 3.35Å
221	C	76.6	Confident	74.8	Confident	2 Å²	2	55.2 Å²	55.2	1%	0.014	34%	0.343	C	S	.	.			trans	-60.6	101.8	176.5	-69.2	0	0	0	0	110.2	C210 L223 C241 S242 G243	C210-C221 HydrophobicContact CB-CB 3.89Å; C210-C221 WeakPolarHBondContact CB-SG 3.4Å; C210-C221 VanDerWaalsContact SG-CA 3.58Å; C210-C221 WeakPolarHBondContact SG-CB 3.37Å; C210-C221 CovalentContact SG-SG 2.02Å; C210-C221 PolarHBondContact SG-SG 2.68Å; C221-L223 VanDerWaalsContact C-N 3.32Å; C221-L223 HydrophobicContact CB-CD1 4.39Å; C221-L223 PolarHBondContact O-N 3.38Å; C221-C241 HydrophobicContact CB-CB 4.33Å; C221-C241 CarbonylContact O-C 3.56Å; C221-S242 VanDerWaalsContact O-CA 3.27Å; C221-S242 WeakPolarHBondContact O-CA 3.32Å; C221-S242 PolarHBondContact O-N 2.97Å; C221-G243 WeakPolarHBondContact CB-O 3.48Å; C221-G243 PolarHBondContact N-O 2.91Å
222	S	86.3	Confident	74.4	Confident	28 Å²	28	55.6 Å²	55.6	20%	0.196	34%	0.34	C	S	.	.			trans	-86.6	69.9	173.4	-61.2	0	0	0	0	110.3	G220 S266 Q267	G220-S222 PolarHBondContact O-N 3.28Å; S222-S266 WeakPolarHBondContact CB-OG 3.35Å; S222-S266 PolarHBondContact O-N 2.68Å; S222-S266 PolarHBondContact O-OG 3.08Å; S222-S266 VanDerWaalsContact O-OG 3.06Å; S222-Q267 PolarHBondContact OG-NE2 2.77Å; S222-Q267 VanDerWaalsContact OG-NE2 3.09Å
223	L	89.1	Confident	73.9	Confident	1 Å²	1	57.4 Å²	57.4	1%	0.005	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	145.2	-172.5	-66	174.4	0	0	0	110.8	A184 V207 C221 C241 V263 E264 V272 F274	A184-L223 HydrophobicContact CB-CD2 4.45Å; V207-L223 HydrophobicContact CG1-CD1 3.77Å; C221-L223 VanDerWaalsContact C-N 3.32Å; C221-L223 HydrophobicContact CB-CD1 4.39Å; C221-L223 PolarHBondContact O-N 3.38Å; L223-C241 HydrophobicContact CB-CB 4.27Å; L223-C241 PolarHBondContact N-O 3.41Å; L223-C241 WeakPolarHBondContact O-CA 3.24Å; L223-C241 VanDerWaalsContact O-CB 3.24Å; L223-C241 WeakPolarHBondContact O-CB 3.41Å; L223-C241 PolarHBondContact O-N 3.13Å; L223-V263 HydrophobicContact CB-CG1 4.08Å; L223-V263 HydrophobicContact CD1-CG1 4.05Å; L223-V263 HydrophobicContact CD2-CG1 4.13Å; L223-V263 HydrophobicContact CG-CG1 4.32Å; L223-E264 CarbonylContact C-O 3.56Å; L223-E264 WeakPolarHBondContact CA-O 3.1Å; L223-V272 HydrophobicContact CD1-CG1 4.37Å; L223-V272 HydrophobicContact CD2-CB 3.93Å; L223-V272 HydrophobicContact CD2-CG1 4.06Å; L223-V272 HydrophobicContact CD2-CG2 4.39Å; L223-V272 HydrophobicContact CG-CG1 4.34Å; L223-F274 HydrophobicContact CD1-CB 3.85Å; L223-F274 HydrophobicContact CD1-CD1 3.76Å; L223-F274 HydrophobicContact CD1-CD2 4.47Å; L223-F274 HydrophobicContact CD1-CE1 4.46Å; L223-F274 HydrophobicContact CD1-CG 3.77Å; L223-F274 HydrophobicContact CD2-CD1 4.46Å
224	L	90	Very high	74	Confident	32 Å²	32	56 Å²	56	17%	0.168	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	113.4	169.9	-176.2	67	0	0	0	109	R226 E238 N240 V263 E264	L224-R226 HydrophobicContact CG-CG 4.38Å; L224-E238 HydrophobicContact CD1-CB 4.45Å; L224-N240 HydrophobicContact CD1-CB 4.45Å; L224-V263 WeakPolarHBondContact O-CA 3.15Å; L224-E264 HydrophobicContact CB-CB 4.46Å; L224-E264 PolarHBondContact N-O 2.77Å; L224-E264 PolarHBondContact O-N 3.07Å
225	L	91	Very high	74.5	Confident	1 Å²	1	48.3 Å²	48.3	1%	0.005	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	120.2	176.5	175.3	63.9	0	0	0	109.5	V205 V207 L227 E238 L239 A248 V261 V263	V205-L225 HydrophobicContact CG1-CD1 4.37Å; V205-L225 HydrophobicContact CG1-CD2 4.3Å; V207-L225 HydrophobicContact CG2-CD2 4.39Å; L225-L227 HydrophobicContact CD1-CD2 4.3Å; L225-E238 CarbonylContact O-C 2.86Å; L225-E238 WeakPolarHBondContact O-CA 3.33Å; L225-L239 HydrophobicContact CB-CB 4.49Å; L225-L239 PolarHBondContact N-O 2.95Å; L225-L239 PolarHBondContact O-N 3.22Å; L225-A248 HydrophobicContact CD2-CB 3.59Å; L225-A248 HydrophobicContact CG-CB 4.41Å; L225-V261 HydrophobicContact CD1-CG1 3.63Å; L225-V263 HydrophobicContact CD1-CG2 3.68Å
226	R	91	Very high	75.7	Confident	48 Å²	48	47.8 Å²	47.8	18%	0.181	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	127.3	174.9	-62.8	-173.2	165.6	128.1	6.1	110.7	L224 T237 E238 V261 V262 E264	L224-R226 HydrophobicContact CG-CG 4.38Å; R226-T237 WeakPolarHBondContact CA-O 3.21Å; R226-E238 HydrophobicContact CG-CG 4.05Å; R226-E238 IonicContact CZ-OE1 3.56Å; R226-E238 IonicContact NE-OE1 2.71Å; R226-E238 PolarHBondContact NE-OE1 3.08Å; R226-E238 IonicContact NH2-OE1 3.47Å; R226-E238 PolarHBondContact NH2-OE1 3.07Å; R226-V261 WeakPolarHBondContact O-CA 3.5Å; R226-V262 HydrophobicContact CB-CB 4.31Å; R226-V262 PolarHBondContact N-O 2.88Å; R226-V262 PolarHBondContact O-N 3.35Å; R226-E264 IonicContact CZ-OE2 3.88Å; R226-E264 IonicContact NH1-OE1 3.36Å; R226-E264 PolarHBondContact NH1-OE1 2.84Å; R226-E264 IonicContact NH1-OE2 3.11Å; R226-E264 PolarHBondContact NH1-OE2 2.85Å; R226-E264 IonicContact NH2-OE2 3.71Å
227	L	90.9	Very high	77.2	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	130.3	172.9	-57	178.1	0	0	0	110.2	V205 L225 T237 A248 V261	V205-L227 HydrophobicContact CB-CD2 4.23Å; V205-L227 HydrophobicContact CG2-CD1 4.45Å; V205-L227 HydrophobicContact CG2-CD2 3.91Å; L225-L227 HydrophobicContact CD1-CD2 4.3Å; L227-T237 PolarHBondContact N-O 2.95Å; L227-T237 PolarHBondContact O-N 3.11Å; L227-A248 HydrophobicContact CD1-CB 3.71Å; L227-A248 HydrophobicContact CG-CB 4.44Å; L227-V261 HydrophobicContact CD2-CB 4.24Å; L227-V261 HydrophobicContact CD2-CG1 3.92Å; L227-V261 HydrophobicContact CD2-CG2 3.7Å
228	G	88.9	Confident	78.9	Confident	1 Å²	1	38.2 Å²	38.2	1%	0.01	23%	0.23	C	C	.	.	S	Bend	trans	100.4	179.7	-179.9	0	0	0	0	0	114	Q236 R260	G228-Q236 PolarHBondContact O-NE2 3.12Å; G228-R260 PolarHBondContact N-O 2.89Å
229	S	89.2	Confident	80.5	Confident	27 Å²	27	35 Å²	35	19%	0.189	20%	0.203	C	C	.	.			trans	-116.6	150.2	-177.1	-52.4	0	0	0	0	111.3	A130	A130-S229 VanDerWaalsContact CA-CB 3.45Å
230	A	86.1	Confident	81.9	Confident	11 Å²	11	36.6 Å²	36.6	9%	0.091	20%	0.202	C	C	.	.	B	Isolated β-bridge	trans	-77.4	125.3	-179.2	0	0	0	0	0	110.8	L126 S127 D128 P129 A130	L126-A230 HydrophobicContact CD1-CB 3.84Å; L126-A230 HydrophobicContact CG-CB 4.25Å; S127-A230 WeakPolarHBondContact O-CB 3.46Å; D128-A230 PolarHBondContact O-N 3.32Å; P129-A230 CarbonylContact C-O 3.58Å; P129-A230 WeakPolarHBondContact CA-O 3.44Å; A130-A230 PolarHBondContact N-O 3.03Å
231	S	81.3	Confident	82.7	Confident	4 Å²	4	35.2 Å²	35.2	3%	0.028	19%	0.188	C	C	.	.			trans	-137.7	24.4	-178.5	52.2	0	0	0	0	112.6	Q233 H234	S231-Q233 PolarHBondContact O-N 3.34Å; S231-H234 VanDerWaalsContact OG-CB 3.27Å; S231-H234 WeakPolarHBondContact OG-CB 3.48Å; S231-H234 PolarHBondContact OG-ND1 2.57Å
232	L	75	Confident	83	Confident	73 Å²	73	39.2 Å²	39.2	38%	0.382	22%	0.216	S	C	.	.	S	Bend	trans	64.3	-30.2	-176.9	-60.6	160.5	0	0	0	115.6	L85 L110 F124 W134	L85-L232 HydrophobicContact CB-CD1 4.42Å; L110-L232 HydrophobicContact CB-CD1 3.63Å; L110-L232 HydrophobicContact CB-CD2 4.27Å; L110-L232 HydrophobicContact CB-CG 4.46Å; L110-L232 HydrophobicContact CD2-CD1 4.03Å; L110-L232 HydrophobicContact CD2-CD2 3.95Å; L110-L232 HydrophobicContact CG-CD1 4.46Å; F124-L232 HydrophobicContact CE2-CD2 4.37Å; F124-L232 HydrophobicContact CZ-CD2 3.76Å; W134-L232 HydrophobicContact CH2-CD1 4.28Å; W134-L232 HydrophobicContact CH2-CG 4.4Å; W134-L232 HydrophobicContact CZ3-CD1 3.74Å; W134-L232 HydrophobicContact CZ3-CG 4.34Å
233	Q	63.7	Low	82.6	Confident	70 Å²	70	39.7 Å²	39.7	33%	0.327	23%	0.225	S	C	.	.	S	Bend	trans	-109.9	-34.3	-173.7	-51.3	-133.5	-79.9	0	0	113.6	P108 S231	P108-Q233 VanDerWaalsContact CA-NE2 3.29Å; P108-Q233 VanDerWaalsContact CB-NE2 3.3Å; P108-Q233 PolarHBondContact O-NE2 2.69Å; P108-Q233 PolarHBondContact O-OE1 3.19Å; S231-Q233 PolarHBondContact O-N 3.34Å
234	H	66.9	Low	82.2	Confident	38 Å²	38	45.4 Å²	45.4	18%	0.176	26%	0.259	C	S	.	.	S	Bend	trans	-89.9	138.8	-172.1	-57.4	96.4	0	0	0	110.6	W87 S231 Q236 L418 F419 Q441	W87-H234 AromaticContact CE3-CE1 3.76Å; W87-H234 AromaticContact CE3-ND1 3.86Å; W87-H234 AromaticContact CZ3-CE1 3.59Å; W87-H234 AromaticContact CZ3-ND1 3.76Å; S231-H234 VanDerWaalsContact OG-CB 3.27Å; S231-H234 WeakPolarHBondContact OG-CB 3.48Å; S231-H234 PolarHBondContact OG-ND1 2.57Å; H234-Q236 PolarHBondContact O-N 3.37Å; H234-L418 WeakPolarHBondContact CB-O 3.4Å; H234-F419 AromaticContact CD2-CD1 3.27Å; H234-F419 WeakPolarHBondContact CD2-CD1 3.42Å; H234-F419 AromaticContact CD2-CE1 3.89Å; H234-F419 AromaticContact CG-CD1 3.79Å; H234-F419 AromaticContact CG-CE1 3.94Å; H234-F419 AromaticContact NE2-CD1 3.49Å; H234-F419 WeakPolarHBondContact NE2-CD1 3.01Å; H234-Q441 PolarHBondContact CE1-NE2 3.01Å
235	S	63.7	Low	82	Confident	50 Å²	50	47.6 Å²	47.6	35%	0.35	28%	0.277	S	S	.	.	P	Polyproline II helix	trans	-69.8	119	176.3	52.9	0	0	0	0	109.2	L418	S235-L418 WeakPolarHBondContact O-CD2 3.47Å
236	Q	77	Confident	81.9	Confident	50 Å²	50	48.2 Å²	48.2	23%	0.234	28%	0.282	C	S	.	.	P	Polyproline II helix	trans	-71.2	139	155.8	-68.8	178.1	-59.1	0	0	107.6	G228 H234 E238	G228-Q236 PolarHBondContact O-NE2 3.12Å; H234-Q236 PolarHBondContact O-N 3.37Å; Q236-E238 HydrophobicContact CB-CG 4.48Å; Q236-E238 PolarHBondContact O-N 3.06Å
237	T	82.1	Confident	81.9	Confident	41 Å²	41	49.8 Å²	49.8	25%	0.252	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	109.4	171.7	-48.5	0	0	0	0	107.3	R226 L227 L250	R226-T237 WeakPolarHBondContact CA-O 3.21Å; L227-T237 PolarHBondContact N-O 2.95Å; L227-T237 PolarHBondContact O-N 3.11Å; T237-L250 WeakPolarHBondContact OG1-CD1 3.32Å
238	E	87	Confident	81.8	Confident	103 Å²	103	50 Å²	50	48%	0.481	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	131	176.7	-50.5	-163.4	152.5	0	0	109.8	L224 L225 R226 Q236	L224-E238 HydrophobicContact CD1-CB 4.45Å; L225-E238 CarbonylContact O-C 2.86Å; L225-E238 WeakPolarHBondContact O-CA 3.33Å; R226-E238 HydrophobicContact CG-CG 4.05Å; R226-E238 IonicContact CZ-OE1 3.56Å; R226-E238 IonicContact NE-OE1 2.71Å; R226-E238 PolarHBondContact NE-OE1 3.08Å; R226-E238 IonicContact NH2-OE1 3.47Å; R226-E238 PolarHBondContact NH2-OE1 3.07Å; Q236-E238 HydrophobicContact CB-CG 4.48Å; Q236-E238 PolarHBondContact O-N 3.06Å
239	L	87.8	Confident	81.9	Confident	57 Å²	57	54 Å²	54	30%	0.298	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	118.3	175.5	-175.9	71.1	0	0	0	108.8	L225 C241 C246 A248	L225-L239 HydrophobicContact CB-CB 4.49Å; L225-L239 PolarHBondContact N-O 2.95Å; L225-L239 PolarHBondContact O-N 3.22Å; L239-C241 PolarHBondContact O-N 2.93Å; L239-C246 HydrophobicContact CD2-CB 4.16Å; L239-A248 HydrophobicContact CB-CB 4.33Å; L239-A248 HydrophobicContact CD2-CB 3.9Å
240	N	88.5	Confident	81.9	Confident	102 Å²	102	52.9 Å²	52.9	55%	0.545	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	110.6	171	-168.5	-0.6	0	0	0	108.8	L224	L224-N240 HydrophobicContact CD1-CB 4.45Å
241	C	85.6	Confident	82	Confident	1 Å²	1	55.8 Å²	55.8	1%	0.007	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	131.8	173.1	-55.3	0	0	0	0	108.2	C221 L223 L239 C246	C221-C241 HydrophobicContact CB-CB 4.33Å; C221-C241 CarbonylContact O-C 3.56Å; L223-C241 HydrophobicContact CB-CB 4.27Å; L223-C241 PolarHBondContact N-O 3.41Å; L223-C241 WeakPolarHBondContact O-CA 3.24Å; L223-C241 VanDerWaalsContact O-CB 3.24Å; L223-C241 WeakPolarHBondContact O-CB 3.41Å; L223-C241 PolarHBondContact O-N 3.13Å; L239-C241 PolarHBondContact O-N 2.93Å; C241-C246 HydrophobicContact CB-CB 3.6Å; C241-C246 WeakPolarHBondContact CB-SG 3.38Å; C241-C246 WeakPolarHBondContact SG-CB 3.34Å; C241-C246 CovalentContact SG-SG 2.02Å; C241-C246 PolarHBondContact SG-SG 2.8Å
242	S	82.4	Confident	82.3	Confident	86 Å²	86	57 Å²	57	60%	0.601	34%	0.344	S	S	*	.			trans	-139	-3.1	172.4	-41	0	0	0	0	113	C221	C221-S242 VanDerWaalsContact O-CA 3.27Å; C221-S242 WeakPolarHBondContact O-CA 3.32Å; C221-S242 PolarHBondContact O-N 2.97Å
243	G	78.3	Confident	83.1	Confident	38 Å²	38	53.5 Å²	53.5	39%	0.392	33%	0.326	S	S	.	.	S	Bend	trans	-101.1	-171.3	-177.9	0	0	0	0	0	113.7	G220 C221 S245	G220-G243 CarbonylContact C-O 3.56Å; G220-G243 WeakPolarHBondContact CA-O 3.35Å; C221-G243 WeakPolarHBondContact CB-O 3.48Å; C221-G243 PolarHBondContact N-O 2.91Å; G243-S245 VanDerWaalsContact C-N 3.34Å
244	V	80.8	Confident	84.4	Confident	120 Å²	120	50.5 Å²	50.5	73%	0.727	31%	0.312	S	S	*	.	S	Bend	trans	-68.7	-32.8	-179.8	-177.8	0	0	0	0	112.6
245	S	85	Confident	85.5	Confident	78 Å²	78	49.4 Å²	49.4	55%	0.545	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	146.8	173	59	0	0	0	0	109.4	V207 G243	V207-S245 CarbonylContact O-C 3.58Å; V207-S245 VanDerWaalsContact O-CA 3.26Å; V207-S245 WeakPolarHBondContact O-CA 3.31Å; G243-S245 VanDerWaalsContact C-N 3.34Å
246	C	88.6	Confident	86.8	Confident	15 Å²	15	52.2 Å²	52.2	10%	0.101	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	144	172.9	62.7	0	0	0	0	110.4	S206 V207 L239 C241	S206-C246 CarbonylContact C-O 3.58Å; S206-C246 VanDerWaalsContact CA-O 3.3Å; S206-C246 WeakPolarHBondContact CA-O 3.39Å; V207-C246 PolarHBondContact N-O 3.45Å; V207-C246 PolarHBondContact O-N 2.78Å; L239-C246 HydrophobicContact CD2-CB 4.16Å; C241-C246 HydrophobicContact CB-CB 3.6Å; C241-C246 WeakPolarHBondContact CB-SG 3.38Å; C241-C246 WeakPolarHBondContact SG-CB 3.34Å; C241-C246 CovalentContact SG-SG 2.02Å; C241-C246 PolarHBondContact SG-SG 2.8Å
247	T	90.4	Very high	87.5	Confident	80 Å²	80	50.6 Å²	50.6	49%	0.491	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	121.4	178	-55.2	0	0	0	0	108.8	V205	V205-T247 CarbonylContact O-C 3.57Å; V205-T247 WeakPolarHBondContact O-CA 3.24Å
248	A	90.1	Very high	87.9	Confident	5 Å²	5	53.8 Å²	53.8	4%	0.041	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	128.3	169.6	0	0	0	0	0	109.2	S204 V205 L225 L227 L239	S204-A248 CarbonylContact C-O 3.56Å; S204-A248 WeakPolarHBondContact CA-O 3.35Å; V205-A248 PolarHBondContact N-O 2.89Å; V205-A248 PolarHBondContact O-N 2.87Å; L225-A248 HydrophobicContact CD2-CB 3.59Å; L225-A248 HydrophobicContact CG-CB 4.41Å; L227-A248 HydrophobicContact CD1-CB 3.71Å; L227-A248 HydrophobicContact CG-CB 4.44Å; L239-A248 HydrophobicContact CB-CB 4.33Å; L239-A248 HydrophobicContact CD2-CB 3.9Å
249	S	89.9	Confident	88.1	Confident	84 Å²	84	49.3 Å²	49.3	59%	0.587	30%	0.298	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-113.8	134.1	176.3	58.6	0	0	0	0	111.1	L203	L203-S249 CarbonylContact O-C 3.56Å; L203-S249 VanDerWaalsContact O-CA 3.27Å; L203-S249 WeakPolarHBondContact O-CA 3.4Å
250	L	89.3	Confident	88.3	Confident	4 Å²	4	47.7 Å²	47.7	2%	0.021	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	111.8	179	-169.1	69	0	0	0	109.1	S202 L203 T237 P253 L259 G417 L418	S202-L250 WeakPolarHBondContact CA-O 3.25Å; L203-L250 HydrophobicContact CB-CB 4.37Å; L203-L250 PolarHBondContact N-O 3.03Å; L203-L250 PolarHBondContact O-N 2.74Å; T237-L250 WeakPolarHBondContact OG1-CD1 3.32Å; L250-P253 HydrophobicContact CD2-CB 3.89Å; L250-P253 HydrophobicContact CG-CB 4.35Å; L250-L259 HydrophobicContact CD2-CD2 4.05Å; L250-G417 VanDerWaalsContact CD1-C 3.47Å; L250-G417 WeakPolarHBondContact CD1-O 3.47Å; L250-L418 HydrophobicContact CD1-CD2 4.07Å; L250-L418 HydrophobicContact CD1-CG 4.16Å; L250-L418 HydrophobicContact CD2-CD1 4.04Å; L250-L418 HydrophobicContact CD2-CD2 4.39Å; L250-L418 HydrophobicContact CD2-CG 3.97Å
251	S	88.5	Confident	88.4	Confident	72 Å²	72	42.8 Å²	42.8	50%	0.503	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	143.4	173.7	51.2	0	0	0	0	110.9	G417	S251-G417 WeakPolarHBondContact O-CA 3.1Å; S251-G417 PolarHBondContact O-N 2.96Å
252	N	87.9	Confident	88.7	Confident	30 Å²	30	42.8 Å²	42.8	16%	0.16	26%	0.262	C	S	.	.	S	Bend	trans	45.7	61.2	-178.2	-53.7	-44.5	0	0	0	112.4	S201 G417	S201-N252 PolarHBondContact O-N 3.12Å; N252-G417 PolarHBondContact O-N 3.28Å
253	P	91.1	Very high	89.1	Confident	0 Å²	0	38.7 Å²	38.7	0%	0	23%	0.234	C	C	.	.	P	Polyproline II helix	trans	-68.4	155.1	179.8	32	-37.1	0	0	0	111.3	V196 T200 L203 L250 W255 A403	V196-P253 HydrophobicContact CG1-CB 3.96Å; V196-P253 HydrophobicContact CG1-CG 3.8Å; V196-P253 HydrophobicContact CG2-CB 4.48Å; T200-P253 HydrophobicContact CG2-CG 3.54Å; L203-P253 HydrophobicContact CB-CB 4.26Å; L203-P253 HydrophobicContact CB-CG 4.13Å; L250-P253 HydrophobicContact CD2-CB 3.89Å; L250-P253 HydrophobicContact CG-CB 4.35Å; P253-W255 PolarHBondContact O-N 2.72Å; P253-A403 WeakPolarHBondContact O-CB 3.4Å
254	P	91.1	Very high	89.6	Confident	6 Å²	6	38.7 Å²	38.7	4%	0.039	22%	0.223	C	C	.	.	P	Polyproline II helix	trans	-60.4	125.6	-179.7	27	-35.8	0	0	0	111.5	V196 S257 W402 L418 F419	V196-P254 VanDerWaalsContact CB-O 3.23Å; V196-P254 WeakPolarHBondContact CB-O 3.43Å; V196-P254 WeakPolarHBondContact CG1-O 3.34Å; P254-S257 WeakPolarHBondContact CB-OG 3.32Å; P254-S257 WeakPolarHBondContact CG-OG 3.48Å; P254-S257 PolarHBondContact O-OG 3.19Å; P254-W402 WeakPolarHBondContact CA-O 3.43Å; P254-W402 HydrophobicContact CB-CB 3.88Å; P254-L418 HydrophobicContact CG-CD1 4.14Å; P254-F419 HydrophobicContact CB-CE2 4.03Å; P254-F419 HydrophobicContact CG-CE2 4.31Å
255	W	91.1	Very high	89.9	Confident	16 Å²	16	33.3 Å²	33.3	6%	0.061	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.7	152.8	-177.3	-69.6	-4.6	0	0	0	112.1	E198 F199 T200 P253 S257 L363 W402 P404 L406 Y446	E198-W255 HydrophobicContact CG-CB 4.38Å; F199-W255 AromaticContact CD1-CH2 3.83Å; F199-W255 HydrophobicContact CD1-CH2 3.83Å; F199-W255 HydrophobicContact CD1-CZ2 4.46Å; F199-W255 HydrophobicContact CD1-CZ3 4.01Å; F199-W255 HydrophobicContact CE1-CH2 4.36Å; F199-W255 HydrophobicContact CE1-CZ3 4.14Å; T200-W255 PolarHBondContact O-NE1 3.45Å; P253-W255 PolarHBondContact O-N 2.72Å; W255-S257 PolarHBondContact O-N 2.96Å; W255-L363 HydrophobicContact CH2-CD2 4.48Å; W255-L363 HydrophobicContact CZ3-CD2 4.42Å; W255-W402 PolarHBondContact N-O 2.72Å; W255-P404 HydrophobicContact CD2-CG 4.34Å; W255-P404 HydrophobicContact CE3-CG 4.05Å; W255-P404 HydrophobicContact CH2-CG 3.11Å; W255-P404 HydrophobicContact CZ2-CG 3.42Å; W255-P404 VanDerWaalsContact CZ2-CG 3.42Å; W255-P404 HydrophobicContact CZ3-CG 3.45Å; W255-P404 VanDerWaalsContact CZ3-CG 3.45Å; W255-L406 HydrophobicContact CZ2-CD1 4.48Å; W255-Y446 HydrophobicContact CE3-CE1 4.11Å; W255-Y446 HydrophobicContact CZ3-CE1 4.23Å
256	D	90.3	Very high	89.8	Confident	108 Å²	108	32.7 Å²	32.7	58%	0.578	19%	0.187	S	C	*	.	T	Hydrogen-bonded Turn	trans	48.7	43.2	178.5	-164.2	34.6	0	0	0	113.1	F195 V196 E198	F195-D256 VanDerWaalsContact CZ-OD1 3.28Å; F195-D256 WeakPolarHBondContact CZ-OD1 3.27Å; V196-D256 WeakPolarHBondContact O-CA 3.47Å; V196-D256 PolarHBondContact O-N 3.03Å; E198-D256 HydrophobicContact CG-CB 4.12Å
257	S	90.9	Very high	89.2	Confident	16 Å²	16	35.6 Å²	35.6	11%	0.112	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	150.3	-171.3	76.4	0	0	0	0	113	V196 P254 W255	V196-S257 PolarHBondContact N-O 3.04Å; V196-S257 PolarHBondContact O-N 3.36Å; P254-S257 WeakPolarHBondContact CB-OG 3.32Å; P254-S257 WeakPolarHBondContact CG-OG 3.48Å; P254-S257 PolarHBondContact O-OG 3.19Å; W255-S257 PolarHBondContact O-N 2.96Å
258	W	91.3	Very high	88.4	Confident	109 Å²	109	37.5 Å²	37.5	41%	0.413	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	113.4	171.7	-71	97.7	0	0	0	110.1	V173 K193 L194 F195	V173-W258 HydrophobicContact CG1-CH2 4.39Å; V173-W258 HydrophobicContact CG1-CZ3 4.07Å; V173-W258 HydrophobicContact CG2-CZ3 4.36Å; K193-W258 HydrophobicContact CB-CE3 4.14Å; K193-W258 HydrophobicContact CD-CE3 3.94Å; K193-W258 HydrophobicContact CD-CZ3 4.1Å; K193-W258 HydrophobicContact CG-CE3 3.95Å; K193-W258 HydrophobicContact CG-CZ3 4Å; L194-W258 CarbonylContact O-C 3.51Å; L194-W258 WeakPolarHBondContact O-CA 3.49Å; F195-W258 HydrophobicContact CB-CD2 4.16Å; F195-W258 HydrophobicContact CB-CE3 3.85Å; F195-W258 HydrophobicContact CB-CH2 3.9Å; F195-W258 HydrophobicContact CB-CZ2 4.18Å; F195-W258 HydrophobicContact CB-CZ3 3.73Å; F195-W258 HydrophobicContact CD2-CD2 4.01Å; F195-W258 AromaticContact CD2-CE2 3.79Å; F195-W258 HydrophobicContact CD2-CG 4.28Å; F195-W258 HydrophobicContact CD2-CZ2 4.19Å; F195-W258 AromaticContact CD2-NE1 3.9Å; F195-W258 HydrophobicContact CG-CZ2 4.47Å
259	L	91.2	Very high	87.5	Confident	8 Å²	8	44.5 Å²	44.5	4%	0.042	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	133.2	172.7	-174.3	69.5	0	0	0	110.3	K193 L194 V196 L203 L250 L418	K193-L259 WeakPolarHBondContact CA-O 3.46Å; L194-L259 HydrophobicContact CD1-CB 3.81Å; L194-L259 HydrophobicContact CD1-CD2 4.19Å; L194-L259 HydrophobicContact CD2-CD2 4.35Å; L194-L259 HydrophobicContact CG-CB 3.99Å; L194-L259 HydrophobicContact CG-CD2 4.44Å; L194-L259 PolarHBondContact N-O 2.8Å; L194-L259 PolarHBondContact O-N 2.81Å; V196-L259 HydrophobicContact CG2-CB 4.03Å; L203-L259 HydrophobicContact CD2-CD2 3.33Å; L250-L259 HydrophobicContact CD2-CD2 4.05Å; L259-L418 HydrophobicContact CD1-CD1 3.44Å; L259-L418 VanDerWaalsContact CD1-CD1 3.44Å
260	R	91	Very high	86.9	Confident	23 Å²	23	44.2 Å²	44.2	9%	0.087	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	139.5	174.8	-171.9	172.2	-69.2	167.8	2.7	111.1	Q58 T59 D128 G228 V262	Q58-R260 VanDerWaalsContact N-NH2 3.15Å; T59-R260 PolarHBondContact O-NH1 2.82Å; T59-R260 PolarHBondContact O-NH2 3.06Å; D128-R260 VanDerWaalsContact CA-NH1 3.32Å; D128-R260 IonicContact OD1-NH1 3.96Å; G228-R260 PolarHBondContact N-O 2.89Å; R260-V262 HydrophobicContact CG-CG2 3.95Å
261	V	92.1	Very high	86.6	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	123.1	173.1	-176.4	0	0	0	0	108.4	L192 L194 V205 L225 R226 L227 V263 I276	L192-V261 HydrophobicContact CB-CB 4.3Å; L192-V261 PolarHBondContact N-O 2.91Å; L192-V261 PolarHBondContact O-N 2.78Å; L192-V261 VanDerWaalsContact O-O 3.12Å; L194-V261 HydrophobicContact CD2-CG2 3.48Å; L194-V261 VanDerWaalsContact CD2-CG2 3.48Å; L194-V261 HydrophobicContact CG-CG2 4.28Å; V205-V261 HydrophobicContact CG1-CG1 4.37Å; L225-V261 HydrophobicContact CD1-CG1 3.63Å; R226-V261 WeakPolarHBondContact O-CA 3.5Å; L227-V261 HydrophobicContact CD2-CB 4.24Å; L227-V261 HydrophobicContact CD2-CG1 3.92Å; L227-V261 HydrophobicContact CD2-CG2 3.7Å; V261-V263 HydrophobicContact CG1-CG2 4.43Å; V261-I276 HydrophobicContact CG1-CD1 4Å
262	V	90.9	Very high	86.5	Confident	1 Å²	1	45.4 Å²	45.4	1%	0.006	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	130.2	177	-174.8	0	0	0	0	108.5	P189 A190 R191 R226 R260 E264	P189-V262 HydrophobicContact CB-CG1 3.84Å; P189-V262 HydrophobicContact CG-CG1 4.42Å; A190-V262 WeakPolarHBondContact O-CA 3.27Å; R191-V262 HydrophobicContact CG-CG2 4.46Å; R226-V262 HydrophobicContact CB-CB 4.31Å; R226-V262 PolarHBondContact N-O 2.88Å; R226-V262 PolarHBondContact O-N 3.35Å; R260-V262 HydrophobicContact CG-CG2 3.95Å; V262-E264 HydrophobicContact CG1-CG 4.01Å
263	V	90.7	Very high	86.6	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	121	175.9	-173.8	0	0	0	0	108.7	A184 P189 A190 L223 L224 L225 V261 F274 I276	A184-V263 VanDerWaalsContact CB-O 3.31Å; A184-V263 WeakPolarHBondContact CB-O 3.09Å; P189-V263 CarbonylContact C-O 3.51Å; P189-V263 WeakPolarHBondContact CA-O 3.45Å; A190-V263 HydrophobicContact CB-CB 4.36Å; A190-V263 PolarHBondContact N-O 2.93Å; A190-V263 PolarHBondContact O-N 3.37Å; L223-V263 HydrophobicContact CB-CG1 4.08Å; L223-V263 HydrophobicContact CD1-CG1 4.05Å; L223-V263 HydrophobicContact CD2-CG1 4.13Å; L223-V263 HydrophobicContact CG-CG1 4.32Å; L224-V263 WeakPolarHBondContact O-CA 3.15Å; L225-V263 HydrophobicContact CD1-CG2 3.68Å; V261-V263 HydrophobicContact CG1-CG2 4.43Å; V263-F274 HydrophobicContact CB-CE1 4.3Å; V263-F274 HydrophobicContact CB-CE2 4.27Å; V263-F274 HydrophobicContact CB-CZ 3.7Å; V263-F274 HydrophobicContact CG1-CE1 3.89Å; V263-F274 HydrophobicContact CG1-CE2 4.14Å; V263-F274 HydrophobicContact CG1-CZ 3.66Å; V263-F274 HydrophobicContact CG2-CE2 4.12Å; V263-F274 HydrophobicContact CG2-CZ 4.02Å; V263-I276 HydrophobicContact CG2-CD1 4.08Å
264	E	89.7	Confident	86.5	Confident	37 Å²	37	46.4 Å²	46.4	17%	0.173	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	149.2	180	-36.7	-162.3	137.1	0	0	109.8	P189 L223 L224 R226 V262	P189-E264 HydrophobicContact CB-CB 4.16Å; P189-E264 HydrophobicContact CB-CG 3.59Å; L223-E264 CarbonylContact C-O 3.56Å; L223-E264 WeakPolarHBondContact CA-O 3.1Å; L224-E264 HydrophobicContact CB-CB 4.46Å; L224-E264 PolarHBondContact N-O 2.77Å; L224-E264 PolarHBondContact O-N 3.07Å; R226-E264 IonicContact CZ-OE2 3.88Å; R226-E264 IonicContact NH1-OE1 3.36Å; R226-E264 PolarHBondContact NH1-OE1 2.84Å; R226-E264 IonicContact NH1-OE2 3.11Å; R226-E264 PolarHBondContact NH1-OE2 2.85Å; R226-E264 IonicContact NH2-OE2 3.71Å; V262-E264 HydrophobicContact CG1-CG 4.01Å
265	S	87.6	Confident	86.5	Confident	8 Å²	8	53.2 Å²	53.2	6%	0.056	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	129.9	171.4	-178.1	0	0	0	0	109.6	Q267 Q270	S265-Q267 VanDerWaalsContact C-N 3.28Å; S265-Q267 PolarHBondContact OG-N 3.01Å; S265-Q267 PolarHBondContact OG-O 3.07Å; S265-Q270 WeakPolarHBondContact CB-O 3.3Å; S265-Q270 PolarHBondContact OG-O 2.61Å; S265-Q270 VanDerWaalsContact OG-O 3.07Å
266	S	81.8	Confident	86.6	Confident	64 Å²	64	52.4 Å²	52.4	45%	0.448	27%	0.27	S	S	.	.	S	Bend	trans	-80.4	-10.8	176.9	63.2	0	0	0	0	113	S222	S222-S266 WeakPolarHBondContact CB-OG 3.35Å; S222-S266 PolarHBondContact O-N 2.68Å; S222-S266 PolarHBondContact O-OG 3.08Å; S222-S266 VanDerWaalsContact O-OG 3.06Å
267	Q	77.1	Confident	86.8	Confident	77 Å²	77	47.7 Å²	47.7	36%	0.36	25%	0.246	S	C	.	.	S	Bend	trans	-99	129.2	177.9	-63.8	-161.2	19.1	0	0	111.9	P186 S222 S265 N269 Q270	P186-Q267 WeakPolarHBondContact CG-O 3.34Å; S222-Q267 PolarHBondContact OG-NE2 2.77Å; S222-Q267 VanDerWaalsContact OG-NE2 3.09Å; S265-Q267 VanDerWaalsContact C-N 3.28Å; S265-Q267 PolarHBondContact OG-N 3.01Å; S265-Q267 PolarHBondContact OG-O 3.07Å; Q267-N269 PolarHBondContact O-N 3.38Å; Q267-Q270 HydrophobicContact CB-CB 4.26Å; Q267-Q270 PolarHBondContact O-N 2.69Å; Q267-Q270 VanDerWaalsContact OE1-CD 3.26Å; Q267-Q270 VanDerWaalsContact OE1-OE1 3.1Å
268	V	72.6	Confident	86.9	Confident	120 Å²	120	47.3 Å²	47.3	73%	0.727	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.1	126.6	178.2	-173.7	0	0	0	0	109.5	Q270	V268-Q270 PolarHBondContact O-N 2.97Å
269	N	71.8	Confident	86.9	Confident	152 Å²	152	46.7 Å²	46.7	81%	0.813	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	68.8	15.7	177.4	-54.6	-21.9	0	0	0	117.5	Q267	Q267-N269 PolarHBondContact O-N 3.38Å
270	Q	76.6	Confident	86.9	Confident	77 Å²	77	49.1 Å²	49.1	36%	0.36	26%	0.259	S	S	.	.			trans	-110.2	125.2	171.2	-71.7	-168.3	7.3	0	0	112.3	S265 Q267 V268	S265-Q270 WeakPolarHBondContact CB-O 3.3Å; S265-Q270 PolarHBondContact OG-O 2.61Å; S265-Q270 VanDerWaalsContact OG-O 3.07Å; Q267-Q270 HydrophobicContact CB-CB 4.26Å; Q267-Q270 PolarHBondContact O-N 2.69Å; Q267-Q270 VanDerWaalsContact OE1-CD 3.26Å; Q267-Q270 VanDerWaalsContact OE1-OE1 3.1Å; V268-Q270 PolarHBondContact O-N 2.97Å
271	T	83.4	Confident	86.6	Confident	93 Å²	93	51.5 Å²	51.5	57%	0.571	28%	0.276	S	S	*	.			trans	-83.4	123.2	166.2	52.8	0	0	0	0	109.4	A184 A185	A184-T271 WeakPolarHBondContact O-CA 3.43Å; A185-T271 HydrophobicContact CB-CG2 4.02Å
272	V	86.9	Confident	85.9	Confident	8 Å²	8	55.4 Å²	55.4	5%	0.048	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	123.9	179	-178.5	0	0	0	0	108.9	T183 A184 C210 L223	T183-V272 WeakPolarHBondContact CA-O 3.4Å; A184-V272 PolarHBondContact N-O 2.87Å; A184-V272 PolarHBondContact O-N 2.76Å; C210-V272 HydrophobicContact CB-CG1 3.97Å; L223-V272 HydrophobicContact CD1-CG1 4.37Å; L223-V272 HydrophobicContact CD2-CB 3.93Å; L223-V272 HydrophobicContact CD2-CG1 4.06Å; L223-V272 HydrophobicContact CD2-CG2 4.39Å; L223-V272 HydrophobicContact CG-CG1 4.34Å
273	T	88.7	Confident	84.7	Confident	50 Å²	50	56.2 Å²	56.2	31%	0.307	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	134.2	168	53.9	0	0	0	0	108.8	Q182 T183 C210 S211	Q182-T273 CarbonylContact O-C 3.49Å; Q182-T273 WeakPolarHBondContact O-CA 3.42Å; T183-T273 HydrophobicContact CG2-CG2 3.38Å; C210-T273 CarbonylContact C-O 3.57Å; C210-T273 VanDerWaalsContact CA-O 3.28Å; C210-T273 WeakPolarHBondContact CA-O 3.29Å; S211-T273 PolarHBondContact N-O 3.15Å; S211-T273 PolarHBondContact O-N 3Å; S211-T273 PolarHBondContact O-OG1 2.76Å; S211-T273 PolarHBondContact OG-OG1 3.4Å
274	F	90.6	Very high	83.6	Confident	1 Å²	1	58.2 Å²	58.2	0%	0.004	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	162	-178.4	61.8	-88.5	0	0	0	111.7	T181 Q182 A184 A190 V207 L223 V263 I276	T181-F274 CarbonylContact C-O 3.56Å; T181-F274 WeakPolarHBondContact CA-O 3.32Å; Q182-F274 HydrophobicContact CB-CD2 4.49Å; Q182-F274 HydrophobicContact CB-CE1 4.07Å; Q182-F274 HydrophobicContact CB-CE2 3.82Å; Q182-F274 HydrophobicContact CB-CZ 3.57Å; Q182-F274 PolarHBondContact N-O 3.42Å; Q182-F274 PolarHBondContact O-N 3.09Å; A184-F274 HydrophobicContact CB-CE1 3.71Å; A190-F274 HydrophobicContact CB-CE1 4.28Å; A190-F274 HydrophobicContact CB-CZ 3.85Å; V207-F274 HydrophobicContact CG1-CB 3.88Å; V207-F274 HydrophobicContact CG1-CD2 3.65Å; V207-F274 HydrophobicContact CG1-CG 3.98Å; L223-F274 HydrophobicContact CD1-CB 3.85Å; L223-F274 HydrophobicContact CD1-CD1 3.76Å; L223-F274 HydrophobicContact CD1-CD2 4.47Å; L223-F274 HydrophobicContact CD1-CE1 4.46Å; L223-F274 HydrophobicContact CD1-CG 3.77Å; L223-F274 HydrophobicContact CD2-CD1 4.46Å; V263-F274 HydrophobicContact CB-CE1 4.3Å; V263-F274 HydrophobicContact CB-CE2 4.27Å; V263-F274 HydrophobicContact CB-CZ 3.7Å; V263-F274 HydrophobicContact CG1-CE1 3.89Å; V263-F274 HydrophobicContact CG1-CE2 4.14Å; V263-F274 HydrophobicContact CG1-CZ 3.66Å; V263-F274 HydrophobicContact CG2-CE2 4.12Å; V263-F274 HydrophobicContact CG2-CZ 4.02Å; F274-I276 HydrophobicContact CD2-CB 4.13Å; F274-I276 HydrophobicContact CE2-CB 3.93Å; F274-I276 HydrophobicContact CE2-CD1 4.47Å; F274-I276 HydrophobicContact CE2-CG2 4.05Å
275	R	91.1	Very high	82.7	Confident	149 Å²	149	64 Å²	64	56%	0.562	35%	0.347	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.7	130.7	171.3	-66.8	-177.8	-179	165.8	2.3	109.9	V179 L180 V207 A208	V179-R275 HydrophobicContact CG1-CB 3.69Å; V179-R275 HydrophobicContact CG1-CG 4.31Å; L180-R275 CarbonylContact O-C 3.59Å; L180-R275 VanDerWaalsContact O-CA 3.32Å; L180-R275 WeakPolarHBondContact O-CA 3.42Å; V207-R275 CarbonylContact C-O 3.54Å; V207-R275 VanDerWaalsContact CA-O 3.31Å; V207-R275 WeakPolarHBondContact CA-O 3.36Å; A208-R275 PolarHBondContact N-O 2.9Å; A208-R275 WeakPolarHBondContact O-CB 3.28Å; A208-R275 PolarHBondContact O-N 3.18Å
276	I	92.8	Very high	82.2	Confident	0 Å²	0	65.6 Å²	65.6	0%	0	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	136.2	-180	-176.5	160.9	0	0	0	110.7	L174 V179 L180 Q182 L192 V205 S206 V207 V261 V263 F274	L174-I276 HydrophobicContact CD1-CG1 4.42Å; L174-I276 HydrophobicContact CD1-CG2 4.24Å; L174-I276 HydrophobicContact CD2-CD1 4.22Å; L174-I276 HydrophobicContact CD2-CG1 3.95Å; V179-I276 CarbonylContact C-O 3.54Å; V179-I276 WeakPolarHBondContact CA-O 3.3Å; L180-I276 HydrophobicContact CB-CG2 4.15Å; L180-I276 PolarHBondContact N-O 3.39Å; L180-I276 PolarHBondContact O-N 3.42Å; Q182-I276 HydrophobicContact CG-CG2 4.3Å; L192-I276 HydrophobicContact CD1-CD1 4.45Å; L192-I276 HydrophobicContact CD2-CG2 4.11Å; V205-I276 HydrophobicContact CG1-CD1 3.77Å; V205-I276 HydrophobicContact CG1-CG1 3.95Å; S206-I276 CarbonylContact O-C 3.56Å; S206-I276 VanDerWaalsContact O-CA 3.32Å; S206-I276 WeakPolarHBondContact O-CA 3.32Å; V207-I276 HydrophobicContact CG2-CB 4.36Å; V207-I276 HydrophobicContact CG2-CD1 4.05Å; V207-I276 HydrophobicContact CG2-CG1 4.12Å; V261-I276 HydrophobicContact CG1-CD1 4Å; V263-I276 HydrophobicContact CG2-CD1 4.08Å; F274-I276 HydrophobicContact CD2-CB 4.13Å; F274-I276 HydrophobicContact CE2-CB 3.93Å; F274-I276 HydrophobicContact CE2-CD1 4.47Å; F274-I276 HydrophobicContact CE2-CG2 4.05Å
277	G	93.2	Very high	82	Confident	8 Å²	8	68.1 Å²	68.1	8%	0.082	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	155.4	175	0	0	0	0	0	111.3	V205 S206	V205-G277 WeakPolarHBondContact CA-O 3.28Å; S206-G277 PolarHBondContact N-O 3.31Å; S206-G277 PolarHBondContact O-N 2.8Å
278	S	93.7	Very high	81.9	Confident	8 Å²	8	67.6 Å²	67.6	6%	0.056	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	147.1	170.7	65.1	0	0	0	0	111	G177 S204	G177-S278 PolarHBondContact N-O 2.76Å; S204-S278 CarbonylContact O-C 3.54Å; S204-S278 WeakPolarHBondContact O-CA 3.46Å
279	N	92.4	Very high	81.8	Confident	97 Å²	97	64.5 Å²	64.5	52%	0.519	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	139.5	170.6	-166.4	7.5	0	0	0	109.1	S204	S204-N279 PolarHBondContact N-O 2.96Å; S204-N279 PolarHBondContact O-N 2.9Å; S204-N279 VanDerWaalsContact O-O 3.09Å; S204-N279 PolarHBondContact OG-O 3.13Å
280	F	89.7	Confident	81.2	Confident	59 Å²	59	58.7 Å²	58.7	26%	0.259	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	144.6	175	56.1	-111.3	0	0	0	109.9	P176 P197 T200 S202 L203 V282	P176-F280 HydrophobicContact CB-CD1 3.99Å; P176-F280 HydrophobicContact CB-CE1 3.61Å; P176-F280 HydrophobicContact CB-CZ 4.36Å; P176-F280 HydrophobicContact CG-CD1 3.86Å; P176-F280 HydrophobicContact CG-CE1 3.27Å; P176-F280 HydrophobicContact CG-CZ 4.22Å; P197-F280 HydrophobicContact CG-CE1 4.23Å; P197-F280 HydrophobicContact CG-CZ 4.31Å; T200-F280 HydrophobicContact CG2-CB 3.9Å; S202-F280 WeakPolarHBondContact O-CA 2.92Å; L203-F280 HydrophobicContact CD1-CB 4.33Å; F280-V282 HydrophobicContact CD2-CG2 3.79Å; F280-V282 HydrophobicContact CE2-CG2 3.59Å
281	T	85	Confident	80.3	Confident	73 Å²	73	57.6 Å²	57.6	45%	0.448	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	114.6	162.6	60.7	0	0	0	0	106.9	S201 S202 G283	S201-T281 PolarHBondContact N-O 2.78Å; S201-T281 PolarHBondContact OG-O 2.89Å; S201-T281 PolarHBondContact OG-OG1 2.84Å; S202-T281 WeakPolarHBondContact CB-OG1 3.46Å; S202-T281 PolarHBondContact N-OG1 2.97Å; S202-T281 PolarHBondContact O-N 2.91Å; S202-T281 PolarHBondContact O-OG1 3.23Å; T281-G283 PolarHBondContact O-N 2.83Å; T281-G283 VanDerWaalsContact O-N 3.17Å
282	V	78.4	Confident	79.1	Confident	82 Å²	82	57.6 Å²	57.6	50%	0.497	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.9	124.6	164.8	-167.4	0	0	0	0	105.4	F280	F280-V282 HydrophobicContact CD2-CG2 3.79Å; F280-V282 HydrophobicContact CE2-CG2 3.59Å
283	G	64.6	Low	77.6	Confident	18 Å²	18	62.8 Å²	62.8	19%	0.186	36%	0.362	C	S	.	.			trans	-64.4	-161.8	165.2	0	0	0	0	0	109.4	F199 S201 T281	F199-G283 WeakPolarHBondContact O-CA 3.09Å; F199-G283 PolarHBondContact O-N 3.44Å; S201-G283 WeakPolarHBondContact OG-CA 3.34Å; S201-G283 PolarHBondContact OG-N 3.42Å; T281-G283 PolarHBondContact O-N 2.83Å; T281-G283 VanDerWaalsContact O-N 3.17Å
284	C	67.9	Low	76	Confident	42 Å²	42	68 Å²	68	28%	0.284	39%	0.387	S	S	.	.	P	Polyproline II helix	trans	-98.9	144.5	-178.4	146.8	0	0	0	0	112.3	C328	C284-C328 WeakPolarHBondContact CA-SG 3.5Å; C284-C328 HydrophobicContact CB-CB 3.48Å; C284-C328 VanDerWaalsContact CB-CB 3.48Å; C284-C328 WeakPolarHBondContact CB-SG 3.44Å; C284-C328 PolarHBondContact O-SG 3.02Å; C284-C328 WeakPolarHBondContact SG-CA 3.41Å; C284-C328 WeakPolarHBondContact SG-CB 3.39Å; C284-C328 PolarHBondContact SG-N 2.78Å; C284-C328 CovalentContact SG-SG 1.98Å; C284-C328 PolarHBondContact SG-SG 3.07Å
285	K	70.9	Confident	74.6	Confident	159 Å²	159	69.7 Å²	69.7	69%	0.691	40%	0.397	S	S	*	.	P	Polyproline II helix	trans	-73	131.4	-174	-66.3	-179.1	178	-178.8	0	109.5
286	P	76.9	Confident	72.8	Confident	41 Å²	41	68 Å²	68	27%	0.266	40%	0.399	S	S	.	.	P	Polyproline II helix	trans	-67.2	148.3	-179.9	28.9	-35.7	0	0	0	110.7	F199 V329	F199-P286 HydrophobicContact CD1-CG 4.08Å; F199-P286 VanDerWaalsContact CE1-CD 3.46Å; F199-P286 HydrophobicContact CE1-CG 3.46Å; F199-P286 VanDerWaalsContact CE1-CG 3.46Å; F199-P286 HydrophobicContact CZ-CG 3.83Å; P286-V329 WeakPolarHBondContact CA-O 3.49Å
287	K	78.6	Confident	71.1	Confident	116 Å²	116	73.8 Å²	73.8	50%	0.504	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	119.1	161.4	179.1	163.2	165.1	-169	0	108	V289 P327 V329 W330 S331	K287-V289 PolarHBondContact O-N 3.36Å; K287-P327 HydrophobicContact CB-CB 3.57Å; K287-P327 HydrophobicContact CB-CG 4.19Å; K287-P327 HydrophobicContact CD-CB 4.28Å; K287-P327 HydrophobicContact CD-CG 4.01Å; K287-V329 PolarHBondContact N-O 3.22Å; K287-W330 HydrophobicContact CB-CE3 4.02Å; K287-W330 HydrophobicContact CB-CZ3 3.84Å; K287-W330 HydrophobicContact CD-CH2 4.37Å; K287-W330 HydrophobicContact CD-CZ3 3.66Å; K287-W330 HydrophobicContact CG-CE3 4.3Å; K287-W330 HydrophobicContact CG-CZ3 3.81Å; K287-S331 PolarHBondContact O-N 3.07Å
288	S	75.1	Confident	69.1	Low	66 Å²	66	77.7 Å²	77.7	46%	0.462	45%	0.451	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.7	130.6	173.3	-170.5	0	0	0	0	109.2	S331	S288-S331 WeakPolarHBondContact CA-O 3.48Å
289	V	69.6	Low	67.1	Low	55 Å²	55	84.3 Å²	84.3	33%	0.333	48%	0.479	S	S	.	.			trans	-117.4	132.9	178.2	-172	0	0	0	0	108.2	K287 W330 S331 P333	K287-V289 PolarHBondContact O-N 3.36Å; V289-W330 HydrophobicContact CG2-CB 3.95Å; V289-W330 HydrophobicContact CG2-CD2 3.89Å; V289-W330 HydrophobicContact CG2-CE3 3.24Å; V289-W330 HydrophobicContact CG2-CG 4.2Å; V289-W330 HydrophobicContact CG2-CZ3 3.97Å; V289-S331 PolarHBondContact N-O 2.97Å; V289-P333 VanDerWaalsContact O-CD 3.27Å; V289-P333 WeakPolarHBondContact O-CD 3.42Å
290	G	58.2	Low	65.1	Low	31 Å²	31	83.1 Å²	83.1	32%	0.32	47%	0.472	S	S	.	.	S	Bend	trans	98.4	-20.1	178.8	0	0	0	0	0	114.6	N350	G290-N350 VanDerWaalsContact CA-ND2 3.33Å; G290-N350 WeakPolarHBondContact CA-ND2 3.46Å; G290-N350 PolarHBondContact O-ND2 2.87Å
291	L	58.1	Low	63.3	Low	54 Å²	54	86.5 Å²	86.5	28%	0.283	49%	0.492	S	S	.	.			trans	-122	128.2	172.5	-66.6	176.5	0	0	0	112	D295 L300 P333 V349	L291-D295 HydrophobicContact CD2-CB 4.27Å; L291-L300 HydrophobicContact CD1-CD2 4.12Å; L291-L300 HydrophobicContact CD2-CD2 3.35Å; L291-L300 HydrophobicContact CD2-CG 4.35Å; L291-L300 HydrophobicContact CG-CD2 4.32Å; L291-P333 HydrophobicContact CB-CG 4.37Å; L291-P333 HydrophobicContact CD1-CB 3.83Å; L291-P333 HydrophobicContact CD1-CG 3.41Å; L291-P333 VanDerWaalsContact CD1-CG 3.41Å; L291-P333 HydrophobicContact CG-CG 3.72Å; L291-V349 HydrophobicContact CD1-CG1 4.04Å; L291-V349 HydrophobicContact CD2-CG1 3.73Å; L291-V349 HydrophobicContact CG-CG1 3.94Å
292	T	58.5	Low	61.5	Low	92 Å²	92	86.2 Å²	86.2	56%	0.564	50%	0.504	S	S	*	.			trans	-98.6	153.9	166.7	63.3	0	0	0	0	109.4	D294 D295	T292-D294 PolarHBondContact O-N 2.87Å; T292-D295 PolarHBondContact N-OD2 2.89Å; T292-D295 PolarHBondContact O-N 2.93Å; T292-D295 PolarHBondContact OG1-OD1 2.64Å; T292-D295 PolarHBondContact OG1-OD2 3.43Å
293	A	55	Low	59.7	Low	117 Å²	117	90.8 Å²	90.8	97%	0.967	52%	0.517	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	-16.7	-176	0	0	0	0	0	114.3
294	D	56.5	Low	58.4	Low	159 Å²	159	95.3 Å²	95.3	85%	0.85	55%	0.546	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.7	4	179.1	-91.4	-22.8	0	0	0	113.8	T292 D296	T292-D294 PolarHBondContact O-N 2.87Å; D294-D296 PolarHBondContact O-N 2.78Å; D294-D296 VanDerWaalsContact O-N 3.14Å
295	D	59.5	Low	56.9	Low	37 Å²	37	98.2 Å²	98.2	20%	0.198	57%	0.566	C	S	.	*			trans	-75	108.1	179.8	-75	-45.6	0	0	0	111.3	L291 T292 K299	L291-D295 HydrophobicContact CD2-CB 4.27Å; T292-D295 PolarHBondContact N-OD2 2.89Å; T292-D295 PolarHBondContact O-N 2.93Å; T292-D295 PolarHBondContact OG1-OD1 2.64Å; T292-D295 PolarHBondContact OG1-OD2 3.43Å; D295-K299 HydrophobicContact CB-CD 4.48Å; D295-K299 WeakPolarHBondContact OD1-CD 3.39Å; D295-K299 IonicContact OD1-NZ 2.72Å; D295-K299 PolarHBondContact OD1-NZ 3.46Å
296	D	54.2	Low	55.4	Low	113 Å²	113	97.1 Å²	97.1	60%	0.604	57%	0.573	S	S	*	*			trans	-65.1	150.5	179.1	-143.7	-5.7	0	0	0	112.3	D294 T298 K299	D294-D296 PolarHBondContact O-N 2.78Å; D294-D296 VanDerWaalsContact O-N 3.14Å; D296-T298 PolarHBondContact O-N 3.31Å; D296-K299 WeakPolarHBondContact O-CB 3.48Å; D296-K299 PolarHBondContact O-N 3.12Å
297	I	57.1	Low	53.2	Low	123 Å²	123	100 Å²	100	63%	0.631	59%	0.594	S	S	*	*	H	α-helix	trans	-57.6	-27.5	-175.3	-66.1	170.4	0	0	0	112.4	K299 L300 L301	I297-K299 VanDerWaalsContact C-N 3.31Å; I297-K299 PolarHBondContact O-N 3.25Å; I297-L300 WeakPolarHBondContact O-CB 3.27Å; I297-L300 PolarHBondContact O-N 3.25Å; I297-L301 HydrophobicContact CG2-CD1 4.28Å
298	T	51.5	Low	51	Low	90 Å²	90	102 Å²	102	55%	0.552	61%	0.61	S	S	*	*	H	α-helix	trans	-66.5	-27.5	176	26.4	0	0	0	0	113.7	D296	D296-T298 PolarHBondContact O-N 3.31Å
299	K	52.1	Low	48.8	Very low	146 Å²	146	103.2 Å²	103.2	64%	0.635	62%	0.624	S	S	*	*	H	α-helix	trans	-76.3	-31.2	175.7	-133.1	-179.9	178.7	-177.1	0	111.8	D295 D296 I297 L301	D295-K299 HydrophobicContact CB-CD 4.48Å; D295-K299 WeakPolarHBondContact OD1-CD 3.39Å; D295-K299 IonicContact OD1-NZ 2.72Å; D295-K299 PolarHBondContact OD1-NZ 3.46Å; D296-K299 WeakPolarHBondContact O-CB 3.48Å; D296-K299 PolarHBondContact O-N 3.12Å; I297-K299 VanDerWaalsContact C-N 3.31Å; I297-K299 PolarHBondContact O-N 3.25Å; K299-L301 VanDerWaalsContact C-N 3.34Å; K299-L301 PolarHBondContact O-N 2.99Å
300	L	50.3	Low	47.1	Very low	73 Å²	73	107.5 Å²	107.5	38%	0.382	65%	0.651	S	S	.	*	H	α-helix	trans	-67	-29	177.8	-71.9	171.3	0	0	0	113.9	L291 I297 V349	L291-L300 HydrophobicContact CD1-CD2 4.12Å; L291-L300 HydrophobicContact CD2-CD2 3.35Å; L291-L300 HydrophobicContact CD2-CG 4.35Å; L291-L300 HydrophobicContact CG-CD2 4.32Å; I297-L300 WeakPolarHBondContact O-CB 3.27Å; I297-L300 PolarHBondContact O-N 3.25Å; L300-V349 HydrophobicContact CD2-CB 4.49Å; L300-V349 HydrophobicContact CD2-CG1 3.23Å; L300-V349 HydrophobicContact CD2-CG2 4.47Å
301	L	51.6	Low	45.8	Very low	130 Å²	130	110.5 Å²	110.5	68%	0.681	67%	0.673	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91	5.2	-176	-83.7	150.9	0	0	0	114.3	I297 K299 K303	I297-L301 HydrophobicContact CG2-CD1 4.28Å; K299-L301 VanDerWaalsContact C-N 3.34Å; K299-L301 PolarHBondContact O-N 2.99Å; L301-K303 PolarHBondContact O-N 3.45Å; L301-K303 VanDerWaalsContact O-N 3.14Å
302	G	47	Very low	44.6	Very low	67 Å²	67	115.1 Å²	115.1	69%	0.691	70%	0.703	S	S	*	*	T	Hydrogen-bonded Turn	trans	63.4	19.2	178.1	0	0	0	0	0	114.9
303	K	40	Very low	43.2	Very low	178 Å²	178	114.1 Å²	114.1	77%	0.774	71%	0.712	S	S	*	*			trans	-99.6	68.5	172.1	-95.2	-177	177.4	175.1	0	110.4	L301 S305	L301-K303 PolarHBondContact O-N 3.45Å; L301-K303 VanDerWaalsContact O-N 3.14Å; K303-S305 PolarHBondContact O-N 2.9Å
304	S	38.7	Very low	42.3	Very low	113 Å²	113	117 Å²	117	79%	0.79	71%	0.71	S	S	*	*			trans	-80.8	91.5	163.3	58.4	0	0	0	0	109.3	V306	S304-V306 PolarHBondContact O-N 3.21Å
305	S	35.3	Very low	41.1	Very low	102 Å²	102	115.7 Å²	115.7	71%	0.713	71%	0.708	S	S	*	*			trans	-68.7	123.1	151.3	52.8	0	0	0	0	107.4	K303 S307	K303-S305 PolarHBondContact O-N 2.9Å; S305-S307 PolarHBondContact O-N 2.86Å
306	V	40.4	Very low	40	Very low	136 Å²	136	119.8 Å²	119.8	82%	0.824	74%	0.74	S	S	*	*			trans	-51.5	107.9	173.1	177.7	0	0	0	0	109.2	S304	S304-V306 PolarHBondContact O-N 3.21Å
307	S	29.9	Very low	38.9	Very low	103 Å²	103	118.4 Å²	118.4	72%	0.72	74%	0.744	S	S	*	*			trans	-118	101.4	163.7	52.9	0	0	0	0	108.2	S305 A309	S305-S307 PolarHBondContact O-N 2.86Å; S307-A309 PolarHBondContact O-N 3.15Å; S307-A309 VanDerWaalsContact O-N 3.12Å
308	N	32.7	Very low	37.9	Very low	157 Å²	157	118.6 Å²	118.6	84%	0.84	75%	0.753	S	S	*	*			trans	-56.3	109.3	164.7	-83.6	-17	0	0	0	108.8
309	A	28.9	Very low	36.9	Very low	92 Å²	92	118.6 Å²	118.6	76%	0.76	76%	0.762	S	S	*	*			trans	-118.7	94.3	163	0	0	0	0	0	108.3	S307 A311	S307-A309 PolarHBondContact O-N 3.15Å; S307-A309 VanDerWaalsContact O-N 3.12Å; A309-A311 PolarHBondContact O-N 2.83Å
310	T	34.2	Very low	36.1	Very low	144 Å²	144	117 Å²	117	88%	0.883	77%	0.767	S	S	*	*			trans	-60.2	115.7	158.1	37.6	0	0	0	0	109.2
311	A	29.8	Very low	35.5	Very low	95 Å²	95	119 Å²	119	79%	0.785	79%	0.785	S	S	*	*			trans	-139.6	97.7	163.4	0	0	0	0	0	109.6	A309	A309-A311 PolarHBondContact O-N 2.83Å
312	T	33.6	Very low	34.8	Very low	150 Å²	150	118 Å²	118	92%	0.92	79%	0.786	S	S	*	*			trans	-63.3	126.7	161.8	42.6	0	0	0	0	110
313	G	29.7	Very low	34.6	Very low	72 Å²	72	120.4 Å²	120.4	74%	0.742	79%	0.789	S	S	*	*			trans	-169.3	93.4	173.6	0	0	0	0	0	112.6	V315	G313-V315 PolarHBondContact O-N 3.39Å
314	N	35.8	Very low	34.7	Very low	176 Å²	176	120.7 Å²	120.7	94%	0.941	80%	0.798	S	S	*	*			trans	-67.1	109.4	165.4	-90.3	-4.9	0	0	0	109.7
315	V	30	Very low	35.3	Very low	133 Å²	133	119 Å²	119	81%	0.806	79%	0.79	S	S	*	*			trans	-141.4	111.3	157.6	-176.8	0	0	0	0	108.8	G313 A317	G313-V315 PolarHBondContact O-N 3.39Å; V315-A317 PolarHBondContact O-N 2.85Å
316	S	37.2	Very low	36.3	Very low	123 Å²	123	118.8 Å²	118.8	86%	0.86	79%	0.789	S	S	*	*			trans	-72.2	106.5	168.2	43.7	0	0	0	0	109.8
317	A	31	Very low	37.3	Very low	83 Å²	83	114 Å²	114	69%	0.686	76%	0.761	S	S	*	*	P	Polyproline II helix	trans	-98.7	139.5	166.8	0	0	0	0	0	109.9	V315	V315-A317 PolarHBondContact O-N 2.85Å
318	P	36.3	Very low	39.5	Very low	127 Å²	127	110.7 Å²	110.7	83%	0.825	74%	0.737	S	S	*	*	P	Polyproline II helix	trans	-68.5	136	-177.1	27	-30.8	0	0	0	110.9
319	A	30.6	Very low	41.9	Very low	91 Å²	91	103.4 Å²	103.4	75%	0.752	70%	0.699	S	S	*	*	P	Polyproline II helix	trans	-56	132.4	178.8	0	0	0	0	0	111.3
320	P	36	Very low	44.6	Very low	112 Å²	112	101.8 Å²	101.8	73%	0.727	67%	0.673	S	S	*	*	P	Polyproline II helix	trans	-65.2	146.5	167.6	26.1	-29.1	0	0	0	109.4
321	P	37.1	Very low	47.2	Very low	116 Å²	116	96.3 Å²	96.3	75%	0.753	64%	0.641	S	S	*	*	P	Polyproline II helix	trans	-59.1	144.2	179.7	24.1	-32.2	0	0	0	110.6
322	P	37.3	Very low	49.9	Very low	108 Å²	108	92.6 Å²	92.6	70%	0.701	61%	0.608	S	S	*	*	P	Polyproline II helix	trans	-62.1	138.3	-179.5	24.6	-32.1	0	0	0	110.4	L324	P322-L324 PolarHBondContact O-N 3.31Å
323	P	41.8	Very low	52.5	Low	117 Å²	117	87 Å²	87	76%	0.76	57%	0.574	S	S	*	*	P	Polyproline II helix	trans	-63.5	130	173.4	24.4	-30	0	0	0	109.9	A325	P323-A325 PolarHBondContact O-N 2.8Å
324	L	42.8	Very low	55.3	Low	184 Å²	184	85.1 Å²	85.1	96%	0.963	55%	0.548	S	S	*	.	S	Bend	trans	-65	6.6	-173.8	-93.1	89.7	0	0	0	116	P322	P322-L324 PolarHBondContact O-N 3.31Å
325	A	50.4	Low	57.8	Low	77 Å²	77	80.6 Å²	80.6	64%	0.636	52%	0.524	S	S	*	.	S	Bend	trans	-141.7	126.3	178.8	0	0	0	0	0	111.3	P323	P323-A325 PolarHBondContact O-N 2.8Å
326	S	57.1	Low	60.6	Low	99 Å²	99	78.5 Å²	78.5	69%	0.692	50%	0.502	S	S	*	.			trans	-61.3	136.6	169	49.8	0	0	0	0	110.3
327	P	60.9	Low	63.1	Low	34 Å²	34	75.7 Å²	75.7	22%	0.221	48%	0.475	C	S	.	.			trans	-69.3	135.1	179.6	31.3	-35.5	0	0	0	110.1	K287 W330 H360	K287-P327 HydrophobicContact CB-CB 3.57Å; K287-P327 HydrophobicContact CB-CG 4.19Å; K287-P327 HydrophobicContact CD-CB 4.28Å; K287-P327 HydrophobicContact CD-CG 4.01Å; P327-W330 HydrophobicContact CG-CH2 3.87Å; P327-W330 HydrophobicContact CG-CZ3 4.08Å; P327-H360 PolarHBondContact O-CD2 3.12Å; P327-H360 PolarHBondContact O-NE2 2.86Å
328	C	75.3	Confident	65.9	Low	34 Å²	34	78.1 Å²	78.1	23%	0.23	47%	0.472	C	S	.	.			trans	-98.3	-16.6	-179.1	53.7	0	0	0	0	113.4	C284 H360 P361	C284-C328 WeakPolarHBondContact CA-SG 3.5Å; C284-C328 HydrophobicContact CB-CB 3.48Å; C284-C328 VanDerWaalsContact CB-CB 3.48Å; C284-C328 WeakPolarHBondContact CB-SG 3.44Å; C284-C328 PolarHBondContact O-SG 3.02Å; C284-C328 WeakPolarHBondContact SG-CA 3.41Å; C284-C328 WeakPolarHBondContact SG-CB 3.39Å; C284-C328 PolarHBondContact SG-N 2.78Å; C284-C328 CovalentContact SG-SG 1.98Å; C284-C328 PolarHBondContact SG-SG 3.07Å; C328-H360 VanDerWaalsContact C-CD2 3.49Å; C328-H360 WeakPolarHBondContact CA-CD2 3.33Å; C328-H360 WeakPolarHBondContact O-CB 3.4Å; C328-H360 PolarHBondContact O-CD2 3.12Å; C328-P361 WeakPolarHBondContact O-CD 3.23Å
329	V	84.1	Confident	68.4	Low	5 Å²	5	76.7 Å²	76.7	3%	0.03	46%	0.458	C	S	.	.			trans	-141.6	134.1	-173.4	178.3	0	0	0	0	108.4	P286 K287 P361 L363 L406	P286-V329 WeakPolarHBondContact CA-O 3.49Å; K287-V329 PolarHBondContact N-O 3.22Å; V329-P361 WeakPolarHBondContact CA-O 3.31Å; V329-P361 HydrophobicContact CG2-CG 4.01Å; V329-L363 HydrophobicContact CG1-CB 3.57Å; V329-L363 HydrophobicContact CG1-CD2 4.25Å; V329-L406 HydrophobicContact CG1-CD2 4.34Å; V329-L406 HydrophobicContact CG2-CD1 4.04Å; V329-L406 HydrophobicContact CG2-CD2 3.76Å; V329-L406 HydrophobicContact CG2-CG 4.34Å
330	W	86.1	Confident	71	Confident	57 Å²	57	78.1 Å²	78.1	22%	0.216	45%	0.452	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	114.4	171.9	-60.3	123.4	0	0	0	109.6	K287 V289 P327 H360 P361 T362 L363	K287-W330 HydrophobicContact CB-CE3 4.02Å; K287-W330 HydrophobicContact CB-CZ3 3.84Å; K287-W330 HydrophobicContact CD-CH2 4.37Å; K287-W330 HydrophobicContact CD-CZ3 3.66Å; K287-W330 HydrophobicContact CG-CE3 4.3Å; K287-W330 HydrophobicContact CG-CZ3 3.81Å; V289-W330 HydrophobicContact CG2-CB 3.95Å; V289-W330 HydrophobicContact CG2-CD2 3.89Å; V289-W330 HydrophobicContact CG2-CE3 3.24Å; V289-W330 HydrophobicContact CG2-CG 4.2Å; V289-W330 HydrophobicContact CG2-CZ3 3.97Å; P327-W330 HydrophobicContact CG-CH2 3.87Å; P327-W330 HydrophobicContact CG-CZ3 4.08Å; W330-H360 HydrophobicContact CG-CB 4.48Å; W330-H360 AromaticContact NE1-ND1 3.9Å; W330-P361 PolarHBondContact N-O 2.86Å; W330-T362 CarbonylContact O-C 3.57Å; W330-T362 WeakPolarHBondContact O-CA 3.49Å; W330-L363 PolarHBondContact O-N 2.77Å
331	S	87.6	Confident	73.3	Confident	29 Å²	29	76.3 Å²	76.3	20%	0.203	44%	0.439	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	122.1	176.2	-177.7	0	0	0	0	109.5	K287 S288 V289	K287-S331 PolarHBondContact O-N 3.07Å; S288-S331 WeakPolarHBondContact CA-O 3.48Å; V289-S331 PolarHBondContact N-O 2.97Å
332	V	87.4	Confident	75.8	Confident	18 Å²	18	71.2 Å²	71.2	11%	0.109	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	120.3	175.4	179.9	0	0	0	0	108.4	P348 V354 T362 L363 L364	V332-P348 HydrophobicContact CG1-CB 4.11Å; V332-V354 HydrophobicContact CG2-CG1 4.19Å; V332-T362 HydrophobicContact CG2-CG2 3.64Å; V332-L363 PolarHBondContact N-O 2.96Å; V332-L364 HydrophobicContact CB-CD2 4.49Å; V332-L364 HydrophobicContact CB-CG 4.26Å
333	P	86.9	Confident	78.4	Confident	31 Å²	31	67.7 Å²	67.7	20%	0.201	38%	0.384	C	S	.	.	P	Polyproline II helix	trans	-66.3	141	177.7	17.8	-17.2	0	0	0	110.4	V289 L291 V349	V289-P333 VanDerWaalsContact O-CD 3.27Å; V289-P333 WeakPolarHBondContact O-CD 3.42Å; L291-P333 HydrophobicContact CB-CG 4.37Å; L291-P333 HydrophobicContact CD1-CB 3.83Å; L291-P333 HydrophobicContact CD1-CG 3.41Å; L291-P333 VanDerWaalsContact CD1-CG 3.41Å; L291-P333 HydrophobicContact CG-CG 3.72Å; P333-V349 HydrophobicContact CB-CB 4.31Å; P333-V349 HydrophobicContact CB-CG2 4.08Å; P333-V349 HydrophobicContact CG-CB 4.03Å; P333-V349 HydrophobicContact CG-CG1 4.5Å; P333-V349 HydrophobicContact CG-CG2 4.34Å; P333-V349 WeakPolarHBondContact O-CB 3.39Å; P333-V349 WeakPolarHBondContact O-CG2 3.46Å; P333-V349 PolarHBondContact O-N 2.78Å
334	V	89.4	Confident	80.9	Confident	33 Å²	33	62.5 Å²	62.5	20%	0.2	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	123.7	-178.3	179.4	0	0	0	0	108.5	Y346 T347 L364 Y366	V334-Y346 HydrophobicContact CG1-CD1 4.14Å; V334-Y346 HydrophobicContact CG1-CG 4.43Å; V334-T347 CarbonylContact C-O 3.5Å; V334-T347 WeakPolarHBondContact CA-O 3.33Å; V334-L364 HydrophobicContact CG2-CB 4.03Å; V334-L364 HydrophobicContact CG2-CD2 3.91Å; V334-L364 HydrophobicContact CG2-CG 4.34Å; V334-Y366 HydrophobicContact CG1-CD1 4.04Å; V334-Y366 HydrophobicContact CG1-CE1 3.83Å; V334-Y366 HydrophobicContact CG2-CE1 4.19Å
335	L	88.4	Confident	83.3	Confident	82 Å²	82	59.1 Å²	59.1	43%	0.429	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	134.1	168.4	179.7	69.3	0	0	0	108.6	E337 Y346 T347 V349	L335-E337 HydrophobicContact CD2-CG 4.06Å; L335-E337 HydrophobicContact CG-CG 4.13Å; L335-Y346 CarbonylContact O-C 3.59Å; L335-Y346 VanDerWaalsContact O-CA 3.32Å; L335-Y346 WeakPolarHBondContact O-CA 3.4Å; L335-T347 PolarHBondContact N-O 2.83Å; L335-T347 PolarHBondContact O-N 3.46Å; L335-V349 HydrophobicContact CB-CG2 4.42Å
336	Y	88.8	Confident	85.3	Confident	88 Å²	88	55.7 Å²	55.7	35%	0.345	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	129.4	174	136.8	-90.3	0	0	0	108.6	E338 L344 Y346	Y336-E338 HydrophobicContact CE1-CG 4.3Å; Y336-E338 HydrophobicContact CE2-CG 3.81Å; Y336-E338 VanDerWaalsContact OH-CG 3.24Å; Y336-E338 WeakPolarHBondContact OH-CG 3.29Å; Y336-E338 PolarHBondContact OH-OE1 2.72Å; Y336-L344 HydrophobicContact CD2-CD2 4.33Å; Y336-L344 HydrophobicContact CE2-CD1 4.03Å; Y336-L344 HydrophobicContact CE2-CD2 3.6Å; Y336-L344 HydrophobicContact CE2-CG 4.33Å; Y336-Y346 AromaticContact CD2-CE1 3.9Å; Y336-Y346 HydrophobicContact CD2-CE1 3.9Å; Y336-Y346 HydrophobicContact CG-CE1 4.27Å
337	E	89.8	Confident	86.9	Confident	65 Å²	65	53.1 Å²	53.1	30%	0.304	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	127.9	179.8	-63.6	180	123.6	0	0	110	L335 R345	L335-E337 HydrophobicContact CD2-CG 4.06Å; L335-E337 HydrophobicContact CG-CG 4.13Å; E337-R345 PolarHBondContact N-O 3.39Å; E337-R345 PolarHBondContact O-N 2.86Å; E337-R345 IonicContact OE2-CZ 2.79Å; E337-R345 IonicContact OE2-NE 3.44Å; E337-R345 PolarHBondContact OE2-NE 3.38Å; E337-R345 VanDerWaalsContact OE2-NE 3.13Å; E337-R345 IonicContact OE2-NH2 3.69Å; E337-R345 PolarHBondContact OE2-NH2 2.86Å
338	E	90.1	Very high	88.1	Confident	133 Å²	133	52.3 Å²	52.3	62%	0.621	27%	0.269	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85	116.2	169.8	-54.4	-161.9	137.7	0	0	109.3	Y336 L344	Y336-E338 HydrophobicContact CE1-CG 4.3Å; Y336-E338 HydrophobicContact CE2-CG 3.81Å; Y336-E338 VanDerWaalsContact OH-CG 3.24Å; Y336-E338 WeakPolarHBondContact OH-CG 3.29Å; Y336-E338 PolarHBondContact OH-OE1 2.72Å; E338-L344 HydrophobicContact CB-CD2 4.1Å; E338-L344 HydrophobicContact CG-CD2 3.72Å
339	L	88.4	Confident	88	Confident	98 Å²	98	51.9 Å²	51.9	51%	0.513	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	-42.6	-179.2	-63.1	177.2	0	0	0	111.5	S343 R345	L339-S343 PolarHBondContact N-O 2.71Å; L339-R345 HydrophobicContact CD1-CB 3.87Å; L339-R345 HydrophobicContact CG-CB 4.31Å
340	D	86	Confident	87.1	Confident	120 Å²	120	56.8 Å²	56.8	64%	0.642	29%	0.291	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-161.1	-178.4	-179.6	-160.8	1.4	0	0	0	110.6	L342 S343	D340-L342 PolarHBondContact O-N 2.79Å; D340-S343 PolarHBondContact N-O 2.92Å; D340-S343 PolarHBondContact O-N 3.13Å
341	V	83.4	Confident	86.2	Confident	74 Å²	74	57 Å²	57	45%	0.448	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.9	119.6	172.6	-176.3	0	0	0	0	110.1	S343 L487 L494	V341-S343 PolarHBondContact O-N 3.3Å; V341-L487 HydrophobicContact CB-CD2 4.44Å; V341-L487 HydrophobicContact CG1-CD1 4.08Å; V341-L487 HydrophobicContact CG1-CD2 3.82Å; V341-L494 HydrophobicContact CG1-CD1 3.87Å
342	L	89.1	Confident	85.7	Confident	10 Å²	10	59.2 Å²	59.2	5%	0.052	32%	0.317	C	S	.	.	T	Hydrogen-bonded Turn	trans	62.3	22.8	-173.5	-53.8	175	0	0	0	114.2	D340 Q371 S473 A474 L487	D340-L342 PolarHBondContact O-N 2.79Å; L342-Q371 WeakPolarHBondContact CD2-O 2.85Å; L342-S473 CarbonylContact O-C 3.6Å; L342-S473 VanDerWaalsContact O-C 3.27Å; L342-A474 HydrophobicContact CB-CB 4.2Å; L342-A474 PolarHBondContact O-N 3.45Å; L342-L487 HydrophobicContact CD1-CD1 3.42Å; L342-L487 VanDerWaalsContact CD1-CD1 3.42Å; L342-L487 HydrophobicContact CG-CD1 4.15Å
343	S	91.9	Very high	85.5	Confident	34 Å²	34	60.9 Å²	60.9	24%	0.238	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	109.5	177.8	-171.3	0	0	0	0	111.3	L339 D340 V341 V472	L339-S343 PolarHBondContact N-O 2.71Å; D340-S343 PolarHBondContact N-O 2.92Å; D340-S343 PolarHBondContact O-N 3.13Å; V341-S343 PolarHBondContact O-N 3.3Å; S343-V472 VanDerWaalsContact CA-O 3.3Å; S343-V472 WeakPolarHBondContact CA-O 3.43Å
344	L	93.8	Very high	85.5	Confident	7 Å²	7	59.7 Å²	59.7	4%	0.037	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	142.4	-178.6	-58.9	-179.7	0	0	0	110.2	Y336 E338 Y346 L368 P369 A372 S471 V472	Y336-L344 HydrophobicContact CD2-CD2 4.33Å; Y336-L344 HydrophobicContact CE2-CD1 4.03Å; Y336-L344 HydrophobicContact CE2-CD2 3.6Å; Y336-L344 HydrophobicContact CE2-CG 4.33Å; E338-L344 HydrophobicContact CB-CD2 4.1Å; E338-L344 HydrophobicContact CG-CD2 3.72Å; L344-Y346 HydrophobicContact CB-CE2 4.14Å; L344-L368 HydrophobicContact CD1-CD1 4.08Å; L344-P369 HydrophobicContact CD1-CG 3.93Å; L344-A372 HydrophobicContact CD1-CB 3.54Å; L344-A372 HydrophobicContact CG-CB 4.23Å; L344-S471 CarbonylContact O-C 3.47Å; L344-S471 VanDerWaalsContact O-CA 3.25Å; L344-S471 WeakPolarHBondContact O-CA 3.2Å; L344-S471 WeakPolarHBondContact O-CB 3.2Å; L344-V472 HydrophobicContact CB-CB 3.93Å; L344-V472 HydrophobicContact CB-CG2 4.04Å; L344-V472 HydrophobicContact CD1-CB 4.49Å; L344-V472 HydrophobicContact CD1-CG2 4.12Å; L344-V472 HydrophobicContact CG-CB 4.26Å; L344-V472 HydrophobicContact CG-CG2 4.37Å; L344-V472 PolarHBondContact N-O 3.4Å; L344-V472 PolarHBondContact O-N 3.39Å
345	R	93.6	Very high	85.4	Confident	113 Å²	113	61 Å²	61	43%	0.426	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	133.8	173.5	-173.3	173	68.6	-178.3	2.2	110.6	E337 L339 T347	E337-R345 PolarHBondContact N-O 3.39Å; E337-R345 PolarHBondContact O-N 2.86Å; E337-R345 IonicContact OE2-CZ 2.79Å; E337-R345 IonicContact OE2-NE 3.44Å; E337-R345 PolarHBondContact OE2-NE 3.38Å; E337-R345 VanDerWaalsContact OE2-NE 3.13Å; E337-R345 IonicContact OE2-NH2 3.69Å; E337-R345 PolarHBondContact OE2-NH2 2.86Å; L339-R345 HydrophobicContact CD1-CB 3.87Å; L339-R345 HydrophobicContact CG-CB 4.31Å; R345-T347 HydrophobicContact CG-CG2 4.16Å
346	Y	93.3	Very high	85.3	Confident	6 Å²	6	57.1 Å²	57.1	2%	0.024	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	127.4	176.2	-60.5	-89.8	0	0	0	109.9	V334 L335 Y336 L344 Y366 P367 V470 V472	V334-Y346 HydrophobicContact CG1-CD1 4.14Å; V334-Y346 HydrophobicContact CG1-CG 4.43Å; L335-Y346 CarbonylContact O-C 3.59Å; L335-Y346 VanDerWaalsContact O-CA 3.32Å; L335-Y346 WeakPolarHBondContact O-CA 3.4Å; Y336-Y346 AromaticContact CD2-CE1 3.9Å; Y336-Y346 HydrophobicContact CD2-CE1 3.9Å; Y336-Y346 HydrophobicContact CG-CE1 4.27Å; L344-Y346 HydrophobicContact CB-CE2 4.14Å; Y346-Y366 AromaticContact CD1-CD1 3.66Å; Y346-Y366 HydrophobicContact CD1-CD1 3.66Å; Y346-Y366 HydrophobicContact CD1-CG 4.49Å; Y346-Y366 HydrophobicContact CD2-CD1 4.18Å; Y346-Y366 HydrophobicContact CE1-CD1 4.33Å; Y346-Y366 AromaticContact CG-CD1 3.57Å; Y346-Y366 HydrophobicContact CG-CD1 3.57Å; Y346-Y366 HydrophobicContact CG-CE1 4.21Å; Y346-P367 PolarHBondContact OH-O 3.1Å; Y346-V470 WeakPolarHBondContact CB-O 3.48Å; Y346-V470 HydrophobicContact CD2-CB 4.28Å; Y346-V470 HydrophobicContact CD2-CG1 3.85Å; Y346-V470 HydrophobicContact CE2-CG1 4.41Å; Y346-V470 HydrophobicContact CG-CG1 4.49Å; Y346-V470 PolarHBondContact N-O 3.17Å; Y346-V472 HydrophobicContact CE2-CG2 4.39Å
347	T	89.5	Confident	85.1	Confident	45 Å²	45	53.8 Å²	53.8	28%	0.276	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	127.7	-178.8	53.2	0	0	0	0	110.8	V334 L335 R345	V334-T347 CarbonylContact C-O 3.5Å; V334-T347 WeakPolarHBondContact CA-O 3.33Å; L335-T347 PolarHBondContact N-O 2.83Å; L335-T347 PolarHBondContact O-N 3.46Å; R345-T347 HydrophobicContact CG-CG2 4.16Å
348	P	86.9	Confident	84.6	Confident	16 Å²	16	53.8 Å²	53.8	10%	0.104	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.9	140.6	172.7	-20.4	31.9	0	0	0	111.3	V332 V354 L364 P468	V332-P348 HydrophobicContact CG1-CB 4.11Å; P348-V354 HydrophobicContact CB-CG2 3.93Å; P348-V354 HydrophobicContact CG-CG2 3.84Å; P348-L364 HydrophobicContact CG-CD2 4.09Å; P348-P468 HydrophobicContact CG-CG 4.04Å
349	V	74.3	Confident	84	Confident	25 Å²	25	52.2 Å²	52.2	15%	0.152	30%	0.296	C	S	.	.	S	Bend	trans	-75.3	144.7	179.6	175.3	0	0	0	0	110.6	L291 L300 P333 L335 S351	L291-V349 HydrophobicContact CD1-CG1 4.04Å; L291-V349 HydrophobicContact CD2-CG1 3.73Å; L291-V349 HydrophobicContact CG-CG1 3.94Å; L300-V349 HydrophobicContact CD2-CB 4.49Å; L300-V349 HydrophobicContact CD2-CG1 3.23Å; L300-V349 HydrophobicContact CD2-CG2 4.47Å; P333-V349 HydrophobicContact CB-CB 4.31Å; P333-V349 HydrophobicContact CB-CG2 4.08Å; P333-V349 HydrophobicContact CG-CB 4.03Å; P333-V349 HydrophobicContact CG-CG1 4.5Å; P333-V349 HydrophobicContact CG-CG2 4.34Å; P333-V349 WeakPolarHBondContact O-CB 3.39Å; P333-V349 WeakPolarHBondContact O-CG2 3.46Å; P333-V349 PolarHBondContact O-N 2.78Å; L335-V349 HydrophobicContact CB-CG2 4.42Å; V349-S351 PolarHBondContact O-N 2.02Å
350	N	64.4	Low	83.8	Confident	108 Å²	108	49.8 Å²	49.8	58%	0.578	28%	0.282	S	S	*	.	S	Bend	trans	77.5	-34.8	-174.8	-69.8	-1.1	0	0	0	118.4	G290	G290-N350 VanDerWaalsContact CA-ND2 3.33Å; G290-N350 WeakPolarHBondContact CA-ND2 3.46Å; G290-N350 PolarHBondContact O-ND2 2.87Å
351	S	67.2	Low	83.9	Confident	62 Å²	62	44.4 Å²	44.4	43%	0.434	25%	0.254	S	S	.	.			trans	-165.3	151.5	174.9	52.9	0	0	0	0	111.9	V349 N353	V349-S351 PolarHBondContact O-N 2.02Å; S351-N353 PolarHBondContact O-N 2.71Å; S351-N353 PolarHBondContact OG-O 2.91Å
352	S	77.3	Confident	84.2	Confident	76 Å²	76	41 Å²	41	53%	0.531	23%	0.233	S	C	.	.	S	Bend	trans	-62.4	-22.2	170.8	55.2	0	0	0	0	113.3
353	N	83.9	Confident	84.3	Confident	53 Å²	53	40.8 Å²	40.8	28%	0.283	23%	0.232	S	C	.	.			trans	-88	129	175.8	-62.5	-31.1	0	0	0	110.3	S351 N384 V467	S351-N353 PolarHBondContact O-N 2.71Å; S351-N353 PolarHBondContact OG-O 2.91Å; N353-N384 PolarHBondContact ND2-ND2 3.17Å; N353-N384 PolarHBondContact OD1-ND2 2Å; N353-N384 VanDerWaalsContact OD1-ND2 3.1Å; N353-V467 WeakPolarHBondContact OD1-CG2 3.04Å
354	V	86.8	Confident	84.4	Confident	5 Å²	5	39.1 Å²	39.1	3%	0.03	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	128.6	173.1	176.8	0	0	0	0	109	V332 P348 T362 L364 S465 V466 P468	V332-V354 HydrophobicContact CG2-CG1 4.19Å; P348-V354 HydrophobicContact CB-CG2 3.93Å; P348-V354 HydrophobicContact CG-CG2 3.84Å; V354-T362 HydrophobicContact CG1-CG2 3.66Å; V354-L364 HydrophobicContact CG1-CD1 4.49Å; V354-L364 HydrophobicContact CG2-CD2 4.19Å; V354-S465 WeakPolarHBondContact O-CA 3.01Å; V354-V466 PolarHBondContact N-O 2.96Å; V354-V466 PolarHBondContact O-N 2.85Å; V354-P468 HydrophobicContact CB-CG 4.4Å; V354-P468 HydrophobicContact CG2-CG 3.71Å
355	S	86	Confident	84.4	Confident	61 Å²	61	41.1 Å²	41.1	43%	0.427	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	126.2	173.4	47.5	0	0	0	0	110.9	T362	S355-T362 PolarHBondContact O-OG1 2.83Å; S355-T362 VanDerWaalsContact O-OG1 3.1Å
356	V	85.8	Confident	84.4	Confident	0 Å²	0	35.9 Å²	35.9	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	134.1	177.8	-176.1	0	0	0	0	108.4	I395 L449 L451 V463 V464 V466	V356-I395 HydrophobicContact CG1-CG2 4.29Å; V356-L449 HydrophobicContact CG1-CB 4.13Å; V356-L449 HydrophobicContact CG2-CB 3.9Å; V356-L449 HydrophobicContact CG2-CD1 4.11Å; V356-L451 HydrophobicContact CG1-CB 4.4Å; V356-V463 WeakPolarHBondContact O-CA 3.34Å; V356-V464 PolarHBondContact N-O 3.45Å; V356-V464 PolarHBondContact O-N 3.12Å; V356-V466 HydrophobicContact CG2-CB 4.21Å; V356-V466 HydrophobicContact CG2-CG2 3.84Å
357	T	84.8	Confident	84.4	Confident	18 Å²	18	38.7 Å²	38.7	11%	0.11	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	164.1	-177.1	76.5	0	0	0	0	111.3	T359 H360 L451 V463	T357-T359 PolarHBondContact OG1-OG1 3.12Å; T357-H360 PolarHBondContact OG1-N 2.94Å; T357-H360 PolarHBondContact OG1-O 2.84Å; T357-H360 VanDerWaalsContact OG1-O 3.07Å; T357-L451 PolarHBondContact O-N 2.77Å; T357-V463 HydrophobicContact CG2-CG1 4.4Å; T357-V463 HydrophobicContact CG2-CG2 4.05Å
358	E	80.8	Confident	84.6	Confident	65 Å²	65	37 Å²	37	30%	0.304	22%	0.221	S	C	.	.	S	Bend	trans	-75.9	-40.9	171.8	-177.4	-177.4	-155.9	0	0	111.7	H360 Q450 C458	E358-H360 PolarHBondContact O-N 2.96Å; E358-Q450 PolarHBondContact O-NE2 2.82Å; E358-Q450 VanDerWaalsContact O-NE2 3.1Å; E358-C458 PolarHBondContact OE1-SG 3.03Å; E358-C458 PolarHBondContact OE2-SG 2.84Å
359	T	77.3	Confident	84.7	Confident	100 Å²	100	37.5 Å²	37.5	61%	0.613	23%	0.225	S	C	*	.	S	Bend	trans	-64.6	-39.3	-169.5	59.2	0	0	0	0	114.4	T357	T357-T359 PolarHBondContact OG1-OG1 3.12Å
360	H	83.1	Confident	85.3	Confident	47 Å²	47	39.4 Å²	39.4	22%	0.218	24%	0.238	C	C	.	.	S	Bend	trans	-142.9	134.6	-176.6	-57.8	98.2	0	0	0	109.5	P327 C328 W330 T357 E358	P327-H360 PolarHBondContact O-CD2 3.12Å; P327-H360 PolarHBondContact O-NE2 2.86Å; C328-H360 VanDerWaalsContact C-CD2 3.49Å; C328-H360 WeakPolarHBondContact CA-CD2 3.33Å; C328-H360 WeakPolarHBondContact O-CB 3.4Å; C328-H360 PolarHBondContact O-CD2 3.12Å; W330-H360 HydrophobicContact CG-CB 4.48Å; W330-H360 AromaticContact NE1-ND1 3.9Å; T357-H360 PolarHBondContact OG1-N 2.94Å; T357-H360 PolarHBondContact OG1-O 2.84Å; T357-H360 VanDerWaalsContact OG1-O 3.07Å; E358-H360 PolarHBondContact O-N 2.96Å
361	P	88.3	Confident	86.3	Confident	8 Å²	8	40.9 Å²	40.9	5%	0.052	24%	0.241	C	C	.	.			trans	-64.5	145.1	174.3	30	-40.3	0	0	0	111.4	C328 V329 W330 L406 L449 Q450	C328-P361 WeakPolarHBondContact O-CD 3.23Å; V329-P361 WeakPolarHBondContact CA-O 3.31Å; V329-P361 HydrophobicContact CG2-CG 4.01Å; W330-P361 PolarHBondContact N-O 2.86Å; P361-L406 WeakPolarHBondContact CG-O 3.32Å; P361-L449 WeakPolarHBondContact CA-O 3.29Å; P361-Q450 HydrophobicContact CB-CB 4.41Å
362	T	90.1	Very high	87.3	Confident	2 Å²	2	38.1 Å²	38.1	1%	0.012	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95	126.2	172.3	-54.7	0	0	0	0	109.3	W330 V332 V354 S355 L364 T448 L449	W330-T362 CarbonylContact O-C 3.57Å; W330-T362 WeakPolarHBondContact O-CA 3.49Å; V332-T362 HydrophobicContact CG2-CG2 3.64Å; V354-T362 HydrophobicContact CG1-CG2 3.66Å; S355-T362 PolarHBondContact O-OG1 2.83Å; S355-T362 VanDerWaalsContact O-OG1 3.1Å; T362-L364 HydrophobicContact CG2-CD1 4.2Å; T362-T448 CarbonylContact O-C 3.53Å; T362-T448 WeakPolarHBondContact O-CA 3.43Å; T362-L449 PolarHBondContact N-O 3Å; T362-L449 PolarHBondContact O-N 3.26Å
363	L	91.5	Very high	88	Confident	5 Å²	5	34.6 Å²	34.6	3%	0.026	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	130.4	-177.7	176.3	67.1	0	0	0	110.5	W255 V329 W330 V332 P404 Y446 T448	W255-L363 HydrophobicContact CH2-CD2 4.48Å; W255-L363 HydrophobicContact CZ3-CD2 4.42Å; V329-L363 HydrophobicContact CG1-CB 3.57Å; V329-L363 HydrophobicContact CG1-CD2 4.25Å; W330-L363 PolarHBondContact O-N 2.77Å; V332-L363 PolarHBondContact N-O 2.96Å; L363-P404 HydrophobicContact CD1-CB 3.65Å; L363-P404 HydrophobicContact CD1-CG 4.22Å; L363-Y446 HydrophobicContact CD1-CD1 4.09Å; L363-T448 HydrophobicContact CD1-CG2 3.52Å
364	L	93.2	Very high	88.5	Confident	0 Å²	0	32.1 Å²	32.1	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	139.4	170.4	-62.2	92.5	0	0	0	109.7	V332 V334 P348 V354 T362 Y366 Y446 L447 L449 P468	V332-L364 HydrophobicContact CB-CD2 4.49Å; V332-L364 HydrophobicContact CB-CG 4.26Å; V334-L364 HydrophobicContact CG2-CB 4.03Å; V334-L364 HydrophobicContact CG2-CD2 3.91Å; V334-L364 HydrophobicContact CG2-CG 4.34Å; P348-L364 HydrophobicContact CG-CD2 4.09Å; V354-L364 HydrophobicContact CG1-CD1 4.49Å; V354-L364 HydrophobicContact CG2-CD2 4.19Å; T362-L364 HydrophobicContact CG2-CD1 4.2Å; L364-Y366 HydrophobicContact CB-CE2 3.69Å; L364-Y366 WeakPolarHBondContact CB-OH 3.42Å; L364-Y366 WeakPolarHBondContact CD2-OH 3.35Å; L364-Y446 WeakPolarHBondContact O-CA 3.33Å; L364-L447 HydrophobicContact CB-CB 4.36Å; L364-L447 HydrophobicContact CD1-CD2 4.43Å; L364-L447 PolarHBondContact N-O 3.37Å; L364-L447 PolarHBondContact O-N 2.76Å; L364-L449 HydrophobicContact CD1-CD1 3.88Å; L364-P468 HydrophobicContact CD2-CG 3.99Å
365	T	93.3	Very high	88.8	Confident	49 Å²	49	31.9 Å²	31.9	30%	0.301	18%	0.183	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	129.5	-173.9	-56.6	0	0	0	0	110.2	T444 Y446	T365-T444 HydrophobicContact CG2-CG2 3.28Å; T365-Y446 HydrophobicContact CG2-CD1 4.01Å; T365-Y446 HydrophobicContact CG2-CE1 3.66Å
366	Y	94.8	Very high	89.2	Confident	3 Å²	3	29.1 Å²	29.1	1%	0.012	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	90.2	-175.5	-53.4	-81.6	0	0	0	109.7	V334 Y346 L364 L368 F399 W445 L447 V470	V334-Y366 HydrophobicContact CG1-CD1 4.04Å; V334-Y366 HydrophobicContact CG1-CE1 3.83Å; V334-Y366 HydrophobicContact CG2-CE1 4.19Å; Y346-Y366 AromaticContact CD1-CD1 3.66Å; Y346-Y366 HydrophobicContact CD1-CD1 3.66Å; Y346-Y366 HydrophobicContact CD1-CG 4.49Å; Y346-Y366 HydrophobicContact CD2-CD1 4.18Å; Y346-Y366 HydrophobicContact CE1-CD1 4.33Å; Y346-Y366 AromaticContact CG-CD1 3.57Å; Y346-Y366 HydrophobicContact CG-CD1 3.57Å; Y346-Y366 HydrophobicContact CG-CE1 4.21Å; L364-Y366 HydrophobicContact CB-CE2 3.69Å; L364-Y366 WeakPolarHBondContact CB-OH 3.42Å; L364-Y366 WeakPolarHBondContact CD2-OH 3.35Å; Y366-L368 PolarHBondContact O-N 3.28Å; Y366-F399 HydrophobicContact CD2-CE2 4.17Å; Y366-W445 PolarHBondContact N-O 3.49Å; Y366-W445 PolarHBondContact O-N 3.06Å; Y366-L447 HydrophobicContact CD2-CB 4.43Å; Y366-L447 HydrophobicContact CE2-CB 3.6Å; Y366-L447 HydrophobicContact CE2-CD2 4.32Å; Y366-V470 HydrophobicContact CD1-CB 4.04Å; Y366-V470 HydrophobicContact CD1-CG1 3.98Å; Y366-V470 HydrophobicContact CD1-CG2 4.33Å; Y366-V470 HydrophobicContact CE1-CB 3.71Å; Y366-V470 HydrophobicContact CE1-CG1 4.16Å; Y366-V470 HydrophobicContact CE1-CG2 3.71Å; Y366-V470 HydrophobicContact CE2-CG2 4.12Å; Y366-V470 HydrophobicContact CG-CG1 4.28Å
367	P	93.6	Very high	89.6	Confident	65 Å²	65	29.2 Å²	29.2	42%	0.422	16%	0.164	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.5	124.9	174.8	27.1	-32.9	0	0	0	109.9	Y346	Y346-P367 PolarHBondContact OH-O 3.1Å
368	L	92.9	Very high	90.1	Very high	8 Å²	8	29.4 Å²	29.4	4%	0.042	16%	0.164	C	C	.	.			trans	-110.4	108.7	-179.8	-171.1	70.8	0	0	0	111.9	L344 Y366 A372 P440 S442 T443 V472	L344-L368 HydrophobicContact CD1-CD1 4.08Å; Y366-L368 PolarHBondContact O-N 3.28Å; L368-A372 HydrophobicContact CD1-CB 3.9Å; L368-P440 HydrophobicContact CD2-CB 3.78Å; L368-P440 HydrophobicContact CD2-CG 3.44Å; L368-P440 VanDerWaalsContact CD2-CG 3.44Å; L368-S442 PolarHBondContact O-OG 3Å; L368-T443 VanDerWaalsContact CB-O 3.28Å; L368-T443 WeakPolarHBondContact CB-O 3.48Å; L368-T443 PolarHBondContact N-O 3.1Å; L368-T443 VanDerWaalsContact N-O 3.07Å; L368-V472 HydrophobicContact CD1-CG2 3.56Å
369	P	89.6	Confident	90.8	Very high	28 Å²	28	26.4 Å²	26.4	18%	0.182	15%	0.15	C	C	.	.			trans	-69.3	151.1	-177.5	27.6	-34.1	0	0	0	112.2	L344 Q371 A372	L344-P369 HydrophobicContact CD1-CG 3.93Å; P369-Q371 PolarHBondContact O-N 3.35Å; P369-Q371 VanDerWaalsContact O-N 3.12Å; P369-A372 HydrophobicContact CG-CB 4.01Å; P369-A372 PolarHBondContact O-N 3.25Å
370	P	86.4	Confident	91.6	Very high	65 Å²	65	23.1 Å²	23.1	42%	0.422	13%	0.128	S	C	.	.	G	3₁₀ helix	trans	-55.6	-33	-178.3	-24.1	30	0	0	0	114.2	A372 T373 S442	P370-A372 VanDerWaalsContact C-N 3.29Å; P370-A372 PolarHBondContact O-N 3.37Å; P370-T373 PolarHBondContact O-N 2.99Å; P370-T373 PolarHBondContact O-OG1 3.02Å; P370-S442 VanDerWaalsContact CA-OG 3.24Å; P370-S442 WeakPolarHBondContact CA-OG 2.87Å; P370-S442 VanDerWaalsContact CD-OG 3.31Å; P370-S442 WeakPolarHBondContact CD-OG 3.43Å; P370-S442 VanDerWaalsContact CG-OG 3.28Å; P370-S442 WeakPolarHBondContact CG-OG 3.29Å; P370-S442 VanDerWaalsContact N-OG 3.13Å
371	Q	84.9	Confident	92.1	Very high	138 Å²	138	21 Å²	21	65%	0.645	12%	0.118	S	C	*	.	G	3₁₀ helix	trans	-64.6	-33.8	-179.7	-62.2	79.5	0.5	0	0	111.7	L342 P369	L342-Q371 WeakPolarHBondContact CD2-O 2.85Å; P369-Q371 PolarHBondContact O-N 3.35Å; P369-Q371 VanDerWaalsContact O-N 3.12Å
372	A	89.6	Confident	92.2	Very high	4 Å²	4	22.4 Å²	22.4	3%	0.033	13%	0.127	C	C	.	.	G	3₁₀ helix	trans	-81.1	-11.8	-177.2	0	0	0	0	0	113.9	L344 L368 P369 P370 G374 G375 V472	L344-A372 HydrophobicContact CD1-CB 3.54Å; L344-A372 HydrophobicContact CG-CB 4.23Å; L368-A372 HydrophobicContact CD1-CB 3.9Å; P369-A372 HydrophobicContact CG-CB 4.01Å; P369-A372 PolarHBondContact O-N 3.25Å; P370-A372 VanDerWaalsContact C-N 3.29Å; P370-A372 PolarHBondContact O-N 3.37Å; A372-G374 PolarHBondContact O-N 2.93Å; A372-G374 VanDerWaalsContact O-N 3.09Å; A372-G375 PolarHBondContact O-N 3.1Å; A372-G375 VanDerWaalsContact O-N 3.12Å; A372-V472 HydrophobicContact CB-CG1 4.44Å
373	T	91.9	Very high	92.1	Very high	3 Å²	3	23 Å²	23	2%	0.018	13%	0.13	C	C	.	.	G	3₁₀ helix	trans	-64.2	-14	179	61.7	0	0	0	0	114.2	P370 G375 F439 P440 Y493	P370-T373 PolarHBondContact O-N 2.99Å; P370-T373 PolarHBondContact O-OG1 3.02Å; T373-G375 PolarHBondContact O-N 2.99Å; T373-F439 VanDerWaalsContact O-CA 3.31Å; T373-F439 WeakPolarHBondContact O-CA 3.49Å; T373-P440 WeakPolarHBondContact CB-O 3.46Å; T373-P440 VanDerWaalsContact CG2-O 3.29Å; T373-P440 WeakPolarHBondContact CG2-O 3.43Å; T373-Y493 VanDerWaalsContact C-OH 3.25Å; T373-Y493 PolarHBondContact O-OH 3.38Å; T373-Y493 WeakPolarHBondContact OG1-CE2 3.37Å; T373-Y493 PolarHBondContact OG1-OH 3.31Å
374	G	93	Very high	91.5	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	14%	0.143	C	C	.	.	G	3₁₀ helix	trans	-79.4	1.8	175.2	0	0	0	0	0	114.5	A372 F439 Y493 Y495 S496	A372-G374 PolarHBondContact O-N 2.93Å; A372-G374 VanDerWaalsContact O-N 3.09Å; G374-F439 VanDerWaalsContact O-CE1 3.29Å; G374-F439 WeakPolarHBondContact O-CE1 3.5Å; G374-Y493 WeakPolarHBondContact CA-OH 3.39Å; G374-Y493 PolarHBondContact N-OH 3.21Å; G374-Y493 VanDerWaalsContact N-OH 3.15Å; G374-Y495 CarbonylContact O-C 3.52Å; G374-Y495 VanDerWaalsContact O-CA 3.32Å; G374-Y495 WeakPolarHBondContact O-CA 3.42Å; G374-S496 PolarHBondContact O-N 2.7Å; G374-S496 PolarHBondContact O-OG 3.05Å
375	G	93.8	Very high	90	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	17%	0.166	C	C	.	.	S	Bend	trans	-111.4	-155.1	176.2	0	0	0	0	0	113.3	A372 T373 F439 P440 S473 A474	A372-G375 PolarHBondContact O-N 3.1Å; A372-G375 VanDerWaalsContact O-N 3.12Å; T373-G375 PolarHBondContact O-N 2.99Å; G375-F439 PolarHBondContact O-N 2.81Å; G375-P440 WeakPolarHBondContact O-CD 3.32Å; G375-S473 CarbonylContact C-O 3.56Å; G375-S473 WeakPolarHBondContact CA-O 3.37Å; G375-A474 WeakPolarHBondContact CA-O 3.25Å
376	T	94.4	Very high	88.3	Confident	3 Å²	3	32 Å²	32	2%	0.018	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	125.6	178.7	-54.6	0	0	0	0	109.9	N378 R436 V472 S473 V476	T376-N378 WeakPolarHBondContact CG2-OD1 3.43Å; T376-R436 HydrophobicContact CG2-CB 4.17Å; T376-V472 VanDerWaalsContact O-CA 3.29Å; T376-V472 WeakPolarHBondContact O-CA 3.4Å; T376-S473 PolarHBondContact N-O 2.8Å; T376-S473 PolarHBondContact O-N 3.13Å; T376-V476 HydrophobicContact CG2-CG2 3.88Å; T376-V476 WeakPolarHBondContact OG1-CG2 3.35Å
377	L	95.1	Very high	86.1	Confident	2 Å²	2	38.2 Å²	38.2	1%	0.01	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	119	173.4	176.1	63.9	0	0	0	109.7	F399 L437 P440 W445 V470 V472	L377-F399 HydrophobicContact CD1-CZ 4.47Å; L377-F399 HydrophobicContact CD2-CE1 3.72Å; L377-F399 HydrophobicContact CD2-CZ 3.69Å; L377-F399 HydrophobicContact CG-CE1 4.12Å; L377-F399 HydrophobicContact CG-CZ 4.13Å; L377-L437 HydrophobicContact CB-CB 4.31Å; L377-L437 HydrophobicContact CD2-CD1 4.44Å; L377-L437 PolarHBondContact N-O 2.03Å; L377-L437 PolarHBondContact O-N 2.72Å; L377-P440 HydrophobicContact CB-CB 3.97Å; L377-P440 HydrophobicContact CB-CG 3.85Å; L377-P440 HydrophobicContact CD2-CB 4.05Å; L377-W445 HydrophobicContact CD2-CD2 3.74Å; L377-W445 HydrophobicContact CD2-CE3 4.2Å; L377-W445 HydrophobicContact CD2-CG 3.99Å; L377-W445 HydrophobicContact CD2-CZ2 4.26Å; L377-V470 HydrophobicContact CD1-CG1 3.9Å; L377-V472 HydrophobicContact CD1-CG2 3.94Å
378	N	95.1	Very high	84.1	Confident	23 Å²	23	39.2 Å²	39.2	12%	0.123	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	129.2	-177.7	-55.4	-56.6	0	0	0	109.7	T376 R436 V470 S471 S473	T376-N378 WeakPolarHBondContact CG2-OD1 3.43Å; N378-R436 WeakPolarHBondContact OD1-CG 3.48Å; N378-V470 WeakPolarHBondContact O-CA 3.33Å; N378-S471 PolarHBondContact N-O 3.43Å; N378-S471 PolarHBondContact O-N 3.23Å; N378-S473 PolarHBondContact ND2-OG 3.29Å
379	L	95.1	Very high	82.5	Confident	2 Å²	2	42.3 Å²	42.3	1%	0.01	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	125.9	169.5	168.1	66.6	0	0	0	107.9	L381 F399 V424 M434 V435 L447 V470	L379-L381 HydrophobicContact CD1-CD2 3.87Å; L379-L381 HydrophobicContact CD1-CG 4.19Å; L379-L381 HydrophobicContact CG-CG 4.4Å; L379-F399 HydrophobicContact CB-CE1 4.47Å; L379-F399 HydrophobicContact CD2-CB 3.8Å; L379-F399 HydrophobicContact CD2-CD1 4.03Å; L379-F399 HydrophobicContact CD2-CD2 4.21Å; L379-F399 HydrophobicContact CD2-CG 3.78Å; L379-V424 HydrophobicContact CD2-CG2 4.47Å; L379-M434 CarbonylContact O-C 3.42Å; L379-M434 VanDerWaalsContact O-CA 3.26Å; L379-M434 WeakPolarHBondContact O-CA 3.39Å; L379-V435 HydrophobicContact CB-CB 4.42Å; L379-V435 PolarHBondContact N-O 3.14Å; L379-V435 PolarHBondContact O-N 3.21Å; L379-L447 HydrophobicContact CD1-CD1 4.36Å; L379-L447 HydrophobicContact CD1-CD2 4.05Å; L379-L447 HydrophobicContact CD2-CD1 4Å; L379-V470 HydrophobicContact CD1-CG2 3.54Å
380	Q	94.1	Very high	81.2	Confident	31 Å²	31	41.2 Å²	41.2	15%	0.145	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	125.5	171	178.9	-173.8	-62.8	0	0	109.2	T382 K432 A433 M434 E469	Q380-T382 PolarHBondContact NE2-OG1 3.14Å; Q380-K432 HydrophobicContact CG-CG 4.39Å; Q380-K432 VanDerWaalsContact OE1-CE 3.25Å; Q380-A433 WeakPolarHBondContact CA-O 3.42Å; Q380-M434 HydrophobicContact CB-CE 4.26Å; Q380-M434 HydrophobicContact CG-CE 4.13Å; Q380-E469 HydrophobicContact CB-CB 4.22Å; Q380-E469 PolarHBondContact N-O 2.7Å; Q380-E469 PolarHBondContact NE2-OE2 3.41Å; Q380-E469 PolarHBondContact O-N 3.34Å
381	L	93.2	Very high	80.2	Confident	1 Å²	1	40.6 Å²	40.6	1%	0.005	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	126.2	175.1	-62	178.9	0	0	0	108.8	L379 A397 V424 I426 K432 A433 L447 L449 V466 P468	L379-L381 HydrophobicContact CD1-CD2 3.87Å; L379-L381 HydrophobicContact CD1-CG 4.19Å; L379-L381 HydrophobicContact CG-CG 4.4Å; L381-A397 HydrophobicContact CD1-CB 3.36Å; L381-V424 HydrophobicContact CD1-CB 4.12Å; L381-V424 HydrophobicContact CD1-CG1 3.92Å; L381-I426 HydrophobicContact CB-CD1 4.3Å; L381-I426 HydrophobicContact CB-CG2 4.13Å; L381-K432 WeakPolarHBondContact O-CA 3.47Å; L381-A433 PolarHBondContact N-O 3.49Å; L381-A433 PolarHBondContact O-N 3.48Å; L381-L447 HydrophobicContact CD2-CD2 4.12Å; L381-L449 HydrophobicContact CD1-CD2 4.27Å; L381-L449 HydrophobicContact CD2-CD2 4.34Å; L381-V466 HydrophobicContact CD2-CG1 4.38Å; L381-P468 HydrophobicContact CD2-CB 3.89Å
382	T	91.6	Very high	79.6	Confident	39 Å²	39	41.2 Å²	41.2	24%	0.239	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	126.6	177.9	-46.5	0	0	0	0	110.3	Q380 V467	Q380-T382 PolarHBondContact NE2-OG1 3.14Å; T382-V467 PolarHBondContact N-O 3.48Å; T382-V467 PolarHBondContact O-N 2.69Å
383	L	87.5	Confident	79.1	Confident	13 Å²	13	41.7 Å²	41.7	7%	0.068	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	121.6	176	-172.6	70.4	0	0	0	109.9	S385 L390 I395 I426 P431 V464 V466	L383-S385 PolarHBondContact O-N 3.2Å; L383-L390 HydrophobicContact CD1-CD2 3.91Å; L383-L390 HydrophobicContact CD2-CD2 3.55Å; L383-L390 HydrophobicContact CG-CD2 4.39Å; L383-I395 HydrophobicContact CD1-CD1 3.76Å; L383-I426 HydrophobicContact CB-CD1 4.26Å; L383-I426 HydrophobicContact CD1-CD1 4.37Å; L383-P431 HydrophobicContact CB-CB 4.05Å; L383-P431 WeakPolarHBondContact CB-O 3.46Å; L383-P431 PolarHBondContact N-O 3.21Å; L383-V464 HydrophobicContact CD1-CG1 3.68Å; L383-V466 HydrophobicContact CD1-CG2 4.46Å
384	N	77.6	Confident	78.8	Confident	58 Å²	58	42.7 Å²	42.7	31%	0.31	27%	0.267	S	S	.	.			trans	-84.5	94.5	177.8	-167.4	-10.9	0	0	0	110	N353 T386 S465	N353-N384 PolarHBondContact ND2-ND2 3.17Å; N353-N384 PolarHBondContact OD1-ND2 2Å; N353-N384 VanDerWaalsContact OD1-ND2 3.1Å; N384-T386 PolarHBondContact O-N 3Å; N384-S465 PolarHBondContact N-O 3.49Å
385	S	61.8	Low	78.5	Confident	68 Å²	68	42.7 Å²	42.7	48%	0.476	27%	0.267	S	S	.	.			trans	-93.4	45.1	-169.4	-174.9	0	0	0	0	114.1	L383 N387	L383-S385 PolarHBondContact O-N 3.2Å; S385-N387 VanDerWaalsContact C-N 3.34Å
386	T	57.4	Low	78.3	Confident	117 Å²	117	43.9 Å²	43.9	72%	0.718	27%	0.273	S	S	*	.	S	Bend	trans	-76.2	-18	179.6	47.1	0	0	0	0	114.2	N384	N384-T386 PolarHBondContact O-N 3Å
387	N	48.8	Very low	78.2	Confident	135 Å²	135	43.8 Å²	43.8	72%	0.722	27%	0.272	S	S	*	.	S	Bend	trans	-143.1	107	168.2	-75.9	-38	0	0	0	108.7	S385 T389	S385-N387 VanDerWaalsContact C-N 3.34Å; N387-T389 VanDerWaalsContact C-N 3.27Å; N387-T389 PolarHBondContact O-N 3.17Å
388	A	52.7	Low	78.1	Confident	86 Å²	86	43.7 Å²	43.7	71%	0.711	27%	0.272	S	S	*	.			trans	-66.9	75.7	-174.3	0	0	0	0	0	113.1
389	T	58.7	Low	78	Confident	72 Å²	72	42.6 Å²	42.6	44%	0.442	27%	0.266	S	S	.	.			trans	-93.4	-11	173.4	52.2	0	0	0	0	112.8	N387 G391 A461	N387-T389 VanDerWaalsContact C-N 3.27Å; N387-T389 PolarHBondContact O-N 3.17Å; T389-G391 VanDerWaalsContact C-N 3.33Å; T389-G391 PolarHBondContact O-N 2.95Å; T389-A461 WeakPolarHBondContact O-CB 3.33Å
390	L	62.8	Low	77.9	Confident	6 Å²	6	42.5 Å²	42.5	3%	0.031	27%	0.266	C	S	.	.			trans	-71.5	-20.9	-171	-160.4	67.1	0	0	0	114.3	L383 N392 N393 V428 L451 V464	L383-L390 HydrophobicContact CD1-CD2 3.91Å; L383-L390 HydrophobicContact CD2-CD2 3.55Å; L383-L390 HydrophobicContact CG-CD2 4.39Å; L390-N392 PolarHBondContact O-N 3.33Å; L390-N393 HydrophobicContact CD1-CB 4.21Å; L390-N393 HydrophobicContact CG-CB 4.32Å; L390-N393 WeakPolarHBondContact O-CA 3.35Å; L390-N393 WeakPolarHBondContact O-CB 3.46Å; L390-N393 PolarHBondContact O-N 3.38Å; L390-N393 PolarHBondContact O-ND2 3.31Å; L390-V428 HydrophobicContact CB-CG2 3.79Å; L390-V428 HydrophobicContact CD2-CG2 4.11Å; L390-V428 HydrophobicContact CG-CG2 4.33Å; L390-L451 HydrophobicContact CD1-CD1 3.64Å; L390-V464 HydrophobicContact CD1-CB 4.24Å; L390-V464 HydrophobicContact CD1-CG1 3.95Å; L390-V464 HydrophobicContact CD1-CG2 3.39Å
391	G	65.7	Low	77.8	Confident	52 Å²	52	41.3 Å²	41.3	54%	0.536	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.3	-131	177.9	0	0	0	0	0	113.1	T389 N393	T389-G391 VanDerWaalsContact C-N 3.33Å; T389-G391 PolarHBondContact O-N 2.95Å; G391-N393 VanDerWaalsContact C-N 3.31Å
392	N	71.2	Confident	77.6	Confident	150 Å²	150	44.2 Å²	44.2	80%	0.802	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.1	8.2	173.7	-76.6	-8.5	0	0	0	113.7	L390	L390-N392 PolarHBondContact O-N 3.33Å
393	N	79.8	Confident	77.6	Confident	15 Å²	15	42.4 Å²	42.4	8%	0.08	26%	0.261	C	S	.	.			trans	-77.3	154.6	-179.2	-54.9	-26.1	0	0	0	110	L390 G391 L451 C453	L390-N393 HydrophobicContact CD1-CB 4.21Å; L390-N393 HydrophobicContact CG-CB 4.32Å; L390-N393 WeakPolarHBondContact O-CA 3.35Å; L390-N393 WeakPolarHBondContact O-CB 3.46Å; L390-N393 PolarHBondContact O-N 3.38Å; L390-N393 PolarHBondContact O-ND2 3.31Å; G391-N393 VanDerWaalsContact C-N 3.31Å; N393-L451 HydrophobicContact CB-CD1 4.07Å; N393-C453 PolarHBondContact ND2-SG 2.85Å
394	S	84.8	Confident	77.7	Confident	23 Å²	23	41.8 Å²	41.8	16%	0.161	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	148.2	179.9	68.9	0	0	0	0	110.2	H410 L452	S394-H410 PolarHBondContact OG-CE1 3.04Å; S394-L452 PolarHBondContact N-O 2.83Å; S394-L452 VanDerWaalsContact N-O 3.1Å; S394-L452 PolarHBondContact O-N 3Å
395	I	87.6	Confident	78.2	Confident	0 Å²	0	39.6 Å²	39.6	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	122.8	172.7	-59.6	175.7	0	0	0	106.7	V356 L383 G425 I426 L449 L451 V464 V466	V356-I395 HydrophobicContact CG1-CG2 4.29Å; L383-I395 HydrophobicContact CD1-CD1 3.76Å; I395-G425 WeakPolarHBondContact O-CA 3.22Å; I395-I426 HydrophobicContact CB-CD1 4.29Å; I395-I426 HydrophobicContact CB-CG1 3.73Å; I395-I426 HydrophobicContact CD1-CD1 4.33Å; I395-I426 HydrophobicContact CD1-CG1 4.46Å; I395-I426 HydrophobicContact CG2-CG1 4.33Å; I395-I426 PolarHBondContact N-O 3.39Å; I395-I426 PolarHBondContact O-N 3.19Å; I395-L449 HydrophobicContact CG2-CD2 4.47Å; I395-L451 HydrophobicContact CG1-CD1 3.97Å; I395-V464 HydrophobicContact CD1-CB 4.02Å; I395-V464 HydrophobicContact CD1-CG1 3.71Å; I395-V466 HydrophobicContact CD1-CG2 3.28Å; I395-V466 HydrophobicContact CG2-CG2 4.38Å
396	M	89.3	Confident	79.1	Confident	26 Å²	26	37.7 Å²	37.7	13%	0.128	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	131.3	174.1	-174.4	64.9	171.1	0	0	108.9	L408 A423 Q450 L452	M396-L408 HydrophobicContact CG-CD2 4.28Å; M396-A423 HydrophobicContact CE-CB 3.36Å; M396-Q450 PolarHBondContact N-O 3.38Å; M396-Q450 PolarHBondContact O-N 3.06Å; M396-L452 HydrophobicContact CB-CD1 3.52Å; M396-L452 HydrophobicContact CB-CG 4.06Å; M396-L452 HydrophobicContact CG-CD1 4.17Å
397	A	91.9	Very high	80.2	Confident	0 Å²	0	39.4 Å²	39.4	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	141.1	176.1	0	0	0	0	0	110.2	L381 A423 V424 L447 T448 L449	L381-A397 HydrophobicContact CD1-CB 3.36Å; A397-A423 WeakPolarHBondContact O-CA 3.48Å; A397-V424 WeakPolarHBondContact CA-O 3.45Å; A397-V424 HydrophobicContact CB-CB 4.25Å; A397-V424 VanDerWaalsContact CB-O 3.31Å; A397-V424 WeakPolarHBondContact CB-O 3.13Å; A397-V424 PolarHBondContact N-O 3.42Å; A397-V424 PolarHBondContact O-N 2.91Å; A397-L447 HydrophobicContact CB-CD1 4.08Å; A397-T448 CarbonylContact C-O 3.49Å; A397-T448 WeakPolarHBondContact CA-O 3.29Å; A397-L449 HydrophobicContact CB-CD2 3.38Å
398	C	93.1	Very high	81.5	Confident	0 Å²	0	33.4 Å²	33.4	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	116.4	175.3	-159.3	0	0	0	0	110.8	V405 L408 C414 L447 T448	C398-V405 HydrophobicContact CB-CB 4.38Å; C398-L408 HydrophobicContact CB-CD2 3.51Å; C398-C414 WeakPolarHBondContact CA-SG 3.44Å; C398-C414 HydrophobicContact CB-CB 4.3Å; C398-C414 WeakPolarHBondContact CB-SG 3.33Å; C398-C414 WeakPolarHBondContact SG-CA 2.91Å; C398-C414 WeakPolarHBondContact SG-CB 3.44Å; C398-C414 CovalentContact SG-SG 2.02Å; C398-C414 PolarHBondContact SG-SG 3.12Å; C398-L447 WeakPolarHBondContact O-CA 3.3Å; C398-T448 WeakPolarHBondContact CB-OG1 3.48Å; C398-T448 PolarHBondContact N-O 3.28Å; C398-T448 PolarHBondContact O-N 3.36Å
399	F	93.8	Very high	82.6	Confident	1 Å²	1	33 Å²	33	0%	0.004	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	107.6	179.3	-166.5	-130.6	0	0	0	109.9	Y366 L377 L379 G421 Y422 L437 W445 Y446 L447	Y366-F399 HydrophobicContact CD2-CE2 4.17Å; L377-F399 HydrophobicContact CD1-CZ 4.47Å; L377-F399 HydrophobicContact CD2-CE1 3.72Å; L377-F399 HydrophobicContact CD2-CZ 3.69Å; L377-F399 HydrophobicContact CG-CE1 4.12Å; L377-F399 HydrophobicContact CG-CZ 4.13Å; L379-F399 HydrophobicContact CB-CE1 4.47Å; L379-F399 HydrophobicContact CD2-CB 3.8Å; L379-F399 HydrophobicContact CD2-CD1 4.03Å; L379-F399 HydrophobicContact CD2-CD2 4.21Å; L379-F399 HydrophobicContact CD2-CG 3.78Å; F399-G421 CarbonylContact O-C 3.27Å; F399-G421 WeakPolarHBondContact O-CA 3.44Å; F399-Y422 PolarHBondContact N-O 2.75Å; F399-Y422 PolarHBondContact O-N 3.17Å; F399-L437 HydrophobicContact CD1-CD1 4.09Å; F399-L437 HydrophobicContact CE1-CD1 3.92Å; F399-W445 AromaticContact CD1-CE3 3.85Å; F399-W445 HydrophobicContact CD1-CE3 3.85Å; F399-W445 HydrophobicContact CD1-CZ3 4.03Å; F399-W445 HydrophobicContact CD2-CE3 4.45Å; F399-W445 HydrophobicContact CE1-CD2 4.26Å; F399-W445 AromaticContact CE1-CE3 3.54Å; F399-W445 HydrophobicContact CE1-CE3 3.54Å; F399-W445 AromaticContact CE1-CZ3 3.95Å; F399-W445 HydrophobicContact CE1-CZ3 3.95Å; F399-W445 HydrophobicContact CE2-CB 3.91Å; F399-W445 HydrophobicContact CE2-CE3 4.18Å; F399-W445 HydrophobicContact CG-CE3 4.31Å; F399-W445 HydrophobicContact CZ-CB 3.99Å; F399-W445 HydrophobicContact CZ-CD2 4.13Å; F399-W445 AromaticContact CZ-CE3 3.73Å; F399-W445 HydrophobicContact CZ-CE3 3.73Å; F399-W445 HydrophobicContact CZ-CG 4.27Å; F399-Y446 WeakPolarHBondContact CA-O 3.01Å; F399-L447 HydrophobicContact CB-CD1 4.25Å; F399-L447 HydrophobicContact CD2-CB 4.15Å; F399-L447 HydrophobicContact CD2-CD1 4.2Å
400	S	92.6	Very high	82.9	Confident	0 Å²	0	35.6 Å²	35.6	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	143.8	-167.5	44.4	0	0	0	0	111.6	A403 Y446	S400-A403 WeakPolarHBondContact CB-O 3.25Å; S400-A403 PolarHBondContact OG-O 3.3Å; S400-Y446 PolarHBondContact N-O 3.42Å; S400-Y446 PolarHBondContact O-N 3.04Å
401	A	91.4	Very high	82.8	Confident	6 Å²	6	40.4 Å²	40.4	5%	0.05	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	149.9	176.5	0	0	0	0	0	110.2	A403 T443 W445	A401-A403 PolarHBondContact O-N 3.41Å; A401-T443 HydrophobicContact CB-CG2 3.78Å; A401-W445 HydrophobicContact CB-CD2 4.14Å; A401-W445 HydrophobicContact CB-CE3 4.17Å; A401-W445 HydrophobicContact CB-CH2 4.09Å; A401-W445 HydrophobicContact CB-CZ2 4.06Å; A401-W445 HydrophobicContact CB-CZ3 4.14Å
402	W	90.3	Very high	82.8	Confident	62 Å²	62	43.5 Å²	43.5	24%	0.235	23%	0.226	C	C	.	.	S	Bend	trans	68	-30.9	175.3	-57.5	92.3	0	0	0	117.4	W87 P254 W255 F419 T443 T444	W87-W402 AromaticContact CH2-CE2 3.85Å; W87-W402 AromaticContact CH2-CZ2 3.65Å; W87-W402 HydrophobicContact CH2-CZ2 3.65Å; W87-W402 AromaticContact CH2-NE1 3.76Å; W87-W402 AromaticContact CZ2-CZ2 3.83Å; W87-W402 HydrophobicContact CZ2-CZ2 3.83Å; P254-W402 WeakPolarHBondContact CA-O 3.43Å; P254-W402 HydrophobicContact CB-CB 3.88Å; W255-W402 PolarHBondContact N-O 2.72Å; W402-F419 HydrophobicContact CB-CD2 3.85Å; W402-F419 HydrophobicContact CB-CE2 3.8Å; W402-F419 HydrophobicContact CB-CZ 4.46Å; W402-F419 AromaticContact CD1-CD1 3.74Å; W402-F419 AromaticContact CD1-CD2 3.94Å; W402-F419 AromaticContact CD1-CE1 3.68Å; W402-F419 AromaticContact CD1-CE2 3.85Å; W402-F419 AromaticContact CD1-CG 3.91Å; W402-F419 AromaticContact CD1-CZ 3.73Å; W402-F419 HydrophobicContact CD2-CE2 4.42Å; W402-F419 HydrophobicContact CD2-CZ 4.27Å; W402-F419 HydrophobicContact CG-CD2 4.05Å; W402-F419 HydrophobicContact CG-CE1 4.32Å; W402-F419 AromaticContact CG-CE2 3.76Å; W402-F419 HydrophobicContact CG-CE2 3.76Å; W402-F419 HydrophobicContact CG-CG 4.45Å; W402-F419 AromaticContact CG-CZ 3.92Å; W402-F419 HydrophobicContact CG-CZ 3.92Å; W402-F419 AromaticContact NE1-CE1 3.81Å; W402-T443 HydrophobicContact CD2-CG2 4.33Å; W402-T443 HydrophobicContact CG-CG2 4.3Å; W402-T444 PolarHBondContact N-O 2.91Å; W402-T444 VanDerWaalsContact N-O 3.08Å
403	A	90.6	Very high	82.8	Confident	0 Å²	0	40.5 Å²	40.5	0%	0	21%	0.214	C	C	.	.	S	Bend	trans	-152.4	147.3	175	0	0	0	0	0	111	P253 S400 A401 T416	P253-A403 WeakPolarHBondContact O-CB 3.4Å; S400-A403 WeakPolarHBondContact CB-O 3.25Å; S400-A403 PolarHBondContact OG-O 3.3Å; A401-A403 PolarHBondContact O-N 3.41Å; A403-T416 HydrophobicContact CB-CG2 4.14Å; A403-T416 WeakPolarHBondContact O-CG2 3.45Å
404	P	90.2	Very high	83	Confident	1 Å²	1	40 Å²	40	1%	0.006	21%	0.212	C	C	.	.			trans	-82.2	155.1	171.2	30.9	-31.1	0	0	0	112.7	W255 L363 L406 Y446 T448	W255-P404 HydrophobicContact CD2-CG 4.34Å; W255-P404 HydrophobicContact CE3-CG 4.05Å; W255-P404 HydrophobicContact CH2-CG 3.11Å; W255-P404 HydrophobicContact CZ2-CG 3.42Å; W255-P404 VanDerWaalsContact CZ2-CG 3.42Å; W255-P404 HydrophobicContact CZ3-CG 3.45Å; W255-P404 VanDerWaalsContact CZ3-CG 3.45Å; L363-P404 HydrophobicContact CD1-CB 3.65Å; L363-P404 HydrophobicContact CD1-CG 4.22Å; P404-L406 HydrophobicContact CB-CD2 4.13Å; P404-L406 HydrophobicContact CG-CD2 4.14Å; P404-L406 HydrophobicContact CG-CG 4.5Å; P404-Y446 HydrophobicContact CB-CD1 4.42Å; P404-Y446 HydrophobicContact CB-CG 4.06Å; P404-Y446 HydrophobicContact CG-CD1 4.4Å; P404-Y446 HydrophobicContact CG-CG 4.33Å; P404-T448 HydrophobicContact CB-CG2 3.75Å
405	V	88.4	Confident	83.1	Confident	11 Å²	11	45.2 Å²	45.2	7%	0.067	23%	0.228	C	C	.	.			trans	-98.9	109.2	168	-179.2	0	0	0	0	108.8	C398 L408 T416 T448	C398-V405 HydrophobicContact CB-CB 4.38Å; V405-L408 HydrophobicContact CG1-CD2 4.48Å; V405-T416 HydrophobicContact CG2-CG2 3.97Å; V405-T448 VanDerWaalsContact O-CB 3.3Å; V405-T448 WeakPolarHBondContact O-CB 3.41Å; V405-T448 VanDerWaalsContact O-CG2 3.32Å; V405-T448 WeakPolarHBondContact O-CG2 3.49Å; V405-T448 PolarHBondContact O-OG1 2.93Å
406	L	81.1	Confident	83	Confident	29 Å²	29	45.3 Å²	45.3	15%	0.152	23%	0.229	C	C	.	.			trans	-91.7	-9.9	-173.7	-59.3	179.8	0	0	0	114.3	W255 V329 P361 P404 T448	W255-L406 HydrophobicContact CZ2-CD1 4.48Å; V329-L406 HydrophobicContact CG1-CD2 4.34Å; V329-L406 HydrophobicContact CG2-CD1 4.04Å; V329-L406 HydrophobicContact CG2-CD2 3.76Å; V329-L406 HydrophobicContact CG2-CG 4.34Å; P361-L406 WeakPolarHBondContact CG-O 3.32Å; P404-L406 HydrophobicContact CB-CD2 4.13Å; P404-L406 HydrophobicContact CG-CD2 4.14Å; P404-L406 HydrophobicContact CG-CG 4.5Å; L406-T448 HydrophobicContact CD2-CG2 4.21Å
407	Q	80.3	Confident	82.5	Confident	153 Å²	153	44.5 Å²	44.5	72%	0.715	23%	0.227	S	C	*	.	S	Bend	trans	-118.3	105.2	176	-68.9	177.3	-3.7	0	0	107.6
408	L	76.3	Confident	82.1	Confident	8 Å²	8	45.1 Å²	45.1	4%	0.042	23%	0.23	C	C	.	.			trans	-99.9	122	-177.9	-68	159.2	0	0	0	109.1	M396 C398 V405 Q450 L452	M396-L408 HydrophobicContact CG-CD2 4.28Å; C398-L408 HydrophobicContact CB-CD2 3.51Å; V405-L408 HydrophobicContact CG1-CD2 4.48Å; L408-Q450 HydrophobicContact CB-CB 4.15Å; L408-Q450 HydrophobicContact CD1-CB 3.5Å; L408-Q450 VanDerWaalsContact CD1-CB 3.5Å; L408-Q450 HydrophobicContact CG-CB 4.4Å; L408-L452 WeakPolarHBondContact O-CD2 3.4Å
409	N	74.3	Confident	81.6	Confident	78 Å²	78	46.1 Å²	46.1	42%	0.417	24%	0.235	S	C	.	.			trans	-127.2	151.1	177.1	-75.7	-30	0	0	0	110.2	S411 E412	N409-S411 PolarHBondContact O-N 3.24Å; N409-E412 HydrophobicContact CB-CB 4.48Å
410	H	64.5	Low	81.2	Confident	127 Å²	127	51.7 Å²	51.7	59%	0.588	26%	0.262	S	S	*	.	S	Bend	trans	-62.2	-27.9	177.4	-88.1	-71.9	0	0	0	114.1	S394 L452	S394-H410 PolarHBondContact OG-CE1 3.04Å; H410-L452 WeakPolarHBondContact NE2-CB 3.36Å
411	S	62.1	Low	81	Confident	107 Å²	107	52.3 Å²	52.3	75%	0.748	27%	0.269	S	S	*	.	S	Bend	trans	-96.2	-18.6	-172.5	50.8	0	0	0	0	114.3	N409	N409-S411 PolarHBondContact O-N 3.24Å
412	E	64.6	Low	80.9	Confident	117 Å²	117	54.9 Å²	54.9	55%	0.547	28%	0.277	S	S	.	.	S	Bend	trans	-99	127.8	-175	-68.4	-169.1	155.3	0	0	110.9	N409	N409-E412 HydrophobicContact CB-CB 4.48Å
413	P	71.5	Confident	80.9	Confident	86 Å²	86	54.6 Å²	54.6	56%	0.558	29%	0.289	S	S	*	.			trans	-63.1	147.9	172.3	28	-33	0	0	0	109.4	R415	P413-R415 VanDerWaalsContact C-N 3.26Å; P413-R415 WeakPolarHBondContact O-CB 3.36Å; P413-R415 PolarHBondContact O-N 2.9Å
414	C	85.3	Confident	80.9	Confident	5 Å²	5	55.1 Å²	55.1	3%	0.034	29%	0.291	C	S	.	.	S	Bend	trans	-54.7	86.4	169.4	-92.2	0	0	0	0	111.6	C398 G421 A423	C398-C414 WeakPolarHBondContact CA-SG 3.44Å; C398-C414 HydrophobicContact CB-CB 4.3Å; C398-C414 WeakPolarHBondContact CB-SG 3.33Å; C398-C414 WeakPolarHBondContact SG-CA 2.91Å; C398-C414 WeakPolarHBondContact SG-CB 3.44Å; C398-C414 CovalentContact SG-SG 2.02Å; C398-C414 PolarHBondContact SG-SG 3.12Å; C414-G421 CarbonylContact O-C 3.53Å; C414-G421 VanDerWaalsContact O-CA 3.3Å; C414-G421 WeakPolarHBondContact O-CA 2.78Å; C414-G421 PolarHBondContact O-N 3.13Å; C414-A423 HydrophobicContact CB-CB 4.15Å
415	R	85.6	Confident	80.8	Confident	132 Å²	132	57.3 Å²	57.3	50%	0.498	31%	0.314	S	S	.	.	B	Isolated β-bridge	trans	-129.3	126.2	-172.8	-173.6	170.2	-173	-165.7	3.1	109.9	P413 M420	P413-R415 VanDerWaalsContact C-N 3.26Å; P413-R415 WeakPolarHBondContact O-CB 3.36Å; P413-R415 PolarHBondContact O-N 2.9Å; R415-M420 HydrophobicContact CB-SD 4.3Å; R415-M420 HydrophobicContact CG-SD 3.84Å
416	T	85	Confident	80.8	Confident	2 Å²	2	56.9 Å²	56.9	1%	0.012	31%	0.312	C	S	.	.			trans	-95.5	172.9	165.8	71.4	0	0	0	0	108.7	A403 V405 L418 F419	A403-T416 HydrophobicContact CB-CG2 4.14Å; A403-T416 WeakPolarHBondContact O-CG2 3.45Å; V405-T416 HydrophobicContact CG2-CG2 3.97Å; T416-L418 PolarHBondContact O-N 3.28Å; T416-L418 VanDerWaalsContact O-N 3.13Å; T416-F419 PolarHBondContact N-O 3.28Å; T416-F419 WeakPolarHBondContact OG1-CA 3.3Å; T416-F419 WeakPolarHBondContact OG1-CB 3.31Å; T416-F419 PolarHBondContact OG1-N 2.76Å; T416-F419 PolarHBondContact OG1-O 2.84Å
417	G	78.8	Confident	81	Confident	9 Å²	9	58.2 Å²	58.2	9%	0.093	32%	0.319	C	S	.	.	S	Bend	trans	-57.1	-33.1	-175.9	0	0	0	0	0	114.3	L250 S251 N252	L250-G417 VanDerWaalsContact CD1-C 3.47Å; L250-G417 WeakPolarHBondContact CD1-O 3.47Å; S251-G417 WeakPolarHBondContact O-CA 3.1Å; S251-G417 PolarHBondContact O-N 2.96Å; N252-G417 PolarHBondContact O-N 3.28Å
418	L	84.1	Confident	81	Confident	13 Å²	13	53.9 Å²	53.9	7%	0.068	30%	0.303	C	S	.	.	S	Bend	trans	-124.7	-21.6	-175.4	-60.9	172.1	0	0	0	113.8	H234 S235 L250 P254 L259 T416	H234-L418 WeakPolarHBondContact CB-O 3.4Å; S235-L418 WeakPolarHBondContact O-CD2 3.47Å; L250-L418 HydrophobicContact CD1-CD2 4.07Å; L250-L418 HydrophobicContact CD1-CG 4.16Å; L250-L418 HydrophobicContact CD2-CD1 4.04Å; L250-L418 HydrophobicContact CD2-CD2 4.39Å; L250-L418 HydrophobicContact CD2-CG 3.97Å; P254-L418 HydrophobicContact CG-CD1 4.14Å; L259-L418 HydrophobicContact CD1-CD1 3.44Å; L259-L418 VanDerWaalsContact CD1-CD1 3.44Å; T416-L418 PolarHBondContact O-N 3.28Å; T416-L418 VanDerWaalsContact O-N 3.13Å
419	F	83.6	Confident	81.4	Confident	22 Å²	22	58.6 Å²	58.6	10%	0.096	34%	0.337	C	S	.	.			trans	-120.8	142.5	-173.4	-52.2	-86	0	0	0	111.8	W87 H234 P254 W402 T416	W87-F419 AromaticContact CH2-CE1 3.81Å; W87-F419 HydrophobicContact CH2-CE1 3.81Å; W87-F419 HydrophobicContact CH2-CZ 4.28Å; W87-F419 AromaticContact CZ3-CE1 3.8Å; W87-F419 HydrophobicContact CZ3-CE1 3.8Å; H234-F419 AromaticContact CD2-CD1 3.27Å; H234-F419 WeakPolarHBondContact CD2-CD1 3.42Å; H234-F419 AromaticContact CD2-CE1 3.89Å; H234-F419 AromaticContact CG-CD1 3.79Å; H234-F419 AromaticContact CG-CE1 3.94Å; H234-F419 AromaticContact NE2-CD1 3.49Å; H234-F419 WeakPolarHBondContact NE2-CD1 3.01Å; P254-F419 HydrophobicContact CB-CE2 4.03Å; P254-F419 HydrophobicContact CG-CE2 4.31Å; W402-F419 HydrophobicContact CB-CD2 3.85Å; W402-F419 HydrophobicContact CB-CE2 3.8Å; W402-F419 HydrophobicContact CB-CZ 4.46Å; W402-F419 AromaticContact CD1-CD1 3.74Å; W402-F419 AromaticContact CD1-CD2 3.94Å; W402-F419 AromaticContact CD1-CE1 3.68Å; W402-F419 AromaticContact CD1-CE2 3.85Å; W402-F419 AromaticContact CD1-CG 3.91Å; W402-F419 AromaticContact CD1-CZ 3.73Å; W402-F419 HydrophobicContact CD2-CE2 4.42Å; W402-F419 HydrophobicContact CD2-CZ 4.27Å; W402-F419 HydrophobicContact CG-CD2 4.05Å; W402-F419 HydrophobicContact CG-CE1 4.32Å; W402-F419 AromaticContact CG-CE2 3.76Å; W402-F419 HydrophobicContact CG-CE2 3.76Å; W402-F419 HydrophobicContact CG-CG 4.45Å; W402-F419 AromaticContact CG-CZ 3.92Å; W402-F419 HydrophobicContact CG-CZ 3.92Å; W402-F419 AromaticContact NE1-CE1 3.81Å; T416-F419 PolarHBondContact N-O 3.28Å; T416-F419 WeakPolarHBondContact OG1-CA 3.3Å; T416-F419 WeakPolarHBondContact OG1-CB 3.31Å; T416-F419 PolarHBondContact OG1-N 2.76Å; T416-F419 PolarHBondContact OG1-O 2.84Å
420	M	85.1	Confident	82	Confident	118 Å²	118	58.8 Å²	58.8	58%	0.581	34%	0.34	S	S	*	.	B	Isolated β-bridge	trans	-85	134.9	170.9	-66.4	-62.9	-73.4	0	0	109.5	R415	R415-M420 HydrophobicContact CB-SD 4.3Å; R415-M420 HydrophobicContact CG-SD 3.84Å
421	G	87.3	Confident	83	Confident	13 Å²	13	55.4 Å²	55.4	13%	0.134	33%	0.329	C	S	.	.			trans	-104.9	174.6	171.1	0	0	0	0	0	112	F399 C414	F399-G421 CarbonylContact O-C 3.27Å; F399-G421 WeakPolarHBondContact O-CA 3.44Å; C414-G421 CarbonylContact O-C 3.53Å; C414-G421 VanDerWaalsContact O-CA 3.3Å; C414-G421 WeakPolarHBondContact O-CA 2.78Å; C414-G421 PolarHBondContact O-N 3.13Å
422	Y	90.4	Very high	84.4	Confident	59 Å²	59	55.2 Å²	55.2	23%	0.231	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	117.2	-179	-55.3	-80.6	0	0	0	109.8	L105 F399 L437 W445	L105-Y422 HydrophobicContact CB-CD1 4.39Å; L105-Y422 HydrophobicContact CB-CE1 3.97Å; L105-Y422 HydrophobicContact CD1-CD1 3.45Å; L105-Y422 VanDerWaalsContact CD1-CD1 3.45Å; L105-Y422 HydrophobicContact CD1-CE1 3.89Å; L105-Y422 HydrophobicContact CD1-CG 4.33Å; F399-Y422 PolarHBondContact N-O 2.75Å; F399-Y422 PolarHBondContact O-N 3.17Å; Y422-L437 HydrophobicContact CD1-CD2 4.41Å; Y422-L437 HydrophobicContact CD2-CD1 3.84Å; Y422-L437 HydrophobicContact CD2-CD2 4.2Å; Y422-L437 HydrophobicContact CE1-CD2 3.88Å; Y422-L437 HydrophobicContact CE2-CD1 3.51Å; Y422-L437 HydrophobicContact CE2-CD2 3.68Å; Y422-L437 HydrophobicContact CE2-CG 4.27Å; Y422-L437 VanDerWaalsContact CZ-CD2 3.49Å; Y422-W445 HydrophobicContact CD2-CZ3 4.18Å; Y422-W445 HydrophobicContact CE2-CH2 4.07Å; Y422-W445 AromaticContact CE2-CZ3 3.95Å; Y422-W445 HydrophobicContact CE2-CZ3 3.95Å
423	A	90.2	Very high	85.7	Confident	57 Å²	57	50.5 Å²	50.5	47%	0.471	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	130.4	174.4	0	0	0	0	0	110.4	M396 A397 C414	M396-A423 HydrophobicContact CE-CB 3.36Å; A397-A423 WeakPolarHBondContact O-CA 3.48Å; C414-A423 HydrophobicContact CB-CB 4.15Å
424	V	89.6	Confident	86.7	Confident	10 Å²	10	49.1 Å²	49.1	6%	0.061	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	119.6	177.1	-172.5	0	0	0	0	109.1	L379 L381 A397 A433 V435	L379-V424 HydrophobicContact CD2-CG2 4.47Å; L381-V424 HydrophobicContact CD1-CB 4.12Å; L381-V424 HydrophobicContact CD1-CG1 3.92Å; A397-V424 WeakPolarHBondContact CA-O 3.45Å; A397-V424 HydrophobicContact CB-CB 4.25Å; A397-V424 VanDerWaalsContact CB-O 3.31Å; A397-V424 WeakPolarHBondContact CB-O 3.13Å; A397-V424 PolarHBondContact N-O 3.42Å; A397-V424 PolarHBondContact O-N 2.91Å; V424-A433 HydrophobicContact CG1-CB 3.32Å; V424-V435 HydrophobicContact CG2-CG2 3.42Å; V424-V435 VanDerWaalsContact CG2-CG2 3.42Å
425	G	88.4	Confident	87.1	Confident	47 Å²	47	49.3 Å²	49.3	49%	0.485	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	136.3	176.1	0	0	0	0	0	111.4	I395	I395-G425 WeakPolarHBondContact O-CA 3.22Å
426	I	88	Confident	87.5	Confident	2 Å²	2	44.3 Å²	44.3	1%	0.01	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	143.6	168.7	60.9	178.5	0	0	0	110.1	L381 L383 I395 A433 V466	L381-I426 HydrophobicContact CB-CD1 4.3Å; L381-I426 HydrophobicContact CB-CG2 4.13Å; L383-I426 HydrophobicContact CB-CD1 4.26Å; L383-I426 HydrophobicContact CD1-CD1 4.37Å; I395-I426 HydrophobicContact CB-CD1 4.29Å; I395-I426 HydrophobicContact CB-CG1 3.73Å; I395-I426 HydrophobicContact CD1-CD1 4.33Å; I395-I426 HydrophobicContact CD1-CG1 4.46Å; I395-I426 HydrophobicContact CG2-CG1 4.33Å; I395-I426 PolarHBondContact N-O 3.39Å; I395-I426 PolarHBondContact O-N 3.19Å; I426-A433 HydrophobicContact CG2-CB 3.56Å; I426-V466 HydrophobicContact CD1-CG1 3.85Å; I426-V466 HydrophobicContact CD1-CG2 4.06Å
427	N	85.9	Confident	87.9	Confident	57 Å²	57	44.4 Å²	44.4	31%	0.305	27%	0.266	S	S	.	.			trans	-144.1	-178.7	176.8	66.3	12.2	0	0	0	109.7	S429 V430 P431	N427-S429 VanDerWaalsContact C-N 3.27Å; N427-S429 PolarHBondContact O-N 3.16Å; N427-S429 PolarHBondContact OD1-N 3.16Å; N427-S429 VanDerWaalsContact OD1-N 3.15Å; N427-V430 PolarHBondContact N-O 2.88Å; N427-V430 CarbonylContact O-C 3.51Å; N427-V430 PolarHBondContact O-N 3.43Å; N427-V430 VanDerWaalsContact O-O 3.06Å; N427-V430 WeakPolarHBondContact OD1-CA 3.39Å; N427-V430 PolarHBondContact OD1-N 2.9Å; N427-P431 VanDerWaalsContact O-CA 3.25Å; N427-P431 WeakPolarHBondContact O-CA 3.47Å
428	V	81.4	Confident	88.6	Confident	62 Å²	62	44.1 Å²	44.1	38%	0.376	26%	0.262	S	S	.	.	S	Bend	trans	-63.1	-34.1	-179.9	-177.1	0	0	0	0	112.1	L390	L390-V428 HydrophobicContact CB-CG2 3.79Å; L390-V428 HydrophobicContact CD2-CG2 4.11Å; L390-V428 HydrophobicContact CG-CG2 4.33Å
429	S	83.8	Confident	89.1	Confident	108 Å²	108	43.6 Å²	43.6	76%	0.755	26%	0.259	S	S	*	.	S	Bend	trans	-73.6	-33.4	-179.8	-48.9	0	0	0	0	113.2	N427	N427-S429 VanDerWaalsContact C-N 3.27Å; N427-S429 PolarHBondContact O-N 3.16Å; N427-S429 PolarHBondContact OD1-N 3.16Å; N427-S429 VanDerWaalsContact OD1-N 3.15Å
430	V	85.8	Confident	89.5	Confident	81 Å²	81	42.7 Å²	42.7	49%	0.491	26%	0.255	S	S	.	.	S	Bend	trans	-127.1	75.6	179.2	-172	0	0	0	0	106.9	N427 K432	N427-V430 PolarHBondContact N-O 2.88Å; N427-V430 CarbonylContact O-C 3.51Å; N427-V430 PolarHBondContact O-N 3.43Å; N427-V430 VanDerWaalsContact O-O 3.06Å; N427-V430 WeakPolarHBondContact OD1-CA 3.39Å; N427-V430 PolarHBondContact OD1-N 2.9Å; V430-K432 PolarHBondContact O-N 3.26Å
431	P	87.3	Confident	89.7	Confident	56 Å²	56	37.8 Å²	37.8	36%	0.364	23%	0.231	S	C	.	.			trans	-74.6	-6.3	-172.9	31.2	-36.9	0	0	0	112.8	L383 N427	L383-P431 HydrophobicContact CB-CB 4.05Å; L383-P431 WeakPolarHBondContact CB-O 3.46Å; L383-P431 PolarHBondContact N-O 3.21Å; N427-P431 VanDerWaalsContact O-CA 3.25Å; N427-P431 WeakPolarHBondContact O-CA 3.47Å
432	K	91.1	Very high	89.9	Confident	104 Å²	104	39 Å²	39	45%	0.452	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	129.7	-178.7	-175.2	173.6	173.6	159.1	0	110.2	Q380 L381 V430	Q380-K432 HydrophobicContact CG-CG 4.39Å; Q380-K432 VanDerWaalsContact OE1-CE 3.25Å; L381-K432 WeakPolarHBondContact O-CA 3.47Å; V430-K432 PolarHBondContact O-N 3.26Å
433	A	91.6	Very high	89.9	Confident	18 Å²	18	37.1 Å²	37.1	15%	0.149	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	152.5	172.4	0	0	0	0	0	110.4	Q380 L381 V424 I426	Q380-A433 WeakPolarHBondContact CA-O 3.42Å; L381-A433 PolarHBondContact N-O 3.49Å; L381-A433 PolarHBondContact O-N 3.48Å; V424-A433 HydrophobicContact CG1-CB 3.32Å; I426-A433 HydrophobicContact CG2-CB 3.56Å
434	M	92.6	Very high	90.1	Very high	57 Å²	57	36.3 Å²	36.3	28%	0.281	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	146.9	-174.5	-172.7	179.7	-86.6	0	0	110.1	A103 L379 Q380 R436	A103-M434 HydrophobicContact CB-CB 4.41Å; A103-M434 VanDerWaalsContact CB-O 3.3Å; A103-M434 WeakPolarHBondContact CB-O 3.28Å; L379-M434 CarbonylContact O-C 3.42Å; L379-M434 VanDerWaalsContact O-CA 3.26Å; L379-M434 WeakPolarHBondContact O-CA 3.39Å; Q380-M434 HydrophobicContact CB-CE 4.26Å; Q380-M434 HydrophobicContact CG-CE 4.13Å; M434-R436 HydrophobicContact CG-CG 4.47Å; M434-R436 PolarHBondContact SD-NH1 2.85Å; M434-R436 PolarHBondContact SD-NH2 3.35Å
435	V	93.4	Very high	90.3	Very high	9 Å²	9	36.4 Å²	36.4	6%	0.055	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	131.2	173.3	175.4	0	0	0	0	108.3	L105 L379 V424 L437	L105-V435 HydrophobicContact CD1-CG1 3.94Å; L379-V435 HydrophobicContact CB-CB 4.42Å; L379-V435 PolarHBondContact N-O 3.14Å; L379-V435 PolarHBondContact O-N 3.21Å; V424-V435 HydrophobicContact CG2-CG2 3.42Å; V424-V435 VanDerWaalsContact CG2-CG2 3.42Å; V435-L437 HydrophobicContact CG1-CD2 3.91Å; V435-L437 HydrophobicContact CG1-CG 3.99Å
436	R	94	Very high	90.6	Very high	26 Å²	26	34.7 Å²	34.7	10%	0.098	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	124.5	175.5	-55.1	-172.5	176.8	78.5	-4.9	109.9	N102 A103 T104 L105 T376 N378 M434 P438 D477	N102-R436 PolarHBondContact O-NH1 3.14Å; A103-R436 PolarHBondContact O-N 2.91Å; T104-R436 WeakPolarHBondContact CA-O 3.4Å; L105-R436 PolarHBondContact N-O 3.3Å; T376-R436 HydrophobicContact CG2-CB 4.17Å; N378-R436 WeakPolarHBondContact OD1-CG 3.48Å; M434-R436 HydrophobicContact CG-CG 4.47Å; M434-R436 PolarHBondContact SD-NH1 2.85Å; M434-R436 PolarHBondContact SD-NH2 3.35Å; R436-P438 WeakPolarHBondContact O-CD 3.29Å; R436-D477 IonicContact CZ-OD1 2.7Å; R436-D477 VanDerWaalsContact CZ-OD1 3.23Å; R436-D477 IonicContact CZ-OD2 3.13Å; R436-D477 IonicContact NE-OD1 2.96Å; R436-D477 PolarHBondContact NE-OD1 3.48Å; R436-D477 IonicContact NE-OD2 3.34Å; R436-D477 VanDerWaalsContact NH2-CG 3.26Å; R436-D477 IonicContact NH2-OD1 2.75Å; R436-D477 PolarHBondContact NH2-OD1 2.96Å; R436-D477 IonicContact NH2-OD2 2.84Å; R436-D477 PolarHBondContact NH2-OD2 3.08Å
437	L	93.6	Very high	90.9	Very high	5 Å²	5	34.6 Å²	34.6	3%	0.026	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	94.3	-177.9	-59	178.6	0	0	0	109.4	L105 L377 F399 Y422 V435 P440 W445	L105-L437 HydrophobicContact CB-CD2 3.83Å; L105-L437 WeakPolarHBondContact O-CD2 3.4Å; L377-L437 HydrophobicContact CB-CB 4.31Å; L377-L437 HydrophobicContact CD2-CD1 4.44Å; L377-L437 PolarHBondContact N-O 2.03Å; L377-L437 PolarHBondContact O-N 2.72Å; F399-L437 HydrophobicContact CD1-CD1 4.09Å; F399-L437 HydrophobicContact CE1-CD1 3.92Å; Y422-L437 HydrophobicContact CD1-CD2 4.41Å; Y422-L437 HydrophobicContact CD2-CD1 3.84Å; Y422-L437 HydrophobicContact CD2-CD2 4.2Å; Y422-L437 HydrophobicContact CE1-CD2 3.88Å; Y422-L437 HydrophobicContact CE2-CD1 3.51Å; Y422-L437 HydrophobicContact CE2-CD2 3.68Å; Y422-L437 HydrophobicContact CE2-CG 4.27Å; Y422-L437 VanDerWaalsContact CZ-CD2 3.49Å; V435-L437 HydrophobicContact CG1-CD2 3.91Å; V435-L437 HydrophobicContact CG1-CG 3.99Å; L437-P440 WeakPolarHBondContact O-CD 3.46Å; L437-W445 HydrophobicContact CD1-CE3 4.46Å; L437-W445 HydrophobicContact CD1-CH2 3.56Å; L437-W445 HydrophobicContact CD1-CZ2 4.4Å; L437-W445 HydrophobicContact CD1-CZ3 3.59Å
438	P	93.7	Very high	91.2	Very high	2 Å²	2	31.9 Å²	31.9	1%	0.013	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.9	137	174	25.8	-32.2	0	0	0	110.2	V92 T104 L105 W106 R436 W507	V92-P438 HydrophobicContact CG1-CG 4.25Å; V92-P438 HydrophobicContact CG2-CB 4.18Å; V92-P438 HydrophobicContact CG2-CG 3.98Å; V92-P438 WeakPolarHBondContact CG2-O 3.42Å; T104-P438 HydrophobicContact CG2-CG 3.85Å; L105-P438 WeakPolarHBondContact O-CD 3.34Å; W106-P438 HydrophobicContact CB-CG 4.38Å; R436-P438 WeakPolarHBondContact O-CD 3.29Å; P438-W507 HydrophobicContact CB-CE3 4.07Å; P438-W507 HydrophobicContact CB-CH2 3.65Å; P438-W507 HydrophobicContact CB-CZ3 3.3Å; P438-W507 HydrophobicContact CG-CH2 4.45Å; P438-W507 HydrophobicContact CG-CZ3 4.21Å
439	F	93.6	Very high	91.7	Very high	2 Å²	2	29 Å²	29	1%	0.009	17%	0.167	C	C	.	.	S	Bend	trans	48.9	66.1	-178.1	-55.2	-30.9	0	0	0	112.4	Y45 R86 A89 P90 V92 T373 G374 G375 W507	Y45-F439 HydrophobicContact CD1-CE2 4.27Å; Y45-F439 HydrophobicContact CD1-CZ 4.19Å; Y45-F439 AromaticContact CE1-CE2 3.59Å; Y45-F439 HydrophobicContact CE1-CE2 3.59Å; Y45-F439 AromaticContact CE1-CZ 3.76Å; Y45-F439 HydrophobicContact CE1-CZ 3.76Å; Y45-F439 AromaticContact CE2-CE2 3.86Å; Y45-F439 HydrophobicContact CE2-CE2 3.86Å; Y45-F439 AromaticContact CZ-CE2 3.36Å; Y45-F439 WeakPolarHBondContact OH-CE2 3.48Å; R86-F439 PolarHBondContact NH1-O 2.87Å; R86-F439 PolarHBondContact NH2-O 2.82Å; A89-F439 HydrophobicContact CB-CB 4.22Å; A89-F439 WeakPolarHBondContact CB-O 3.31Å; P90-F439 HydrophobicContact CB-CB 4.34Å; P90-F439 HydrophobicContact CB-CD2 3.68Å; P90-F439 HydrophobicContact CB-CE2 4.09Å; P90-F439 HydrophobicContact CB-CG 3.96Å; P90-F439 HydrophobicContact CG-CB 4.49Å; P90-F439 HydrophobicContact CG-CD1 4.48Å; P90-F439 HydrophobicContact CG-CD2 4.39Å; P90-F439 HydrophobicContact CG-CG 4.21Å; V92-F439 HydrophobicContact CG2-CB 4.3Å; V92-F439 HydrophobicContact CG2-CD2 4.03Å; T373-F439 VanDerWaalsContact O-CA 3.31Å; T373-F439 WeakPolarHBondContact O-CA 3.49Å; G374-F439 VanDerWaalsContact O-CE1 3.29Å; G374-F439 WeakPolarHBondContact O-CE1 3.5Å; G375-F439 PolarHBondContact O-N 2.81Å; F439-W507 AromaticContact CD2-CH2 3.62Å; F439-W507 HydrophobicContact CD2-CH2 3.62Å; F439-W507 HydrophobicContact CD2-CZ2 4.24Å; F439-W507 HydrophobicContact CE1-CH2 4.39Å; F439-W507 AromaticContact CE2-CH2 3.24Å; F439-W507 HydrophobicContact CE2-CH2 3.24Å; F439-W507 AromaticContact CE2-CZ2 3.77Å; F439-W507 HydrophobicContact CE2-CZ2 3.77Å; F439-W507 HydrophobicContact CE2-CZ3 4.28Å; F439-W507 HydrophobicContact CG-CH2 4.36Å; F439-W507 AromaticContact CZ-CH2 3.68Å; F439-W507 HydrophobicContact CZ-CH2 3.68Å; F439-W507 HydrophobicContact CZ-CZ2 4.47Å; F439-W507 HydrophobicContact CZ-CZ3 4.33Å
440	P	93.1	Very high	91.9	Very high	3 Å²	3	25.2 Å²	25.2	2%	0.019	14%	0.138	C	C	.	.			trans	-68.7	156.1	177	33.7	-40.2	0	0	0	111.1	A89 L368 T373 G375 L377 L437 W445	A89-P440 WeakPolarHBondContact CB-O 3.47Å; L368-P440 HydrophobicContact CD2-CB 3.78Å; L368-P440 HydrophobicContact CD2-CG 3.44Å; L368-P440 VanDerWaalsContact CD2-CG 3.44Å; T373-P440 WeakPolarHBondContact CB-O 3.46Å; T373-P440 VanDerWaalsContact CG2-O 3.29Å; T373-P440 WeakPolarHBondContact CG2-O 3.43Å; G375-P440 WeakPolarHBondContact O-CD 3.32Å; L377-P440 HydrophobicContact CB-CB 3.97Å; L377-P440 HydrophobicContact CB-CG 3.85Å; L377-P440 HydrophobicContact CD2-CB 4.05Å; L437-P440 WeakPolarHBondContact O-CD 3.46Å; P440-W445 HydrophobicContact CB-CZ2 3.97Å
441	Q	89.8	Confident	92	Very high	16 Å²	16	21.4 Å²	21.4	8%	0.075	11%	0.114	C	C	.	.			trans	-68.4	142.4	174.2	-68	176.3	8.4	0	0	111.2	H234 T443 W445	H234-Q441 PolarHBondContact CE1-NE2 3.01Å; Q441-T443 HydrophobicContact CB-CG2 4.35Å; Q441-T443 PolarHBondContact O-N 2.96Å; Q441-T443 VanDerWaalsContact O-N 3.13Å; Q441-W445 PolarHBondContact O-NE1 2.78Å
442	S	90.1	Very high	91.9	Very high	39 Å²	39	19.6 Å²	19.6	27%	0.273	10%	0.102	S	C	.	.	S	Bend	trans	-73.6	101.9	170.6	-173	0	0	0	0	109.9	L368 P370	L368-S442 PolarHBondContact O-OG 3Å; P370-S442 VanDerWaalsContact CA-OG 3.24Å; P370-S442 WeakPolarHBondContact CA-OG 2.87Å; P370-S442 VanDerWaalsContact CD-OG 3.31Å; P370-S442 WeakPolarHBondContact CD-OG 3.43Å; P370-S442 VanDerWaalsContact CG-OG 3.28Å; P370-S442 WeakPolarHBondContact CG-OG 3.29Å; P370-S442 VanDerWaalsContact N-OG 3.13Å
443	T	91.9	Very high	91.3	Very high	19 Å²	19	15.8 Å²	15.8	12%	0.117	9%	0.088	C	C	.	.	S	Bend	trans	-167.6	179.1	177.2	-173.8	0	0	0	0	108.6	L368 A401 W402 Q441	L368-T443 VanDerWaalsContact CB-O 3.28Å; L368-T443 WeakPolarHBondContact CB-O 3.48Å; L368-T443 PolarHBondContact N-O 3.1Å; L368-T443 VanDerWaalsContact N-O 3.07Å; A401-T443 HydrophobicContact CB-CG2 3.78Å; W402-T443 HydrophobicContact CD2-CG2 4.33Å; W402-T443 HydrophobicContact CG-CG2 4.3Å; Q441-T443 HydrophobicContact CB-CG2 4.35Å; Q441-T443 PolarHBondContact O-N 2.96Å; Q441-T443 VanDerWaalsContact O-N 3.13Å
444	T	93.3	Very high	90.4	Very high	40 Å²	40	21.4 Å²	21.4	25%	0.245	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	124.7	168.7	-55.8	0	0	0	0	109.6	T365 W402 Y446	T365-T444 HydrophobicContact CG2-CG2 3.28Å; W402-T444 PolarHBondContact N-O 2.91Å; W402-T444 VanDerWaalsContact N-O 3.08Å; T444-Y446 HydrophobicContact CG2-CD1 4.42Å; T444-Y446 HydrophobicContact CG2-CE1 3.8Å; T444-Y446 HydrophobicContact CG2-CE2 3.88Å; T444-Y446 VanDerWaalsContact CG2-CZ 3.49Å
445	W	94.6	Very high	89.3	Confident	12 Å²	12	22.2 Å²	22.2	5%	0.045	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	139.7	173.3	-72	77.4	0	0	0	109.6	Y366 L377 F399 A401 Y422 L437 P440 Q441	Y366-W445 PolarHBondContact N-O 3.49Å; Y366-W445 PolarHBondContact O-N 3.06Å; L377-W445 HydrophobicContact CD2-CD2 3.74Å; L377-W445 HydrophobicContact CD2-CE3 4.2Å; L377-W445 HydrophobicContact CD2-CG 3.99Å; L377-W445 HydrophobicContact CD2-CZ2 4.26Å; F399-W445 AromaticContact CD1-CE3 3.85Å; F399-W445 HydrophobicContact CD1-CE3 3.85Å; F399-W445 HydrophobicContact CD1-CZ3 4.03Å; F399-W445 HydrophobicContact CD2-CE3 4.45Å; F399-W445 HydrophobicContact CE1-CD2 4.26Å; F399-W445 AromaticContact CE1-CE3 3.54Å; F399-W445 HydrophobicContact CE1-CE3 3.54Å; F399-W445 AromaticContact CE1-CZ3 3.95Å; F399-W445 HydrophobicContact CE1-CZ3 3.95Å; F399-W445 HydrophobicContact CE2-CB 3.91Å; F399-W445 HydrophobicContact CE2-CE3 4.18Å; F399-W445 HydrophobicContact CG-CE3 4.31Å; F399-W445 HydrophobicContact CZ-CB 3.99Å; F399-W445 HydrophobicContact CZ-CD2 4.13Å; F399-W445 AromaticContact CZ-CE3 3.73Å; F399-W445 HydrophobicContact CZ-CE3 3.73Å; F399-W445 HydrophobicContact CZ-CG 4.27Å; A401-W445 HydrophobicContact CB-CD2 4.14Å; A401-W445 HydrophobicContact CB-CE3 4.17Å; A401-W445 HydrophobicContact CB-CH2 4.09Å; A401-W445 HydrophobicContact CB-CZ2 4.06Å; A401-W445 HydrophobicContact CB-CZ3 4.14Å; Y422-W445 HydrophobicContact CD2-CZ3 4.18Å; Y422-W445 HydrophobicContact CE2-CH2 4.07Å; Y422-W445 AromaticContact CE2-CZ3 3.95Å; Y422-W445 HydrophobicContact CE2-CZ3 3.95Å; L437-W445 HydrophobicContact CD1-CE3 4.46Å; L437-W445 HydrophobicContact CD1-CH2 3.56Å; L437-W445 HydrophobicContact CD1-CZ2 4.4Å; L437-W445 HydrophobicContact CD1-CZ3 3.59Å; P440-W445 HydrophobicContact CB-CZ2 3.97Å; Q441-W445 PolarHBondContact O-NE1 2.78Å
446	Y	93.9	Very high	87.8	Confident	11 Å²	11	28.1 Å²	28.1	4%	0.043	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	133.4	-178.9	-58.3	-85.2	0	0	0	109.9	W255 L363 L364 T365 F399 S400 P404 T444	W255-Y446 HydrophobicContact CE3-CE1 4.11Å; W255-Y446 HydrophobicContact CZ3-CE1 4.23Å; L363-Y446 HydrophobicContact CD1-CD1 4.09Å; L364-Y446 WeakPolarHBondContact O-CA 3.33Å; T365-Y446 HydrophobicContact CG2-CD1 4.01Å; T365-Y446 HydrophobicContact CG2-CE1 3.66Å; F399-Y446 WeakPolarHBondContact CA-O 3.01Å; S400-Y446 PolarHBondContact N-O 3.42Å; S400-Y446 PolarHBondContact O-N 3.04Å; P404-Y446 HydrophobicContact CB-CD1 4.42Å; P404-Y446 HydrophobicContact CB-CG 4.06Å; P404-Y446 HydrophobicContact CG-CD1 4.4Å; P404-Y446 HydrophobicContact CG-CG 4.33Å; T444-Y446 HydrophobicContact CG2-CD1 4.42Å; T444-Y446 HydrophobicContact CG2-CE1 3.8Å; T444-Y446 HydrophobicContact CG2-CE2 3.88Å; T444-Y446 VanDerWaalsContact CG2-CZ 3.49Å
447	L	94.5	Very high	86.4	Confident	0 Å²	0	32.1 Å²	32.1	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	117.4	170.1	-178.6	67.4	0	0	0	108.4	L364 Y366 L379 L381 A397 C398 F399 L449 P468	L364-L447 HydrophobicContact CB-CB 4.36Å; L364-L447 HydrophobicContact CD1-CD2 4.43Å; L364-L447 PolarHBondContact N-O 3.37Å; L364-L447 PolarHBondContact O-N 2.76Å; Y366-L447 HydrophobicContact CD2-CB 4.43Å; Y366-L447 HydrophobicContact CE2-CB 3.6Å; Y366-L447 HydrophobicContact CE2-CD2 4.32Å; L379-L447 HydrophobicContact CD1-CD1 4.36Å; L379-L447 HydrophobicContact CD1-CD2 4.05Å; L379-L447 HydrophobicContact CD2-CD1 4Å; L381-L447 HydrophobicContact CD2-CD2 4.12Å; A397-L447 HydrophobicContact CB-CD1 4.08Å; C398-L447 WeakPolarHBondContact O-CA 3.3Å; F399-L447 HydrophobicContact CB-CD1 4.25Å; F399-L447 HydrophobicContact CD2-CB 4.15Å; F399-L447 HydrophobicContact CD2-CD1 4.2Å; L447-L449 HydrophobicContact CD1-CD2 4.44Å; L447-L449 HydrophobicContact CD2-CD1 4.26Å; L447-L449 HydrophobicContact CD2-CD2 4.44Å; L447-L449 HydrophobicContact CD2-CG 4.35Å; L447-L449 HydrophobicContact CG-CD2 4.33Å; L447-L449 HydrophobicContact CG-CG 4.17Å; L447-P468 HydrophobicContact CD2-CB 3.91Å
448	T	92.4	Very high	85.2	Confident	0 Å²	0	32.2 Å²	32.2	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	132.9	169.6	54.6	0	0	0	0	110.1	T362 L363 A397 C398 P404 V405 L406	T362-T448 CarbonylContact O-C 3.53Å; T362-T448 WeakPolarHBondContact O-CA 3.43Å; L363-T448 HydrophobicContact CD1-CG2 3.52Å; A397-T448 CarbonylContact C-O 3.49Å; A397-T448 WeakPolarHBondContact CA-O 3.29Å; C398-T448 WeakPolarHBondContact CB-OG1 3.48Å; C398-T448 PolarHBondContact N-O 3.28Å; C398-T448 PolarHBondContact O-N 3.36Å; P404-T448 HydrophobicContact CB-CG2 3.75Å; V405-T448 VanDerWaalsContact O-CB 3.3Å; V405-T448 WeakPolarHBondContact O-CB 3.41Å; V405-T448 VanDerWaalsContact O-CG2 3.32Å; V405-T448 WeakPolarHBondContact O-CG2 3.49Å; V405-T448 PolarHBondContact O-OG1 2.93Å; L406-T448 HydrophobicContact CD2-CG2 4.21Å
449	L	91.5	Very high	83.9	Confident	0 Å²	0	34.3 Å²	34.3	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	130.3	-178	-64.5	166.5	0	0	0	108.7	V356 P361 T362 L364 L381 I395 A397 L447	V356-L449 HydrophobicContact CG1-CB 4.13Å; V356-L449 HydrophobicContact CG2-CB 3.9Å; V356-L449 HydrophobicContact CG2-CD1 4.11Å; P361-L449 WeakPolarHBondContact CA-O 3.29Å; T362-L449 PolarHBondContact N-O 3Å; T362-L449 PolarHBondContact O-N 3.26Å; L364-L449 HydrophobicContact CD1-CD1 3.88Å; L381-L449 HydrophobicContact CD1-CD2 4.27Å; L381-L449 HydrophobicContact CD2-CD2 4.34Å; I395-L449 HydrophobicContact CG2-CD2 4.47Å; A397-L449 HydrophobicContact CB-CD2 3.38Å; L447-L449 HydrophobicContact CD1-CD2 4.44Å; L447-L449 HydrophobicContact CD2-CD1 4.26Å; L447-L449 HydrophobicContact CD2-CD2 4.44Å; L447-L449 HydrophobicContact CD2-CG 4.35Å; L447-L449 HydrophobicContact CG-CD2 4.33Å; L447-L449 HydrophobicContact CG-CG 4.17Å
450	Q	89	Confident	82.3	Confident	29 Å²	29	41.8 Å²	41.8	14%	0.136	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	141.2	173.9	-171.2	168.9	6.8	0	0	110.7	E358 P361 M396 L408	E358-Q450 PolarHBondContact O-NE2 2.82Å; E358-Q450 VanDerWaalsContact O-NE2 3.1Å; P361-Q450 HydrophobicContact CB-CB 4.41Å; M396-Q450 PolarHBondContact N-O 3.38Å; M396-Q450 PolarHBondContact O-N 3.06Å; L408-Q450 HydrophobicContact CB-CB 4.15Å; L408-Q450 HydrophobicContact CD1-CB 3.5Å; L408-Q450 VanDerWaalsContact CD1-CB 3.5Å; L408-Q450 HydrophobicContact CG-CB 4.4Å
451	L	87.3	Confident	80.9	Confident	1 Å²	1	41.8 Å²	41.8	1%	0.005	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	123.9	172.1	178.7	65.8	0	0	0	108.7	V356 T357 L390 N393 I395 C458 A461 V464	V356-L451 HydrophobicContact CG1-CB 4.4Å; T357-L451 PolarHBondContact O-N 2.77Å; L390-L451 HydrophobicContact CD1-CD1 3.64Å; N393-L451 HydrophobicContact CB-CD1 4.07Å; I395-L451 HydrophobicContact CG1-CD1 3.97Å; L451-C458 HydrophobicContact CD2-CB 4.31Å; L451-A461 WeakPolarHBondContact CD2-O 3Å; L451-V464 HydrophobicContact CD1-CG2 4.1Å; L451-V464 HydrophobicContact CD2-CG2 4.08Å
452	L	84.6	Confident	79.8	Confident	19 Å²	19	44.2 Å²	44.2	10%	0.099	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	123.1	174.8	-60.5	-178.7	0	0	0	109.8	S394 M396 L408 H410	S394-L452 PolarHBondContact N-O 2.83Å; S394-L452 VanDerWaalsContact N-O 3.1Å; S394-L452 PolarHBondContact O-N 3Å; M396-L452 HydrophobicContact CB-CD1 3.52Å; M396-L452 HydrophobicContact CB-CG 4.06Å; M396-L452 HydrophobicContact CG-CD1 4.17Å; L408-L452 WeakPolarHBondContact O-CD2 3.4Å; H410-L452 WeakPolarHBondContact NE2-CB 3.36Å
453	C	79.5	Confident	79.2	Confident	24 Å²	24	46.1 Å²	46.1	16%	0.162	28%	0.283	C	S	.	.			trans	-103.8	136.5	180	-72.8	0	0	0	0	111.3	N393 S455 C458	N393-C453 PolarHBondContact ND2-SG 2.85Å; C453-S455 VanDerWaalsContact C-N 3.34Å; C453-C458 HydrophobicContact CB-CB 4.14Å; C453-C458 WeakPolarHBondContact CB-SG 3.37Å; C453-C458 WeakPolarHBondContact SG-CA 3.43Å; C453-C458 WeakPolarHBondContact SG-CB 3.31Å; C453-C458 CovalentContact SG-SG 1.98Å; C453-C458 PolarHBondContact SG-SG 2.79Å
454	N	73	Confident	78.7	Confident	136 Å²	136	45.8 Å²	45.8	73%	0.727	28%	0.281	S	S	*	.	S	Bend	trans	-80.5	-20.6	-178	-160.9	21.7	0	0	0	111.8
455	S	67.8	Low	78.3	Confident	73 Å²	73	46.1 Å²	46.1	51%	0.51	29%	0.285	S	S	.	.	S	Bend	trans	-103	159	168.4	50	0	0	0	0	110.7	C453 D457	C453-S455 VanDerWaalsContact C-N 3.34Å; S455-D457 PolarHBondContact O-N 1.98Å; S455-D457 PolarHBondContact OG-O 3.04Å
456	S	63.5	Low	78	Confident	133 Å²	133	45.5 Å²	45.5	93%	0.93	28%	0.283	S	S	*	.	S	Bend	trans	-61.9	-1.2	-180	55.1	0	0	0	0	115.8
457	D	64.1	Low	77.9	Confident	110 Å²	110	46.1 Å²	46.1	59%	0.588	29%	0.288	S	S	*	.			trans	-149.2	130.7	176.6	-162.1	-20.1	0	0	0	108.7	S455 G459	S455-D457 PolarHBondContact O-N 1.98Å; S455-D457 PolarHBondContact OG-O 3.04Å; D457-G459 PolarHBondContact O-N 3.46Å; D457-G459 PolarHBondContact OD1-N 3.26Å
458	C	67.4	Low	77.8	Confident	8 Å²	8	46.3 Å²	46.3	5%	0.054	29%	0.289	C	S	.	.			trans	-74.2	-5.2	176.6	-69.6	0	0	0	0	113.9	E358 L451 C453 N460 A461	E358-C458 PolarHBondContact OE1-SG 3.03Å; E358-C458 PolarHBondContact OE2-SG 2.84Å; L451-C458 HydrophobicContact CD2-CB 4.31Å; C453-C458 HydrophobicContact CB-CB 4.14Å; C453-C458 WeakPolarHBondContact CB-SG 3.37Å; C453-C458 WeakPolarHBondContact SG-CA 3.43Å; C453-C458 WeakPolarHBondContact SG-CB 3.31Å; C453-C458 CovalentContact SG-SG 1.98Å; C453-C458 PolarHBondContact SG-SG 2.79Å; C458-N460 PolarHBondContact O-N 3.22Å; C458-A461 VanDerWaalsContact O-CB 3.3Å; C458-A461 WeakPolarHBondContact O-CB 3.42Å; C458-A461 PolarHBondContact O-N 2.91Å; C458-A461 VanDerWaalsContact O-N 3.13Å
459	G	66.9	Low	77.8	Confident	45 Å²	45	50.9 Å²	50.9	46%	0.464	31%	0.31	S	S	.	.	G	3₁₀ helix	trans	56.5	-135.1	179.9	0	0	0	0	0	112.8	D457 A461	D457-G459 PolarHBondContact O-N 3.46Å; D457-G459 PolarHBondContact OD1-N 3.26Å; G459-A461 PolarHBondContact O-N 2.9Å; G459-A461 VanDerWaalsContact O-N 3.12Å
460	N	61.3	Low	78	Confident	160 Å²	160	51 Å²	51	86%	0.856	31%	0.311	S	S	*	.	G	3₁₀ helix	trans	-70.3	-2.5	179.4	-70.7	-8.1	0	0	0	114.3	C458 S462	C458-N460 PolarHBondContact O-N 3.22Å; N460-S462 VanDerWaalsContact C-N 3.31Å; N460-S462 PolarHBondContact O-N 3.05Å
461	A	62	Low	78.2	Confident	2 Å²	2	51.9 Å²	51.9	2%	0.017	32%	0.32	C	S	.	.	G	3₁₀ helix	trans	-91.6	20.2	-179.5	0	0	0	0	0	113.1	T389 L451 C458 G459 V463	T389-A461 WeakPolarHBondContact O-CB 3.33Å; L451-A461 WeakPolarHBondContact CD2-O 3Å; C458-A461 VanDerWaalsContact O-CB 3.3Å; C458-A461 WeakPolarHBondContact O-CB 3.42Å; C458-A461 PolarHBondContact O-N 2.91Å; C458-A461 VanDerWaalsContact O-N 3.13Å; G459-A461 PolarHBondContact O-N 2.9Å; G459-A461 VanDerWaalsContact O-N 3.12Å; A461-V463 PolarHBondContact O-N 3.49Å
462	S	67.5	Low	78.6	Confident	68 Å²	68	51.9 Å²	51.9	48%	0.476	32%	0.32	S	S	.	.	S	Bend	trans	-60.2	-21.2	-171.2	60.5	0	0	0	0	114.8	N460	N460-S462 VanDerWaalsContact C-N 3.31Å; N460-S462 PolarHBondContact O-N 3.05Å
463	V	76.6	Confident	79.1	Confident	79 Å²	79	52 Å²	52	48%	0.479	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	129.9	175.6	-172.2	0	0	0	0	110.4	V356 T357 A461	V356-V463 WeakPolarHBondContact O-CA 3.34Å; T357-V463 HydrophobicContact CG2-CG1 4.4Å; T357-V463 HydrophobicContact CG2-CG2 4.05Å; A461-V463 PolarHBondContact O-N 3.49Å
464	V	82.1	Confident	79.7	Confident	11 Å²	11	52 Å²	52	7%	0.067	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	138.3	-178.2	-172.3	0	0	0	0	110.1	V356 L383 L390 I395 L451	V356-V464 PolarHBondContact N-O 3.45Å; V356-V464 PolarHBondContact O-N 3.12Å; L383-V464 HydrophobicContact CD1-CG1 3.68Å; L390-V464 HydrophobicContact CD1-CB 4.24Å; L390-V464 HydrophobicContact CD1-CG1 3.95Å; L390-V464 HydrophobicContact CD1-CG2 3.39Å; I395-V464 HydrophobicContact CD1-CB 4.02Å; I395-V464 HydrophobicContact CD1-CG1 3.71Å; L451-V464 HydrophobicContact CD1-CG2 4.1Å; L451-V464 HydrophobicContact CD2-CG2 4.08Å
465	S	85.8	Confident	80.7	Confident	47 Å²	47	45.6 Å²	45.6	33%	0.329	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	123.3	178.7	-66.5	0	0	0	0	111.5	V354 N384	V354-S465 WeakPolarHBondContact O-CA 3.01Å; N384-S465 PolarHBondContact N-O 3.49Å
466	V	88.5	Confident	81.7	Confident	0 Å²	0	42.3 Å²	42.3	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	142.2	175.7	-178.3	0	0	0	0	109.2	V354 V356 L381 L383 I395 I426 P468	V354-V466 PolarHBondContact N-O 2.96Å; V354-V466 PolarHBondContact O-N 2.85Å; V356-V466 HydrophobicContact CG2-CB 4.21Å; V356-V466 HydrophobicContact CG2-CG2 3.84Å; L381-V466 HydrophobicContact CD2-CG1 4.38Å; L383-V466 HydrophobicContact CD1-CG2 4.46Å; I395-V466 HydrophobicContact CD1-CG2 3.28Å; I395-V466 HydrophobicContact CG2-CG2 4.38Å; I426-V466 HydrophobicContact CD1-CG1 3.85Å; I426-V466 HydrophobicContact CD1-CG2 4.06Å; V466-P468 WeakPolarHBondContact O-CD 3.05Å
467	V	91	Very high	82.7	Confident	23 Å²	23	39.7 Å²	39.7	14%	0.139	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	100.7	173.4	-175.2	0	0	0	0	108.4	N353 T382 E469	N353-V467 WeakPolarHBondContact OD1-CG2 3.04Å; T382-V467 PolarHBondContact N-O 3.48Å; T382-V467 PolarHBondContact O-N 2.69Å; V467-E469 HydrophobicContact CG1-CG 4.09Å
468	P	92.5	Very high	83.9	Confident	4 Å²	4	39.9 Å²	39.9	3%	0.026	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	112.3	170.7	32.2	-31.2	0	0	0	110.3	P348 V354 L364 L381 L447 V466	P348-P468 HydrophobicContact CG-CG 4.04Å; V354-P468 HydrophobicContact CB-CG 4.4Å; V354-P468 HydrophobicContact CG2-CG 3.71Å; L364-P468 HydrophobicContact CD2-CG 3.99Å; L381-P468 HydrophobicContact CD2-CB 3.89Å; L447-P468 HydrophobicContact CD2-CB 3.91Å; V466-P468 WeakPolarHBondContact O-CD 3.05Å
469	E	92.5	Very high	85	Confident	97 Å²	97	39.5 Å²	39.5	45%	0.453	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	111.1	171.5	-64.7	177.6	157	0	0	108.3	Q380 V467	Q380-E469 HydrophobicContact CB-CB 4.22Å; Q380-E469 PolarHBondContact N-O 2.7Å; Q380-E469 PolarHBondContact NE2-OE2 3.41Å; Q380-E469 PolarHBondContact O-N 3.34Å; V467-E469 HydrophobicContact CG1-CG 4.09Å
470	V	94.7	Very high	85.9	Confident	3 Å²	3	38.9 Å²	38.9	2%	0.018	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	127.6	175.2	-177.6	0	0	0	0	108.9	Y346 Y366 L377 N378 L379	Y346-V470 WeakPolarHBondContact CB-O 3.48Å; Y346-V470 HydrophobicContact CD2-CB 4.28Å; Y346-V470 HydrophobicContact CD2-CG1 3.85Å; Y346-V470 HydrophobicContact CE2-CG1 4.41Å; Y346-V470 HydrophobicContact CG-CG1 4.49Å; Y346-V470 PolarHBondContact N-O 3.17Å; Y366-V470 HydrophobicContact CD1-CB 4.04Å; Y366-V470 HydrophobicContact CD1-CG1 3.98Å; Y366-V470 HydrophobicContact CD1-CG2 4.33Å; Y366-V470 HydrophobicContact CE1-CB 3.71Å; Y366-V470 HydrophobicContact CE1-CG1 4.16Å; Y366-V470 HydrophobicContact CE1-CG2 3.71Å; Y366-V470 HydrophobicContact CE2-CG2 4.12Å; Y366-V470 HydrophobicContact CG-CG1 4.28Å; L377-V470 HydrophobicContact CD1-CG1 3.9Å; N378-V470 WeakPolarHBondContact O-CA 3.33Å; L379-V470 HydrophobicContact CD1-CG2 3.54Å
471	S	94.7	Very high	87.1	Confident	46 Å²	46	37 Å²	37	32%	0.322	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	156.2	178.5	63	0	0	0	0	111.1	L344 N378	L344-S471 CarbonylContact O-C 3.47Å; L344-S471 VanDerWaalsContact O-CA 3.25Å; L344-S471 WeakPolarHBondContact O-CA 3.2Å; L344-S471 WeakPolarHBondContact O-CB 3.2Å; N378-S471 PolarHBondContact N-O 3.43Å; N378-S471 PolarHBondContact O-N 3.23Å
472	V	95.2	Very high	88.2	Confident	2 Å²	2	41.7 Å²	41.7	1%	0.012	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	125.2	164	-176.8	0	0	0	0	106.7	S343 L344 Y346 L368 A372 T376 L377	S343-V472 VanDerWaalsContact CA-O 3.3Å; S343-V472 WeakPolarHBondContact CA-O 3.43Å; L344-V472 HydrophobicContact CB-CB 3.93Å; L344-V472 HydrophobicContact CB-CG2 4.04Å; L344-V472 HydrophobicContact CD1-CB 4.49Å; L344-V472 HydrophobicContact CD1-CG2 4.12Å; L344-V472 HydrophobicContact CG-CB 4.26Å; L344-V472 HydrophobicContact CG-CG2 4.37Å; L344-V472 PolarHBondContact N-O 3.4Å; L344-V472 PolarHBondContact O-N 3.39Å; Y346-V472 HydrophobicContact CE2-CG2 4.39Å; L368-V472 HydrophobicContact CD1-CG2 3.56Å; A372-V472 HydrophobicContact CB-CG1 4.44Å; T376-V472 VanDerWaalsContact O-CA 3.29Å; T376-V472 WeakPolarHBondContact O-CA 3.4Å; L377-V472 HydrophobicContact CD1-CG2 3.94Å
473	S	94.3	Very high	89.2	Confident	20 Å²	20	39.2 Å²	39.2	14%	0.14	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	155.4	168.5	62.2	0	0	0	0	109.2	L342 G375 T376 N378 C475	L342-S473 CarbonylContact O-C 3.6Å; L342-S473 VanDerWaalsContact O-C 3.27Å; G375-S473 CarbonylContact C-O 3.56Å; G375-S473 WeakPolarHBondContact CA-O 3.37Å; T376-S473 PolarHBondContact N-O 2.8Å; T376-S473 PolarHBondContact O-N 3.13Å; N378-S473 PolarHBondContact ND2-OG 3.29Å; S473-C475 PolarHBondContact OG-O 3.27Å
474	A	93.4	Very high	89.8	Confident	24 Å²	24	40.6 Å²	40.6	20%	0.198	24%	0.236	C	C	.	.	S	Bend	trans	-60.6	-64.4	173.5	0	0	0	0	0	109.4	L342 G375 S496	L342-A474 HydrophobicContact CB-CB 4.2Å; L342-A474 PolarHBondContact O-N 3.45Å; G375-A474 WeakPolarHBondContact CA-O 3.25Å; A474-S496 WeakPolarHBondContact CA-OG 3.35Å; A474-S496 WeakPolarHBondContact CB-OG 3.25Å; A474-S496 PolarHBondContact O-OG 3.2Å
475	C	92.5	Very high	90.3	Very high	3 Å²	3	42.4 Å²	42.4	2%	0.02	25%	0.248	C	C	.	.	S	Bend	trans	-103.8	160.9	178.8	-63.4	0	0	0	0	112.8	S473 D477 C479 C485	S473-C475 PolarHBondContact OG-O 3.27Å; C475-D477 PolarHBondContact O-N 2.93Å; C475-C479 WeakPolarHBondContact CB-SG 3.27Å; C475-C479 VanDerWaalsContact SG-SG 3.61Å; C475-C485 HydrophobicContact CB-CB 3.65Å; C475-C485 WeakPolarHBondContact CB-SG 3.36Å; C475-C485 WeakPolarHBondContact SG-CA 3.34Å; C475-C485 WeakPolarHBondContact SG-CB 3.37Å; C475-C485 CovalentContact SG-SG 2.03Å; C475-C485 PolarHBondContact SG-SG 2.8Å
476	V	88.6	Confident	90.7	Very high	3 Å²	3	45.9 Å²	45.9	2%	0.018	25%	0.254	C	S	.	.	G	3₁₀ helix	trans	-69.1	119.7	172.1	-176.6	0	0	0	0	108.6	P101 T376 D478 C479 W507	P101-V476 HydrophobicContact CB-CG1 3.96Å; P101-V476 HydrophobicContact CG-CG1 3.75Å; T376-V476 HydrophobicContact CG2-CG2 3.88Å; T376-V476 WeakPolarHBondContact OG1-CG2 3.35Å; V476-D478 PolarHBondContact O-N 3.23Å; V476-D478 VanDerWaalsContact O-N 3.09Å; V476-C479 PolarHBondContact O-N 2.76Å; V476-W507 HydrophobicContact CG2-CE3 4.33Å
477	D	85.4	Confident	90.9	Very high	78 Å²	78	50.3 Å²	50.3	42%	0.417	28%	0.277	S	S	.	.	G	3₁₀ helix	trans	48.8	34.5	-179.7	-62.8	-24.4	0	0	0	114.1	R436 C475 C479 G480	R436-D477 IonicContact CZ-OD1 2.7Å; R436-D477 VanDerWaalsContact CZ-OD1 3.23Å; R436-D477 IonicContact CZ-OD2 3.13Å; R436-D477 IonicContact NE-OD1 2.96Å; R436-D477 PolarHBondContact NE-OD1 3.48Å; R436-D477 IonicContact NE-OD2 3.34Å; R436-D477 VanDerWaalsContact NH2-CG 3.26Å; R436-D477 IonicContact NH2-OD1 2.75Å; R436-D477 PolarHBondContact NH2-OD1 2.96Å; R436-D477 IonicContact NH2-OD2 2.84Å; R436-D477 PolarHBondContact NH2-OD2 3.08Å; C475-D477 PolarHBondContact O-N 2.93Å; D477-C479 PolarHBondContact O-N 3.41Å; D477-G480 PolarHBondContact O-N 2.82Å
478	D	88.2	Confident	91	Very high	114 Å²	114	50.5 Å²	50.5	61%	0.61	28%	0.277	S	S	*	.	G	3₁₀ helix	trans	50.1	30.1	-175.7	-61.9	-39.2	0	0	0	114.2	V476 G480	V476-D478 PolarHBondContact O-N 3.23Å; V476-D478 VanDerWaalsContact O-N 3.09Å; D478-G480 PolarHBondContact O-N 3.46Å
479	C	90.4	Very high	90.9	Very high	0 Å²	0	59.2 Å²	59.2	0%	0	31%	0.31	C	S	.	.	G	3₁₀ helix	trans	65.2	12.6	-177.4	-48.5	0	0	0	0	115.4	C475 V476 D477 G483 C485 C498 G508	C475-C479 WeakPolarHBondContact CB-SG 3.27Å; C475-C479 VanDerWaalsContact SG-SG 3.61Å; V476-C479 PolarHBondContact O-N 2.76Å; D477-C479 PolarHBondContact O-N 3.41Å; C479-G483 PolarHBondContact O-N 3.22Å; C479-C485 WeakPolarHBondContact SG-CA 3.35Å; C479-C485 PolarHBondContact SG-N 2.96Å; C479-C498 WeakPolarHBondContact CA-SG 3.4Å; C479-C498 HydrophobicContact CB-CB 3.64Å; C479-C498 WeakPolarHBondContact CB-SG 3.2Å; C479-C498 WeakPolarHBondContact SG-CA 3.44Å; C479-C498 WeakPolarHBondContact SG-CB 3.43Å; C479-C498 CovalentContact SG-SG 2.02Å; C479-C498 PolarHBondContact SG-SG 2.88Å; C479-G508 CarbonylContact C-O 3.16Å
480	G	87.1	Confident	90.8	Very high	33 Å²	33	55.3 Å²	55.3	34%	0.34	29%	0.293	S	S	.	.	G	3₁₀ helix	trans	61.2	-165	-179.2	0	0	0	0	0	113.7	D477 D478 Y482	D477-G480 PolarHBondContact O-N 2.82Å; D478-G480 PolarHBondContact O-N 3.46Å; G480-Y482 VanDerWaalsContact C-N 3.29Å; G480-Y482 PolarHBondContact O-N 2.88Å
481	P	85.3	Confident	90.4	Very high	120 Å²	120	59.9 Å²	59.9	78%	0.779	31%	0.311	S	S	*	.	G	3₁₀ helix	trans	-79.3	-9.5	-177.1	31.3	-34.9	0	0	0	114.1
482	Y	85.6	Confident	90	Very high	100 Å²	100	62.7 Å²	62.7	39%	0.392	33%	0.326	S	S	.	.	G	3₁₀ helix	trans	-114	15.4	-174.5	-54.5	-65	0	0	0	112.9	G480 S501 W504	G480-Y482 VanDerWaalsContact C-N 3.29Å; G480-Y482 PolarHBondContact O-N 2.88Å; Y482-S501 WeakPolarHBondContact O-CB 3.43Å; Y482-S501 PolarHBondContact O-N 3.46Å; Y482-W504 AromaticContact CD1-CD1 4Å; Y482-W504 AromaticContact CD1-NE1 3.57Å; Y482-W504 AromaticContact CD2-CD2 3.71Å; Y482-W504 HydrophobicContact CD2-CD2 3.71Å; Y482-W504 AromaticContact CD2-CE2 3.31Å; Y482-W504 HydrophobicContact CD2-CE3 4.19Å; Y482-W504 HydrophobicContact CD2-CG 4.24Å; Y482-W504 HydrophobicContact CD2-CH2 4.02Å; Y482-W504 AromaticContact CD2-CZ2 3.5Å; Y482-W504 HydrophobicContact CD2-CZ2 3.5Å; Y482-W504 HydrophobicContact CD2-CZ3 4.33Å; Y482-W504 AromaticContact CD2-NE1 3.59Å; Y482-W504 AromaticContact CE1-NE1 3.94Å; Y482-W504 HydrophobicContact CE2-CD2 4.4Å; Y482-W504 AromaticContact CE2-CE2 3.61Å; Y482-W504 AromaticContact CE2-CH2 3.86Å; Y482-W504 HydrophobicContact CE2-CH2 3.86Å; Y482-W504 AromaticContact CE2-CZ2 3.3Å; Y482-W504 HydrophobicContact CE2-CZ2 3.3Å; Y482-W504 AromaticContact CE2-NE1 3.97Å; Y482-W504 AromaticContact CG-CD1 3.65Å; Y482-W504 AromaticContact CG-CD2 3.97Å; Y482-W504 HydrophobicContact CG-CD2 3.97Å; Y482-W504 AromaticContact CG-CE2 3.63Å; Y482-W504 HydrophobicContact CG-CG 4Å; Y482-W504 HydrophobicContact CG-CZ2 4.23Å; Y482-W504 AromaticContact CG-NE1 3.38Å; Y482-W504 AromaticContact CZ-CZ2 3.89Å
483	G	88.9	Confident	89.8	Confident	16 Å²	16	63.3 Å²	63.3	17%	0.165	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146	162.2	178.5	0	0	0	0	0	112.6	C479 V499	C479-G483 PolarHBondContact O-N 3.22Å; G483-V499 CarbonylContact C-O 3.59Å; G483-V499 WeakPolarHBondContact CA-O 3.28Å
484	E	90.2	Very high	89.7	Confident	108 Å²	108	65.3 Å²	65.3	51%	0.505	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	132.2	172	-67.1	-177.5	164.5	0	0	109.6	R486 V499	E484-R486 PolarHBondContact O-N 2.86Å; E484-R486 IonicContact OE2-CZ 3.9Å; E484-R486 IonicContact OE2-NE 2.72Å; E484-R486 IonicContact OE2-NH2 2.98Å; E484-R486 PolarHBondContact OE2-NH2 3.23Å; E484-R486 VanDerWaalsContact OE2-NH2 3.11Å; E484-V499 PolarHBondContact N-O 3.49Å; E484-V499 PolarHBondContact O-N 2.85Å
485	C	92.6	Very high	89.8	Confident	49 Å²	49	64.8 Å²	64.8	33%	0.331	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	122.1	171.4	-173.6	0	0	0	0	110.2	C475 C479	C475-C485 HydrophobicContact CB-CB 3.65Å; C475-C485 WeakPolarHBondContact CB-SG 3.36Å; C475-C485 WeakPolarHBondContact SG-CA 3.34Å; C475-C485 WeakPolarHBondContact SG-CB 3.37Å; C475-C485 CovalentContact SG-SG 2.03Å; C475-C485 PolarHBondContact SG-SG 2.8Å; C479-C485 WeakPolarHBondContact SG-CA 3.35Å; C479-C485 PolarHBondContact SG-N 2.96Å
486	R	92.4	Very high	89.9	Confident	121 Å²	121	64.8 Å²	64.8	46%	0.457	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	131.4	176.8	-66.2	-158.4	178.6	179.7	-1	112	W44 E484 S496 A497 V499	W44-R486 HydrophobicContact CH2-CB 4.41Å; W44-R486 HydrophobicContact CZ3-CB 4.44Å; E484-R486 PolarHBondContact O-N 2.86Å; E484-R486 IonicContact OE2-CZ 3.9Å; E484-R486 IonicContact OE2-NE 2.72Å; E484-R486 IonicContact OE2-NH2 2.98Å; E484-R486 PolarHBondContact OE2-NH2 3.23Å; E484-R486 VanDerWaalsContact OE2-NH2 3.11Å; R486-S496 VanDerWaalsContact O-CA 3.25Å; R486-S496 WeakPolarHBondContact O-CA 3.38Å; R486-S496 WeakPolarHBondContact O-CB 3.49Å; R486-A497 PolarHBondContact N-O 3.12Å; R486-A497 PolarHBondContact O-N 3.23Å; R486-A497 VanDerWaalsContact O-N 3.08Å; R486-V499 HydrophobicContact CG-CG2 4.01Å
487	L	93.1	Very high	90.1	Very high	92 Å²	92	65.1 Å²	65.1	48%	0.482	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	127.1	169.4	-169.6	70.6	0	0	0	109.8	V341 L342 L494	V341-L487 HydrophobicContact CB-CD2 4.44Å; V341-L487 HydrophobicContact CG1-CD1 4.08Å; V341-L487 HydrophobicContact CG1-CD2 3.82Å; L342-L487 HydrophobicContact CD1-CD1 3.42Å; L342-L487 VanDerWaalsContact CD1-CD1 3.42Å; L342-L487 HydrophobicContact CG-CD1 4.15Å; L487-L494 HydrophobicContact CD1-CB 4.44Å; L487-L494 HydrophobicContact CD2-CD2 4.49Å
488	L	92.6	Very high	90.5	Very high	27 Å²	27	61.9 Å²	61.9	14%	0.141	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	152.3	-176.6	-58.3	170.7	0	0	0	109.7	W44 A46 L494 Y495 A497	W44-L488 HydrophobicContact CH2-CD2 3.95Å; W44-L488 HydrophobicContact CZ3-CD1 4.17Å; W44-L488 HydrophobicContact CZ3-CD2 4.34Å; A46-L488 HydrophobicContact CB-CD1 3.49Å; A46-L488 VanDerWaalsContact CB-CD1 3.49Å; A46-L488 HydrophobicContact CB-CD2 3.67Å; A46-L488 HydrophobicContact CB-CG 4.24Å; L488-L494 WeakPolarHBondContact O-CA 3.4Å; L488-Y495 CarbonylContact C-O 3.53Å; L488-Y495 WeakPolarHBondContact CA-O 3.39Å; L488-Y495 HydrophobicContact CB-CD1 4.12Å; L488-Y495 HydrophobicContact CB-CD2 4Å; L488-Y495 HydrophobicContact CB-CE1 3.78Å; L488-Y495 HydrophobicContact CB-CE2 3.66Å; L488-Y495 HydrophobicContact CB-CG 4.22Å; L488-Y495 WeakPolarHBondContact CB-O 3.34Å; L488-Y495 HydrophobicContact CD1-CD2 3.93Å; L488-Y495 HydrophobicContact CD1-CE2 3.36Å; L488-Y495 HydrophobicContact CG-CE2 4.16Å; L488-Y495 PolarHBondContact N-O 3.36Å; L488-Y495 PolarHBondContact O-N 3.48Å; L488-A497 HydrophobicContact CD1-CB 3.91Å
489	R	91.9	Very high	90.6	Very high	188 Å²	188	58 Å²	58	71%	0.709	30%	0.297	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-130.8	121	-177.9	-175.4	175.3	174.6	167.1	1.2	110.6	Y491 L494	R489-Y491 PolarHBondContact NE-O 2.89Å; R489-Y491 PolarHBondContact NH2-O 3.44Å; R489-L494 HydrophobicContact CB-CD2 3.8Å; R489-L494 HydrophobicContact CG-CD2 3.87Å
490	S	89.3	Confident	90.6	Very high	15 Å²	15	59.8 Å²	59.8	11%	0.105	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	101	165.3	-177.8	0	0	0	0	109.4	L50 T492 Y493	L50-S490 WeakPolarHBondContact O-CB 3.3Å; L50-S490 PolarHBondContact O-OG 3.39Å; S490-T492 PolarHBondContact O-N 3.34Å; S490-Y493 PolarHBondContact N-O 3.43Å; S490-Y493 PolarHBondContact O-N 2.99Å
491	Y	87.3	Confident	90.6	Very high	98 Å²	98	59.8 Å²	59.8	38%	0.384	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.5	-101.2	-174.6	-59.2	-84	0	0	0	112.9	P35 Q37 R489	P35-Y491 WeakPolarHBondContact CD-OH 3.31Å; P35-Y491 HydrophobicContact CG-CE1 4.38Å; P35-Y491 WeakPolarHBondContact CG-OH 3.16Å; Q37-Y491 PolarHBondContact NE2-OH 2.99Å; Q37-Y491 VanDerWaalsContact NE2-OH 3.08Å; R489-Y491 PolarHBondContact NE-O 2.89Å; R489-Y491 PolarHBondContact NH2-O 3.44Å
492	T	85.3	Confident	90.6	Very high	106 Å²	106	54.2 Å²	54.2	65%	0.65	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.4	-4.9	179.5	65.7	0	0	0	0	112.6	S490	S490-T492 PolarHBondContact O-N 3.34Å
493	Y	91.4	Very high	90.5	Very high	15 Å²	15	50.9 Å²	50.9	6%	0.059	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	128.9	-178.3	-174.2	-101.8	0	0	0	110.2	L50 P90 F135 T373 G374 S490 Y495	L50-Y493 HydrophobicContact CD2-CD1 4.15Å; L50-Y493 HydrophobicContact CD2-CE1 4.18Å; P90-Y493 WeakPolarHBondContact CD-OH 3.42Å; P90-Y493 HydrophobicContact CG-CE1 3.51Å; P90-Y493 VanDerWaalsContact CG-OH 3.27Å; P90-Y493 WeakPolarHBondContact CG-OH 3.35Å; F135-Y493 HydrophobicContact CD1-CE1 4.49Å; F135-Y493 AromaticContact CE1-CD1 3.81Å; F135-Y493 HydrophobicContact CE1-CD1 3.81Å; F135-Y493 HydrophobicContact CE1-CD2 4Å; F135-Y493 AromaticContact CE1-CE1 3.64Å; F135-Y493 HydrophobicContact CE1-CE1 3.64Å; F135-Y493 AromaticContact CE1-CE2 3.86Å; F135-Y493 HydrophobicContact CE1-CE2 3.86Å; F135-Y493 AromaticContact CE1-CG 3.97Å; F135-Y493 HydrophobicContact CE1-CG 3.97Å; F135-Y493 AromaticContact CE1-CZ 3.68Å; F135-Y493 HydrophobicContact CZ-CD2 4.07Å; F135-Y493 HydrophobicContact CZ-CE1 4.2Å; F135-Y493 AromaticContact CZ-CE2 3.67Å; F135-Y493 HydrophobicContact CZ-CE2 3.67Å; F135-Y493 AromaticContact CZ-CZ 3.74Å; T373-Y493 VanDerWaalsContact C-OH 3.25Å; T373-Y493 PolarHBondContact O-OH 3.38Å; T373-Y493 WeakPolarHBondContact OG1-CE2 3.37Å; T373-Y493 PolarHBondContact OG1-OH 3.31Å; G374-Y493 WeakPolarHBondContact CA-OH 3.39Å; G374-Y493 PolarHBondContact N-OH 3.21Å; G374-Y493 VanDerWaalsContact N-OH 3.15Å; S490-Y493 PolarHBondContact N-O 3.43Å; S490-Y493 PolarHBondContact O-N 2.99Å; Y493-Y495 HydrophobicContact CD1-CD1 4.03Å; Y493-Y495 HydrophobicContact CE1-CD1 4.3Å; Y493-Y495 HydrophobicContact CE1-CG 4.42Å
494	L	93.1	Very high	90.5	Very high	62 Å²	62	52.8 Å²	52.8	33%	0.325	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	138.6	176.6	-66.7	172.3	0	0	0	109.2	V341 L487 L488 R489	V341-L494 HydrophobicContact CG1-CD1 3.87Å; L487-L494 HydrophobicContact CD1-CB 4.44Å; L487-L494 HydrophobicContact CD2-CD2 4.49Å; L488-L494 WeakPolarHBondContact O-CA 3.4Å; R489-L494 HydrophobicContact CB-CD2 3.8Å; R489-L494 HydrophobicContact CG-CD2 3.87Å
495	Y	94.3	Very high	90.4	Very high	12 Å²	12	51 Å²	51	5%	0.047	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150	164.5	176	62.9	-75.2	0	0	0	108.8	Y45 L50 G374 L488 Y493	Y45-Y495 AromaticContact CD1-CD2 3.98Å; Y45-Y495 HydrophobicContact CD1-CD2 3.98Å; Y45-Y495 AromaticContact CD1-CE2 3.7Å; Y45-Y495 HydrophobicContact CD1-CE2 3.7Å; Y45-Y495 AromaticContact CE1-CD2 3.8Å; Y45-Y495 HydrophobicContact CE1-CD2 3.8Å; Y45-Y495 AromaticContact CE1-CE2 3.68Å; Y45-Y495 HydrophobicContact CE1-CE2 3.68Å; L50-Y495 HydrophobicContact CD2-CD1 3.94Å; L50-Y495 HydrophobicContact CD2-CD2 4.46Å; L50-Y495 HydrophobicContact CD2-CE1 3.91Å; L50-Y495 HydrophobicContact CD2-CE2 4.42Å; L50-Y495 HydrophobicContact CD2-CG 4.22Å; G374-Y495 CarbonylContact O-C 3.52Å; G374-Y495 VanDerWaalsContact O-CA 3.32Å; G374-Y495 WeakPolarHBondContact O-CA 3.42Å; L488-Y495 CarbonylContact C-O 3.53Å; L488-Y495 WeakPolarHBondContact CA-O 3.39Å; L488-Y495 HydrophobicContact CB-CD1 4.12Å; L488-Y495 HydrophobicContact CB-CD2 4Å; L488-Y495 HydrophobicContact CB-CE1 3.78Å; L488-Y495 HydrophobicContact CB-CE2 3.66Å; L488-Y495 HydrophobicContact CB-CG 4.22Å; L488-Y495 WeakPolarHBondContact CB-O 3.34Å; L488-Y495 HydrophobicContact CD1-CD2 3.93Å; L488-Y495 HydrophobicContact CD1-CE2 3.36Å; L488-Y495 HydrophobicContact CG-CE2 4.16Å; L488-Y495 PolarHBondContact N-O 3.36Å; L488-Y495 PolarHBondContact O-N 3.48Å; Y493-Y495 HydrophobicContact CD1-CD1 4.03Å; Y493-Y495 HydrophobicContact CE1-CD1 4.3Å; Y493-Y495 HydrophobicContact CE1-CG 4.42Å
496	S	94.4	Very high	90.2	Very high	4 Å²	4	49.5 Å²	49.5	3%	0.028	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	156.5	179.6	58.8	0	0	0	0	111.6	G374 A474 R486	G374-S496 PolarHBondContact O-N 2.7Å; G374-S496 PolarHBondContact O-OG 3.05Å; A474-S496 WeakPolarHBondContact CA-OG 3.35Å; A474-S496 WeakPolarHBondContact CB-OG 3.25Å; A474-S496 PolarHBondContact O-OG 3.2Å; R486-S496 VanDerWaalsContact O-CA 3.25Å; R486-S496 WeakPolarHBondContact O-CA 3.38Å; R486-S496 WeakPolarHBondContact O-CB 3.49Å
497	A	94.3	Very high	90	Very high	9 Å²	9	45.1 Å²	45.1	7%	0.074	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.4	157.4	178.1	0	0	0	0	0	110.8	W44 Y45 R486 L488	W44-A497 HydrophobicContact CE3-CB 4.28Å; W44-A497 HydrophobicContact CZ3-CB 4.3Å; Y45-A497 HydrophobicContact CD1-CB 4.27Å; Y45-A497 HydrophobicContact CG-CB 4.35Å; R486-A497 PolarHBondContact N-O 3.12Å; R486-A497 PolarHBondContact O-N 3.23Å; R486-A497 VanDerWaalsContact O-N 3.08Å; L488-A497 HydrophobicContact CD1-CB 3.91Å
498	C	93.1	Very high	89.8	Confident	11 Å²	11	40.9 Å²	40.9	7%	0.074	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83	134.9	177.5	-63.5	0	0	0	0	112.4	C479 W507	C479-C498 WeakPolarHBondContact CA-SG 3.4Å; C479-C498 HydrophobicContact CB-CB 3.64Å; C479-C498 WeakPolarHBondContact CB-SG 3.2Å; C479-C498 WeakPolarHBondContact SG-CA 3.44Å; C479-C498 WeakPolarHBondContact SG-CB 3.43Å; C479-C498 CovalentContact SG-SG 2.02Å; C479-C498 PolarHBondContact SG-SG 2.88Å; C498-W507 WeakPolarHBondContact CB-O 3.32Å; C498-W507 PolarHBondContact SG-O 2.79Å
499	V	91.3	Very high	89.7	Confident	31 Å²	31	39.8 Å²	39.8	19%	0.188	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	116.4	163.4	-179.1	0	0	0	0	108	W44 G483 E484 R486	W44-V499 HydrophobicContact CD2-CG2 3.89Å; W44-V499 HydrophobicContact CE3-CG2 3.49Å; W44-V499 VanDerWaalsContact CE3-CG2 3.49Å; W44-V499 HydrophobicContact CH2-CG2 3.22Å; W44-V499 HydrophobicContact CZ2-CG2 3.64Å; W44-V499 HydrophobicContact CZ3-CB 4.48Å; W44-V499 HydrophobicContact CZ3-CG2 3.15Å; G483-V499 CarbonylContact C-O 3.59Å; G483-V499 WeakPolarHBondContact CA-O 3.28Å; E484-V499 PolarHBondContact N-O 3.49Å; E484-V499 PolarHBondContact O-N 2.85Å; R486-V499 HydrophobicContact CG-CG2 4.01Å
500	C	89.3	Confident	89.6	Confident	39 Å²	39	33.9 Å²	33.9	26%	0.264	19%	0.191	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	146.7	-178.6	-52.2	0	0	0	0	112.1	W504 G506 C509	C500-W504 HydrophobicContact CB-CB 4.26Å; C500-W504 WeakPolarHBondContact CB-O 3.01Å; C500-G506 PolarHBondContact SG-O 2.72Å; C500-C509 WeakPolarHBondContact CA-SG 3.44Å; C500-C509 HydrophobicContact CB-CB 3.77Å; C500-C509 WeakPolarHBondContact CB-SG 3.17Å; C500-C509 PolarHBondContact N-SG 3.4Å; C500-C509 WeakPolarHBondContact SG-CA 3.47Å; C500-C509 WeakPolarHBondContact SG-CB 3.39Å; C500-C509 CovalentContact SG-SG 2.04Å; C500-C509 PolarHBondContact SG-SG 3.25Å
501	S	87.4	Confident	89.5	Confident	33 Å²	33	34 Å²	34	23%	0.231	19%	0.19	C	C	.	.			trans	-114	161.1	-178.2	-74.5	0	0	0	0	111.2	Y482 G503 W504	Y482-S501 WeakPolarHBondContact O-CB 3.43Å; Y482-S501 PolarHBondContact O-N 3.46Å; S501-G503 PolarHBondContact O-N 3.11Å; S501-G503 VanDerWaalsContact O-N 3.12Å; S501-W504 WeakPolarHBondContact O-CB 3.42Å; S501-W504 VanDerWaalsContact O-CD1 3.31Å; S501-W504 PolarHBondContact O-N 3.48Å; S501-W504 VanDerWaalsContact O-N 3.07Å
502	A	84.9	Confident	89.5	Confident	3 Å²	3	31.1 Å²	31.1	3%	0.025	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	55	34.1	171.4	0	0	0	0	0	114.8	W504 Q516 Q521	A502-W504 VanDerWaalsContact C-N 3.25Å; A502-W504 PolarHBondContact O-N 2.02Å; A502-Q516 WeakPolarHBondContact O-CB 3.33Å; A502-Q516 PolarHBondContact O-N 2.92Å; A502-Q521 HydrophobicContact CB-CG 4.46Å
503	G	84.2	Confident	89.6	Confident	29 Å²	29	30.5 Å²	30.5	30%	0.299	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	76.3	4.7	178.6	0	0	0	0	0	115.1	S501 T514 A515	S501-G503 PolarHBondContact O-N 3.11Å; S501-G503 VanDerWaalsContact O-N 3.12Å; G503-T514 CarbonylContact O-C 3.38Å; G503-T514 PolarHBondContact O-OG1 2.93Å; G503-A515 PolarHBondContact O-N 2.93Å
504	W	88.1	Confident	89.3	Confident	56 Å²	56	33 Å²	33	21%	0.212	21%	0.207	C	C	.	.			trans	-66	146.8	168	-73	82.9	0	0	0	110.4	Y482 C500 S501 A502 C509 D511 G512 A515	Y482-W504 AromaticContact CD1-CD1 4Å; Y482-W504 AromaticContact CD1-NE1 3.57Å; Y482-W504 AromaticContact CD2-CD2 3.71Å; Y482-W504 HydrophobicContact CD2-CD2 3.71Å; Y482-W504 AromaticContact CD2-CE2 3.31Å; Y482-W504 HydrophobicContact CD2-CE3 4.19Å; Y482-W504 HydrophobicContact CD2-CG 4.24Å; Y482-W504 HydrophobicContact CD2-CH2 4.02Å; Y482-W504 AromaticContact CD2-CZ2 3.5Å; Y482-W504 HydrophobicContact CD2-CZ2 3.5Å; Y482-W504 HydrophobicContact CD2-CZ3 4.33Å; Y482-W504 AromaticContact CD2-NE1 3.59Å; Y482-W504 AromaticContact CE1-NE1 3.94Å; Y482-W504 HydrophobicContact CE2-CD2 4.4Å; Y482-W504 AromaticContact CE2-CE2 3.61Å; Y482-W504 AromaticContact CE2-CH2 3.86Å; Y482-W504 HydrophobicContact CE2-CH2 3.86Å; Y482-W504 AromaticContact CE2-CZ2 3.3Å; Y482-W504 HydrophobicContact CE2-CZ2 3.3Å; Y482-W504 AromaticContact CE2-NE1 3.97Å; Y482-W504 AromaticContact CG-CD1 3.65Å; Y482-W504 AromaticContact CG-CD2 3.97Å; Y482-W504 HydrophobicContact CG-CD2 3.97Å; Y482-W504 AromaticContact CG-CE2 3.63Å; Y482-W504 HydrophobicContact CG-CG 4Å; Y482-W504 HydrophobicContact CG-CZ2 4.23Å; Y482-W504 AromaticContact CG-NE1 3.38Å; Y482-W504 AromaticContact CZ-CZ2 3.89Å; C500-W504 HydrophobicContact CB-CB 4.26Å; C500-W504 WeakPolarHBondContact CB-O 3.01Å; S501-W504 WeakPolarHBondContact O-CB 3.42Å; S501-W504 VanDerWaalsContact O-CD1 3.31Å; S501-W504 PolarHBondContact O-N 3.48Å; S501-W504 VanDerWaalsContact O-N 3.07Å; A502-W504 VanDerWaalsContact C-N 3.25Å; A502-W504 PolarHBondContact O-N 2.02Å; W504-C509 VanDerWaalsContact CE3-O 3.26Å; W504-D511 VanDerWaalsContact CE3-C 3.49Å; W504-G512 VanDerWaalsContact CZ3-CA 3.47Å; W504-A515 HydrophobicContact CD2-CB 3.98Å; W504-A515 HydrophobicContact CG-CB 4.14Å; W504-A515 HydrophobicContact CZ2-CB 4.09Å
505	K	88.8	Confident	89	Confident	71 Å²	71	31.8 Å²	31.8	31%	0.309	21%	0.206	S	C	.	.	B	Isolated β-bridge	trans	-129.7	179.7	179.2	-66.9	-171.1	178.7	-168.6	0	110.5	T98 E142 C509 T510 D511 T514	T98-K505 HydrophobicContact CG2-CB 3.83Å; T98-K505 HydrophobicContact CG2-CD 4.43Å; E142-K505 IonicContact OE1-NZ 2.69Å; E142-K505 PolarHBondContact OE1-NZ 3Å; K505-C509 CarbonylContact O-C 3.06Å; K505-C509 WeakPolarHBondContact O-CA 3.46Å; K505-T510 PolarHBondContact O-N 3.09Å; K505-D511 HydrophobicContact CB-CB 4.29Å; K505-D511 PolarHBondContact N-O 3.48Å; K505-D511 VanDerWaalsContact O-CB 3.22Å; K505-D511 WeakPolarHBondContact O-CB 3.3Å; K505-D511 PolarHBondContact O-N 3Å; K505-T514 WeakPolarHBondContact CD-OG1 3.47Å; K505-T514 WeakPolarHBondContact CE-OG1 2.94Å
506	G	87.9	Confident	88.6	Confident	17 Å²	17	34.5 Å²	34.5	18%	0.175	22%	0.219	C	C	.	.	S	Bend	trans	95.2	167.9	176.2	0	0	0	0	0	114.5	T98 C500 G508 C509	T98-G506 WeakPolarHBondContact OG1-CA 3.5Å; C500-G506 PolarHBondContact SG-O 2.72Å; G506-G508 VanDerWaalsContact C-N 3.33Å; G506-G508 PolarHBondContact O-N 3.11Å; G506-C509 PolarHBondContact O-N 3.17Å
507	W	87.3	Confident	88.2	Confident	30 Å²	30	37.7 Å²	37.7	11%	0.114	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-35.2	-172.2	-112.7	77.2	0	0	0	114.2	Y45 V92 I93 F100 P438 F439 V476 C498	Y45-W507 HydrophobicContact CD2-CZ2 4.16Å; Y45-W507 HydrophobicContact CE2-CZ2 4.19Å; V92-W507 HydrophobicContact CB-CZ2 4.19Å; V92-W507 HydrophobicContact CG1-CH2 4.25Å; V92-W507 HydrophobicContact CG1-CZ2 3.68Å; V92-W507 HydrophobicContact CG2-CH2 4.19Å; V92-W507 HydrophobicContact CG2-CZ2 4.23Å; I93-W507 PolarHBondContact O-NE1 2.98Å; F100-W507 HydrophobicContact CD1-CB 3.83Å; F100-W507 AromaticContact CD1-CG 3.93Å; F100-W507 HydrophobicContact CD1-CG 3.93Å; F100-W507 HydrophobicContact CE1-CB 3.89Å; F100-W507 AromaticContact CE1-CD1 3.38Å; F100-W507 AromaticContact CE1-CD2 3.9Å; F100-W507 HydrophobicContact CE1-CD2 3.9Å; F100-W507 AromaticContact CE1-CG 3.45Å; F100-W507 HydrophobicContact CE1-CG 3.45Å; F100-W507 VanDerWaalsContact CE1-CG 3.45Å; F100-W507 AromaticContact CE1-NE1 3.77Å; F100-W507 AromaticContact CZ-CD1 3.72Å; F100-W507 HydrophobicContact CZ-CG 4.24Å; F100-W507 AromaticContact CZ-NE1 3.98Å; P438-W507 HydrophobicContact CB-CE3 4.07Å; P438-W507 HydrophobicContact CB-CH2 3.65Å; P438-W507 HydrophobicContact CB-CZ3 3.3Å; P438-W507 HydrophobicContact CG-CH2 4.45Å; P438-W507 HydrophobicContact CG-CZ3 4.21Å; F439-W507 AromaticContact CD2-CH2 3.62Å; F439-W507 HydrophobicContact CD2-CH2 3.62Å; F439-W507 HydrophobicContact CD2-CZ2 4.24Å; F439-W507 HydrophobicContact CE1-CH2 4.39Å; F439-W507 AromaticContact CE2-CH2 3.24Å; F439-W507 HydrophobicContact CE2-CH2 3.24Å; F439-W507 AromaticContact CE2-CZ2 3.77Å; F439-W507 HydrophobicContact CE2-CZ2 3.77Å; F439-W507 HydrophobicContact CE2-CZ3 4.28Å; F439-W507 HydrophobicContact CG-CH2 4.36Å; F439-W507 AromaticContact CZ-CH2 3.68Å; F439-W507 HydrophobicContact CZ-CH2 3.68Å; F439-W507 HydrophobicContact CZ-CZ2 4.47Å; F439-W507 HydrophobicContact CZ-CZ3 4.33Å; V476-W507 HydrophobicContact CG2-CE3 4.33Å; C498-W507 WeakPolarHBondContact CB-O 3.32Å; C498-W507 PolarHBondContact SG-O 2.79Å
508	G	89.2	Confident	87.9	Confident	2 Å²	2	44 Å²	44	2%	0.021	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-112.2	19.7	174.6	0	0	0	0	0	113.4	C479 G506 T510	C479-G508 CarbonylContact C-O 3.16Å; G506-G508 VanDerWaalsContact C-N 3.33Å; G506-G508 PolarHBondContact O-N 3.11Å; G508-T510 PolarHBondContact O-N 2.97Å
509	C	91.1	Very high	87.6	Confident	4 Å²	4	46.3 Å²	46.3	3%	0.027	29%	0.285	C	S	.	.	S	Bend	trans	55.4	34.2	-174.5	-52.4	0	0	0	0	114.4	C500 W504 K505 G506	C500-C509 WeakPolarHBondContact CA-SG 3.44Å; C500-C509 HydrophobicContact CB-CB 3.77Å; C500-C509 WeakPolarHBondContact CB-SG 3.17Å; C500-C509 PolarHBondContact N-SG 3.4Å; C500-C509 WeakPolarHBondContact SG-CA 3.47Å; C500-C509 WeakPolarHBondContact SG-CB 3.39Å; C500-C509 CovalentContact SG-SG 2.04Å; C500-C509 PolarHBondContact SG-SG 3.25Å; W504-C509 VanDerWaalsContact CE3-O 3.26Å; K505-C509 CarbonylContact O-C 3.06Å; K505-C509 WeakPolarHBondContact O-CA 3.46Å; G506-C509 PolarHBondContact O-N 3.17Å
510	T	88.9	Confident	87.4	Confident	64 Å²	64	50.2 Å²	50.2	39%	0.393	30%	0.296	S	S	.	.			trans	-97.6	-7.4	-178	51	0	0	0	0	113.7	P101 K505 G508 G512	P101-T510 HydrophobicContact CB-CG2 4.34Å; P101-T510 HydrophobicContact CG-CG2 4.06Å; K505-T510 PolarHBondContact O-N 3.09Å; G508-T510 PolarHBondContact O-N 2.97Å; T510-G512 PolarHBondContact O-N 3.03Å
511	D	87.9	Confident	87.3	Confident	19 Å²	19	49 Å²	49	10%	0.102	29%	0.286	C	S	.	.	B	Isolated β-bridge	trans	-89.5	108.1	179.7	-167.8	-25	0	0	0	110.5	T98 V99 W504 K505 S513	T98-D511 WeakPolarHBondContact CA-OD2 3.26Å; T98-D511 WeakPolarHBondContact CB-OD2 3.37Å; V99-D511 HydrophobicContact CB-CB 4.46Å; V99-D511 PolarHBondContact N-OD2 3.32Å; W504-D511 VanDerWaalsContact CE3-C 3.49Å; K505-D511 HydrophobicContact CB-CB 4.29Å; K505-D511 PolarHBondContact N-O 3.48Å; K505-D511 VanDerWaalsContact O-CB 3.22Å; K505-D511 WeakPolarHBondContact O-CB 3.3Å; K505-D511 PolarHBondContact O-N 3Å; D511-S513 WeakPolarHBondContact OD1-CB 3.4Å; D511-S513 PolarHBondContact OD1-N 3.42Å; D511-S513 PolarHBondContact OD1-OG 3.48Å
512	G	87.3	Confident	87.4	Confident	37 Å²	37	50.4 Å²	50.4	38%	0.381	29%	0.291	S	S	.	.			trans	-90.4	5.6	-178.5	0	0	0	0	0	114.8	W504 T510 T514 A515	W504-G512 VanDerWaalsContact CZ3-CA 3.47Å; T510-G512 PolarHBondContact O-N 3.03Å; G512-T514 PolarHBondContact O-N 2.92Å; G512-A515 WeakPolarHBondContact O-CB 3.26Å; G512-A515 PolarHBondContact O-N 3.41Å; G512-A515 VanDerWaalsContact O-N 3.08Å
513	S	87.4	Confident	87.6	Confident	92 Å²	92	53.5 Å²	53.5	64%	0.643	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56	-35.6	-174.9	53.6	0	0	0	0	113.8	D511	D511-S513 WeakPolarHBondContact OD1-CB 3.4Å; D511-S513 PolarHBondContact OD1-N 3.42Å; D511-S513 PolarHBondContact OD1-OG 3.48Å
514	T	85.4	Confident	87.8	Confident	69 Å²	69	52.2 Å²	52.2	42%	0.423	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111.1	12.6	176.9	55.6	0	0	0	0	113.7	G503 K505 G512 Q516	G503-T514 CarbonylContact O-C 3.38Å; G503-T514 PolarHBondContact O-OG1 2.93Å; K505-T514 WeakPolarHBondContact CD-OG1 3.47Å; K505-T514 WeakPolarHBondContact CE-OG1 2.94Å; G512-T514 PolarHBondContact O-N 2.92Å; T514-Q516 PolarHBondContact O-N 3.47Å
515	A	86.8	Confident	87.9	Confident	36 Å²	36	50.1 Å²	50.1	30%	0.298	29%	0.29	S	S	.	.	P	Polyproline II helix	trans	-63.1	134.1	-176.2	0	0	0	0	0	111.7	G503 W504 G512	G503-A515 PolarHBondContact O-N 2.93Å; W504-A515 HydrophobicContact CD2-CB 3.98Å; W504-A515 HydrophobicContact CG-CB 4.14Å; W504-A515 HydrophobicContact CZ2-CB 4.09Å; G512-A515 WeakPolarHBondContact O-CB 3.26Å; G512-A515 PolarHBondContact O-N 3.41Å; G512-A515 VanDerWaalsContact O-N 3.08Å
516	Q	84.6	Confident	88	Confident	68 Å²	68	51 Å²	51	32%	0.318	30%	0.296	S	S	.	.	P	Polyproline II helix	trans	-78.5	134.1	177.9	-62.7	-178.1	0.6	0	0	110.3	A502 T514 Q521	A502-Q516 WeakPolarHBondContact O-CB 3.33Å; A502-Q516 PolarHBondContact O-N 2.92Å; T514-Q516 PolarHBondContact O-N 3.47Å; Q516-Q521 HydrophobicContact CB-CG 4.15Å; Q516-Q521 PolarHBondContact O-NE2 3.03Å
517	S	87.7	Confident	88.3	Confident	72 Å²	72	53.2 Å²	53.2	50%	0.503	30%	0.304	S	S	.	.	P	Polyproline II helix	trans	-64.1	150.1	173.7	67.8	0	0	0	0	111.5	A519 R520 Q521	S517-A519 PolarHBondContact O-N 3.35Å; S517-R520 WeakPolarHBondContact O-CB 3.34Å; S517-R520 PolarHBondContact O-N 3.11Å; S517-R520 PolarHBondContact OG-N 3.29Å; S517-Q521 PolarHBondContact O-N 3.26Å
518	Y	87	Confident	88.5	Confident	140 Å²	140	51.8 Å²	51.8	55%	0.549	30%	0.298	S	S	.	.	H	α-helix	trans	-55.4	-39.2	177.1	179.2	-105.5	0	0	0	112.5	R520 Q521 L522 A572	Y518-R520 VanDerWaalsContact C-N 3.28Å; Y518-R520 PolarHBondContact O-N 3.07Å; Y518-Q521 PolarHBondContact O-N 2.86Å; Y518-L522 HydrophobicContact CE1-CD2 4.41Å; Y518-L522 WeakPolarHBondContact O-CB 3.26Å; Y518-L522 PolarHBondContact O-N 2.98Å; Y518-A572 HydrophobicContact CD2-CB 4.27Å; Y518-A572 HydrophobicContact CE2-CB 4.06Å
519	A	86.9	Confident	88.8	Confident	61 Å²	61	52.4 Å²	52.4	50%	0.504	30%	0.302	S	S	.	.	H	α-helix	trans	-60.5	-37.5	176.1	0	0	0	0	0	112.5	S517 T523	S517-A519 PolarHBondContact O-N 3.35Å; A519-T523 WeakPolarHBondContact O-CB 3.39Å; A519-T523 PolarHBondContact O-N 2.89Å; A519-T523 PolarHBondContact O-OG1 2.91Å
520	R	86.5	Confident	88.9	Confident	112 Å²	112	56.7 Å²	56.7	42%	0.423	32%	0.324	S	S	.	.	H	α-helix	trans	-71	-43.6	177.4	-171.1	173.3	-173.3	174.8	-0.2	111.7	S517 Y518 T523 A524 Y696	S517-R520 WeakPolarHBondContact O-CB 3.34Å; S517-R520 PolarHBondContact O-N 3.11Å; S517-R520 PolarHBondContact OG-N 3.29Å; Y518-R520 VanDerWaalsContact C-N 3.28Å; Y518-R520 PolarHBondContact O-N 3.07Å; R520-T523 PolarHBondContact O-N 3.26Å; R520-A524 WeakPolarHBondContact O-CB 3.33Å; R520-A524 PolarHBondContact O-N 3.34Å; R520-Y696 PolarHBondContact NE-OH 3.08Å; R520-Y696 PolarHBondContact NH2-OH 3.02Å
521	Q	87.8	Confident	89.3	Confident	13 Å²	13	54 Å²	54	6%	0.061	31%	0.307	C	S	.	.	H	α-helix	trans	-57.4	-50.6	174.5	-65.3	172.3	34.7	0	0	110.4	A502 Q516 S517 Y518 T523 A524 T525 P570	A502-Q521 HydrophobicContact CB-CG 4.46Å; Q516-Q521 HydrophobicContact CB-CG 4.15Å; Q516-Q521 PolarHBondContact O-NE2 3.03Å; S517-Q521 PolarHBondContact O-N 3.26Å; Y518-Q521 PolarHBondContact O-N 2.86Å; Q521-T523 VanDerWaalsContact C-N 3.34Å; Q521-T523 PolarHBondContact O-N 3.24Å; Q521-A524 PolarHBondContact O-N 3.47Å; Q521-T525 PolarHBondContact O-N 3.4Å; Q521-T525 PolarHBondContact O-OG1 3.18Å; Q521-P570 PolarHBondContact OE1-O 2.79Å
522	L	88.9	Confident	89.6	Confident	63 Å²	63	53 Å²	53	33%	0.33	30%	0.302	S	S	.	.	H	α-helix	trans	-60.4	-42.2	178.4	-177.3	63.2	0	0	0	112.4	Y518 A524 T525 M526	Y518-L522 HydrophobicContact CE1-CD2 4.41Å; Y518-L522 WeakPolarHBondContact O-CB 3.26Å; Y518-L522 PolarHBondContact O-N 2.98Å; L522-A524 VanDerWaalsContact C-N 3.35Å; L522-T525 PolarHBondContact O-N 2.76Å; L522-M526 HydrophobicContact CD1-CE 3.76Å; L522-M526 HydrophobicContact CD1-CG 4.14Å; L522-M526 HydrophobicContact CG-CG 4.35Å; L522-M526 WeakPolarHBondContact O-CB 3.5Å; L522-M526 WeakPolarHBondContact O-CG 3.11Å; L522-M526 PolarHBondContact O-N 3.13Å
523	T	89.4	Confident	90	Very high	68 Å²	68	54.7 Å²	54.7	42%	0.417	30%	0.302	S	S	.	.	H	α-helix	trans	-63.8	-41.7	177.8	-57.8	0	0	0	0	111.1	A519 R520 Q521 M526 L527	A519-T523 WeakPolarHBondContact O-CB 3.39Å; A519-T523 PolarHBondContact O-N 2.89Å; A519-T523 PolarHBondContact O-OG1 2.91Å; R520-T523 PolarHBondContact O-N 3.26Å; Q521-T523 VanDerWaalsContact C-N 3.34Å; Q521-T523 PolarHBondContact O-N 3.24Å; T523-M526 PolarHBondContact O-N 2.91Å; T523-L527 HydrophobicContact CG2-CD1 3.87Å; T523-L527 HydrophobicContact CG2-CG 4.36Å; T523-L527 WeakPolarHBondContact O-CB 3.38Å; T523-L527 VanDerWaalsContact O-CG 3.29Å; T523-L527 WeakPolarHBondContact O-CG 3.27Å; T523-L527 PolarHBondContact O-N 2.9Å
524	A	88.1	Confident	90.4	Very high	3 Å²	3	55.2 Å²	55.2	3%	0.025	29%	0.293	C	S	.	.	H	α-helix	trans	-62.9	-48.2	176.5	0	0	0	0	0	111.4	R520 Q521 L522 M526 L527 L528 Y696	R520-A524 WeakPolarHBondContact O-CB 3.33Å; R520-A524 PolarHBondContact O-N 3.34Å; Q521-A524 PolarHBondContact O-N 3.47Å; L522-A524 VanDerWaalsContact C-N 3.35Å; A524-M526 PolarHBondContact O-N 3.46Å; A524-L527 PolarHBondContact O-N 3.21Å; A524-L528 PolarHBondContact O-N 3.31Å; A524-Y696 HydrophobicContact CB-CD1 4.21Å; A524-Y696 HydrophobicContact CB-CD2 4.02Å; A524-Y696 HydrophobicContact CB-CG 3.77Å
525	T	90.3	Very high	90.8	Very high	11 Å²	11	52.1 Å²	52.1	7%	0.067	27%	0.273	C	S	.	.	H	α-helix	trans	-58	-48.7	175.2	-47.4	0	0	0	0	111.4	Q521 L522 L527 L528 T529 Q569	Q521-T525 PolarHBondContact O-N 3.4Å; Q521-T525 PolarHBondContact O-OG1 3.18Å; L522-T525 PolarHBondContact O-N 2.76Å; T525-L527 PolarHBondContact O-N 3.31Å; T525-L528 PolarHBondContact O-N 3.2Å; T525-T529 HydrophobicContact CG2-CG2 4.17Å; T525-T529 VanDerWaalsContact O-CB 3.31Å; T525-T529 WeakPolarHBondContact O-CB 3.33Å; T525-T529 WeakPolarHBondContact O-CG2 3.17Å; T525-T529 PolarHBondContact O-N 3.08Å; T525-T529 PolarHBondContact O-OG1 3.38Å; T525-Q569 HydrophobicContact CG2-CG 4.2Å; T525-Q569 WeakPolarHBondContact OG1-CB 3.44Å; T525-Q569 WeakPolarHBondContact OG1-CG 3.33Å
526	M	91.4	Very high	91.2	Very high	91 Å²	91	54.2 Å²	54.2	45%	0.448	28%	0.279	S	S	.	.	H	α-helix	trans	-64.6	-40.9	-178.5	-71.7	-66.6	168.7	0	0	112.1	L522 T523 A524 T529 L530	L522-M526 HydrophobicContact CD1-CE 3.76Å; L522-M526 HydrophobicContact CD1-CG 4.14Å; L522-M526 HydrophobicContact CG-CG 4.35Å; L522-M526 WeakPolarHBondContact O-CB 3.5Å; L522-M526 WeakPolarHBondContact O-CG 3.11Å; L522-M526 PolarHBondContact O-N 3.13Å; T523-M526 PolarHBondContact O-N 2.91Å; A524-M526 PolarHBondContact O-N 3.46Å; M526-T529 PolarHBondContact O-OG1 3.1Å; M526-L530 HydrophobicContact CB-CD1 4.24Å; M526-L530 WeakPolarHBondContact O-CB 3.3Å; M526-L530 WeakPolarHBondContact O-CG 3.2Å; M526-L530 PolarHBondContact O-N 3.09Å; M526-L530 HydrophobicContact SD-CD1 4.22Å
527	L	93.5	Very high	91.7	Very high	63 Å²	63	54 Å²	54	33%	0.33	28%	0.284	S	S	.	.	H	α-helix	trans	-63.6	-49.1	177.7	-77.2	170.2	0	0	0	111.7	T523 A524 T525 T529 S531 Y696 Y697 S700	T523-L527 HydrophobicContact CG2-CD1 3.87Å; T523-L527 HydrophobicContact CG2-CG 4.36Å; T523-L527 WeakPolarHBondContact O-CB 3.38Å; T523-L527 VanDerWaalsContact O-CG 3.29Å; T523-L527 WeakPolarHBondContact O-CG 3.27Å; T523-L527 PolarHBondContact O-N 2.9Å; A524-L527 PolarHBondContact O-N 3.21Å; T525-L527 PolarHBondContact O-N 3.31Å; L527-T529 PolarHBondContact O-N 2.74Å; L527-S531 WeakPolarHBondContact O-CB 3.4Å; L527-S531 PolarHBondContact O-N 3.46Å; L527-S531 VanDerWaalsContact O-N 3.1Å; L527-S531 PolarHBondContact O-OG 2.97Å; L527-Y696 HydrophobicContact CD1-CD2 3.94Å; L527-Y696 HydrophobicContact CD1-CE2 4.36Å; L527-Y697 HydrophobicContact CD1-CD1 3.9Å; L527-Y697 HydrophobicContact CD1-CE1 3.76Å; L527-S700 PolarHBondContact O-OG 3.46Å
528	L	92.9	Very high	91.9	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-68.3	-34.4	-177.8	-73.4	165	0	0	0	112.8	A524 T525 S531 N532 H565 Q569 Y695 H699 S700	A524-L528 PolarHBondContact O-N 3.31Å; T525-L528 PolarHBondContact O-N 3.2Å; L528-S531 PolarHBondContact O-OG 3.14Å; L528-S531 VanDerWaalsContact O-OG 3.11Å; L528-N532 PolarHBondContact O-ND2 3.48Å; L528-N532 VanDerWaalsContact O-ND2 3.08Å; L528-H565 HydrophobicContact CB-CB 3.79Å; L528-Q569 VanDerWaalsContact CD1-NE2 3.25Å; L528-Y695 HydrophobicContact CD1-CD1 4.27Å; L528-Y695 HydrophobicContact CD1-CE1 3.92Å; L528-Y695 HydrophobicContact CD2-CE1 4.22Å; L528-H699 HydrophobicContact CD2-CB 3.97Å; L528-S700 WeakPolarHBondContact CA-OG 3.2Å; L528-S700 PolarHBondContact N-OG 3.06Å
529	T	94.2	Very high	92.3	Very high	15 Å²	15	45.1 Å²	45.1	9%	0.092	24%	0.24	C	C	.	.	H	α-helix	trans	-81.8	-47	179.5	57	0	0	0	0	112.7	T525 M526 L527 S531 N532 T562 H565 A566	T525-T529 HydrophobicContact CG2-CG2 4.17Å; T525-T529 VanDerWaalsContact O-CB 3.31Å; T525-T529 WeakPolarHBondContact O-CB 3.33Å; T525-T529 WeakPolarHBondContact O-CG2 3.17Å; T525-T529 PolarHBondContact O-N 3.08Å; T525-T529 PolarHBondContact O-OG1 3.38Å; M526-T529 PolarHBondContact O-OG1 3.1Å; L527-T529 PolarHBondContact O-N 2.74Å; T529-S531 PolarHBondContact O-N 2.91Å; T529-N532 WeakPolarHBondContact O-CB 3.46Å; T529-N532 PolarHBondContact O-N 2.82Å; T529-T562 HydrophobicContact CG2-CG2 4.37Å; T529-T562 WeakPolarHBondContact CG2-O 3.5Å; T529-H565 HydrophobicContact CG2-CB 4.4Å; T529-A566 HydrophobicContact CG2-CB 3.89Å
530	L	94.8	Very high	92.7	Very high	94 Å²	94	45.5 Å²	45.5	49%	0.492	24%	0.236	S	C	.	.	H	α-helix	trans	-72.2	-28.8	-177.7	-63.5	175.2	0	0	0	112.6	M526 N532 L533	M526-L530 HydrophobicContact CB-CD1 4.24Å; M526-L530 WeakPolarHBondContact O-CB 3.3Å; M526-L530 WeakPolarHBondContact O-CG 3.2Å; M526-L530 PolarHBondContact O-N 3.09Å; M526-L530 HydrophobicContact SD-CD1 4.22Å; L530-N532 PolarHBondContact O-N 3.45Å; L530-L533 HydrophobicContact CD2-CD1 3.88Å; L530-L533 WeakPolarHBondContact O-CB 3.32Å; L530-L533 PolarHBondContact O-N 3.47Å
531	S	95.9	Very high	93	Very high	6 Å²	6	41.7 Å²	41.7	4%	0.042	23%	0.225	C	C	.	.	H	α-helix	trans	-60.5	-30.4	175.1	55.6	0	0	0	0	112.6	L527 L528 T529 L533 F534 S700 H703	L527-S531 WeakPolarHBondContact O-CB 3.4Å; L527-S531 PolarHBondContact O-N 3.46Å; L527-S531 VanDerWaalsContact O-N 3.1Å; L527-S531 PolarHBondContact O-OG 2.97Å; L528-S531 PolarHBondContact O-OG 3.14Å; L528-S531 VanDerWaalsContact O-OG 3.11Å; T529-S531 PolarHBondContact O-N 2.91Å; S531-L533 PolarHBondContact O-N 2.91Å; S531-F534 WeakPolarHBondContact O-CB 3.31Å; S531-F534 WeakPolarHBondContact O-CD2 3.3Å; S531-F534 PolarHBondContact O-N 2.85Å; S531-S700 WeakPolarHBondContact CB-O 3.2Å; S531-H703 PolarHBondContact OG-ND1 3.23Å
532	N	95.1	Very high	93.2	Very high	0 Å²	0	41 Å²	41	0%	0	22%	0.222	C	C	.	.	G	3₁₀ helix	trans	-65.3	-25	175	-87.4	-64.5	0	0	0	113.7	L528 T529 L530 F534 F535 M558 S561 T562 H703	L528-N532 PolarHBondContact O-ND2 3.48Å; L528-N532 VanDerWaalsContact O-ND2 3.08Å; T529-N532 WeakPolarHBondContact O-CB 3.46Å; T529-N532 PolarHBondContact O-N 2.82Å; L530-N532 PolarHBondContact O-N 3.45Å; N532-F534 PolarHBondContact O-N 3.24Å; N532-F534 VanDerWaalsContact O-N 3.08Å; N532-F535 WeakPolarHBondContact O-CD2 3.38Å; N532-F535 PolarHBondContact O-N 3.39Å; N532-F535 VanDerWaalsContact O-N 3.09Å; N532-M558 WeakPolarHBondContact O-CG 3.26Å; N532-S561 PolarHBondContact ND2-OG 3.22Å; N532-S561 VanDerWaalsContact OD1-CB 3.24Å; N532-S561 WeakPolarHBondContact OD1-CB 3.18Å; N532-S561 PolarHBondContact OD1-OG 2.85Å; N532-T562 WeakPolarHBondContact CB-OG1 3.38Å; N532-H703 PolarHBondContact ND2-CE1 3.12Å; N532-H703 PolarHBondContact ND2-ND1 2.87Å
533	L	95.4	Very high	93.4	Very high	71 Å²	71	41.4 Å²	41.4	37%	0.372	23%	0.227	S	C	.	.	G	3₁₀ helix	trans	-65.4	-12.5	176.1	-59.7	-179.1	0	0	0	113	L530 S531 F535 L536 M558	L530-L533 HydrophobicContact CD2-CD1 3.88Å; L530-L533 WeakPolarHBondContact O-CB 3.32Å; L530-L533 PolarHBondContact O-N 3.47Å; S531-L533 PolarHBondContact O-N 2.91Å; L533-F535 PolarHBondContact O-N 3.43Å; L533-F535 VanDerWaalsContact O-N 3.14Å; L533-L536 HydrophobicContact CB-CD1 4.19Å; L533-L536 HydrophobicContact CD2-CD1 4.46Å; L533-L536 VanDerWaalsContact O-CB 3.22Å; L533-L536 WeakPolarHBondContact O-CB 3.41Å; L533-L536 VanDerWaalsContact O-CG 3.26Å; L533-L536 WeakPolarHBondContact O-CG 3.5Å; L533-L536 PolarHBondContact O-N 2.85Å; L533-M558 HydrophobicContact CD2-SD 4.26Å
534	F	94.9	Very high	93.5	Very high	103 Å²	103	48.1 Å²	48.1	45%	0.452	24%	0.244	S	C	.	.	G	3₁₀ helix	trans	-64.2	-11.5	171	-83.4	-98.5	0	0	0	113.7	S531 N532 L536 P537 I704 A707	S531-F534 WeakPolarHBondContact O-CB 3.31Å; S531-F534 WeakPolarHBondContact O-CD2 3.3Å; S531-F534 PolarHBondContact O-N 2.85Å; N532-F534 PolarHBondContact O-N 3.24Å; N532-F534 VanDerWaalsContact O-N 3.08Å; F534-L536 PolarHBondContact O-N 3.48Å; F534-P537 VanDerWaalsContact O-CD 3.31Å; F534-P537 WeakPolarHBondContact O-CD 3.3Å; F534-I704 HydrophobicContact CD1-CG1 4.45Å; F534-I704 HydrophobicContact CD1-CG2 3.94Å; F534-I704 HydrophobicContact CD2-CD1 4.35Å; F534-I704 HydrophobicContact CD2-CG1 3.72Å; F534-I704 HydrophobicContact CE1-CG2 4Å; F534-I704 HydrophobicContact CE2-CD1 4.04Å; F534-I704 HydrophobicContact CE2-CG1 3.91Å; F534-I704 HydrophobicContact CG-CB 4.45Å; F534-I704 HydrophobicContact CG-CG1 3.99Å; F534-I704 HydrophobicContact CG-CG2 4.27Å; F534-I704 HydrophobicContact CZ-CD1 4.38Å; F534-I704 HydrophobicContact CZ-CG1 4.36Å; F534-I704 HydrophobicContact CZ-CG2 4.39Å; F534-A707 HydrophobicContact CB-CB 3.99Å; F534-A707 WeakPolarHBondContact O-CB 3.25Å
535	F	94.6	Very high	93.6	Very high	4 Å²	4	50.7 Å²	50.7	2%	0.018	25%	0.253	C	S	.	.	H	α-helix	trans	-69.2	-18.8	167	-82.4	-79.6	0	0	0	113.4	N532 L533 A538 I539 T557 M558 V706 A707	N532-F535 WeakPolarHBondContact O-CD2 3.38Å; N532-F535 PolarHBondContact O-N 3.39Å; N532-F535 VanDerWaalsContact O-N 3.09Å; L533-F535 PolarHBondContact O-N 3.43Å; L533-F535 VanDerWaalsContact O-N 3.14Å; F535-A538 WeakPolarHBondContact O-CA 3.49Å; F535-A538 WeakPolarHBondContact O-CB 3.43Å; F535-A538 PolarHBondContact O-N 3.19Å; F535-I539 HydrophobicContact CB-CD1 4.45Å; F535-I539 WeakPolarHBondContact O-CG1 3.22Å; F535-I539 PolarHBondContact O-N 3.29Å; F535-T557 HydrophobicContact CE2-CG2 4.19Å; F535-T557 HydrophobicContact CZ-CG2 4.02Å; F535-M558 HydrophobicContact CB-CB 3.93Å; F535-M558 HydrophobicContact CB-CG 4.18Å; F535-M558 HydrophobicContact CB-SD 4.41Å; F535-M558 HydrophobicContact CG-CB 4.46Å; F535-V706 HydrophobicContact CZ-CG1 4.35Å; F535-A707 HydrophobicContact CD1-CB 4Å; F535-A707 HydrophobicContact CD2-CB 3.94Å; F535-A707 HydrophobicContact CE1-CB 4.14Å; F535-A707 HydrophobicContact CE2-CB 4.07Å; F535-A707 HydrophobicContact CG-CB 3.9Å; F535-A707 HydrophobicContact CZ-CB 4.17Å
536	L	95.7	Very high	93.5	Very high	81 Å²	81	52.9 Å²	52.9	42%	0.424	27%	0.27	S	S	.	.	H	α-helix	trans	-56.5	-49.8	178.7	-70.6	172.6	0	0	0	112.9	L533 F534 A538 I539 V540 M558	L533-L536 HydrophobicContact CB-CD1 4.19Å; L533-L536 HydrophobicContact CD2-CD1 4.46Å; L533-L536 VanDerWaalsContact O-CB 3.22Å; L533-L536 WeakPolarHBondContact O-CB 3.41Å; L533-L536 VanDerWaalsContact O-CG 3.26Å; L533-L536 WeakPolarHBondContact O-CG 3.5Å; L533-L536 PolarHBondContact O-N 2.85Å; F534-L536 PolarHBondContact O-N 3.48Å; L536-A538 VanDerWaalsContact C-N 3.29Å; L536-A538 PolarHBondContact O-N 3.46Å; L536-I539 HydrophobicContact CD2-CD1 4.49Å; L536-I539 PolarHBondContact O-N 3.36Å; L536-V540 WeakPolarHBondContact O-CG2 3.3Å; L536-V540 PolarHBondContact O-N 3.37Å; L536-M558 HydrophobicContact CD2-CE 4.13Å; L536-M558 HydrophobicContact CD2-SD 3.68Å; L536-M558 HydrophobicContact CG-SD 3.8Å
537	P	94.4	Very high	93.4	Very high	64 Å²	64	50.4 Å²	50.4	42%	0.416	26%	0.255	S	S	.	.	H	α-helix	trans	-50.8	-43.8	169.6	-30	31.3	0	0	0	114.2	F534 V540 V541 V711	F534-P537 VanDerWaalsContact O-CD 3.31Å; F534-P537 WeakPolarHBondContact O-CD 3.3Å; P537-V540 PolarHBondContact O-N 3.05Å; P537-V541 WeakPolarHBondContact O-CB 3.5Å; P537-V541 VanDerWaalsContact O-CG2 3.3Å; P537-V541 WeakPolarHBondContact O-CG2 3.43Å; P537-V541 PolarHBondContact O-N 2.94Å; P537-V711 HydrophobicContact CB-CG2 3.94Å
538	A	92.8	Very high	93.2	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-64.4	-43.4	179.1	0	0	0	0	0	111.5	F535 L536 V541 A542 Y554 V710 V711	F535-A538 WeakPolarHBondContact O-CA 3.49Å; F535-A538 WeakPolarHBondContact O-CB 3.43Å; F535-A538 PolarHBondContact O-N 3.19Å; L536-A538 VanDerWaalsContact C-N 3.29Å; L536-A538 PolarHBondContact O-N 3.46Å; A538-V541 PolarHBondContact O-N 2.92Å; A538-A542 VanDerWaalsContact O-CB 3.27Å; A538-A542 WeakPolarHBondContact O-CB 3.2Å; A538-A542 PolarHBondContact O-N 2.99Å; A538-Y554 HydrophobicContact CB-CD2 4.37Å; A538-V710 HydrophobicContact CB-CB 4.14Å; A538-V710 HydrophobicContact CB-CG1 3.84Å; A538-V711 HydrophobicContact CB-CG2 3.96Å
539	I	95.5	Very high	93.1	Very high	25 Å²	25	54.4 Å²	54.4	13%	0.128	28%	0.278	C	S	.	.	H	α-helix	trans	-61.4	-46.1	175.6	-65.3	161.5	0	0	0	110.8	F535 L536 V541 A542 T543 L555 M558	F535-I539 HydrophobicContact CB-CD1 4.45Å; F535-I539 WeakPolarHBondContact O-CG1 3.22Å; F535-I539 PolarHBondContact O-N 3.29Å; L536-I539 HydrophobicContact CD2-CD1 4.49Å; L536-I539 PolarHBondContact O-N 3.36Å; I539-V541 PolarHBondContact O-N 2.97Å; I539-A542 PolarHBondContact O-N 2.92Å; I539-T543 WeakPolarHBondContact O-CB 3.34Å; I539-T543 PolarHBondContact O-N 3.47Å; I539-T543 PolarHBondContact O-OG1 3.29Å; I539-L555 HydrophobicContact CD1-CB 4.21Å; I539-L555 HydrophobicContact CD1-CD1 4.25Å; I539-M558 HydrophobicContact CD1-SD 4.03Å
540	V	94.5	Very high	93.1	Very high	69 Å²	69	53.7 Å²	53.7	42%	0.418	27%	0.274	S	S	.	.	H	α-helix	trans	-62.9	-44.6	179.1	171.1	0	0	0	0	110.8	L536 P537 T543 R544	L536-V540 WeakPolarHBondContact O-CG2 3.3Å; L536-V540 PolarHBondContact O-N 3.37Å; P537-V540 PolarHBondContact O-N 3.05Å; V540-T543 PolarHBondContact O-N 3.2Å; V540-R544 HydrophobicContact CG1-CG 4.49Å; V540-R544 WeakPolarHBondContact O-CB 3.36Å; V540-R544 WeakPolarHBondContact O-CG 3.35Å; V540-R544 PolarHBondContact O-N 3.09Å
541	V	92.4	Very high	93.1	Very high	31 Å²	31	49.6 Å²	49.6	19%	0.188	25%	0.254	C	S	.	.	H	α-helix	trans	-65.7	-44.6	178.4	170.1	0	0	0	0	111.3	P537 A538 I539 R544 R545 V711 L714	P537-V541 WeakPolarHBondContact O-CB 3.5Å; P537-V541 VanDerWaalsContact O-CG2 3.3Å; P537-V541 WeakPolarHBondContact O-CG2 3.43Å; P537-V541 PolarHBondContact O-N 2.94Å; A538-V541 PolarHBondContact O-N 2.92Å; I539-V541 PolarHBondContact O-N 2.97Å; V541-R544 PolarHBondContact O-N 3.33Å; V541-R545 WeakPolarHBondContact O-CB 3.37Å; V541-R545 VanDerWaalsContact O-CG 3.27Å; V541-R545 WeakPolarHBondContact O-CG 3.34Å; V541-R545 PolarHBondContact O-N 2.97Å; V541-V711 HydrophobicContact CG2-CG1 4.32Å; V541-L714 HydrophobicContact CG1-CD1 4.23Å
542	A	92.8	Very high	93.1	Very high	0 Å²	0	55.9 Å²	55.9	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-59.3	-47.4	176.3	0	0	0	0	0	111.4	A538 I539 R545 S546 Y547 A551 Y554 L714	A538-A542 VanDerWaalsContact O-CB 3.27Å; A538-A542 WeakPolarHBondContact O-CB 3.2Å; A538-A542 PolarHBondContact O-N 2.99Å; I539-A542 PolarHBondContact O-N 2.92Å; A542-R545 CarbonylContact O-C 3.55Å; A542-R545 PolarHBondContact O-N 3.5Å; A542-S546 PolarHBondContact O-N 2.97Å; A542-S546 VanDerWaalsContact O-N 3.12Å; A542-Y547 PolarHBondContact O-N 3.4Å; A542-A551 HydrophobicContact CB-CB 3.94Å; A542-Y554 HydrophobicContact CB-CD2 4.25Å; A542-Y554 HydrophobicContact CB-CE2 4Å; A542-L714 HydrophobicContact CB-CD1 4.16Å
543	T	92.6	Very high	93.1	Very high	71 Å²	71	57.4 Å²	57.4	44%	0.436	29%	0.29	S	S	.	.	H	α-helix	trans	-61.8	-48.5	178.2	-54.9	0	0	0	0	111.8	I539 V540 R545 S546 I548	I539-T543 WeakPolarHBondContact O-CB 3.34Å; I539-T543 PolarHBondContact O-N 3.47Å; I539-T543 PolarHBondContact O-OG1 3.29Å; V540-T543 PolarHBondContact O-N 3.2Å; T543-R545 PolarHBondContact O-N 2.04Å; T543-S546 PolarHBondContact O-N 3.24Å; T543-I548 HydrophobicContact CG2-CD1 4.47Å
544	R	91.7	Very high	93.2	Very high	208 Å²	208	54 Å²	54	79%	0.785	27%	0.272	S	S	*	.	H	α-helix	trans	-61.7	-30.4	178	-76.2	-177.5	177.5	179.8	1.3	112.9	V540 V541 S546	V540-R544 HydrophobicContact CG1-CG 4.49Å; V540-R544 WeakPolarHBondContact O-CB 3.36Å; V540-R544 WeakPolarHBondContact O-CG 3.35Å; V540-R544 PolarHBondContact O-N 3.09Å; V541-R544 PolarHBondContact O-N 3.33Å; R544-S546 VanDerWaalsContact C-N 3.33Å
545	R	89.4	Confident	93.3	Very high	57 Å²	57	52.7 Å²	52.7	22%	0.215	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.2	2.4	178.1	-66.4	179.8	-174.8	-173.6	13.1	113.7	V541 A542 T543 Y547 L714 P715	V541-R545 WeakPolarHBondContact O-CB 3.37Å; V541-R545 VanDerWaalsContact O-CG 3.27Å; V541-R545 WeakPolarHBondContact O-CG 3.34Å; V541-R545 PolarHBondContact O-N 2.97Å; A542-R545 CarbonylContact O-C 3.55Å; A542-R545 PolarHBondContact O-N 3.5Å; T543-R545 PolarHBondContact O-N 2.04Å; R545-Y547 HydrophobicContact CB-CD2 3.61Å; R545-Y547 HydrophobicContact CB-CE2 3.83Å; R545-L714 VanDerWaalsContact NH1-C 3.32Å; R545-L714 PolarHBondContact NH1-O 3.39Å; R545-P715 WeakPolarHBondContact CD-O 3.34Å; R545-P715 PolarHBondContact NH1-O 3.02Å
546	S	88.1	Confident	93.4	Very high	58 Å²	58	56 Å²	56	41%	0.406	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	68.8	27.8	-179.4	-46.7	0	0	0	0	114.8	A542 T543 R544 I548 K717	A542-S546 PolarHBondContact O-N 2.97Å; A542-S546 VanDerWaalsContact O-N 3.12Å; T543-S546 PolarHBondContact O-N 3.24Å; R544-S546 VanDerWaalsContact C-N 3.33Å; S546-I548 PolarHBondContact O-N 2.91Å; S546-K717 PolarHBondContact OG-NZ 3.12Å
547	Y	89.8	Confident	93.4	Very high	39 Å²	39	52.2 Å²	52.2	15%	0.153	26%	0.264	C	S	.	.			trans	-93.2	71.3	170.6	-68.3	-69.5	0	0	0	110.2	A542 R545 E550 A551 L714 P715	A542-Y547 PolarHBondContact O-N 3.4Å; R545-Y547 HydrophobicContact CB-CD2 3.61Å; R545-Y547 HydrophobicContact CB-CE2 3.83Å; Y547-E550 VanDerWaalsContact CA-OE2 3.27Å; Y547-E550 WeakPolarHBondContact CA-OE2 3.22Å; Y547-E550 VanDerWaalsContact CB-OE2 3.29Å; Y547-E550 WeakPolarHBondContact CB-OE2 3.35Å; Y547-A551 WeakPolarHBondContact O-CB 3Å; Y547-A551 PolarHBondContact O-N 3.12Å; Y547-A551 VanDerWaalsContact O-N 3.09Å; Y547-L714 HydrophobicContact CD2-CD2 4.23Å; Y547-P715 HydrophobicContact CE2-CG 4.44Å; Y547-P715 WeakPolarHBondContact CE2-O 3.35Å
548	I	90.3	Very high	93.5	Very high	86 Å²	86	50.2 Å²	50.2	44%	0.441	25%	0.249	S	C	.	.	H	α-helix	trans	-70.5	-42.4	-170.8	-57.1	-58	0	0	0	112.1	T543 S546 E550 A551 F552	T543-I548 HydrophobicContact CG2-CD1 4.47Å; S546-I548 PolarHBondContact O-N 2.91Å; I548-E550 VanDerWaalsContact C-N 3.3Å; I548-E550 PolarHBondContact O-N 3.4Å; I548-A551 WeakPolarHBondContact O-CB 3.34Å; I548-A551 PolarHBondContact O-N 3.18Å; I548-F552 HydrophobicContact CG2-CD2 3.89Å; I548-F552 HydrophobicContact CG2-CE2 3.66Å; I548-F552 VanDerWaalsContact O-CD2 3.28Å; I548-F552 WeakPolarHBondContact O-CD2 3.02Å; I548-F552 PolarHBondContact O-N 3.46Å; I548-F552 VanDerWaalsContact O-N 3.13Å
549	T	91.1	Very high	93.7	Very high	60 Å²	60	54.5 Å²	54.5	37%	0.368	27%	0.268	S	S	.	.	H	α-helix	trans	-60.3	-44.4	179.4	-52.4	0	0	0	0	111	F552 V553 Y611 F614	T549-F552 PolarHBondContact O-N 3.25Å; T549-V553 WeakPolarHBondContact O-CG2 3.39Å; T549-V553 PolarHBondContact O-N 2.97Å; T549-Y611 HydrophobicContact CG2-CE1 4.41Å; T549-F614 HydrophobicContact CG2-CD2 4.06Å; T549-F614 HydrophobicContact CG2-CE2 4.33Å
550	E	93.2	Very high	93.7	Very high	0 Å²	0	55.2 Å²	55.2	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-66.6	-40.4	179.2	-58.3	81.1	175.5	0	0	111	Y547 I548 F552 V553 Y554 V597 C601 K610 F614	Y547-E550 VanDerWaalsContact CA-OE2 3.27Å; Y547-E550 WeakPolarHBondContact CA-OE2 3.22Å; Y547-E550 VanDerWaalsContact CB-OE2 3.29Å; Y547-E550 WeakPolarHBondContact CB-OE2 3.35Å; I548-E550 VanDerWaalsContact C-N 3.3Å; I548-E550 PolarHBondContact O-N 3.4Å; E550-F552 VanDerWaalsContact C-N 3.3Å; E550-F552 PolarHBondContact O-N 2.92Å; E550-V553 PolarHBondContact O-N 3.33Å; E550-V553 VanDerWaalsContact O-N 3.15Å; E550-Y554 HydrophobicContact CB-CE2 4.03Å; E550-Y554 VanDerWaalsContact O-CD2 3.24Å; E550-Y554 WeakPolarHBondContact O-CD2 3.41Å; E550-Y554 VanDerWaalsContact O-CG 3.25Å; E550-Y554 PolarHBondContact O-N 3.44Å; E550-V597 HydrophobicContact CB-CG2 4.48Å; E550-V597 HydrophobicContact CG-CB 4.4Å; E550-V597 HydrophobicContact CG-CG2 4.35Å; E550-C601 VanDerWaalsContact CG-SG 3.57Å; E550-C601 PolarHBondContact OE1-SG 3.35Å; E550-K610 IonicContact OE1-NZ 3.48Å; E550-K610 PolarHBondContact OE1-NZ 2.75Å; E550-F614 HydrophobicContact CG-CE2 4.1Å; E550-F614 HydrophobicContact CG-CZ 4.28Å; E550-F614 WeakPolarHBondContact OE1-CE2 3.34Å; E550-F614 WeakPolarHBondContact OE1-CZ 3.41Å
551	A	94.9	Very high	93.8	Very high	8 Å²	8	51.9 Å²	51.9	7%	0.066	25%	0.25	C	S	.	.	H	α-helix	trans	-59.1	-38.8	175.1	0	0	0	0	0	112.7	A542 Y547 I548 Y554 L555	A542-A551 HydrophobicContact CB-CB 3.94Å; Y547-A551 WeakPolarHBondContact O-CB 3Å; Y547-A551 PolarHBondContact O-N 3.12Å; Y547-A551 VanDerWaalsContact O-N 3.09Å; I548-A551 WeakPolarHBondContact O-CB 3.34Å; I548-A551 PolarHBondContact O-N 3.18Å; A551-Y554 PolarHBondContact O-N 3.42Å; A551-L555 WeakPolarHBondContact O-CB 3.03Å; A551-L555 PolarHBondContact O-N 3.04Å
552	F	95.9	Very high	93.9	Very high	139 Å²	139	51.8 Å²	51.8	61%	0.61	25%	0.25	S	C	*	.	H	α-helix	trans	-67.9	-36.7	174.9	-83.2	-71.7	0	0	0	112.9	I548 T549 E550 L555 F556	I548-F552 HydrophobicContact CG2-CD2 3.89Å; I548-F552 HydrophobicContact CG2-CE2 3.66Å; I548-F552 VanDerWaalsContact O-CD2 3.28Å; I548-F552 WeakPolarHBondContact O-CD2 3.02Å; I548-F552 PolarHBondContact O-N 3.46Å; I548-F552 VanDerWaalsContact O-N 3.13Å; T549-F552 PolarHBondContact O-N 3.25Å; E550-F552 VanDerWaalsContact C-N 3.3Å; E550-F552 PolarHBondContact O-N 2.92Å; F552-L555 HydrophobicContact CD1-CD2 4.48Å; F552-L555 PolarHBondContact O-N 2.63Å; F552-F556 WeakPolarHBondContact O-CB 3.5Å; F552-F556 PolarHBondContact O-N 3.5Å
553	V	96.1	Very high	94	Very high	31 Å²	31	54.4 Å²	54.4	19%	0.188	26%	0.261	C	S	.	.	H	α-helix	trans	-65.9	-40.9	175.6	177	0	0	0	0	111	T549 E550 F556 T557 C593 V597	T549-V553 WeakPolarHBondContact O-CG2 3.39Å; T549-V553 PolarHBondContact O-N 2.97Å; E550-V553 PolarHBondContact O-N 3.33Å; E550-V553 VanDerWaalsContact O-N 3.15Å; V553-F556 PolarHBondContact O-N 3.18Å; V553-T557 PolarHBondContact O-N 3.31Å; V553-T557 PolarHBondContact O-OG1 3.35Å; V553-C593 HydrophobicContact CG1-CB 3.92Å; V553-V597 HydrophobicContact CB-CG2 4.3Å; V553-V597 HydrophobicContact CG1-CG2 4.12Å; V553-V597 HydrophobicContact CG2-CG1 4.46Å
554	Y	96.6	Very high	94	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-66.8	-38.8	175.1	-54.4	-31.2	0	0	0	112.1	A538 A542 E550 A551 T557 M558 V597 T598 V710 L714	A538-Y554 HydrophobicContact CB-CD2 4.37Å; A542-Y554 HydrophobicContact CB-CD2 4.25Å; A542-Y554 HydrophobicContact CB-CE2 4Å; E550-Y554 HydrophobicContact CB-CE2 4.03Å; E550-Y554 VanDerWaalsContact O-CD2 3.24Å; E550-Y554 WeakPolarHBondContact O-CD2 3.41Å; E550-Y554 VanDerWaalsContact O-CG 3.25Å; E550-Y554 PolarHBondContact O-N 3.44Å; A551-Y554 PolarHBondContact O-N 3.42Å; Y554-T557 PolarHBondContact O-N 2.93Å; Y554-M558 WeakPolarHBondContact O-CB 3.49Å; Y554-M558 PolarHBondContact O-N 3.21Å; Y554-V597 HydrophobicContact CE1-CG2 4.15Å; Y554-T598 PolarHBondContact OH-OG1 3.04Å; Y554-V710 HydrophobicContact CD2-CG1 4.38Å; Y554-V710 HydrophobicContact CE1-CG1 3.93Å; Y554-V710 HydrophobicContact CE2-CG1 3.7Å; Y554-V710 VanDerWaalsContact CZ-CG1 3.45Å; Y554-L714 HydrophobicContact CE2-CD1 4.21Å
555	L	97.1	Very high	94.1	Very high	76 Å²	76	41.6 Å²	41.6	40%	0.398	21%	0.205	S	C	.	.	H	α-helix	trans	-63.4	-44.2	174.7	-179	65.2	0	0	0	111.7	I539 A551 F552 T557 M558 F559	I539-L555 HydrophobicContact CD1-CB 4.21Å; I539-L555 HydrophobicContact CD1-CD1 4.25Å; A551-L555 WeakPolarHBondContact O-CB 3.03Å; A551-L555 PolarHBondContact O-N 3.04Å; F552-L555 HydrophobicContact CD1-CD2 4.48Å; F552-L555 PolarHBondContact O-N 2.63Å; L555-T557 VanDerWaalsContact C-N 3.35Å; L555-M558 HydrophobicContact CD1-CE 3.81Å; L555-M558 PolarHBondContact O-N 2.72Å; L555-F559 WeakPolarHBondContact O-CB 3.36Å; L555-F559 PolarHBondContact O-N 3.08Å
556	F	96.4	Very high	94.2	Very high	74 Å²	74	39.3 Å²	39.3	33%	0.325	20%	0.198	S	C	.	.	H	α-helix	trans	-57.3	-48.9	174.8	176.8	-85.2	0	0	0	111	F552 V553 F559 F560 C586	F552-F556 WeakPolarHBondContact O-CB 3.5Å; F552-F556 PolarHBondContact O-N 3.5Å; V553-F556 PolarHBondContact O-N 3.18Å; F556-F559 PolarHBondContact O-N 2.82Å; F556-F560 HydrophobicContact CD1-CD2 4.11Å; F556-F560 AromaticContact CD2-CD2 3.6Å; F556-F560 HydrophobicContact CD2-CD2 3.6Å; F556-F560 AromaticContact CD2-CE2 3.5Å; F556-F560 HydrophobicContact CD2-CE2 3.5Å; F556-F560 VanDerWaalsContact CD2-CE2 3.5Å; F556-F560 AromaticContact CE1-CD2 3.91Å; F556-F560 HydrophobicContact CE1-CD2 3.91Å; F556-F560 AromaticContact CE2-CD2 3.39Å; F556-F560 HydrophobicContact CE2-CD2 3.39Å; F556-F560 AromaticContact CE2-CE2 3.18Å; F556-F560 HydrophobicContact CE2-CE2 3.18Å; F556-F560 HydrophobicContact CE2-CZ 4.18Å; F556-F560 AromaticContact CG-CD2 3.95Å; F556-F560 HydrophobicContact CG-CD2 3.95Å; F556-F560 HydrophobicContact CG-CE2 4.31Å; F556-F560 AromaticContact CZ-CD2 3.54Å; F556-F560 HydrophobicContact CZ-CD2 3.54Å; F556-F560 AromaticContact CZ-CE2 3.77Å; F556-F560 HydrophobicContact CZ-CE2 3.77Å; F556-F560 HydrophobicContact CZ-CG 4.34Å; F556-F560 WeakPolarHBondContact O-CD2 3.21Å; F556-F560 PolarHBondContact O-N 2.97Å; F556-C586 HydrophobicContact CE1-CB 4.34Å; F556-C586 WeakPolarHBondContact CE1-O 3.19Å; F556-C586 HydrophobicContact CZ-CB 4.01Å
557	T	96	Very high	94.3	Very high	0 Å²	0	37 Å²	37	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-61	-49.8	179.8	-54	0	0	0	0	111.3	F535 V553 Y554 L555 F559 S561 G590 S594	F535-T557 HydrophobicContact CE2-CG2 4.19Å; F535-T557 HydrophobicContact CZ-CG2 4.02Å; V553-T557 PolarHBondContact O-N 3.31Å; V553-T557 PolarHBondContact O-OG1 3.35Å; Y554-T557 PolarHBondContact O-N 2.93Å; L555-T557 VanDerWaalsContact C-N 3.35Å; T557-F559 VanDerWaalsContact C-N 3.34Å; T557-F559 PolarHBondContact O-N 2.89Å; T557-S561 WeakPolarHBondContact O-CB 3.46Å; T557-S561 PolarHBondContact O-N 2.98Å; T557-G590 WeakPolarHBondContact OG1-CA 3.47Å; T557-G590 PolarHBondContact OG1-O 3.14Å; T557-S594 PolarHBondContact OG1-OG 2.7Å
558	M	97	Very high	94.1	Very high	23 Å²	23	37.1 Å²	37.1	11%	0.113	19%	0.185	C	C	.	.	H	α-helix	trans	-56.2	-47.9	177.6	-176.5	-171.1	81.7	0	0	111.7	N532 L533 F535 L536 I539 Y554 L555 T562	N532-M558 WeakPolarHBondContact O-CG 3.26Å; L533-M558 HydrophobicContact CD2-SD 4.26Å; F535-M558 HydrophobicContact CB-CB 3.93Å; F535-M558 HydrophobicContact CB-CG 4.18Å; F535-M558 HydrophobicContact CB-SD 4.41Å; F535-M558 HydrophobicContact CG-CB 4.46Å; L536-M558 HydrophobicContact CD2-CE 4.13Å; L536-M558 HydrophobicContact CD2-SD 3.68Å; L536-M558 HydrophobicContact CG-SD 3.8Å; I539-M558 HydrophobicContact CD1-SD 4.03Å; Y554-M558 WeakPolarHBondContact O-CB 3.49Å; Y554-M558 PolarHBondContact O-N 3.21Å; L555-M558 HydrophobicContact CD1-CE 3.81Å; L555-M558 PolarHBondContact O-N 2.72Å; M558-T562 VanDerWaalsContact O-CB 3.3Å; M558-T562 WeakPolarHBondContact O-CB 3.3Å; M558-T562 PolarHBondContact O-N 3.15Å; M558-T562 VanDerWaalsContact O-N 3.13Å; M558-T562 PolarHBondContact O-OG1 3.48Å
559	F	96.3	Very high	93.8	Very high	90 Å²	90	33.8 Å²	33.8	40%	0.395	17%	0.168	S	C	.	.	H	α-helix	trans	-63.3	-57.4	-178.2	179.9	-89.7	0	0	0	111.5	L555 F556 T557 S561 T562 F563 I577	L555-F559 WeakPolarHBondContact O-CB 3.36Å; L555-F559 PolarHBondContact O-N 3.08Å; F556-F559 PolarHBondContact O-N 2.82Å; T557-F559 VanDerWaalsContact C-N 3.34Å; T557-F559 PolarHBondContact O-N 2.89Å; F559-S561 PolarHBondContact O-N 3.28Å; F559-T562 PolarHBondContact O-N 2.94Å; F559-F563 HydrophobicContact CD1-CD2 4.15Å; F559-F563 HydrophobicContact CD2-CD2 4.03Å; F559-F563 AromaticContact CD2-CE2 3.69Å; F559-F563 HydrophobicContact CD2-CE2 3.69Å; F559-F563 AromaticContact CE1-CD2 3.93Å; F559-F563 HydrophobicContact CE1-CD2 3.93Å; F559-F563 HydrophobicContact CE1-CE2 4.28Å; F559-F563 AromaticContact CE2-CD2 3.82Å; F559-F563 HydrophobicContact CE2-CD2 3.82Å; F559-F563 AromaticContact CE2-CE2 3.32Å; F559-F563 HydrophobicContact CE2-CE2 3.32Å; F559-F563 HydrophobicContact CE2-CZ 4.31Å; F559-F563 HydrophobicContact CG-CD2 4.19Å; F559-F563 HydrophobicContact CG-CE2 4.31Å; F559-F563 AromaticContact CZ-CD2 3.76Å; F559-F563 HydrophobicContact CZ-CD2 3.76Å; F559-F563 AromaticContact CZ-CE2 3.65Å; F559-F563 HydrophobicContact CZ-CE2 3.65Å; F559-F563 VanDerWaalsContact O-CD2 3.24Å; F559-F563 WeakPolarHBondContact O-CD2 3.25Å; F559-F563 PolarHBondContact O-N 3.07Å; F559-F563 VanDerWaalsContact O-N 3.15Å; F559-I577 HydrophobicContact CE1-CD1 3.93Å; F559-I577 HydrophobicContact CZ-CD1 3.91Å
560	F	96.4	Very high	92.8	Very high	39 Å²	39	33.2 Å²	33.2	17%	0.171	17%	0.165	C	C	.	.	H	α-helix	trans	-70.2	-34.6	-174	-77.8	-73.8	0	0	0	113	F556 F563 Y564 M578 L583 C586	F556-F560 HydrophobicContact CD1-CD2 4.11Å; F556-F560 AromaticContact CD2-CD2 3.6Å; F556-F560 HydrophobicContact CD2-CD2 3.6Å; F556-F560 AromaticContact CD2-CE2 3.5Å; F556-F560 HydrophobicContact CD2-CE2 3.5Å; F556-F560 VanDerWaalsContact CD2-CE2 3.5Å; F556-F560 AromaticContact CE1-CD2 3.91Å; F556-F560 HydrophobicContact CE1-CD2 3.91Å; F556-F560 AromaticContact CE2-CD2 3.39Å; F556-F560 HydrophobicContact CE2-CD2 3.39Å; F556-F560 AromaticContact CE2-CE2 3.18Å; F556-F560 HydrophobicContact CE2-CE2 3.18Å; F556-F560 HydrophobicContact CE2-CZ 4.18Å; F556-F560 AromaticContact CG-CD2 3.95Å; F556-F560 HydrophobicContact CG-CD2 3.95Å; F556-F560 HydrophobicContact CG-CE2 4.31Å; F556-F560 AromaticContact CZ-CD2 3.54Å; F556-F560 HydrophobicContact CZ-CD2 3.54Å; F556-F560 AromaticContact CZ-CE2 3.77Å; F556-F560 HydrophobicContact CZ-CE2 3.77Å; F556-F560 HydrophobicContact CZ-CG 4.34Å; F556-F560 WeakPolarHBondContact O-CD2 3.21Å; F556-F560 PolarHBondContact O-N 2.97Å; F560-F563 PolarHBondContact O-N 3.44Å; F560-Y564 WeakPolarHBondContact O-CB 3.08Å; F560-Y564 PolarHBondContact O-N 3.41Å; F560-M578 HydrophobicContact CE1-CE 3.96Å; F560-L583 HydrophobicContact CD1-CD2 4.08Å; F560-C586 HydrophobicContact CB-CB 3.64Å; F560-C586 HydrophobicContact CD1-CB 3.56Å; F560-C586 HydrophobicContact CD2-CB 4.13Å; F560-C586 HydrophobicContact CE1-CB 4.23Å; F560-C586 HydrophobicContact CG-CB 3.49Å; F560-C586 VanDerWaalsContact CG-CB 3.49Å
561	S	95.1	Very high	91.9	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-64.7	-42.2	174.4	-167.7	0	0	0	0	112.1	N532 T557 F559 F563 Y564 H565 D587	N532-S561 PolarHBondContact ND2-OG 3.22Å; N532-S561 VanDerWaalsContact OD1-CB 3.24Å; N532-S561 WeakPolarHBondContact OD1-CB 3.18Å; N532-S561 PolarHBondContact OD1-OG 2.85Å; T557-S561 WeakPolarHBondContact O-CB 3.46Å; T557-S561 PolarHBondContact O-N 2.98Å; F559-S561 PolarHBondContact O-N 3.28Å; S561-F563 PolarHBondContact O-N 3.32Å; S561-Y564 PolarHBondContact O-N 2.98Å; S561-H565 PolarHBondContact O-CD2 2.89Å; S561-H565 PolarHBondContact O-N 3.47Å; S561-D587 WeakPolarHBondContact CA-OD1 3.36Å; S561-D587 WeakPolarHBondContact CB-OD1 3.38Å; S561-D587 PolarHBondContact OG-OD1 3.5Å
562	T	95.1	Very high	90.6	Very high	28 Å²	28	38 Å²	38	17%	0.172	21%	0.207	C	C	.	.	H	α-helix	trans	-59.6	-50.9	176.4	-57.5	0	0	0	0	111.1	T529 N532 M558 F559 H565 A566	T529-T562 HydrophobicContact CG2-CG2 4.37Å; T529-T562 WeakPolarHBondContact CG2-O 3.5Å; N532-T562 WeakPolarHBondContact CB-OG1 3.38Å; M558-T562 VanDerWaalsContact O-CB 3.3Å; M558-T562 WeakPolarHBondContact O-CB 3.3Å; M558-T562 PolarHBondContact O-N 3.15Å; M558-T562 VanDerWaalsContact O-N 3.13Å; M558-T562 PolarHBondContact O-OG1 3.48Å; F559-T562 PolarHBondContact O-N 2.94Å; T562-H565 PolarHBondContact O-N 3.32Å; T562-A566 WeakPolarHBondContact O-CB 3.24Å; T562-A566 PolarHBondContact O-N 3.36Å
563	F	94.3	Very high	89.5	Confident	55 Å²	55	32.3 Å²	32.3	24%	0.241	19%	0.186	C	C	.	.	H	α-helix	trans	-74.1	-28.7	-178	-74.5	-71.6	0	0	0	113.4	F559 F560 S561 A566 C567 I577 L583	F559-F563 HydrophobicContact CD1-CD2 4.15Å; F559-F563 HydrophobicContact CD2-CD2 4.03Å; F559-F563 AromaticContact CD2-CE2 3.69Å; F559-F563 HydrophobicContact CD2-CE2 3.69Å; F559-F563 AromaticContact CE1-CD2 3.93Å; F559-F563 HydrophobicContact CE1-CD2 3.93Å; F559-F563 HydrophobicContact CE1-CE2 4.28Å; F559-F563 AromaticContact CE2-CD2 3.82Å; F559-F563 HydrophobicContact CE2-CD2 3.82Å; F559-F563 AromaticContact CE2-CE2 3.32Å; F559-F563 HydrophobicContact CE2-CE2 3.32Å; F559-F563 HydrophobicContact CE2-CZ 4.31Å; F559-F563 HydrophobicContact CG-CD2 4.19Å; F559-F563 HydrophobicContact CG-CE2 4.31Å; F559-F563 AromaticContact CZ-CD2 3.76Å; F559-F563 HydrophobicContact CZ-CD2 3.76Å; F559-F563 AromaticContact CZ-CE2 3.65Å; F559-F563 HydrophobicContact CZ-CE2 3.65Å; F559-F563 VanDerWaalsContact O-CD2 3.24Å; F559-F563 WeakPolarHBondContact O-CD2 3.25Å; F559-F563 PolarHBondContact O-N 3.07Å; F559-F563 VanDerWaalsContact O-N 3.15Å; F560-F563 PolarHBondContact O-N 3.44Å; S561-F563 PolarHBondContact O-N 3.32Å; F563-A566 PolarHBondContact O-N 2.85Å; F563-C567 WeakPolarHBondContact O-CB 3.49Å; F563-C567 PolarHBondContact O-N 3.49Å; F563-I577 HydrophobicContact CB-CD1 3.82Å; F563-I577 HydrophobicContact CB-CG1 4.03Å; F563-I577 HydrophobicContact CD1-CD1 3.99Å; F563-I577 HydrophobicContact CD1-CG1 4.2Å; F563-I577 HydrophobicContact CD1-CG2 3.6Å; F563-I577 HydrophobicContact CD2-CD1 3.82Å; F563-I577 HydrophobicContact CE1-CG2 3.8Å; F563-I577 HydrophobicContact CE2-CD1 4.43Å; F563-I577 HydrophobicContact CG-CD1 3.59Å; F563-I577 HydrophobicContact CG-CG1 4.09Å; F563-I577 HydrophobicContact CG-CG2 4.33Å; F563-L583 HydrophobicContact CB-CD2 4.11Å
564	Y	93.6	Very high	88.8	Confident	11 Å²	11	34.3 Å²	34.3	4%	0.043	20%	0.198	C	C	.	.	H	α-helix	trans	-60.4	-52.9	170.2	167.7	-116.7	0	0	0	110.9	F560 S561 A566 C567 D568 Y580 L583 Q584 D587	F560-Y564 WeakPolarHBondContact O-CB 3.08Å; F560-Y564 PolarHBondContact O-N 3.41Å; S561-Y564 PolarHBondContact O-N 2.98Å; Y564-A566 VanDerWaalsContact C-N 3.28Å; Y564-A566 PolarHBondContact O-N 3.28Å; Y564-C567 CarbonylContact O-C 3.54Å; Y564-C567 WeakPolarHBondContact O-CA 3.08Å; Y564-C567 WeakPolarHBondContact O-CB 3.06Å; Y564-C567 PolarHBondContact O-N 2.97Å; Y564-D568 HydrophobicContact CE2-CB 4.26Å; Y564-D568 WeakPolarHBondContact O-CB 3.49Å; Y564-D568 PolarHBondContact O-N 2.97Å; Y564-Y580 AromaticContact CE2-CE2 3.86Å; Y564-Y580 HydrophobicContact CE2-CE2 3.86Å; Y564-Y580 AromaticContact CE2-CZ 3.88Å; Y564-Y580 PolarHBondContact OH-OH 3.21Å; Y564-L583 HydrophobicContact CD2-CB 4.24Å; Y564-Q584 VanDerWaalsContact CD2-CA 3.46Å; Y564-Q584 HydrophobicContact CD2-CB 3.8Å; Y564-Q584 HydrophobicContact CD2-CG 4.4Å; Y564-Q584 HydrophobicContact CE2-CB 3.42Å; Y564-Q584 VanDerWaalsContact CE2-CB 3.42Å; Y564-Q584 HydrophobicContact CE2-CG 3.64Å; Y564-Q584 PolarHBondContact OH-NE2 3.07Å; Y564-D587 HydrophobicContact CD1-CB 3.78Å; Y564-D587 VanDerWaalsContact CD1-OD2 3.29Å; Y564-D587 WeakPolarHBondContact CD1-OD2 3.35Å; Y564-D587 HydrophobicContact CG-CB 3.96Å
565	H	92.7	Very high	88.3	Confident	0 Å²	0	39.1 Å²	39.1	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-69.8	-24.1	179.8	-70.1	-57.8	0	0	0	113.8	L528 T529 S561 T562 C567 Q569 Y695 H699 H703	L528-H565 HydrophobicContact CB-CB 3.79Å; T529-H565 HydrophobicContact CG2-CB 4.4Å; S561-H565 PolarHBondContact O-CD2 2.89Å; S561-H565 PolarHBondContact O-N 3.47Å; T562-H565 PolarHBondContact O-N 3.32Å; H565-C567 VanDerWaalsContact C-N 3.3Å; H565-Q569 WeakPolarHBondContact O-CG 3.46Å; H565-Y695 PolarHBondContact CE1-OH 3.09Å; H565-H699 AromaticContact CE1-CD2 3.62Å; H565-H699 AromaticContact CE1-NE2 3.6Å; H565-H699 AromaticContact NE2-CD2 3.71Å; H565-H699 AromaticContact NE2-NE2 3.62Å; H565-H703 AromaticContact CD2-CE1 3.5Å; H565-H703 PolarHBondContact CD2-CE1 3.42Å; H565-H703 VanDerWaalsContact CD2-CE1 3.5Å; H565-H703 AromaticContact CD2-NE2 3.98Å; H565-H703 AromaticContact NE2-CE1 3.28Å; H565-H703 PolarHBondContact NE2-CE1 3.02Å; H565-H703 VanDerWaalsContact NE2-CE1 3.28Å; H565-H703 AromaticContact NE2-NE2 3.4Å; H565-H703 PolarHBondContact NE2-NE2 3.28Å
566	A	91.5	Very high	87.9	Confident	9 Å²	9	38.7 Å²	38.7	7%	0.074	23%	0.226	C	C	.	.	H	α-helix	trans	-67.2	-33.3	168.3	0	0	0	0	0	112	T529 T562 F563 Y564 L575	T529-A566 HydrophobicContact CG2-CB 3.89Å; T562-A566 WeakPolarHBondContact O-CB 3.24Å; T562-A566 PolarHBondContact O-N 3.36Å; F563-A566 PolarHBondContact O-N 2.85Å; Y564-A566 VanDerWaalsContact C-N 3.28Å; Y564-A566 PolarHBondContact O-N 3.28Å; A566-L575 CarbonylContact C-O 3.55Å; A566-L575 HydrophobicContact CB-CB 4.25Å; A566-L575 PolarHBondContact O-N 3.35Å
567	C	90	Very high	87.7	Confident	8 Å²	8	39.2 Å²	39.2	5%	0.054	23%	0.231	C	C	.	.	H	α-helix	trans	-84.2	-26.5	178.9	-176.5	0	0	0	0	113.4	F563 Y564 H565 Q569 V574 L575 C576 L583	F563-C567 WeakPolarHBondContact O-CB 3.49Å; F563-C567 PolarHBondContact O-N 3.49Å; Y564-C567 CarbonylContact O-C 3.54Å; Y564-C567 WeakPolarHBondContact O-CA 3.08Å; Y564-C567 WeakPolarHBondContact O-CB 3.06Å; Y564-C567 PolarHBondContact O-N 2.97Å; H565-C567 VanDerWaalsContact C-N 3.3Å; C567-Q569 VanDerWaalsContact C-N 3.33Å; C567-Q569 PolarHBondContact O-N 3.21Å; C567-V574 WeakPolarHBondContact O-CG2 3.36Å; C567-L575 WeakPolarHBondContact CA-O 3.22Å; C567-L575 WeakPolarHBondContact CB-O 3.43Å; C567-L575 PolarHBondContact N-O 3.45Å; C567-C576 WeakPolarHBondContact CA-SG 3.37Å; C567-C576 HydrophobicContact CB-CB 3.88Å; C567-C576 WeakPolarHBondContact CB-SG 3.25Å; C567-C576 WeakPolarHBondContact SG-CB 3.37Å; C567-C576 CovalentContact SG-SG 2.03Å; C567-C576 PolarHBondContact SG-SG 2.03Å; C567-L583 HydrophobicContact CB-CD1 3.77Å
568	D	86.9	Confident	87.5	Confident	42 Å²	42	43 Å²	43	23%	0.225	25%	0.25	C	C	.	.	H	α-helix	trans	-79	-12.9	-178	-168.1	55.4	0	0	0	113.6	Y564 Y580	Y564-D568 HydrophobicContact CE2-CB 4.26Å; Y564-D568 WeakPolarHBondContact O-CB 3.49Å; Y564-D568 PolarHBondContact O-N 2.97Å; D568-Y580 HydrophobicContact CB-CE2 4.04Å; D568-Y580 VanDerWaalsContact OD1-CE2 3.25Å; D568-Y580 WeakPolarHBondContact OD1-CE2 3.12Å; D568-Y580 PolarHBondContact OD1-OH 2.75Å
569	Q	84.3	Confident	87.1	Confident	17 Å²	17	48.1 Å²	48.1	8%	0.079	28%	0.277	C	S	.	.	S	Bend	trans	-80.6	127.3	179.1	-67.4	-57.4	-66.5	0	0	111.8	T525 L528 H565 C567 V574	T525-Q569 HydrophobicContact CG2-CG 4.2Å; T525-Q569 WeakPolarHBondContact OG1-CB 3.44Å; T525-Q569 WeakPolarHBondContact OG1-CG 3.33Å; L528-Q569 VanDerWaalsContact CD1-NE2 3.25Å; H565-Q569 WeakPolarHBondContact O-CG 3.46Å; C567-Q569 VanDerWaalsContact C-N 3.33Å; C567-Q569 PolarHBondContact O-N 3.21Å; Q569-V574 VanDerWaalsContact O-CB 3.3Å; Q569-V574 WeakPolarHBondContact O-CB 3.42Å; Q569-V574 WeakPolarHBondContact O-CG2 3.38Å
570	P	69.9	Low	86.7	Confident	48 Å²	48	47.9 Å²	47.9	31%	0.312	27%	0.274	S	S	.	.			trans	-79.9	150.5	-178.2	32.9	-36	0	0	0	112.2	Q521	Q521-P570 PolarHBondContact OE1-O 2.79Å
571	G	72.8	Confident	86.3	Confident	26 Å²	26	51 Å²	51	27%	0.268	29%	0.293	S	S	.	.	S	Bend	trans	94.4	-146.9	173.9	0	0	0	0	0	114	A573 V574	G571-A573 VanDerWaalsContact C-N 3.27Å; G571-A573 PolarHBondContact O-N 3.37Å; G571-V574 WeakPolarHBondContact O-CG1 3.49Å
572	A	68.9	Low	86.1	Confident	83 Å²	83	52.5 Å²	52.5	69%	0.686	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.9	-10.5	-169.9	0	0	0	0	0	114.5	Y518	Y518-A572 HydrophobicContact CD2-CB 4.27Å; Y518-A572 HydrophobicContact CE2-CB 4.06Å
573	A	71.7	Confident	86.1	Confident	19 Å²	19	51.2 Å²	51.2	16%	0.157	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.7	9.7	-178.3	0	0	0	0	0	113.6	G571	G571-A573 VanDerWaalsContact C-N 3.27Å; G571-A573 PolarHBondContact O-N 3.37Å
574	V	82.1	Confident	86	Confident	72 Å²	72	49.1 Å²	49.1	44%	0.436	29%	0.289	S	S	.	.			trans	-73.9	135.1	-179.8	71.5	0	0	0	0	111.6	C567 Q569 G571	C567-V574 WeakPolarHBondContact O-CG2 3.36Å; Q569-V574 VanDerWaalsContact O-CB 3.3Å; Q569-V574 WeakPolarHBondContact O-CB 3.42Å; Q569-V574 WeakPolarHBondContact O-CG2 3.38Å; G571-V574 WeakPolarHBondContact O-CG1 3.49Å
575	L	86.1	Confident	86	Confident	101 Å²	101	50.9 Å²	50.9	53%	0.529	30%	0.296	S	S	.	.			trans	-142.3	106	173.2	-178.6	71.1	0	0	0	110.8	A566 C567	A566-L575 CarbonylContact C-O 3.55Å; A566-L575 HydrophobicContact CB-CB 4.25Å; A566-L575 PolarHBondContact O-N 3.35Å; C567-L575 WeakPolarHBondContact CA-O 3.22Å; C567-L575 WeakPolarHBondContact CB-O 3.43Å; C567-L575 PolarHBondContact N-O 3.45Å
576	C	89	Confident	86	Confident	68 Å²	68	51.7 Å²	51.7	46%	0.459	30%	0.301	S	S	.	.			trans	-108.6	117.6	177	-56.9	0	0	0	0	110.5	C567	C567-C576 WeakPolarHBondContact CA-SG 3.37Å; C567-C576 HydrophobicContact CB-CB 3.88Å; C567-C576 WeakPolarHBondContact CB-SG 3.25Å; C567-C576 WeakPolarHBondContact SG-CB 3.37Å; C567-C576 CovalentContact SG-SG 2.03Å; C567-C576 PolarHBondContact SG-SG 2.03Å
577	I	92.9	Very high	86.1	Confident	84 Å²	84	51.6 Å²	51.6	43%	0.431	30%	0.299	S	S	.	.	S	Bend	trans	-85.5	-15.7	174.4	62.9	166.7	0	0	0	113	F559 F563 L583	F559-I577 HydrophobicContact CE1-CD1 3.93Å; F559-I577 HydrophobicContact CZ-CD1 3.91Å; F563-I577 HydrophobicContact CB-CD1 3.82Å; F563-I577 HydrophobicContact CB-CG1 4.03Å; F563-I577 HydrophobicContact CD1-CD1 3.99Å; F563-I577 HydrophobicContact CD1-CG1 4.2Å; F563-I577 HydrophobicContact CD1-CG2 3.6Å; F563-I577 HydrophobicContact CD2-CD1 3.82Å; F563-I577 HydrophobicContact CE1-CG2 3.8Å; F563-I577 HydrophobicContact CE2-CD1 4.43Å; F563-I577 HydrophobicContact CG-CD1 3.59Å; F563-I577 HydrophobicContact CG-CG1 4.09Å; F563-I577 HydrophobicContact CG-CG2 4.33Å; I577-L583 HydrophobicContact CD1-CD2 4.35Å; I577-L583 HydrophobicContact CG1-CD1 4.43Å; I577-L583 HydrophobicContact CG1-CD2 4.01Å
578	M	90.1	Very high	86.2	Confident	81 Å²	81	53.1 Å²	53.1	40%	0.399	31%	0.305	S	S	.	.	S	Bend	trans	-157	168.5	-175.6	-176.4	170.1	63	0	0	108	F560 Y580 A582 L583	F560-M578 HydrophobicContact CE1-CE 3.96Å; M578-Y580 PolarHBondContact O-N 3.33Å; M578-A582 HydrophobicContact CE-CB 3.64Å; M578-A582 HydrophobicContact CG-CB 4.19Å; M578-A582 HydrophobicContact SD-CB 4.07Å; M578-L583 HydrophobicContact CB-CD2 4.36Å; M578-L583 HydrophobicContact CB-CG 4.19Å; M578-L583 HydrophobicContact CE-CD2 4.04Å; M578-L583 HydrophobicContact CE-CG 4.27Å; M578-L583 WeakPolarHBondContact O-CD1 3.24Å
579	D	89.8	Confident	86.5	Confident	129 Å²	129	52.3 Å²	52.3	69%	0.69	30%	0.3	S	S	*	.			trans	-49.2	135.4	175.3	-66.1	-26.7	0	0	0	112.5	D581 A582 L583	D579-D581 VanDerWaalsContact C-N 3.28Å; D579-D581 PolarHBondContact O-N 3.29Å; D579-A582 HydrophobicContact CB-CB 4.39Å; D579-A582 PolarHBondContact O-N 3.5Å; D579-L583 PolarHBondContact O-N 3.01Å
580	Y	87.4	Confident	87	Confident	85 Å²	85	51.5 Å²	51.5	33%	0.333	30%	0.297	S	S	.	.	H	α-helix	trans	-52.5	-45.9	-178.9	176.7	-90.2	0	0	0	112.2	Y564 D568 M578 A582 L583 Q584	Y564-Y580 AromaticContact CE2-CE2 3.86Å; Y564-Y580 HydrophobicContact CE2-CE2 3.86Å; Y564-Y580 AromaticContact CE2-CZ 3.88Å; Y564-Y580 PolarHBondContact OH-OH 3.21Å; D568-Y580 HydrophobicContact CB-CE2 4.04Å; D568-Y580 VanDerWaalsContact OD1-CE2 3.25Å; D568-Y580 WeakPolarHBondContact OD1-CE2 3.12Å; D568-Y580 PolarHBondContact OD1-OH 2.75Å; M578-Y580 PolarHBondContact O-N 3.33Å; Y580-A582 VanDerWaalsContact C-N 3.26Å; Y580-A582 PolarHBondContact O-N 3.34Å; Y580-L583 PolarHBondContact O-N 3.27Å; Y580-Q584 WeakPolarHBondContact O-CB 3.31Å; Y580-Q584 PolarHBondContact O-N 3.42Å; Y580-Q584 PolarHBondContact OH-NE2 2.82Å
581	D	87.9	Confident	88	Confident	104 Å²	104	49.9 Å²	49.9	56%	0.556	29%	0.286	S	S	*	.	H	α-helix	trans	-63.7	-31.8	-177.7	-75.4	-32.6	0	0	0	113	D579 Y585 R629	D579-D581 VanDerWaalsContact C-N 3.28Å; D579-D581 PolarHBondContact O-N 3.29Å; D581-Y585 WeakPolarHBondContact O-CB 3.43Å; D581-Y585 PolarHBondContact O-N 2.99Å; D581-Y585 VanDerWaalsContact O-N 3.11Å; D581-R629 PolarHBondContact O-NH1 3.45Å
582	A	91.9	Very high	88.9	Confident	33 Å²	33	48.8 Å²	48.8	27%	0.273	27%	0.274	S	S	.	.	H	α-helix	trans	-78.2	-42.5	177.7	0	0	0	0	0	111.3	M578 D579 Y580 Y585 C586	M578-A582 HydrophobicContact CE-CB 3.64Å; M578-A582 HydrophobicContact CG-CB 4.19Å; M578-A582 HydrophobicContact SD-CB 4.07Å; D579-A582 HydrophobicContact CB-CB 4.39Å; D579-A582 PolarHBondContact O-N 3.5Å; Y580-A582 VanDerWaalsContact C-N 3.26Å; Y580-A582 PolarHBondContact O-N 3.34Å; A582-Y585 PolarHBondContact O-N 3.38Å; A582-C586 PolarHBondContact O-N 3.12Å; A582-C586 PolarHBondContact O-SG 3.07Å; A582-C586 VanDerWaalsContact O-SG 3.36Å
583	L	93.5	Very high	90.1	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-59.8	-46.9	173.7	-74.5	173.8	0	0	0	111.3	F560 F563 Y564 C567 I577 M578 D579 Y580 Y585 C586 D587	F560-L583 HydrophobicContact CD1-CD2 4.08Å; F563-L583 HydrophobicContact CB-CD2 4.11Å; Y564-L583 HydrophobicContact CD2-CB 4.24Å; C567-L583 HydrophobicContact CB-CD1 3.77Å; I577-L583 HydrophobicContact CD1-CD2 4.35Å; I577-L583 HydrophobicContact CG1-CD1 4.43Å; I577-L583 HydrophobicContact CG1-CD2 4.01Å; M578-L583 HydrophobicContact CB-CD2 4.36Å; M578-L583 HydrophobicContact CB-CG 4.19Å; M578-L583 HydrophobicContact CE-CD2 4.04Å; M578-L583 HydrophobicContact CE-CG 4.27Å; M578-L583 WeakPolarHBondContact O-CD1 3.24Å; D579-L583 PolarHBondContact O-N 3.01Å; Y580-L583 PolarHBondContact O-N 3.27Å; L583-Y585 PolarHBondContact O-N 2.84Å; L583-C586 PolarHBondContact O-N 3.36Å; L583-D587 PolarHBondContact O-N 3.19Å
584	Q	92.6	Very high	91.1	Very high	12 Å²	12	44.7 Å²	44.7	6%	0.056	24%	0.239	C	C	.	.	H	α-helix	trans	-60.1	-46	176.1	-173.3	176.9	73.8	0	0	111.4	Y564 Y580 C586 D587 F588	Y564-Q584 VanDerWaalsContact CD2-CA 3.46Å; Y564-Q584 HydrophobicContact CD2-CB 3.8Å; Y564-Q584 HydrophobicContact CD2-CG 4.4Å; Y564-Q584 HydrophobicContact CE2-CB 3.42Å; Y564-Q584 VanDerWaalsContact CE2-CB 3.42Å; Y564-Q584 HydrophobicContact CE2-CG 3.64Å; Y564-Q584 PolarHBondContact OH-NE2 3.07Å; Y580-Q584 WeakPolarHBondContact O-CB 3.31Å; Y580-Q584 PolarHBondContact O-N 3.42Å; Y580-Q584 PolarHBondContact OH-NE2 2.82Å; Q584-C586 VanDerWaalsContact C-N 3.34Å; Q584-C586 PolarHBondContact O-N 2.94Å; Q584-D587 PolarHBondContact O-N 3.48Å; Q584-F588 HydrophobicContact CG-CD2 3.87Å; Q584-F588 HydrophobicContact CG-CE2 3.76Å; Q584-F588 VanDerWaalsContact O-CD2 3.3Å; Q584-F588 WeakPolarHBondContact O-CD2 3.48Å; Q584-F588 PolarHBondContact O-N 2.91Å
585	Y	93.1	Very high	91.6	Very high	48 Å²	48	42.9 Å²	42.9	19%	0.188	23%	0.227	C	C	.	.	H	α-helix	trans	-58.4	-45.6	177.2	169.3	-96.8	0	0	0	112.1	D581 A582 L583 D587 L589 A622 M625	D581-Y585 WeakPolarHBondContact O-CB 3.43Å; D581-Y585 PolarHBondContact O-N 2.99Å; D581-Y585 VanDerWaalsContact O-N 3.11Å; A582-Y585 PolarHBondContact O-N 3.38Å; L583-Y585 PolarHBondContact O-N 2.84Å; Y585-D587 PolarHBondContact O-N 3.4Å; Y585-L589 HydrophobicContact CE1-CD2 3.81Å; Y585-L589 WeakPolarHBondContact O-CB 3.36Å; Y585-L589 PolarHBondContact O-N 3.43Å; Y585-A622 WeakPolarHBondContact OH-CB 3.46Å; Y585-A622 PolarHBondContact OH-O 2.91Å; Y585-M625 HydrophobicContact CD2-CB 4Å; Y585-M625 HydrophobicContact CE2-CB 3.68Å
586	C	94.3	Very high	92	Very high	17 Å²	17	39 Å²	39	12%	0.115	21%	0.205	C	C	.	.	H	α-helix	trans	-65.8	-35.9	179.4	-71.5	0	0	0	0	113	F556 F560 A582 L583 Q584 G590	F556-C586 HydrophobicContact CE1-CB 4.34Å; F556-C586 WeakPolarHBondContact CE1-O 3.19Å; F556-C586 HydrophobicContact CZ-CB 4.01Å; F560-C586 HydrophobicContact CB-CB 3.64Å; F560-C586 HydrophobicContact CD1-CB 3.56Å; F560-C586 HydrophobicContact CD2-CB 4.13Å; F560-C586 HydrophobicContact CE1-CB 4.23Å; F560-C586 HydrophobicContact CG-CB 3.49Å; F560-C586 VanDerWaalsContact CG-CB 3.49Å; A582-C586 PolarHBondContact O-N 3.12Å; A582-C586 PolarHBondContact O-SG 3.07Å; A582-C586 VanDerWaalsContact O-SG 3.36Å; L583-C586 PolarHBondContact O-N 3.36Å; Q584-C586 VanDerWaalsContact C-N 3.34Å; Q584-C586 PolarHBondContact O-N 2.94Å; C586-G590 PolarHBondContact O-N 2.87Å
587	D	93.8	Very high	92.2	Very high	6 Å²	6	36.1 Å²	36.1	3%	0.032	19%	0.186	C	C	.	.	H	α-helix	trans	-62.4	-53.6	176	175.2	51	0	0	0	112	S561 Y564 L583 Q584 Y585 L589 G590 S591	S561-D587 WeakPolarHBondContact CA-OD1 3.36Å; S561-D587 WeakPolarHBondContact CB-OD1 3.38Å; S561-D587 PolarHBondContact OG-OD1 3.5Å; Y564-D587 HydrophobicContact CD1-CB 3.78Å; Y564-D587 VanDerWaalsContact CD1-OD2 3.29Å; Y564-D587 WeakPolarHBondContact CD1-OD2 3.35Å; Y564-D587 HydrophobicContact CG-CB 3.96Å; L583-D587 PolarHBondContact O-N 3.19Å; Q584-D587 PolarHBondContact O-N 3.48Å; Y585-D587 PolarHBondContact O-N 3.4Å; D587-L589 PolarHBondContact O-N 3.01Å; D587-G590 PolarHBondContact O-N 3.45Å; D587-S591 WeakPolarHBondContact O-CB 3.41Å; D587-S591 PolarHBondContact O-N 3.16Å; D587-S591 PolarHBondContact O-OG 3.11Å; D587-S591 VanDerWaalsContact O-OG 3.13Å
588	F	91.3	Very high	92.2	Very high	41 Å²	41	32.3 Å²	32.3	18%	0.18	17%	0.167	C	C	.	.	H	α-helix	trans	-61.9	-44.6	177.3	-79.9	-80	0	0	0	112.1	Q584 I592 M625	Q584-F588 HydrophobicContact CG-CD2 3.87Å; Q584-F588 HydrophobicContact CG-CE2 3.76Å; Q584-F588 VanDerWaalsContact O-CD2 3.3Å; Q584-F588 WeakPolarHBondContact O-CD2 3.48Å; Q584-F588 PolarHBondContact O-N 2.91Å; F588-I592 WeakPolarHBondContact O-CG1 3.39Å; F588-I592 PolarHBondContact O-N 2.86Å; F588-I592 VanDerWaalsContact O-N 3.12Å; F588-M625 HydrophobicContact CB-SD 3.97Å
589	L	93.8	Very high	92.2	Very high	24 Å²	24	29.2 Å²	29.2	13%	0.126	15%	0.151	C	C	.	.	H	α-helix	trans	-60.5	-47.8	177.3	174.6	61.7	0	0	0	111.6	Y585 D587 C593 I621 A622	Y585-L589 HydrophobicContact CE1-CD2 3.81Å; Y585-L589 WeakPolarHBondContact O-CB 3.36Å; Y585-L589 PolarHBondContact O-N 3.43Å; D587-L589 PolarHBondContact O-N 3.01Å; L589-C593 VanDerWaalsContact CD1-SG 3.58Å; L589-C593 WeakPolarHBondContact O-CB 3.45Å; L589-C593 PolarHBondContact O-N 3.29Å; L589-C593 PolarHBondContact O-SG 2.92Å; L589-I621 HydrophobicContact CD1-CB 4.38Å; L589-I621 HydrophobicContact CD1-CG2 3.74Å; L589-A622 HydrophobicContact CD1-CB 4.11Å
590	G	93.6	Very high	92.3	Very high	1 Å²	1	23 Å²	23	1%	0.01	12%	0.118	C	C	.	.	H	α-helix	trans	-61	-48.9	-179.7	0	0	0	0	0	111.5	T557 C586 D587 I592 C593 S594	T557-G590 WeakPolarHBondContact OG1-CA 3.47Å; T557-G590 PolarHBondContact OG1-O 3.14Å; C586-G590 PolarHBondContact O-N 2.87Å; D587-G590 PolarHBondContact O-N 3.45Å; G590-I592 PolarHBondContact O-N 3.32Å; G590-C593 PolarHBondContact O-N 2.97Å; G590-S594 WeakPolarHBondContact O-CB 3.36Å; G590-S594 PolarHBondContact O-N 2.87Å; G590-S594 PolarHBondContact O-OG 3.44Å; G590-S594 VanDerWaalsContact O-OG 3.07Å
591	S	91.4	Very high	92.4	Very high	13 Å²	13	19.2 Å²	19.2	9%	0.091	10%	0.104	C	C	.	.	H	α-helix	trans	-58	-48.2	179.6	-71.2	0	0	0	0	112.4	D587 S594 I595	D587-S591 WeakPolarHBondContact O-CB 3.41Å; D587-S591 PolarHBondContact O-N 3.16Å; D587-S591 PolarHBondContact O-OG 3.11Å; D587-S591 VanDerWaalsContact O-OG 3.13Å; S591-S594 PolarHBondContact O-N 3.22Å; S591-I595 WeakPolarHBondContact O-CG1 3.37Å; S591-I595 PolarHBondContact O-N 3.19Å
592	I	91.6	Very high	92.4	Very high	3 Å²	3	14.8 Å²	14.8	2%	0.015	8%	0.08	C	C	.	.	H	α-helix	trans	-69.7	-42.2	179.4	-60.9	172.2	0	0	0	111.1	F588 G590 S594 I595 W596 I621 M625 L635 P638	F588-I592 WeakPolarHBondContact O-CG1 3.39Å; F588-I592 PolarHBondContact O-N 2.86Å; F588-I592 VanDerWaalsContact O-N 3.12Å; G590-I592 PolarHBondContact O-N 3.32Å; I592-S594 VanDerWaalsContact C-N 3.3Å; I592-S594 PolarHBondContact O-N 3.17Å; I592-I595 PolarHBondContact O-N 3.11Å; I592-W596 WeakPolarHBondContact O-CB 3.29Å; I592-W596 PolarHBondContact O-N 2.93Å; I592-I621 HydrophobicContact CB-CG2 4.01Å; I592-I621 HydrophobicContact CG2-CD1 3.97Å; I592-I621 HydrophobicContact CG2-CG1 4.15Å; I592-I621 HydrophobicContact CG2-CG2 3.75Å; I592-M625 HydrophobicContact CD1-CE 3.43Å; I592-M625 VanDerWaalsContact CD1-CE 3.43Å; I592-M625 HydrophobicContact CD1-SD 3.54Å; I592-M625 VanDerWaalsContact CD1-SD 3.54Å; I592-L635 HydrophobicContact CD1-CD1 3.95Å; I592-L635 HydrophobicContact CG1-CD1 3.71Å; I592-P638 HydrophobicContact CG2-CB 3.97Å; I592-P638 HydrophobicContact CG2-CG 4.17Å
593	C	94	Very high	92.1	Very high	15 Å²	15	13.2 Å²	13.2	10%	0.101	7%	0.067	C	C	.	.	H	α-helix	trans	-59.6	-41	175.5	-75.8	0	0	0	0	111.7	V553 L589 G590 I595 W596 V597	V553-C593 HydrophobicContact CG1-CB 3.92Å; L589-C593 VanDerWaalsContact CD1-SG 3.58Å; L589-C593 WeakPolarHBondContact O-CB 3.45Å; L589-C593 PolarHBondContact O-N 3.29Å; L589-C593 PolarHBondContact O-SG 2.92Å; G590-C593 PolarHBondContact O-N 2.97Å; C593-I595 PolarHBondContact O-N 2.68Å; C593-W596 WeakPolarHBondContact O-CB 2.92Å; C593-W596 PolarHBondContact O-N 3.03Å; C593-V597 WeakPolarHBondContact O-CG1 3.35Å; C593-V597 WeakPolarHBondContact O-CG2 3.5Å; C593-V597 PolarHBondContact O-N 3.28Å
594	S	93.8	Very high	91.6	Very high	1 Å²	1	15.6 Å²	15.6	1%	0.007	8%	0.076	C	C	.	.	H	α-helix	trans	-59.5	-44.5	176.8	-74.6	0	0	0	0	111.9	T557 G590 S591 I592 V597 T598	T557-S594 PolarHBondContact OG1-OG 2.7Å; G590-S594 WeakPolarHBondContact O-CB 3.36Å; G590-S594 PolarHBondContact O-N 2.87Å; G590-S594 PolarHBondContact O-OG 3.44Å; G590-S594 VanDerWaalsContact O-OG 3.07Å; S591-S594 PolarHBondContact O-N 3.22Å; I592-S594 VanDerWaalsContact C-N 3.3Å; I592-S594 PolarHBondContact O-N 3.17Å; S594-V597 WeakPolarHBondContact O-CG2 3.46Å; S594-T598 WeakPolarHBondContact O-CB 3.35Å; S594-T598 PolarHBondContact O-N 3.45Å; S594-T598 PolarHBondContact O-OG1 3.18Å
595	I	91.9	Very high	91.2	Very high	35 Å²	35	17 Å²	17	18%	0.179	8%	0.084	C	C	.	.	H	α-helix	trans	-65.5	-46	176	-63.2	167.1	0	0	0	110.4	S591 I592 C593 T598 I599 I639	S591-I595 WeakPolarHBondContact O-CG1 3.37Å; S591-I595 PolarHBondContact O-N 3.19Å; I592-I595 PolarHBondContact O-N 3.11Å; C593-I595 PolarHBondContact O-N 2.68Å; I595-T598 PolarHBondContact O-N 2.99Å; I595-I599 HydrophobicContact CG2-CD1 3.64Å; I595-I599 HydrophobicContact CG2-CG1 4.43Å; I595-I599 WeakPolarHBondContact O-CG1 3.3Å; I595-I599 PolarHBondContact O-N 3.38Å; I595-I639 HydrophobicContact CD1-CD1 4.04Å; I595-I639 HydrophobicContact CG2-CD1 4.27Å; I595-I639 HydrophobicContact CG2-CG1 3.89Å; I595-I639 HydrophobicContact CG2-CG2 4.35Å
596	W	94.1	Very high	90.8	Very high	19 Å²	19	17.1 Å²	17.1	7%	0.072	10%	0.1	C	C	.	.	H	α-helix	trans	-57.1	-53.7	179.7	178	-97.6	0	0	0	112.7	I592 C593 T598 I599 L600 L613 I621 P638 C641 A642 L645	I592-W596 WeakPolarHBondContact O-CB 3.29Å; I592-W596 PolarHBondContact O-N 2.93Å; C593-W596 WeakPolarHBondContact O-CB 2.92Å; C593-W596 PolarHBondContact O-N 3.03Å; W596-T598 VanDerWaalsContact C-N 3.3Å; W596-T598 PolarHBondContact O-N 3.27Å; W596-I599 PolarHBondContact O-N 3.34Å; W596-L600 HydrophobicContact CD2-CD1 4.27Å; W596-L600 HydrophobicContact CG-CD1 4.43Å; W596-L600 HydrophobicContact CZ2-CD1 3.87Å; W596-L600 VanDerWaalsContact NE1-CD1 3.25Å; W596-L600 WeakPolarHBondContact O-CG 3.48Å; W596-L600 PolarHBondContact O-N 3.47Å; W596-L600 VanDerWaalsContact O-N 3.08Å; W596-L613 PolarHBondContact NE1-O 2.79Å; W596-L613 VanDerWaalsContact NE1-O 3.12Å; W596-I621 HydrophobicContact CB-CD1 4.01Å; W596-I621 HydrophobicContact CD2-CD1 4.2Å; W596-I621 HydrophobicContact CG-CD1 3.97Å; W596-P638 HydrophobicContact CE3-CB 4.13Å; W596-P638 VanDerWaalsContact CE3-O 3.28Å; W596-P638 HydrophobicContact CZ3-CB 4.47Å; W596-P638 WeakPolarHBondContact CZ3-O 3.21Å; W596-C641 HydrophobicContact CZ3-CB 4.12Å; W596-A642 HydrophobicContact CD2-CB 4.41Å; W596-A642 HydrophobicContact CE3-CB 3.66Å; W596-A642 HydrophobicContact CZ3-CB 3.83Å; W596-L645 HydrophobicContact CH2-CD1 4.25Å
597	V	93.5	Very high	90.3	Very high	8 Å²	8	21.1 Å²	21.1	5%	0.048	12%	0.12	C	C	.	.	H	α-helix	trans	-66.6	-32.5	-178.8	-59.5	0	0	0	0	112.2	E550 V553 Y554 C593 S594 C601 F614	E550-V597 HydrophobicContact CB-CG2 4.48Å; E550-V597 HydrophobicContact CG-CB 4.4Å; E550-V597 HydrophobicContact CG-CG2 4.35Å; V553-V597 HydrophobicContact CB-CG2 4.3Å; V553-V597 HydrophobicContact CG1-CG2 4.12Å; V553-V597 HydrophobicContact CG2-CG1 4.46Å; Y554-V597 HydrophobicContact CE1-CG2 4.15Å; C593-V597 WeakPolarHBondContact O-CG1 3.35Å; C593-V597 WeakPolarHBondContact O-CG2 3.5Å; C593-V597 PolarHBondContact O-N 3.28Å; S594-V597 WeakPolarHBondContact O-CG2 3.46Å; V597-C601 WeakPolarHBondContact O-CB 3.24Å; V597-C601 PolarHBondContact O-N 3.45Å; V597-C601 PolarHBondContact O-SG 3.01Å; V597-C601 VanDerWaalsContact O-SG 3.35Å; V597-F614 HydrophobicContact CB-CE1 4.22Å; V597-F614 HydrophobicContact CB-CE2 4.08Å; V597-F614 HydrophobicContact CB-CZ 3.91Å; V597-F614 HydrophobicContact CG1-CD1 4.3Å; V597-F614 HydrophobicContact CG1-CD2 4.07Å; V597-F614 HydrophobicContact CG1-CE1 4.36Å; V597-F614 HydrophobicContact CG1-CE2 4.12Å; V597-F614 HydrophobicContact CG1-CG 4.15Å; V597-F614 HydrophobicContact CG1-CZ 4.26Å
598	T	92.4	Very high	90.1	Very high	4 Å²	4	26.4 Å²	26.4	3%	0.025	15%	0.153	C	C	.	.	H	α-helix	trans	-64.4	-47.9	176	-57.5	0	0	0	0	111	Y554 S594 I595 W596 C601 M602 V710 L713	Y554-T598 PolarHBondContact OH-OG1 3.04Å; S594-T598 WeakPolarHBondContact O-CB 3.35Å; S594-T598 PolarHBondContact O-N 3.45Å; S594-T598 PolarHBondContact O-OG1 3.18Å; I595-T598 PolarHBondContact O-N 2.99Å; W596-T598 VanDerWaalsContact C-N 3.3Å; W596-T598 PolarHBondContact O-N 3.27Å; T598-C601 WeakPolarHBondContact O-CB 3.47Å; T598-C601 PolarHBondContact O-N 3.35Å; T598-M602 WeakPolarHBondContact O-CG 3.33Å; T598-M602 PolarHBondContact O-N 3.07Å; T598-M602 VanDerWaalsContact O-N 3.13Å; T598-V710 HydrophobicContact CG2-CG1 4.4Å; T598-V710 HydrophobicContact CG2-CG2 4.4Å; T598-L713 HydrophobicContact CG2-CB 4.23Å
599	I	91.4	Very high	90	Very high	15 Å²	15	26.9 Å²	26.9	8%	0.077	16%	0.164	C	C	.	.	H	α-helix	trans	-67.7	-42.3	-178.1	-64.4	166.3	0	0	0	111.4	I595 W596 C601 M602 A603 I639 A642 I643 M646	I595-I599 HydrophobicContact CG2-CD1 3.64Å; I595-I599 HydrophobicContact CG2-CG1 4.43Å; I595-I599 WeakPolarHBondContact O-CG1 3.3Å; I595-I599 PolarHBondContact O-N 3.38Å; W596-I599 PolarHBondContact O-N 3.34Å; I599-C601 VanDerWaalsContact C-N 3.29Å; I599-C601 PolarHBondContact O-N 3.05Å; I599-M602 HydrophobicContact CB-CE 4.17Å; I599-M602 HydrophobicContact CG1-CE 3.85Å; I599-M602 HydrophobicContact CG2-CE 4.37Å; I599-M602 WeakPolarHBondContact O-CA 3.07Å; I599-M602 WeakPolarHBondContact O-CB 3.41Å; I599-M602 PolarHBondContact O-N 3.33Å; I599-A603 PolarHBondContact O-N 2.84Å; I599-I639 HydrophobicContact CD1-CG2 4.36Å; I599-A642 HydrophobicContact CB-CB 3.87Å; I599-A642 HydrophobicContact CD1-CB 3.99Å; I599-A642 VanDerWaalsContact CG2-C 3.46Å; I599-A642 HydrophobicContact CG2-CB 3.67Å; I599-A642 VanDerWaalsContact CG2-O 3.3Å; I599-A642 WeakPolarHBondContact CG2-O 3.34Å; I599-I643 HydrophobicContact CD1-CG1 4.08Å; I599-M646 HydrophobicContact CG2-CB 3.93Å; I599-M646 HydrophobicContact CG2-SD 4.12Å
600	L	91.3	Very high	89.8	Confident	0 Å²	0	26.3 Å²	26.3	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-65	-32.3	175.8	-72.3	-177.5	0	0	0	112.6	W596 M602 A603 L605 L613 F614 L645	W596-L600 HydrophobicContact CD2-CD1 4.27Å; W596-L600 HydrophobicContact CG-CD1 4.43Å; W596-L600 HydrophobicContact CZ2-CD1 3.87Å; W596-L600 VanDerWaalsContact NE1-CD1 3.25Å; W596-L600 WeakPolarHBondContact O-CG 3.48Å; W596-L600 PolarHBondContact O-N 3.47Å; W596-L600 VanDerWaalsContact O-N 3.08Å; L600-M602 VanDerWaalsContact C-N 3.33Å; L600-A603 WeakPolarHBondContact O-CB 3.32Å; L600-A603 PolarHBondContact O-N 3.49Å; L600-L605 HydrophobicContact CD2-CD1 4.25Å; L600-L613 HydrophobicContact CD1-CB 3.8Å; L600-L613 HydrophobicContact CD2-CD1 4.32Å; L600-F614 HydrophobicContact CB-CD1 4.22Å; L600-F614 HydrophobicContact CB-CE1 3.57Å; L600-F614 HydrophobicContact CD1-CD1 3.65Å; L600-F614 HydrophobicContact CD1-CE1 3.9Å; L600-F614 HydrophobicContact CG-CE1 4.42Å; L600-L645 HydrophobicContact CD2-CB 4.33Å; L600-L645 HydrophobicContact CD2-CD1 3.99Å
601	C	89.4	Confident	89.7	Confident	5 Å²	5	31 Å²	31	3%	0.034	18%	0.179	C	C	.	.	H	α-helix	trans	-61	-41.2	168.6	-84.8	0	0	0	0	112.6	E550 V597 T598 I599 A603 R604	E550-C601 VanDerWaalsContact CG-SG 3.57Å; E550-C601 PolarHBondContact OE1-SG 3.35Å; V597-C601 WeakPolarHBondContact O-CB 3.24Å; V597-C601 PolarHBondContact O-N 3.45Å; V597-C601 PolarHBondContact O-SG 3.01Å; V597-C601 VanDerWaalsContact O-SG 3.35Å; T598-C601 WeakPolarHBondContact O-CB 3.47Å; T598-C601 PolarHBondContact O-N 3.35Å; I599-C601 VanDerWaalsContact C-N 3.29Å; I599-C601 PolarHBondContact O-N 3.05Å; C601-A603 VanDerWaalsContact C-N 3.29Å; C601-A603 PolarHBondContact O-N 2.62Å; C601-R604 PolarHBondContact O-N 3.3Å
602	M	87.8	Confident	89.8	Confident	11 Å²	11	34.4 Å²	34.4	5%	0.054	20%	0.199	C	C	.	.	H	α-helix	trans	-66.1	-31.4	175.9	-66.4	-167	-72.6	0	0	112.9	T598 I599 L600 R604 M646 W650 L713	T598-M602 WeakPolarHBondContact O-CG 3.33Å; T598-M602 PolarHBondContact O-N 3.07Å; T598-M602 VanDerWaalsContact O-N 3.13Å; I599-M602 HydrophobicContact CB-CE 4.17Å; I599-M602 HydrophobicContact CG1-CE 3.85Å; I599-M602 HydrophobicContact CG2-CE 4.37Å; I599-M602 WeakPolarHBondContact O-CA 3.07Å; I599-M602 WeakPolarHBondContact O-CB 3.41Å; I599-M602 PolarHBondContact O-N 3.33Å; L600-M602 VanDerWaalsContact C-N 3.33Å; M602-R604 PolarHBondContact O-N 3.12Å; M602-M646 HydrophobicContact CB-CG 4.41Å; M602-M646 HydrophobicContact CB-SD 3.6Å; M602-M646 HydrophobicContact CE-SD 3.7Å; M602-M646 HydrophobicContact SD-SD 4.22Å; M602-W650 HydrophobicContact CB-CZ2 4.44Å; M602-W650 PolarHBondContact O-NE1 3.03Å; M602-L713 HydrophobicContact CE-CB 4.41Å; M602-L713 HydrophobicContact CE-CD1 3.88Å; M602-L713 WeakPolarHBondContact CG-O 3.5Å; M602-L713 HydrophobicContact SD-CB 3.69Å; M602-L713 HydrophobicContact SD-CD1 4.06Å; M602-L713 HydrophobicContact SD-CD2 3.88Å; M602-L713 HydrophobicContact SD-CG 4.08Å
603	A	86.4	Confident	89.9	Confident	0 Å²	0	36.3 Å²	36.3	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-64	-18.3	175.1	0	0	0	0	0	113.1	I599 L600 C601 L605 M646 S649	I599-A603 PolarHBondContact O-N 2.84Å; L600-A603 WeakPolarHBondContact O-CB 3.32Å; L600-A603 PolarHBondContact O-N 3.49Å; C601-A603 VanDerWaalsContact C-N 3.29Å; C601-A603 PolarHBondContact O-N 2.62Å; A603-L605 VanDerWaalsContact C-N 3.27Å; A603-L605 HydrophobicContact CB-CD1 4.35Å; A603-L605 HydrophobicContact CB-CD2 4.33Å; A603-L605 HydrophobicContact CB-CG 3.94Å; A603-L605 PolarHBondContact O-N 3.2Å; A603-M646 HydrophobicContact CB-CB 4.02Å; A603-M646 HydrophobicContact CB-CG 4.18Å; A603-S649 PolarHBondContact O-OG 3.08Å
604	R	82.9	Confident	89.9	Confident	49 Å²	49	36.3 Å²	36.3	19%	0.185	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	48.8	43.3	-179.7	-69.5	-153.8	-179.3	178.5	-3.6	113.5	C601 M602 R653 Y661 E718	C601-R604 PolarHBondContact O-N 3.3Å; M602-R604 PolarHBondContact O-N 3.12Å; R604-R653 PolarHBondContact O-NH2 3.01Å; R604-Y661 WeakPolarHBondContact CD-OH 3.5Å; R604-Y661 PolarHBondContact NE-OH 3.13Å; R604-E718 IonicContact NH1-OE1 3.25Å; R604-E718 PolarHBondContact NH1-OE1 3.45Å
605	L	83.9	Confident	89.9	Confident	41 Å²	41	41.8 Å²	41.8	22%	0.215	24%	0.236	C	C	.	.			trans	-64.8	160.4	176.6	-57.2	174	0	0	0	110.8	L600 A603 K610 L613	L600-L605 HydrophobicContact CD2-CD1 4.25Å; A603-L605 VanDerWaalsContact C-N 3.27Å; A603-L605 HydrophobicContact CB-CD1 4.35Å; A603-L605 HydrophobicContact CB-CD2 4.33Å; A603-L605 HydrophobicContact CB-CG 3.94Å; A603-L605 PolarHBondContact O-N 3.2Å; L605-K610 HydrophobicContact CB-CB 4.38Å; L605-L613 HydrophobicContact CD1-CD1 3.49Å; L605-L613 VanDerWaalsContact CD1-CD1 3.49Å
606	G	84.3	Confident	90	Very high	51 Å²	51	44.5 Å²	44.5	53%	0.526	25%	0.25	S	S	.	.			trans	-61.5	149.7	172.4	0	0	0	0	0	111	T608 A609 K610	G606-T608 VanDerWaalsContact C-N 3.32Å; G606-T608 PolarHBondContact O-N 3.02Å; G606-A609 PolarHBondContact O-N 3.22Å; G606-A609 VanDerWaalsContact O-N 3.08Å; G606-K610 PolarHBondContact O-N 3.08Å
607	D	84.7	Confident	90	Very high	101 Å²	101	43.8 Å²	43.8	54%	0.54	25%	0.249	S	C	.	.	H	α-helix	trans	-53.6	-45.8	-169.4	-71.8	-27.4	0	0	0	112.9	A609 K610 Y611	D607-A609 PolarHBondContact O-N 2.65Å; D607-K610 PolarHBondContact O-N 3.39Å; D607-Y611 HydrophobicContact CB-CD2 4.35Å; D607-Y611 HydrophobicContact CB-CE2 4.26Å; D607-Y611 WeakPolarHBondContact O-CD2 3.41Å; D607-Y611 PolarHBondContact O-N 3.18Å
608	T	88.3	Confident	90	Very high	118 Å²	118	45.2 Å²	45.2	72%	0.724	26%	0.261	S	S	*	.	H	α-helix	trans	-57.3	-53	177.1	-44.6	0	0	0	0	111.6	G606 K610 Y611 T612	G606-T608 VanDerWaalsContact C-N 3.32Å; G606-T608 PolarHBondContact O-N 3.02Å; T608-K610 VanDerWaalsContact C-N 3.34Å; T608-K610 PolarHBondContact O-N 3.35Å; T608-Y611 PolarHBondContact O-N 2.91Å; T608-T612 WeakPolarHBondContact O-CB 3.34Å; T608-T612 PolarHBondContact O-N 3.26Å; T608-T612 PolarHBondContact O-OG1 3.47Å
609	A	88.6	Confident	90.1	Very high	50 Å²	50	50.3 Å²	50.3	41%	0.413	29%	0.288	S	S	.	.	H	α-helix	trans	-64.1	-38.1	179.6	0	0	0	0	0	112.3	G606 D607 L613	G606-A609 PolarHBondContact O-N 3.22Å; G606-A609 VanDerWaalsContact O-N 3.08Å; D607-A609 PolarHBondContact O-N 2.65Å; A609-L613 WeakPolarHBondContact O-CB 3.07Å; A609-L613 VanDerWaalsContact O-CG 3.28Å; A609-L613 WeakPolarHBondContact O-CG 3.44Å; A609-L613 PolarHBondContact O-N 2.9Å
610	K	89.9	Confident	90.2	Very high	12 Å²	12	54.1 Å²	54.1	5%	0.052	31%	0.308	C	S	.	.	H	α-helix	trans	-59.9	-54.3	177.6	-169.4	-169.9	77.3	159	0	110.6	E550 L605 G606 D607 T608 L613 F614	E550-K610 IonicContact OE1-NZ 3.48Å; E550-K610 PolarHBondContact OE1-NZ 2.75Å; L605-K610 HydrophobicContact CB-CB 4.38Å; G606-K610 PolarHBondContact O-N 3.08Å; D607-K610 PolarHBondContact O-N 3.39Å; T608-K610 VanDerWaalsContact C-N 3.34Å; T608-K610 PolarHBondContact O-N 3.35Å; K610-L613 PolarHBondContact O-N 3.13Å; K610-F614 HydrophobicContact CD-CE1 4.14Å; K610-F614 HydrophobicContact CD-CZ 3.87Å; K610-F614 HydrophobicContact CG-CD1 4.16Å; K610-F614 HydrophobicContact CG-CE1 3.58Å; K610-F614 HydrophobicContact CG-CZ 3.83Å; K610-F614 WeakPolarHBondContact O-CD1 3.42Å; K610-F614 WeakPolarHBondContact O-CG 3.16Å; K610-F614 PolarHBondContact O-N 3.07Å
611	Y	91.9	Very high	90.3	Very high	100 Å²	100	54.3 Å²	54.3	39%	0.392	31%	0.309	S	S	.	.	H	α-helix	trans	-72.7	-32	-175.8	-68.4	-63.6	0	0	0	112.9	T549 D607 T608 F614 L615	T549-Y611 HydrophobicContact CG2-CE1 4.41Å; D607-Y611 HydrophobicContact CB-CD2 4.35Å; D607-Y611 HydrophobicContact CB-CE2 4.26Å; D607-Y611 WeakPolarHBondContact O-CD2 3.41Å; D607-Y611 PolarHBondContact O-N 3.18Å; T608-Y611 PolarHBondContact O-N 2.91Å; Y611-F614 HydrophobicContact CD1-CD2 4.04Å; Y611-F614 HydrophobicContact CD1-CE2 4.46Å; Y611-F614 HydrophobicContact CE1-CD2 4.34Å; Y611-F614 HydrophobicContact CE1-CE2 4.36Å; Y611-F614 PolarHBondContact O-N 3.35Å; Y611-L615 PolarHBondContact O-N 2.68Å
612	T	93.1	Very high	90.5	Very high	85 Å²	85	55.1 Å²	55.1	52%	0.521	32%	0.316	S	S	.	.	H	α-helix	trans	-60.9	-45.8	170	-58.6	0	0	0	0	111.3	T608 F614 L615 L616	T608-T612 WeakPolarHBondContact O-CB 3.34Å; T608-T612 PolarHBondContact O-N 3.26Å; T608-T612 PolarHBondContact O-OG1 3.47Å; T612-F614 VanDerWaalsContact C-N 3.33Å; T612-F614 PolarHBondContact O-N 3.41Å; T612-L615 PolarHBondContact O-N 2.83Å; T612-L616 VanDerWaalsContact O-CB 3.26Å; T612-L616 WeakPolarHBondContact O-CB 3.49Å; T612-L616 PolarHBondContact O-N 2.96Å
613	L	93.8	Very high	90.6	Very high	43 Å²	43	60 Å²	60	23%	0.225	34%	0.34	C	S	.	.	H	α-helix	trans	-69.5	-28.8	177.3	-71.9	169.9	0	0	0	113.2	W596 L600 L605 A609 K610 G617 L645	W596-L613 PolarHBondContact NE1-O 2.79Å; W596-L613 VanDerWaalsContact NE1-O 3.12Å; L600-L613 HydrophobicContact CD1-CB 3.8Å; L600-L613 HydrophobicContact CD2-CD1 4.32Å; L605-L613 HydrophobicContact CD1-CD1 3.49Å; L605-L613 VanDerWaalsContact CD1-CD1 3.49Å; A609-L613 WeakPolarHBondContact O-CB 3.07Å; A609-L613 VanDerWaalsContact O-CG 3.28Å; A609-L613 WeakPolarHBondContact O-CG 3.44Å; A609-L613 PolarHBondContact O-N 2.9Å; K610-L613 PolarHBondContact O-N 3.13Å; L613-G617 WeakPolarHBondContact O-CA 3.38Å; L613-G617 PolarHBondContact O-N 3.02Å; L613-L645 HydrophobicContact CD1-CD1 4.44Å
614	F	93.9	Very high	90.7	Very high	14 Å²	14	61 Å²	61	6%	0.061	35%	0.347	C	S	.	.	H	α-helix	trans	-63.1	-53.3	172.1	-79.4	19.7	0	0	0	110.5	T549 E550 V597 L600 K610 Y611 T612 A618	T549-F614 HydrophobicContact CG2-CD2 4.06Å; T549-F614 HydrophobicContact CG2-CE2 4.33Å; E550-F614 HydrophobicContact CG-CE2 4.1Å; E550-F614 HydrophobicContact CG-CZ 4.28Å; E550-F614 WeakPolarHBondContact OE1-CE2 3.34Å; E550-F614 WeakPolarHBondContact OE1-CZ 3.41Å; V597-F614 HydrophobicContact CB-CE1 4.22Å; V597-F614 HydrophobicContact CB-CE2 4.08Å; V597-F614 HydrophobicContact CB-CZ 3.91Å; V597-F614 HydrophobicContact CG1-CD1 4.3Å; V597-F614 HydrophobicContact CG1-CD2 4.07Å; V597-F614 HydrophobicContact CG1-CE1 4.36Å; V597-F614 HydrophobicContact CG1-CE2 4.12Å; V597-F614 HydrophobicContact CG1-CG 4.15Å; V597-F614 HydrophobicContact CG1-CZ 4.26Å; L600-F614 HydrophobicContact CB-CD1 4.22Å; L600-F614 HydrophobicContact CB-CE1 3.57Å; L600-F614 HydrophobicContact CD1-CD1 3.65Å; L600-F614 HydrophobicContact CD1-CE1 3.9Å; L600-F614 HydrophobicContact CG-CE1 4.42Å; K610-F614 HydrophobicContact CD-CE1 4.14Å; K610-F614 HydrophobicContact CD-CZ 3.87Å; K610-F614 HydrophobicContact CG-CD1 4.16Å; K610-F614 HydrophobicContact CG-CE1 3.58Å; K610-F614 HydrophobicContact CG-CZ 3.83Å; K610-F614 WeakPolarHBondContact O-CD1 3.42Å; K610-F614 WeakPolarHBondContact O-CG 3.16Å; K610-F614 PolarHBondContact O-N 3.07Å; Y611-F614 HydrophobicContact CD1-CD2 4.04Å; Y611-F614 HydrophobicContact CD1-CE2 4.46Å; Y611-F614 HydrophobicContact CE1-CD2 4.34Å; Y611-F614 HydrophobicContact CE1-CE2 4.36Å; Y611-F614 PolarHBondContact O-N 3.35Å; T612-F614 VanDerWaalsContact C-N 3.33Å; T612-F614 PolarHBondContact O-N 3.41Å; F614-A618 VanDerWaalsContact O-CB 3.24Å; F614-A618 WeakPolarHBondContact O-CB 3.5Å; F614-A618 PolarHBondContact O-N 3.42Å
615	L	94.1	Very high	91	Very high	117 Å²	117	58.8 Å²	58.8	61%	0.613	34%	0.339	S	S	*	.	H	α-helix	trans	-66.9	-48.2	-177.4	-176.3	63.1	0	0	0	111.6	Y611 T612 G617 A618 L619	Y611-L615 PolarHBondContact O-N 2.68Å; T612-L615 PolarHBondContact O-N 2.83Å; L615-G617 PolarHBondContact O-N 3.5Å; L615-A618 PolarHBondContact O-N 3.4Å; L615-L619 HydrophobicContact CD1-CD1 4.46Å; L615-L619 HydrophobicContact CG-CD1 4.29Å; L615-L619 WeakPolarHBondContact O-CG 3.36Å; L615-L619 PolarHBondContact O-N 3.28Å
616	L	94.6	Very high	91.2	Very high	91 Å²	91	63 Å²	63	48%	0.476	36%	0.357	S	S	.	.	H	α-helix	trans	-60.9	-46.2	178.5	-179.9	62.9	0	0	0	111.3	T612 L619 L620	T612-L616 VanDerWaalsContact O-CB 3.26Å; T612-L616 WeakPolarHBondContact O-CB 3.49Å; T612-L616 PolarHBondContact O-N 2.96Å; L616-L619 PolarHBondContact O-N 3.04Å; L616-L620 HydrophobicContact CD1-CD1 4.27Å; L616-L620 HydrophobicContact CD1-CG 4.44Å; L616-L620 HydrophobicContact CG-CD1 4.16Å; L616-L620 WeakPolarHBondContact O-CG 3.48Å; L616-L620 PolarHBondContact O-N 2.98Å
617	G	93.9	Very high	91.2	Very high	5 Å²	5	67.2 Å²	67.2	5%	0.052	37%	0.367	C	S	.	.	H	α-helix	trans	-61.1	-46.8	177.3	0	0	0	0	0	112.1	L613 L615 L619 L620 I621	L613-G617 WeakPolarHBondContact O-CA 3.38Å; L613-G617 PolarHBondContact O-N 3.02Å; L615-G617 PolarHBondContact O-N 3.5Å; G617-L619 VanDerWaalsContact C-N 3.35Å; G617-L619 PolarHBondContact O-N 2.83Å; G617-L620 PolarHBondContact O-N 3.48Å; G617-I621 WeakPolarHBondContact O-CB 3.33Å; G617-I621 WeakPolarHBondContact O-CD1 3.22Å; G617-I621 WeakPolarHBondContact O-CG1 3.28Å; G617-I621 PolarHBondContact O-N 3.39Å
618	A	93.9	Very high	90.9	Very high	37 Å²	37	64.4 Å²	64.4	31%	0.306	35%	0.352	S	S	.	.	H	α-helix	trans	-60.3	-41.3	178.5	0	0	0	0	0	112.6	F614 L615 I621 A622	F614-A618 VanDerWaalsContact O-CB 3.24Å; F614-A618 WeakPolarHBondContact O-CB 3.5Å; F614-A618 PolarHBondContact O-N 3.42Å; L615-A618 PolarHBondContact O-N 3.4Å; A618-I621 PolarHBondContact O-N 3.36Å; A618-A622 VanDerWaalsContact O-CB 3.26Å; A618-A622 WeakPolarHBondContact O-CB 3.41Å; A618-A622 PolarHBondContact O-N 2.79Å
619	L	94.3	Very high	90.6	Very high	112 Å²	112	61.1 Å²	61.1	59%	0.586	33%	0.327	S	S	*	.	H	α-helix	trans	-65.4	-41.7	176.4	-69.3	173.1	0	0	0	112.3	L615 L616 G617 A622 M623	L615-L619 HydrophobicContact CD1-CD1 4.46Å; L615-L619 HydrophobicContact CG-CD1 4.29Å; L615-L619 WeakPolarHBondContact O-CG 3.36Å; L615-L619 PolarHBondContact O-N 3.28Å; L616-L619 PolarHBondContact O-N 3.04Å; G617-L619 VanDerWaalsContact C-N 3.35Å; G617-L619 PolarHBondContact O-N 2.83Å; L619-A622 PolarHBondContact O-N 2.8Å; L619-M623 PolarHBondContact O-N 3.4Å
620	L	92.9	Very high	89.9	Confident	94 Å²	94	64.7 Å²	64.7	49%	0.492	33%	0.333	S	S	.	.	H	α-helix	trans	-68	-40.9	177.1	-69.6	174.3	0	0	0	112.1	L616 G617 M623 S624	L616-L620 HydrophobicContact CD1-CD1 4.27Å; L616-L620 HydrophobicContact CD1-CG 4.44Å; L616-L620 HydrophobicContact CG-CD1 4.16Å; L616-L620 WeakPolarHBondContact O-CG 3.48Å; L616-L620 PolarHBondContact O-N 2.98Å; G617-L620 PolarHBondContact O-N 3.48Å; L620-M623 HydrophobicContact CD2-CE 4.27Å; L620-M623 PolarHBondContact O-N 3Å; L620-S624 VanDerWaalsContact O-CB 3.29Å; L620-S624 WeakPolarHBondContact O-CB 3.07Å; L620-S624 PolarHBondContact O-N 3.02Å
621	I	93.8	Very high	89.4	Confident	5 Å²	5	64.5 Å²	64.5	3%	0.026	33%	0.334	C	S	.	.	H	α-helix	trans	-63.6	-45.9	175.6	-66.2	160.7	0	0	0	109.7	L589 I592 W596 G617 A618 M623 S624 M625 P638	L589-I621 HydrophobicContact CD1-CB 4.38Å; L589-I621 HydrophobicContact CD1-CG2 3.74Å; I592-I621 HydrophobicContact CB-CG2 4.01Å; I592-I621 HydrophobicContact CG2-CD1 3.97Å; I592-I621 HydrophobicContact CG2-CG1 4.15Å; I592-I621 HydrophobicContact CG2-CG2 3.75Å; W596-I621 HydrophobicContact CB-CD1 4.01Å; W596-I621 HydrophobicContact CD2-CD1 4.2Å; W596-I621 HydrophobicContact CG-CD1 3.97Å; G617-I621 WeakPolarHBondContact O-CB 3.33Å; G617-I621 WeakPolarHBondContact O-CD1 3.22Å; G617-I621 WeakPolarHBondContact O-CG1 3.28Å; G617-I621 PolarHBondContact O-N 3.39Å; A618-I621 PolarHBondContact O-N 3.36Å; I621-M623 PolarHBondContact O-N 3.49Å; I621-S624 WeakPolarHBondContact O-CB 3.45Å; I621-S624 PolarHBondContact O-N 3.34Å; I621-S624 VanDerWaalsContact O-N 3.16Å; I621-M625 HydrophobicContact CG2-CG 4.23Å; I621-M625 WeakPolarHBondContact O-CG 3.36Å; I621-M625 PolarHBondContact O-N 3.42Å; I621-P638 HydrophobicContact CD1-CB 4.24Å; I621-P638 HydrophobicContact CG1-CB 4.07Å; I621-P638 HydrophobicContact CG1-CG 4.04Å
622	A	93	Very high	88.8	Confident	21 Å²	21	61 Å²	61	17%	0.174	32%	0.322	C	S	.	.	H	α-helix	trans	-56.4	-50.2	176.7	0	0	0	0	0	112.2	Y585 L589 A618 L619 S624 M625 Q626	Y585-A622 WeakPolarHBondContact OH-CB 3.46Å; Y585-A622 PolarHBondContact OH-O 2.91Å; L589-A622 HydrophobicContact CD1-CB 4.11Å; A618-A622 VanDerWaalsContact O-CB 3.26Å; A618-A622 WeakPolarHBondContact O-CB 3.41Å; A618-A622 PolarHBondContact O-N 2.79Å; L619-A622 PolarHBondContact O-N 2.8Å; A622-S624 VanDerWaalsContact C-N 3.34Å; A622-S624 PolarHBondContact O-N 2.98Å; A622-M625 PolarHBondContact O-N 3.46Å; A622-Q626 PolarHBondContact O-N 3.06Å; A622-Q626 VanDerWaalsContact O-N 3.14Å
623	M	91.6	Very high	88.3	Confident	113 Å²	113	64.8 Å²	64.8	56%	0.557	33%	0.327	S	S	*	.	H	α-helix	trans	-59.7	-43.6	175.1	-176.2	-171.2	69.6	0	0	111.9	L619 L620 I621 M625 Q626 L627	L619-M623 PolarHBondContact O-N 3.4Å; L620-M623 HydrophobicContact CD2-CE 4.27Å; L620-M623 PolarHBondContact O-N 3Å; I621-M623 PolarHBondContact O-N 3.49Å; M623-M625 PolarHBondContact O-N 3.49Å; M623-Q626 WeakPolarHBondContact O-CB 3.47Å; M623-Q626 PolarHBondContact O-N 2.85Å; M623-L627 PolarHBondContact O-N 3.47Å
624	S	88.5	Confident	87.7	Confident	23 Å²	23	64.4 Å²	64.4	16%	0.161	33%	0.325	C	S	.	.	H	α-helix	trans	-63.5	-40.2	179.5	-174.7	0	0	0	0	112.7	L620 I621 A622 Q626 L627 D628 N634	L620-S624 VanDerWaalsContact O-CB 3.29Å; L620-S624 WeakPolarHBondContact O-CB 3.07Å; L620-S624 PolarHBondContact O-N 3.02Å; I621-S624 WeakPolarHBondContact O-CB 3.45Å; I621-S624 PolarHBondContact O-N 3.34Å; I621-S624 VanDerWaalsContact O-N 3.16Å; A622-S624 VanDerWaalsContact C-N 3.34Å; A622-S624 PolarHBondContact O-N 2.98Å; S624-Q626 VanDerWaalsContact C-N 3.29Å; S624-Q626 PolarHBondContact O-N 2.9Å; S624-L627 PolarHBondContact O-N 3.23Å; S624-D628 PolarHBondContact O-N 3.3Å; S624-D628 VanDerWaalsContact O-N 3.14Å; S624-N634 PolarHBondContact O-ND2 3.38Å; S624-N634 WeakPolarHBondContact OG-CB 3.49Å; S624-N634 PolarHBondContact OG-OD1 2.93Å
625	M	88.3	Confident	87	Confident	1 Å²	1	65.5 Å²	65.5	1%	0.005	33%	0.331	C	S	.	.	H	α-helix	trans	-66.7	-32.4	177.1	-70.7	-54.3	102	0	0	112	Y585 F588 I592 I621 A622 M623 R629 N634	Y585-M625 HydrophobicContact CD2-CB 4Å; Y585-M625 HydrophobicContact CE2-CB 3.68Å; F588-M625 HydrophobicContact CB-SD 3.97Å; I592-M625 HydrophobicContact CD1-CE 3.43Å; I592-M625 VanDerWaalsContact CD1-CE 3.43Å; I592-M625 HydrophobicContact CD1-SD 3.54Å; I592-M625 VanDerWaalsContact CD1-SD 3.54Å; I621-M625 HydrophobicContact CG2-CG 4.23Å; I621-M625 WeakPolarHBondContact O-CG 3.36Å; I621-M625 PolarHBondContact O-N 3.42Å; A622-M625 PolarHBondContact O-N 3.46Å; M623-M625 PolarHBondContact O-N 3.49Å; M625-R629 WeakPolarHBondContact O-CB 3.31Å; M625-R629 PolarHBondContact O-N 2.93Å; M625-N634 HydrophobicContact CE-CB 3.57Å; M625-N634 WeakPolarHBondContact CE-O 3.33Å
626	Q	87.4	Confident	86.5	Confident	129 Å²	129	63 Å²	63	60%	0.603	32%	0.318	S	S	*	.	H	α-helix	trans	-68.7	-35.5	175.3	-165.3	66.5	12.7	0	0	112.4	A622 M623 S624	A622-Q626 PolarHBondContact O-N 3.06Å; A622-Q626 VanDerWaalsContact O-N 3.14Å; M623-Q626 WeakPolarHBondContact O-CB 3.47Å; M623-Q626 PolarHBondContact O-N 2.85Å; S624-Q626 VanDerWaalsContact C-N 3.29Å; S624-Q626 PolarHBondContact O-N 2.9Å
627	L	84.5	Confident	86.2	Confident	140 Å²	140	59.9 Å²	59.9	73%	0.733	31%	0.308	S	S	*	.	H	α-helix	trans	-72.4	-49.8	179.1	-69.5	173.2	0	0	0	112.3	M623 S624	M623-L627 PolarHBondContact O-N 3.47Å; S624-L627 PolarHBondContact O-N 3.23Å
628	D	79.6	Confident	86	Confident	42 Å²	42	60.7 Å²	60.7	23%	0.225	31%	0.312	C	S	.	.	H	α-helix	trans	-157.1	85.6	178.9	-172.7	11.2	0	0	0	112.5	K150 S624 K630 G631 N634	K150-D628 WeakPolarHBondContact CD-OD2 3.39Å; K150-D628 WeakPolarHBondContact CE-OD2 3.32Å; K150-D628 IonicContact NZ-OD1 2.98Å; K150-D628 PolarHBondContact NZ-OD1 3.09Å; K150-D628 IonicContact NZ-OD2 3.55Å; K150-D628 PolarHBondContact NZ-OD2 2.93Å; S624-D628 PolarHBondContact O-N 3.3Å; S624-D628 VanDerWaalsContact O-N 3.14Å; D628-K630 PolarHBondContact O-N 3.24Å; D628-K630 VanDerWaalsContact O-N 3.17Å; D628-K630 PolarHBondContact OD1-N 3.49Å; D628-G631 PolarHBondContact O-N 3.33Å; D628-G631 VanDerWaalsContact O-N 3.13Å; D628-G631 PolarHBondContact OD1-N 3.4Å; D628-N634 WeakPolarHBondContact CB-ND2 3.38Å; D628-N634 PolarHBondContact O-ND2 3.39Å
629	R	80.4	Confident	85.7	Confident	50 Å²	50	60.4 Å²	60.4	19%	0.189	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-25.7	179.8	67.6	-172.6	71.7	-172.1	-3.7	115	D581 M625	D581-R629 PolarHBondContact O-NH1 3.45Å; M625-R629 WeakPolarHBondContact O-CB 3.31Å; M625-R629 PolarHBondContact O-N 2.93Å
630	K	75.3	Confident	85.5	Confident	125 Å²	125	59 Å²	59	54%	0.543	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95	-4.6	-179	-61.3	-168.3	178.7	-173.2	0	113	K150 D628 L632	K150-K630 HydrophobicContact CB-CB 4.41Å; K150-K630 WeakPolarHBondContact CB-O 3.39Å; K150-K630 HydrophobicContact CD-CB 4.27Å; D628-K630 PolarHBondContact O-N 3.24Å; D628-K630 VanDerWaalsContact O-N 3.17Å; D628-K630 PolarHBondContact OD1-N 3.49Å; K630-L632 PolarHBondContact O-N 3.31Å
631	G	79.4	Confident	85.5	Confident	7 Å²	7	57.4 Å²	57.4	7%	0.072	29%	0.294	C	S	.	.			trans	-69.7	125	-176.6	0	0	0	0	0	112.1	D628 W633 N634 L635	D628-G631 PolarHBondContact O-N 3.33Å; D628-G631 VanDerWaalsContact O-N 3.13Å; D628-G631 PolarHBondContact OD1-N 3.4Å; G631-W633 VanDerWaalsContact C-N 3.28Å; G631-W633 PolarHBondContact O-N 3.14Å; G631-N634 WeakPolarHBondContact O-CB 3.35Å; G631-N634 PolarHBondContact O-N 3.33Å; G631-L635 PolarHBondContact O-N 3.27Å
632	L	79.5	Confident	85.4	Confident	27 Å²	27	57.1 Å²	57.1	14%	0.141	29%	0.293	C	S	.	.	H	α-helix	trans	-52.9	-43.6	179.4	178.1	66.8	0	0	0	112.8	K150 F152 K630 N634 L635 L636	K150-L632 WeakPolarHBondContact O-CB 3.17Å; K150-L632 PolarHBondContact O-N 2.92Å; F152-L632 HydrophobicContact CD2-CD2 3.91Å; F152-L632 HydrophobicContact CE2-CD1 4.45Å; F152-L632 HydrophobicContact CE2-CD2 3.42Å; F152-L632 VanDerWaalsContact CE2-CD2 3.42Å; F152-L632 HydrophobicContact CZ-CD2 3.9Å; K630-L632 PolarHBondContact O-N 3.31Å; L632-N634 VanDerWaalsContact C-N 3.27Å; L632-N634 PolarHBondContact O-N 3.5Å; L632-L635 PolarHBondContact O-N 3.3Å; L632-L636 WeakPolarHBondContact O-CB 3.41Å; L632-L636 PolarHBondContact O-N 2.98Å
633	W	81	Confident	85.3	Confident	164 Å²	164	59.5 Å²	59.5	62%	0.621	30%	0.302	S	S	*	.	H	α-helix	trans	-68.4	-25.7	-179.9	-75.2	109.3	0	0	0	113.4	G631 L635 G637 L640	G631-W633 VanDerWaalsContact C-N 3.28Å; G631-W633 PolarHBondContact O-N 3.14Å; W633-L635 VanDerWaalsContact C-N 3.31Å; W633-G637 VanDerWaalsContact O-CA 3.3Å; W633-G637 WeakPolarHBondContact O-CA 3.26Å; W633-G637 PolarHBondContact O-N 2.83Å; W633-L640 HydrophobicContact CZ3-CD1 4.46Å
634	N	82.6	Confident	85.3	Confident	36 Å²	36	59.5 Å²	59.5	19%	0.193	30%	0.303	C	S	.	.	H	α-helix	trans	-75.5	-26.4	177.3	-65.3	-6.1	0	0	0	111.3	S624 M625 D628 G631 L632 P638	S624-N634 PolarHBondContact O-ND2 3.38Å; S624-N634 WeakPolarHBondContact OG-CB 3.49Å; S624-N634 PolarHBondContact OG-OD1 2.93Å; M625-N634 HydrophobicContact CE-CB 3.57Å; M625-N634 WeakPolarHBondContact CE-O 3.33Å; D628-N634 WeakPolarHBondContact CB-ND2 3.38Å; D628-N634 PolarHBondContact O-ND2 3.39Å; G631-N634 WeakPolarHBondContact O-CB 3.35Å; G631-N634 PolarHBondContact O-N 3.33Å; L632-N634 VanDerWaalsContact C-N 3.27Å; L632-N634 PolarHBondContact O-N 3.5Å; N634-P638 VanDerWaalsContact O-CD 3.25Å; N634-P638 WeakPolarHBondContact O-CD 3.34Å; N634-P638 WeakPolarHBondContact O-CG 3.17Å
635	L	78.8	Confident	85.5	Confident	37 Å²	37	60.9 Å²	60.9	19%	0.194	31%	0.309	C	S	.	.	H	α-helix	trans	-79.6	-52.6	168.6	177.1	63.5	0	0	0	111.8	I592 G631 L632 W633 I639 Y686	I592-L635 HydrophobicContact CD1-CD1 3.95Å; I592-L635 HydrophobicContact CG1-CD1 3.71Å; G631-L635 PolarHBondContact O-N 3.27Å; L632-L635 PolarHBondContact O-N 3.3Å; W633-L635 VanDerWaalsContact C-N 3.31Å; L635-I639 HydrophobicContact CD1-CD1 4.21Å; L635-I639 HydrophobicContact CG-CD1 4.47Å; L635-I639 WeakPolarHBondContact O-CD1 3.33Å; L635-I639 WeakPolarHBondContact O-CG1 3.47Å; L635-Y686 HydrophobicContact CD2-CD1 4.02Å; L635-Y686 HydrophobicContact CD2-CE1 3.31Å
636	L	83.4	Confident	85.6	Confident	63 Å²	63	61.8 Å²	61.8	33%	0.33	31%	0.313	S	S	.	.	H	α-helix	trans	-76.8	-35.4	-170.4	-173.1	63.3	0	0	0	113	L632 I639 L640	L632-L636 WeakPolarHBondContact O-CB 3.41Å; L632-L636 PolarHBondContact O-N 2.98Å; L636-I639 PolarHBondContact O-N 3.1Å; L636-L640 HydrophobicContact CD1-CD1 4.29Å; L636-L640 HydrophobicContact CD1-CD2 4.35Å; L636-L640 HydrophobicContact CD1-CG 4.01Å; L636-L640 HydrophobicContact CD2-CD1 3.99Å; L636-L640 HydrophobicContact CG-CD1 3.68Å; L636-L640 HydrophobicContact CG-CG 3.87Å; L636-L640 WeakPolarHBondContact O-CG 3.48Å; L636-L640 PolarHBondContact O-N 2.97Å
637	G	87.8	Confident	85.7	Confident	26 Å²	26	58.9 Å²	58.9	27%	0.268	30%	0.304	S	S	.	.	H	α-helix	trans	-56.9	-54.1	-176.2	0	0	0	0	0	113.7	W633 I639 L640 C641	W633-G637 VanDerWaalsContact O-CA 3.3Å; W633-G637 WeakPolarHBondContact O-CA 3.26Å; W633-G637 PolarHBondContact O-N 2.83Å; G637-I639 VanDerWaalsContact C-N 3.3Å; G637-I639 PolarHBondContact O-N 3.4Å; G637-L640 PolarHBondContact O-N 3.14Å; G637-C641 WeakPolarHBondContact O-CB 3.42Å; G637-C641 PolarHBondContact O-N 3.29Å
638	P	89.4	Confident	85.9	Confident	22 Å²	22	55.7 Å²	55.7	14%	0.143	29%	0.29	C	S	.	.	H	α-helix	trans	-58.2	-40.7	175.3	-25.8	35.1	0	0	0	112.7	I592 W596 I621 N634 C641 A642	I592-P638 HydrophobicContact CG2-CB 3.97Å; I592-P638 HydrophobicContact CG2-CG 4.17Å; W596-P638 HydrophobicContact CE3-CB 4.13Å; W596-P638 VanDerWaalsContact CE3-O 3.28Å; W596-P638 HydrophobicContact CZ3-CB 4.47Å; W596-P638 WeakPolarHBondContact CZ3-O 3.21Å; I621-P638 HydrophobicContact CD1-CB 4.24Å; I621-P638 HydrophobicContact CG1-CB 4.07Å; I621-P638 HydrophobicContact CG1-CG 4.04Å; N634-P638 VanDerWaalsContact O-CD 3.25Å; N634-P638 WeakPolarHBondContact O-CD 3.34Å; N634-P638 WeakPolarHBondContact O-CG 3.17Å; P638-C641 PolarHBondContact O-N 3.04Å; P638-A642 WeakPolarHBondContact O-CB 3.46Å; P638-A642 PolarHBondContact O-N 2.89Å
639	I	88.2	Confident	86.3	Confident	31 Å²	31	54.3 Å²	54.3	16%	0.159	28%	0.284	C	S	.	.	H	α-helix	trans	-64.3	-48.6	-179.9	-60.2	174.6	0	0	0	110.7	I595 I599 L635 L636 G637 C641 A642 I643	I595-I639 HydrophobicContact CD1-CD1 4.04Å; I595-I639 HydrophobicContact CG2-CD1 4.27Å; I595-I639 HydrophobicContact CG2-CG1 3.89Å; I595-I639 HydrophobicContact CG2-CG2 4.35Å; I599-I639 HydrophobicContact CD1-CG2 4.36Å; L635-I639 HydrophobicContact CD1-CD1 4.21Å; L635-I639 HydrophobicContact CG-CD1 4.47Å; L635-I639 WeakPolarHBondContact O-CD1 3.33Å; L635-I639 WeakPolarHBondContact O-CG1 3.47Å; L636-I639 PolarHBondContact O-N 3.1Å; G637-I639 VanDerWaalsContact C-N 3.3Å; G637-I639 PolarHBondContact O-N 3.4Å; I639-C641 VanDerWaalsContact C-N 3.34Å; I639-C641 PolarHBondContact O-N 3.12Å; I639-A642 PolarHBondContact O-N 3.31Å; I639-I643 HydrophobicContact CG2-CD1 3.94Å; I639-I643 VanDerWaalsContact O-CG1 3.3Å; I639-I643 WeakPolarHBondContact O-CG1 3.39Å; I639-I643 PolarHBondContact O-N 3.2Å
640	L	90.8	Very high	86.7	Confident	84 Å²	84	53.6 Å²	53.6	44%	0.44	28%	0.281	S	S	.	.	H	α-helix	trans	-62.1	-41.8	177.6	-70.2	177.4	0	0	0	111.9	W633 L636 G637 I643 L644	W633-L640 HydrophobicContact CZ3-CD1 4.46Å; L636-L640 HydrophobicContact CD1-CD1 4.29Å; L636-L640 HydrophobicContact CD1-CD2 4.35Å; L636-L640 HydrophobicContact CD1-CG 4.01Å; L636-L640 HydrophobicContact CD2-CD1 3.99Å; L636-L640 HydrophobicContact CG-CD1 3.68Å; L636-L640 HydrophobicContact CG-CG 3.87Å; L636-L640 WeakPolarHBondContact O-CG 3.48Å; L636-L640 PolarHBondContact O-N 2.97Å; G637-L640 PolarHBondContact O-N 3.14Å; L640-I643 PolarHBondContact O-N 3.35Å; L640-L644 WeakPolarHBondContact O-CB 3.49Å; L640-L644 PolarHBondContact O-N 3.28Å
641	C	92.6	Very high	87.2	Confident	59 Å²	59	51.5 Å²	51.5	40%	0.399	28%	0.279	S	S	.	.	H	α-helix	trans	-61.6	-45.2	176.2	-176.9	0	0	0	0	111.4	W596 G637 P638 I639 I643 L644 L645	W596-C641 HydrophobicContact CZ3-CB 4.12Å; G637-C641 WeakPolarHBondContact O-CB 3.42Å; G637-C641 PolarHBondContact O-N 3.29Å; P638-C641 PolarHBondContact O-N 3.04Å; I639-C641 VanDerWaalsContact C-N 3.34Å; I639-C641 PolarHBondContact O-N 3.12Å; C641-I643 PolarHBondContact O-N 3.44Å; C641-L644 WeakPolarHBondContact O-CB 3.29Å; C641-L644 PolarHBondContact O-N 3.49Å; C641-L645 WeakPolarHBondContact O-CG 3.24Å; C641-L645 PolarHBondContact O-N 2.91Å
642	A	91	Very high	87.5	Confident	0 Å²	0	58 Å²	58	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-62.6	-42.6	176.7	0	0	0	0	0	112.3	W596 I599 P638 I639 L645 M646	W596-A642 HydrophobicContact CD2-CB 4.41Å; W596-A642 HydrophobicContact CE3-CB 3.66Å; W596-A642 HydrophobicContact CZ3-CB 3.83Å; I599-A642 HydrophobicContact CB-CB 3.87Å; I599-A642 HydrophobicContact CD1-CB 3.99Å; I599-A642 VanDerWaalsContact CG2-C 3.46Å; I599-A642 HydrophobicContact CG2-CB 3.67Å; I599-A642 VanDerWaalsContact CG2-O 3.3Å; I599-A642 WeakPolarHBondContact CG2-O 3.34Å; P638-A642 WeakPolarHBondContact O-CB 3.46Å; P638-A642 PolarHBondContact O-N 2.89Å; I639-A642 PolarHBondContact O-N 3.31Å; A642-L645 PolarHBondContact O-N 3.39Å; A642-M646 WeakPolarHBondContact O-CB 3.39Å; A642-M646 PolarHBondContact O-N 3Å
643	I	90.9	Very high	87.6	Confident	70 Å²	70	59.5 Å²	59.5	36%	0.359	31%	0.306	S	S	.	.	H	α-helix	trans	-62	-44.1	176.5	-68.1	169.1	0	0	0	110.3	I599 I639 L640 C641 L645 M646 V647	I599-I643 HydrophobicContact CD1-CG1 4.08Å; I639-I643 HydrophobicContact CG2-CD1 3.94Å; I639-I643 VanDerWaalsContact O-CG1 3.3Å; I639-I643 WeakPolarHBondContact O-CG1 3.39Å; I639-I643 PolarHBondContact O-N 3.2Å; L640-I643 PolarHBondContact O-N 3.35Å; C641-I643 PolarHBondContact O-N 3.44Å; I643-L645 PolarHBondContact O-N 3.08Å; I643-M646 PolarHBondContact O-N 3.28Å; I643-V647 HydrophobicContact CG2-CG2 4.15Å; I643-V647 WeakPolarHBondContact O-CB 3.37Å; I643-V647 VanDerWaalsContact O-CG2 3.31Å; I643-V647 WeakPolarHBondContact O-CG2 3.34Å; I643-V647 PolarHBondContact O-N 3.21Å
644	L	93.1	Very high	87.7	Confident	114 Å²	114	53.3 Å²	53.3	60%	0.597	29%	0.288	S	S	*	.	H	α-helix	trans	-59.1	-45.8	176.6	-175.1	76.1	0	0	0	111.4	L640 C641 M646 V647 T648	L640-L644 WeakPolarHBondContact O-CB 3.49Å; L640-L644 PolarHBondContact O-N 3.28Å; C641-L644 WeakPolarHBondContact O-CB 3.29Å; C641-L644 PolarHBondContact O-N 3.49Å; L644-M646 VanDerWaalsContact C-N 3.31Å; L644-M646 PolarHBondContact O-N 3.25Å; L644-V647 PolarHBondContact O-N 3.41Å; L644-T648 WeakPolarHBondContact O-CB 3.3Å; L644-T648 VanDerWaalsContact O-CG2 3.26Å; L644-T648 WeakPolarHBondContact O-CG2 3.24Å; L644-T648 PolarHBondContact O-N 3.13Å; L644-T648 PolarHBondContact O-OG1 3.34Å
645	L	91.9	Very high	87.8	Confident	51 Å²	51	56.8 Å²	56.8	27%	0.267	31%	0.31	S	S	.	.	H	α-helix	trans	-61.9	-39.1	176.4	-70.6	173.5	0	0	0	112.1	W596 L600 L613 C641 A642 I643 T648 S649	W596-L645 HydrophobicContact CH2-CD1 4.25Å; L600-L645 HydrophobicContact CD2-CB 4.33Å; L600-L645 HydrophobicContact CD2-CD1 3.99Å; L613-L645 HydrophobicContact CD1-CD1 4.44Å; C641-L645 WeakPolarHBondContact O-CG 3.24Å; C641-L645 PolarHBondContact O-N 2.91Å; A642-L645 PolarHBondContact O-N 3.39Å; I643-L645 PolarHBondContact O-N 3.08Å; L645-T648 WeakPolarHBondContact CA-OG1 3.48Å; L645-T648 PolarHBondContact O-OG1 2.94Å; L645-S649 WeakPolarHBondContact O-CB 3.27Å; L645-S649 PolarHBondContact O-N 3.16Å; L645-S649 VanDerWaalsContact O-N 3.09Å
646	M	90.3	Very high	87.9	Confident	21 Å²	21	64 Å²	64	10%	0.103	33%	0.334	C	S	.	.	H	α-helix	trans	-66.3	-50	175.9	-178.9	-174.4	67.7	0	0	111.8	I599 M602 A603 A642 I643 L644 T648 S649 W650	I599-M646 HydrophobicContact CG2-CB 3.93Å; I599-M646 HydrophobicContact CG2-SD 4.12Å; M602-M646 HydrophobicContact CB-CG 4.41Å; M602-M646 HydrophobicContact CB-SD 3.6Å; M602-M646 HydrophobicContact CE-SD 3.7Å; M602-M646 HydrophobicContact SD-SD 4.22Å; A603-M646 HydrophobicContact CB-CB 4.02Å; A603-M646 HydrophobicContact CB-CG 4.18Å; A642-M646 WeakPolarHBondContact O-CB 3.39Å; A642-M646 PolarHBondContact O-N 3Å; I643-M646 PolarHBondContact O-N 3.28Å; L644-M646 VanDerWaalsContact C-N 3.31Å; L644-M646 PolarHBondContact O-N 3.25Å; M646-T648 PolarHBondContact O-N 2.89Å; M646-S649 PolarHBondContact O-N 3.23Å; M646-W650 HydrophobicContact CE-CH2 4.43Å; M646-W650 HydrophobicContact CG-CD2 4.28Å; M646-W650 HydrophobicContact CG-CZ2 3.98Å; M646-W650 VanDerWaalsContact O-CD1 3.27Å; M646-W650 PolarHBondContact O-N 3.11Å; M646-W650 HydrophobicContact SD-CH2 4.15Å; M646-W650 HydrophobicContact SD-CZ2 3.7Å
647	V	89.8	Confident	87.6	Confident	68 Å²	68	69.5 Å²	69.5	41%	0.412	35%	0.351	S	S	.	.	H	α-helix	trans	-61	-45.3	-179.5	171.2	0	0	0	0	110.5	I643 L644 S649 W650 V651	I643-V647 HydrophobicContact CG2-CG2 4.15Å; I643-V647 WeakPolarHBondContact O-CB 3.37Å; I643-V647 VanDerWaalsContact O-CG2 3.31Å; I643-V647 WeakPolarHBondContact O-CG2 3.34Å; I643-V647 PolarHBondContact O-N 3.21Å; L644-V647 PolarHBondContact O-N 3.41Å; V647-S649 PolarHBondContact O-N 3.37Å; V647-W650 PolarHBondContact O-N 2.95Å; V647-V651 HydrophobicContact CG1-CG2 4.22Å; V647-V651 WeakPolarHBondContact O-CB 3.48Å; V647-V651 VanDerWaalsContact O-CG2 3.27Å; V647-V651 WeakPolarHBondContact O-CG2 3.44Å; V647-V651 PolarHBondContact O-N 3.25Å
648	T	89.3	Confident	86.9	Confident	72 Å²	72	79.3 Å²	79.3	44%	0.442	38%	0.379	S	S	.	.	H	α-helix	trans	-62.5	-42.8	177.6	51.7	0	0	0	0	112	L644 L645 M646 W650 V651 Y652	L644-T648 WeakPolarHBondContact O-CB 3.3Å; L644-T648 VanDerWaalsContact O-CG2 3.26Å; L644-T648 WeakPolarHBondContact O-CG2 3.24Å; L644-T648 PolarHBondContact O-N 3.13Å; L644-T648 PolarHBondContact O-OG1 3.34Å; L645-T648 WeakPolarHBondContact CA-OG1 3.48Å; L645-T648 PolarHBondContact O-OG1 2.94Å; M646-T648 PolarHBondContact O-N 2.89Å; T648-W650 PolarHBondContact O-N 3.5Å; T648-V651 PolarHBondContact O-N 3.18Å; T648-Y652 VanDerWaalsContact O-CB 3.3Å; T648-Y652 WeakPolarHBondContact O-CB 3.4Å; T648-Y652 PolarHBondContact O-N 3.03Å
649	S	87.8	Confident	86	Confident	13 Å²	13	85.4 Å²	85.4	9%	0.091	41%	0.406	C	S	.	.	H	α-helix	trans	-60.4	-43.2	173.6	177.8	0	0	0	0	112.3	A603 L645 M646 V647 R653	A603-S649 PolarHBondContact O-OG 3.08Å; L645-S649 WeakPolarHBondContact O-CB 3.27Å; L645-S649 PolarHBondContact O-N 3.16Å; L645-S649 VanDerWaalsContact O-N 3.09Å; M646-S649 PolarHBondContact O-N 3.23Å; V647-S649 PolarHBondContact O-N 3.37Å; S649-R653 WeakPolarHBondContact O-CG 3.43Å; S649-R653 PolarHBondContact O-N 3.09Å; S649-R653 VanDerWaalsContact O-N 3.11Å
650	W	87.6	Confident	84.9	Confident	35 Å²	35	89.2 Å²	89.2	13%	0.133	43%	0.434	C	S	.	.	H	α-helix	trans	-66.7	-47.1	178.5	-72.1	14.7	0	0	0	111.5	M602 M646 V647 T648 Y652 R653 C654 Y661 L672	M602-W650 HydrophobicContact CB-CZ2 4.44Å; M602-W650 PolarHBondContact O-NE1 3.03Å; M646-W650 HydrophobicContact CE-CH2 4.43Å; M646-W650 HydrophobicContact CG-CD2 4.28Å; M646-W650 HydrophobicContact CG-CZ2 3.98Å; M646-W650 VanDerWaalsContact O-CD1 3.27Å; M646-W650 PolarHBondContact O-N 3.11Å; M646-W650 HydrophobicContact SD-CH2 4.15Å; M646-W650 HydrophobicContact SD-CZ2 3.7Å; V647-W650 PolarHBondContact O-N 2.95Å; T648-W650 PolarHBondContact O-N 3.5Å; W650-Y652 PolarHBondContact O-N 3.41Å; W650-R653 PolarHBondContact O-N 3.36Å; W650-R653 VanDerWaalsContact O-N 3.17Å; W650-C654 PolarHBondContact O-N 3.37Å; W650-C654 PolarHBondContact O-SG 3.48Å; W650-Y661 HydrophobicContact CB-CD1 4.38Å; W650-Y661 AromaticContact CD1-CD1 3.83Å; W650-Y661 AromaticContact CD1-CE1 3.8Å; W650-Y661 HydrophobicContact CD2-CD1 4.15Å; W650-Y661 HydrophobicContact CD2-CE1 4.41Å; W650-Y661 AromaticContact CG-CD1 3.86Å; W650-Y661 HydrophobicContact CG-CD1 3.86Å; W650-Y661 HydrophobicContact CG-CE1 4.24Å; W650-Y661 AromaticContact NE1-CE1 3.69Å; W650-L672 HydrophobicContact CH2-CD1 4.35Å; W650-L672 HydrophobicContact CH2-CD2 4.47Å
651	V	86.8	Confident	83.6	Confident	82 Å²	82	86.5 Å²	86.5	50%	0.497	42%	0.418	S	S	.	.	H	α-helix	trans	-58.9	-46.6	176.7	171.1	0	0	0	0	110.9	V647 T648 R653 C654 V655	V647-V651 HydrophobicContact CG1-CG2 4.22Å; V647-V651 WeakPolarHBondContact O-CB 3.48Å; V647-V651 VanDerWaalsContact O-CG2 3.27Å; V647-V651 WeakPolarHBondContact O-CG2 3.44Å; V647-V651 PolarHBondContact O-N 3.25Å; T648-V651 PolarHBondContact O-N 3.18Å; V651-R653 VanDerWaalsContact C-N 3.28Å; V651-R653 PolarHBondContact O-N 3.15Å; V651-C654 WeakPolarHBondContact O-CB 3.34Å; V651-C654 PolarHBondContact O-N 2.97Å; V651-C654 VanDerWaalsContact O-N 3.11Å; V651-V655 HydrophobicContact CG1-CG2 4.37Å; V651-V655 WeakPolarHBondContact O-CG2 3.3Å; V651-V655 PolarHBondContact O-N 2.98Å
652	Y	85.8	Confident	82.3	Confident	142 Å²	142	83.8 Å²	83.8	56%	0.557	40%	0.4	S	S	*	.	H	α-helix	trans	-56.5	-42.5	176.4	173.6	-107.7	0	0	0	112.1	T648 W650 R656	T648-Y652 VanDerWaalsContact O-CB 3.3Å; T648-Y652 WeakPolarHBondContact O-CB 3.4Å; T648-Y652 PolarHBondContact O-N 3.03Å; W650-Y652 PolarHBondContact O-N 3.41Å; Y652-R656 WeakPolarHBondContact O-CB 3.49Å; Y652-R656 PolarHBondContact O-N 2.62Å; Y652-R656 PolarHBondContact OH-NH1 3.26Å
653	R	81.6	Confident	81	Confident	60 Å²	60	89.1 Å²	89.1	23%	0.226	43%	0.434	C	S	.	.	H	α-helix	trans	-68.2	-39.3	175.4	-72.5	176.8	-179.7	-146.3	-8.3	112.9	R604 S649 W650 V651 R656 R657	R604-R653 PolarHBondContact O-NH2 3.01Å; S649-R653 WeakPolarHBondContact O-CG 3.43Å; S649-R653 PolarHBondContact O-N 3.09Å; S649-R653 VanDerWaalsContact O-N 3.11Å; W650-R653 PolarHBondContact O-N 3.36Å; W650-R653 VanDerWaalsContact O-N 3.17Å; V651-R653 VanDerWaalsContact C-N 3.28Å; V651-R653 PolarHBondContact O-N 3.15Å; R653-R656 PolarHBondContact O-N 3.13Å; R653-R657 WeakPolarHBondContact O-CB 3.28Å; R653-R657 WeakPolarHBondContact O-CG 3.41Å; R653-R657 PolarHBondContact O-N 3.46Å
654	C	81.8	Confident	80.3	Confident	34 Å²	34	88.3 Å²	88.3	23%	0.23	44%	0.435	C	S	.	.	H	α-helix	trans	-60.4	-46.9	176.3	-67.6	0	0	0	0	111.1	W650 V651 R657 R658 H659 Y661	W650-C654 PolarHBondContact O-N 3.37Å; W650-C654 PolarHBondContact O-SG 3.48Å; V651-C654 WeakPolarHBondContact O-CB 3.34Å; V651-C654 PolarHBondContact O-N 2.97Å; V651-C654 VanDerWaalsContact O-N 3.11Å; C654-R657 PolarHBondContact O-N 3.49Å; C654-R658 WeakPolarHBondContact O-CA 3.29Å; C654-R658 PolarHBondContact O-N 2.92Å; C654-H659 WeakPolarHBondContact CA-O 3.27Å; C654-H659 PolarHBondContact O-N 3.34Å; C654-Y661 PolarHBondContact SG-N 3.38Å
655	V	84.4	Confident	79.5	Confident	108 Å²	108	90.8 Å²	90.8	66%	0.655	44%	0.436	S	S	*	.	H	α-helix	trans	-63.7	-46.3	178	174.3	0	0	0	0	110.7	V651 R657	V651-V655 HydrophobicContact CG1-CG2 4.37Å; V651-V655 WeakPolarHBondContact O-CG2 3.3Å; V651-V655 PolarHBondContact O-N 2.98Å; V655-R657 PolarHBondContact O-N 3.15Å
656	R	81.8	Confident	78.9	Confident	189 Å²	189	95.9 Å²	95.9	71%	0.713	45%	0.452	S	S	*	.	H	α-helix	trans	-68.4	-32	-178.5	-170.2	170.5	178.1	175.5	-2.3	113.7	Y652 R653	Y652-R656 WeakPolarHBondContact O-CB 3.49Å; Y652-R656 PolarHBondContact O-N 2.62Å; Y652-R656 PolarHBondContact OH-NH1 3.26Å; R653-R656 PolarHBondContact O-N 3.13Å
657	R	76.9	Confident	78.4	Confident	179 Å²	179	96.8 Å²	96.8	68%	0.675	45%	0.454	S	S	*	.	H	α-helix	trans	-102.5	-1.9	-177.7	-62.8	-173.3	178.2	-161.7	-0.9	114.3	R653 C654 V655 H659	R653-R657 WeakPolarHBondContact O-CB 3.28Å; R653-R657 WeakPolarHBondContact O-CG 3.41Å; R653-R657 PolarHBondContact O-N 3.46Å; C654-R657 PolarHBondContact O-N 3.49Å; V655-R657 PolarHBondContact O-N 3.15Å; R657-H659 PolarHBondContact O-N 3.01Å; R657-H659 VanDerWaalsContact O-N 3.09Å
658	R	72.4	Confident	78	Confident	231 Å²	231	99.3 Å²	99.3	87%	0.872	46%	0.457	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.3	22.7	-176.2	-62.6	-171.5	177.2	179.9	-0.1	115.5	C654	C654-R658 WeakPolarHBondContact O-CA 3.29Å; C654-R658 PolarHBondContact O-N 2.92Å
659	H	71.4	Confident	77.7	Confident	151 Å²	151	99.3 Å²	99.3	70%	0.699	46%	0.456	S	S	*	.	S	Bend	trans	-140	146.5	176.4	-83.4	-51.2	0	0	0	110.9	C654 R657 Y661	C654-H659 WeakPolarHBondContact CA-O 3.27Å; C654-H659 PolarHBondContact O-N 3.34Å; R657-H659 PolarHBondContact O-N 3.01Å; R657-H659 VanDerWaalsContact O-N 3.09Å; H659-Y661 PolarHBondContact O-N 3.41Å
660	C	65.9	Low	77.4	Confident	110 Å²	110	104.7 Å²	104.7	74%	0.743	48%	0.478	S	S	*	.	P	Polyproline II helix	trans	-64.6	126.2	178.4	-62.6	0	0	0	0	111.3	P662	C660-P662 CarbonylContact O-C 3.58Å
661	Y	62.7	Low	77.2	Confident	27 Å²	27	107.3 Å²	107.3	11%	0.106	49%	0.491	C	S	.	.	S	Bend	trans	-101.5	133.4	173.6	-178.9	-93.1	0	0	0	109.4	R604 W650 C654 H659	R604-Y661 WeakPolarHBondContact CD-OH 3.5Å; R604-Y661 PolarHBondContact NE-OH 3.13Å; W650-Y661 HydrophobicContact CB-CD1 4.38Å; W650-Y661 AromaticContact CD1-CD1 3.83Å; W650-Y661 AromaticContact CD1-CE1 3.8Å; W650-Y661 HydrophobicContact CD2-CD1 4.15Å; W650-Y661 HydrophobicContact CD2-CE1 4.41Å; W650-Y661 AromaticContact CG-CD1 3.86Å; W650-Y661 HydrophobicContact CG-CD1 3.86Å; W650-Y661 HydrophobicContact CG-CE1 4.24Å; W650-Y661 AromaticContact NE1-CE1 3.69Å; C654-Y661 PolarHBondContact SG-N 3.38Å; H659-Y661 PolarHBondContact O-N 3.41Å
662	P	65.6	Low	77.1	Confident	3 Å²	3	104.1 Å²	104.1	2%	0.019	47%	0.471	C	S	.	.	S	Bend	cis	-79.2	141.7	-0.5	20.6	-19.8	0	0	0	114.3	C660 S664 W668 L672	C660-P662 CarbonylContact O-C 3.58Å; P662-S664 VanDerWaalsContact C-N 3.32Å; P662-S664 PolarHBondContact O-N 2.88Å; P662-W668 HydrophobicContact CG-CZ2 4.38Å; P662-W668 PolarHBondContact O-NE1 3.49Å; P662-W668 VanDerWaalsContact O-NE1 3.09Å; P662-L672 HydrophobicContact CG-CD1 3.59Å
663	P	64.5	Low	77.1	Confident	112 Å²	112	102.7 Å²	102.7	73%	0.727	47%	0.472	S	S	*	.			trans	-78.5	-2.8	-165.6	30.2	-37.1	0	0	0	115.8
664	S	75.3	Confident	77.4	Confident	52 Å²	52	101.5 Å²	101.5	36%	0.364	47%	0.472	S	S	.	.			trans	-111.1	116.8	-174.3	-178.2	0	0	0	0	111.6	P662 R666 R667 W668	P662-S664 VanDerWaalsContact C-N 3.32Å; P662-S664 PolarHBondContact O-N 2.88Å; S664-R666 PolarHBondContact O-N 3.4Å; S664-R667 WeakPolarHBondContact O-CB 3.45Å; S664-R667 PolarHBondContact O-N 3.09Å; S664-W668 PolarHBondContact O-N 2.92Å
665	W	76	Confident	77.7	Confident	167 Å²	167	99.9 Å²	99.9	63%	0.633	46%	0.461	S	S	*	.	H	α-helix	trans	-57.8	-33.1	175.5	74	-94.3	0	0	0	112.7	R667 W668 V669	W665-R667 VanDerWaalsContact C-N 3.26Å; W665-R667 PolarHBondContact O-N 3.47Å; W665-W668 WeakPolarHBondContact O-CB 3.26Å; W665-W668 PolarHBondContact O-N 3.41Å; W665-W668 VanDerWaalsContact O-N 3.14Å; W665-V669 HydrophobicContact CE3-CG2 4.03Å; W665-V669 HydrophobicContact CZ3-CG2 4.38Å; W665-V669 PolarHBondContact O-N 3.04Å
666	R	79.1	Confident	77.8	Confident	158 Å²	158	97.5 Å²	97.5	60%	0.596	45%	0.453	S	S	*	.	H	α-helix	trans	-61.8	-35	175.2	-65.1	-176	-178.6	177.8	0.2	111.8	S664 F670	S664-R666 PolarHBondContact O-N 3.4Å; R666-F670 HydrophobicContact CB-CD2 4.29Å; R666-F670 WeakPolarHBondContact O-CB 3.17Å; R666-F670 WeakPolarHBondContact O-CD2 3.43Å; R666-F670 PolarHBondContact O-N 3.46Å
667	R	80.5	Confident	78.2	Confident	40 Å²	40	92.9 Å²	92.9	15%	0.151	44%	0.442	C	S	.	.	H	α-helix	trans	-70.3	-34.5	176.7	-171.9	172.1	178.8	-172.5	-5.8	112	S664 W665 F671 L672	S664-R667 WeakPolarHBondContact O-CB 3.45Å; S664-R667 PolarHBondContact O-N 3.09Å; W665-R667 VanDerWaalsContact C-N 3.26Å; W665-R667 PolarHBondContact O-N 3.47Å; R667-F671 WeakPolarHBondContact O-CB 3.38Å; R667-F671 PolarHBondContact O-N 3.44Å; R667-L672 PolarHBondContact O-N 3.34Å
668	W	80.6	Confident	78.7	Confident	121 Å²	121	85.7 Å²	85.7	46%	0.458	42%	0.419	S	S	.	.	I	π-helix	trans	-65.4	-51.7	173.9	-78.5	93.9	0	0	0	111.5	P662 S664 W665 L672 L673	P662-W668 HydrophobicContact CG-CZ2 4.38Å; P662-W668 PolarHBondContact O-NE1 3.49Å; P662-W668 VanDerWaalsContact O-NE1 3.09Å; S664-W668 PolarHBondContact O-N 2.92Å; W665-W668 WeakPolarHBondContact O-CB 3.26Å; W665-W668 PolarHBondContact O-N 3.41Å; W665-W668 VanDerWaalsContact O-N 3.14Å; W668-L672 HydrophobicContact CD2-CD1 3.91Å; W668-L672 HydrophobicContact CE3-CB 4.33Å; W668-L672 HydrophobicContact CE3-CD1 4.07Å; W668-L672 HydrophobicContact CG-CD1 4.33Å; W668-L672 HydrophobicContact CZ2-CD1 4.48Å; W668-L672 HydrophobicContact CZ3-CD1 4.42Å; W668-L672 PolarHBondContact O-N 3.22Å; W668-L673 VanDerWaalsContact O-CB 3.27Å; W668-L673 WeakPolarHBondContact O-CB 3.13Å; W668-L673 PolarHBondContact O-N 2.85Å
669	V	83.3	Confident	79.4	Confident	72 Å²	72	76.5 Å²	76.5	44%	0.436	39%	0.392	S	S	.	.	I	π-helix	trans	-70.9	-42.2	-174.5	175.9	0	0	0	0	113.2	W665 P674	W665-V669 HydrophobicContact CE3-CG2 4.03Å; W665-V669 HydrophobicContact CZ3-CG2 4.38Å; W665-V669 PolarHBondContact O-N 3.04Å; V669-P674 VanDerWaalsContact O-CD 3.25Å; V669-P674 WeakPolarHBondContact O-CD 3.23Å; V669-P674 WeakPolarHBondContact O-CG 3.45Å
670	F	82.7	Confident	80.1	Confident	126 Å²	126	74.5 Å²	74.5	55%	0.553	39%	0.386	S	S	*	.	I	π-helix	trans	-96.6	-11.9	-171.6	-66.8	-70.2	0	0	0	115.2	R666	R666-F670 HydrophobicContact CB-CD2 4.29Å; R666-F670 WeakPolarHBondContact O-CB 3.17Å; R666-F670 WeakPolarHBondContact O-CD2 3.43Å; R666-F670 PolarHBondContact O-N 3.46Å
671	F	83.4	Confident	81.2	Confident	90 Å²	90	72.7 Å²	72.7	40%	0.395	37%	0.369	S	S	.	.	I	π-helix	trans	-131.2	-55.7	-174.5	-63.4	-87.8	0	0	0	112.7	R667 G675	R667-F671 WeakPolarHBondContact O-CB 3.38Å; R667-F671 PolarHBondContact O-N 3.44Å; F671-G675 PolarHBondContact O-N 3.13Å; F671-G675 VanDerWaalsContact O-N 3.13Å
672	L	83.8	Confident	82.3	Confident	15 Å²	15	71.5 Å²	71.5	8%	0.079	36%	0.364	C	S	.	.	I	π-helix	trans	-73.1	-44.2	-174.9	-65.3	175	0	0	0	113.1	W650 P662 R667 W668 G675 A676 L713	W650-L672 HydrophobicContact CH2-CD1 4.35Å; W650-L672 HydrophobicContact CH2-CD2 4.47Å; P662-L672 HydrophobicContact CG-CD1 3.59Å; R667-L672 PolarHBondContact O-N 3.34Å; W668-L672 HydrophobicContact CD2-CD1 3.91Å; W668-L672 HydrophobicContact CE3-CB 4.33Å; W668-L672 HydrophobicContact CE3-CD1 4.07Å; W668-L672 HydrophobicContact CG-CD1 4.33Å; W668-L672 HydrophobicContact CZ2-CD1 4.48Å; W668-L672 HydrophobicContact CZ3-CD1 4.42Å; W668-L672 PolarHBondContact O-N 3.22Å; L672-G675 PolarHBondContact O-N 2.98Å; L672-A676 WeakPolarHBondContact O-CB 3.42Å; L672-A676 PolarHBondContact O-N 3.18Å; L672-L713 HydrophobicContact CD2-CD2 4.13Å
673	L	86.3	Confident	83.1	Confident	111 Å²	111	75.2 Å²	75.2	58%	0.581	39%	0.387	S	S	*	.	H	α-helix	trans	-68.3	-46.2	-178.7	-162.4	160.9	0	0	0	111.8	W668 G675 A676 L677	W668-L673 VanDerWaalsContact O-CB 3.27Å; W668-L673 WeakPolarHBondContact O-CB 3.13Å; W668-L673 PolarHBondContact O-N 2.85Å; L673-G675 PolarHBondContact O-N 3.29Å; L673-A676 PolarHBondContact O-N 2.98Å; L673-L677 WeakPolarHBondContact O-CB 3.29Å; L673-L677 PolarHBondContact O-N 3.35Å
674	P	88.3	Confident	84	Confident	36 Å²	36	72.5 Å²	72.5	23%	0.234	37%	0.37	C	S	.	.	H	α-helix	trans	-60.7	-42.7	173.1	-24.7	35.9	0	0	0	112.8	V669 L677 C678	V669-P674 VanDerWaalsContact O-CD 3.25Å; V669-P674 WeakPolarHBondContact O-CD 3.23Å; V669-P674 WeakPolarHBondContact O-CG 3.45Å; P674-L677 PolarHBondContact O-N 3.39Å; P674-C678 PolarHBondContact O-N 3.42Å; P674-C678 PolarHBondContact O-SG 3.3Å
675	G	87.6	Confident	84.4	Confident	0 Å²	0	71.7 Å²	71.7	0%	0	36%	0.361	C	S	.	.	H	α-helix	trans	-63.5	-45.8	177	0	0	0	0	0	112.9	F671 L672 L673 L677 C678 A679 C709	F671-G675 PolarHBondContact O-N 3.13Å; F671-G675 VanDerWaalsContact O-N 3.13Å; L672-G675 PolarHBondContact O-N 2.98Å; L673-G675 PolarHBondContact O-N 3.29Å; G675-L677 VanDerWaalsContact C-N 3.34Å; G675-L677 PolarHBondContact O-N 2.95Å; G675-C678 PolarHBondContact O-N 3.4Å; G675-A679 PolarHBondContact O-N 3.4Å; G675-C709 PolarHBondContact O-SG 3Å
676	A	86.3	Confident	84.5	Confident	58 Å²	58	66 Å²	66	48%	0.479	34%	0.34	S	S	.	.	H	α-helix	trans	-64.1	-38.3	177	0	0	0	0	0	112.4	L672 L673 A679 L680	L672-A676 WeakPolarHBondContact O-CB 3.42Å; L672-A676 PolarHBondContact O-N 3.18Å; L673-A676 PolarHBondContact O-N 2.98Å; A676-A679 PolarHBondContact O-N 3.4Å; A676-L680 WeakPolarHBondContact O-CB 3.36Å; A676-L680 PolarHBondContact O-N 3.49Å
677	L	89.5	Confident	84.2	Confident	91 Å²	91	60.4 Å²	60.4	48%	0.476	32%	0.323	S	S	.	.	H	α-helix	trans	-64.3	-45.9	175.3	-175.7	66.7	0	0	0	111.3	L673 P674 G675 A679 L680 I681	L673-L677 WeakPolarHBondContact O-CB 3.29Å; L673-L677 PolarHBondContact O-N 3.35Å; P674-L677 PolarHBondContact O-N 3.39Å; G675-L677 VanDerWaalsContact C-N 3.34Å; G675-L677 PolarHBondContact O-N 2.95Å; L677-A679 VanDerWaalsContact C-N 3.33Å; L677-A679 PolarHBondContact O-N 3.18Å; L677-L680 PolarHBondContact O-N 3.29Å; L677-I681 HydrophobicContact CD1-CD1 4.12Å; L677-I681 HydrophobicContact CD1-CG1 4.4Å; L677-I681 HydrophobicContact CG-CD1 3.88Å; L677-I681 VanDerWaalsContact O-CG1 3.3Å; L677-I681 WeakPolarHBondContact O-CG1 3.46Å; L677-I681 PolarHBondContact O-N 2.88Å
678	C	88.7	Confident	84	Confident	28 Å²	28	66.7 Å²	66.7	19%	0.189	35%	0.352	C	S	.	.	H	α-helix	trans	-59.2	-43.5	175	-70.4	0	0	0	0	112	P674 G675 G682 L705 C709	P674-C678 PolarHBondContact O-N 3.42Å; P674-C678 PolarHBondContact O-SG 3.3Å; G675-C678 PolarHBondContact O-N 3.4Å; C678-G682 PolarHBondContact O-N 2.88Å; C678-L705 HydrophobicContact CB-CD2 4.38Å; C678-C709 HydrophobicContact CB-CB 4.06Å
679	A	85.9	Confident	83.8	Confident	39 Å²	39	62.7 Å²	62.7	32%	0.322	35%	0.345	S	S	.	.	H	α-helix	trans	-62.5	-44.2	176.5	0	0	0	0	0	112.1	G675 A676 L677 G682 V683	G675-A679 PolarHBondContact O-N 3.4Å; A676-A679 PolarHBondContact O-N 3.4Å; L677-A679 VanDerWaalsContact C-N 3.33Å; L677-A679 PolarHBondContact O-N 3.18Å; A679-G682 PolarHBondContact O-N 2.91Å; A679-V683 WeakPolarHBondContact O-CG2 3.47Å; A679-V683 PolarHBondContact O-N 3.43Å
680	L	87.4	Confident	83.3	Confident	108 Å²	108	60.7 Å²	60.7	57%	0.565	33%	0.33	S	S	*	.	H	α-helix	trans	-63.5	-47.9	178.9	-177.4	66.9	0	0	0	111.5	A676 L677 G682 V683 C684	A676-L680 WeakPolarHBondContact O-CB 3.36Å; A676-L680 PolarHBondContact O-N 3.49Å; L677-L680 PolarHBondContact O-N 3.29Å; L680-G682 VanDerWaalsContact C-N 3.31Å; L680-G682 PolarHBondContact O-N 3.31Å; L680-V683 PolarHBondContact O-N 3.21Å; L680-C684 WeakPolarHBondContact O-CB 3.35Å; L680-C684 PolarHBondContact O-N 2.6Å; L680-C684 PolarHBondContact O-SG 2.94Å
681	I	88.4	Confident	83.1	Confident	73 Å²	73	56.8 Å²	56.8	37%	0.374	32%	0.317	S	S	.	.	H	α-helix	trans	-61.5	-43.3	177.6	-64.7	169.3	0	0	0	110.1	L677 V683 C684 L685 L705	L677-I681 HydrophobicContact CD1-CD1 4.12Å; L677-I681 HydrophobicContact CD1-CG1 4.4Å; L677-I681 HydrophobicContact CG-CD1 3.88Å; L677-I681 VanDerWaalsContact O-CG1 3.3Å; L677-I681 WeakPolarHBondContact O-CG1 3.46Å; L677-I681 PolarHBondContact O-N 2.88Å; I681-V683 PolarHBondContact O-N 3.46Å; I681-C684 PolarHBondContact O-N 3.29Å; I681-L685 HydrophobicContact CG2-CD1 4.01Å; I681-L685 HydrophobicContact CG2-CG 4.33Å; I681-L685 WeakPolarHBondContact O-CG 3.37Å; I681-L685 PolarHBondContact O-N 3.46Å; I681-L705 HydrophobicContact CB-CD1 4.25Å; I681-L705 HydrophobicContact CG2-CD1 3.67Å
682	G	85.4	Confident	82.6	Confident	1 Å²	1	58.1 Å²	58.1	1%	0.01	33%	0.325	C	S	.	.	H	α-helix	trans	-57	-50.6	176	0	0	0	0	0	112.2	C678 A679 L680 C684 L685 Y686 W702	C678-G682 PolarHBondContact O-N 2.88Å; A679-G682 PolarHBondContact O-N 2.91Å; L680-G682 VanDerWaalsContact C-N 3.31Å; L680-G682 PolarHBondContact O-N 3.31Å; G682-C684 VanDerWaalsContact C-N 3.34Å; G682-C684 PolarHBondContact O-N 3.15Å; G682-L685 PolarHBondContact O-N 2.92Å; G682-Y686 PolarHBondContact O-N 3.3Å; G682-Y686 VanDerWaalsContact O-N 3.07Å; G682-W702 VanDerWaalsContact O-CD1 3.26Å
683	V	82.6	Confident	82.1	Confident	82 Å²	82	61.2 Å²	61.2	50%	0.497	35%	0.347	S	S	.	.	H	α-helix	trans	-61.3	-42.3	177.4	173.4	0	0	0	0	111.6	A679 L680 I681 L685 Y686 V687	A679-V683 WeakPolarHBondContact O-CG2 3.47Å; A679-V683 PolarHBondContact O-N 3.43Å; L680-V683 PolarHBondContact O-N 3.21Å; I681-V683 PolarHBondContact O-N 3.46Å; V683-L685 PolarHBondContact O-N 3.29Å; V683-Y686 PolarHBondContact O-N 3.07Å; V683-V687 HydrophobicContact CG1-CG2 4.21Å; V683-V687 WeakPolarHBondContact O-CG2 3.49Å; V683-V687 PolarHBondContact O-N 3.31Å
684	C	83.9	Confident	82	Confident	55 Å²	55	58 Å²	58	37%	0.372	33%	0.331	S	S	.	.	H	α-helix	trans	-62.7	-41.8	178.1	-72.1	0	0	0	0	112.7	L680 I681 G682 F688	L680-C684 WeakPolarHBondContact O-CB 3.35Å; L680-C684 PolarHBondContact O-N 2.6Å; L680-C684 PolarHBondContact O-SG 2.94Å; I681-C684 PolarHBondContact O-N 3.29Å; G682-C684 VanDerWaalsContact C-N 3.34Å; G682-C684 PolarHBondContact O-N 3.15Å; C684-F688 WeakPolarHBondContact O-CB 3.36Å; C684-F688 PolarHBondContact O-N 3.18Å
685	L	82.8	Confident	81.8	Confident	35 Å²	35	58.1 Å²	58.1	18%	0.183	33%	0.327	C	S	.	.	I	π-helix	trans	-61.8	-45.7	176.3	-73.7	170.9	0	0	0	111.3	I681 G682 V683 V687 A689 L701 L705	I681-L685 HydrophobicContact CG2-CD1 4.01Å; I681-L685 HydrophobicContact CG2-CG 4.33Å; I681-L685 WeakPolarHBondContact O-CG 3.37Å; I681-L685 PolarHBondContact O-N 3.46Å; G682-L685 PolarHBondContact O-N 2.92Å; V683-L685 PolarHBondContact O-N 3.29Å; L685-V687 PolarHBondContact O-N 3.35Å; L685-A689 HydrophobicContact CD2-CB 3.98Å; L685-A689 WeakPolarHBondContact O-CB 3.41Å; L685-A689 PolarHBondContact O-N 3.41Å; L685-A689 VanDerWaalsContact O-N 3.07Å; L685-L701 HydrophobicContact CD1-CB 4.47Å; L685-L701 HydrophobicContact CD1-CD2 3.62Å; L685-L701 HydrophobicContact CD1-CG 3.86Å; L685-L705 HydrophobicContact CD1-CD1 3.6Å
686	Y	77.6	Confident	81.8	Confident	48 Å²	48	59.1 Å²	59.1	19%	0.188	33%	0.331	C	S	.	.	I	π-helix	trans	-65.8	-36.9	-179.3	-176.8	-107.9	0	0	0	113.3	Q149 L635 G682 V683	Q149-Y686 VanDerWaalsContact NE2-CD1 3.34Å; L635-Y686 HydrophobicContact CD2-CD1 4.02Å; L635-Y686 HydrophobicContact CD2-CE1 3.31Å; G682-Y686 PolarHBondContact O-N 3.3Å; G682-Y686 VanDerWaalsContact O-N 3.07Å; V683-Y686 PolarHBondContact O-N 3.07Å
687	V	74.3	Confident	81.9	Confident	40 Å²	40	62.4 Å²	62.4	24%	0.242	33%	0.331	C	S	.	.	I	π-helix	trans	-85.1	-37	-176.7	176.4	0	0	0	0	112.7	V683 L685	V683-V687 HydrophobicContact CG1-CG2 4.21Å; V683-V687 WeakPolarHBondContact O-CG2 3.49Å; V683-V687 PolarHBondContact O-N 3.31Å; L685-V687 PolarHBondContact O-N 3.35Å
688	F	75.4	Confident	82	Confident	172 Å²	172	58.9 Å²	58.9	75%	0.754	31%	0.314	S	S	*	.	I	π-helix	trans	-117.1	-24.1	-166.7	-60.6	-67.3	0	0	0	115.5	C684	C684-F688 WeakPolarHBondContact O-CB 3.36Å; C684-F688 PolarHBondContact O-N 3.18Å
689	A	75.6	Confident	82	Confident	37 Å²	37	58.2 Å²	58.2	31%	0.306	31%	0.308	S	S	.	.	I	π-helix	trans	-104.8	-12.4	-168.1	0	0	0	0	0	114.6	L685 N694	L685-A689 HydrophobicContact CD2-CB 3.98Å; L685-A689 WeakPolarHBondContact O-CB 3.41Å; L685-A689 PolarHBondContact O-N 3.41Å; L685-A689 VanDerWaalsContact O-N 3.07Å; A689-N694 PolarHBondContact O-ND2 2.97Å; A689-N694 PolarHBondContact O-OD1 2.7Å
690	E	74.6	Confident	82.4	Confident	29 Å²	29	56.7 Å²	56.7	14%	0.136	30%	0.295	C	S	.	.			trans	-79.8	123.3	-172.2	-153.6	173.8	127.7	0	0	112.5	I147 Y695 H699	I147-E690 HydrophobicContact CD1-CG 4.12Å; E690-Y695 HydrophobicContact CG-CD2 3.9Å; E690-Y695 WeakPolarHBondContact OE1-CD2 3.48Å; E690-Y695 VanDerWaalsContact OE1-CE2 3.24Å; E690-Y695 WeakPolarHBondContact OE1-CE2 3.49Å; E690-H699 IonicContact OE2-ND1 2.79Å
691	T	77.4	Confident	82.6	Confident	44 Å²	44	55.1 Å²	55.1	27%	0.27	29%	0.287	S	S	.	.			trans	-130	161.1	170.9	68.2	0	0	0	0	109.3	S693 N694 Y695	T691-S693 PolarHBondContact O-N 3.24Å; T691-S693 PolarHBondContact OG1-OG 2.62Å; T691-S693 VanDerWaalsContact OG1-OG 3.12Å; T691-N694 PolarHBondContact N-OD1 2.97Å; T691-N694 PolarHBondContact O-N 3.41Å; T691-N694 PolarHBondContact O-OD1 3.03Å; T691-N694 VanDerWaalsContact O-OD1 3.14Å; T691-N694 PolarHBondContact OG1-N 3.05Å; T691-N694 PolarHBondContact OG1-ND2 3.47Å; T691-N694 PolarHBondContact OG1-OD1 3.32Å; T691-Y695 WeakPolarHBondContact O-CA 3.31Å; T691-Y695 VanDerWaalsContact O-CB 3.31Å; T691-Y695 WeakPolarHBondContact O-CB 3.45Å; T691-Y695 PolarHBondContact O-N 2.94Å
692	E	72.8	Confident	82.7	Confident	119 Å²	119	53.1 Å²	53.1	56%	0.556	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.5	-33.9	179.1	-69.5	-174.7	166.9	0	0	112.8	G145 I147	G145-E692 WeakPolarHBondContact O-CG 3.37Å; G145-E692 PolarHBondContact O-N 3.17Å; G145-E692 VanDerWaalsContact O-N 3.14Å; I147-E692 HydrophobicContact CD1-CG 4.29Å; I147-E692 HydrophobicContact CG1-CG 3.9Å
693	S	73.3	Confident	83	Confident	79 Å²	79	53.1 Å²	53.1	55%	0.552	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.7	-26.4	-177.7	60.3	0	0	0	0	114.4	T691 Y696	T691-S693 PolarHBondContact O-N 3.24Å; T691-S693 PolarHBondContact OG1-OG 2.62Å; T691-S693 VanDerWaalsContact OG1-OG 3.12Å; S693-Y696 VanDerWaalsContact O-CE1 3.31Å; S693-Y696 WeakPolarHBondContact O-CE1 3.2Å
694	N	84.1	Confident	83.5	Confident	45 Å²	45	51.9 Å²	51.9	24%	0.241	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110.4	-4.9	-177.7	78.9	10	0	0	0	113.6	A689 T691 Y696 Y697 T698	A689-N694 PolarHBondContact O-ND2 2.97Å; A689-N694 PolarHBondContact O-OD1 2.7Å; T691-N694 PolarHBondContact N-OD1 2.97Å; T691-N694 PolarHBondContact O-N 3.41Å; T691-N694 PolarHBondContact O-OD1 3.03Å; T691-N694 VanDerWaalsContact O-OD1 3.14Å; T691-N694 PolarHBondContact OG1-N 3.05Å; T691-N694 PolarHBondContact OG1-ND2 3.47Å; T691-N694 PolarHBondContact OG1-OD1 3.32Å; N694-Y696 VanDerWaalsContact C-N 3.31Å; N694-Y696 PolarHBondContact O-N 3.14Å; N694-Y697 WeakPolarHBondContact O-CA 3.39Å; N694-Y697 WeakPolarHBondContact O-CB 3.46Å; N694-Y697 PolarHBondContact O-N 3.19Å; N694-T698 HydrophobicContact CB-CG2 4.39Å; N694-T698 PolarHBondContact O-N 3.29Å; N694-T698 PolarHBondContact O-OG1 3.47Å; N694-T698 VanDerWaalsContact O-OG1 3.14Å; N694-T698 PolarHBondContact OD1-OG1 3.45Å
695	Y	84.8	Confident	83.9	Confident	37 Å²	37	50.6 Å²	50.6	15%	0.145	25%	0.253	C	S	.	.	H	α-helix	trans	-44.8	-51.3	-175.7	170.1	-110.5	0	0	0	113	I147 L528 H565 E690 T691 Y697 T698 H699	I147-Y695 HydrophobicContact CD1-CD2 4.46Å; L528-Y695 HydrophobicContact CD1-CD1 4.27Å; L528-Y695 HydrophobicContact CD1-CE1 3.92Å; L528-Y695 HydrophobicContact CD2-CE1 4.22Å; H565-Y695 PolarHBondContact CE1-OH 3.09Å; E690-Y695 HydrophobicContact CG-CD2 3.9Å; E690-Y695 WeakPolarHBondContact OE1-CD2 3.48Å; E690-Y695 VanDerWaalsContact OE1-CE2 3.24Å; E690-Y695 WeakPolarHBondContact OE1-CE2 3.49Å; T691-Y695 WeakPolarHBondContact O-CA 3.31Å; T691-Y695 VanDerWaalsContact O-CB 3.31Å; T691-Y695 WeakPolarHBondContact O-CB 3.45Å; T691-Y695 PolarHBondContact O-N 2.94Å; Y695-Y697 PolarHBondContact O-N 3.31Å; Y695-Y697 VanDerWaalsContact O-N 3.12Å; Y695-T698 WeakPolarHBondContact CA-OG1 3.13Å; Y695-T698 PolarHBondContact O-N 3.33Å; Y695-T698 PolarHBondContact O-OG1 3.1Å; Y695-H699 HydrophobicContact CD2-CB 3.9Å; Y695-H699 HydrophobicContact CE2-CB 3.74Å; Y695-H699 AromaticContact CE2-CG 3.59Å; Y695-H699 AromaticContact CE2-ND1 3.68Å; Y695-H699 WeakPolarHBondContact O-CB 3.34Å; Y695-H699 PolarHBondContact O-N 2.87Å
696	Y	86.7	Confident	84.2	Confident	21 Å²	21	49.9 Å²	49.9	8%	0.082	25%	0.25	C	S	.	.	H	α-helix	trans	-65.8	-18.5	-177.1	63.8	-88.4	0	0	0	113.8	R520 A524 L527 S693 N694 S700	R520-Y696 PolarHBondContact NE-OH 3.08Å; R520-Y696 PolarHBondContact NH2-OH 3.02Å; A524-Y696 HydrophobicContact CB-CD1 4.21Å; A524-Y696 HydrophobicContact CB-CD2 4.02Å; A524-Y696 HydrophobicContact CB-CG 3.77Å; L527-Y696 HydrophobicContact CD1-CD2 3.94Å; L527-Y696 HydrophobicContact CD1-CE2 4.36Å; S693-Y696 VanDerWaalsContact O-CE1 3.31Å; S693-Y696 WeakPolarHBondContact O-CE1 3.2Å; N694-Y696 VanDerWaalsContact C-N 3.31Å; N694-Y696 PolarHBondContact O-N 3.14Å; Y696-S700 VanDerWaalsContact O-CB 3.23Å; Y696-S700 WeakPolarHBondContact O-CB 3.31Å; Y696-S700 PolarHBondContact O-OG 3.47Å
697	Y	89.7	Confident	84.8	Confident	127 Å²	127	47.6 Å²	47.6	50%	0.498	24%	0.241	S	C	.	.	H	α-helix	trans	-87.9	-51.4	170.4	-64.7	-66	0	0	0	112	L527 N694 Y695 S700 L701	L527-Y697 HydrophobicContact CD1-CD1 3.9Å; L527-Y697 HydrophobicContact CD1-CE1 3.76Å; N694-Y697 WeakPolarHBondContact O-CA 3.39Å; N694-Y697 WeakPolarHBondContact O-CB 3.46Å; N694-Y697 PolarHBondContact O-N 3.19Å; Y695-Y697 PolarHBondContact O-N 3.31Å; Y695-Y697 VanDerWaalsContact O-N 3.12Å; Y697-S700 PolarHBondContact O-N 3.07Å; Y697-L701 WeakPolarHBondContact O-CB 3.34Å; Y697-L701 PolarHBondContact O-N 3.37Å
698	T	89.8	Confident	85.5	Confident	18 Å²	18	46.7 Å²	46.7	11%	0.11	24%	0.24	C	C	.	.	H	α-helix	trans	-67.4	-41.9	-173.7	48.4	0	0	0	0	111.4	N694 Y695 L701 W702	N694-T698 HydrophobicContact CB-CG2 4.39Å; N694-T698 PolarHBondContact O-N 3.29Å; N694-T698 PolarHBondContact O-OG1 3.47Å; N694-T698 VanDerWaalsContact O-OG1 3.14Å; N694-T698 PolarHBondContact OD1-OG1 3.45Å; Y695-T698 WeakPolarHBondContact CA-OG1 3.13Å; Y695-T698 PolarHBondContact O-N 3.33Å; Y695-T698 PolarHBondContact O-OG1 3.1Å; T698-L701 PolarHBondContact O-N 2.72Å; T698-W702 PolarHBondContact O-N 2.87Å
699	H	90.1	Very high	86.3	Confident	14 Å²	14	39 Å²	39	7%	0.065	21%	0.208	C	C	.	.	H	α-helix	trans	-72	-38.5	178	-156	80.8	0	0	0	112.3	L528 H565 E690 Y695 L701 W702 H703	L528-H699 HydrophobicContact CD2-CB 3.97Å; H565-H699 AromaticContact CE1-CD2 3.62Å; H565-H699 AromaticContact CE1-NE2 3.6Å; H565-H699 AromaticContact NE2-CD2 3.71Å; H565-H699 AromaticContact NE2-NE2 3.62Å; E690-H699 IonicContact OE2-ND1 2.79Å; Y695-H699 HydrophobicContact CD2-CB 3.9Å; Y695-H699 HydrophobicContact CE2-CB 3.74Å; Y695-H699 AromaticContact CE2-CG 3.59Å; Y695-H699 AromaticContact CE2-ND1 3.68Å; Y695-H699 WeakPolarHBondContact O-CB 3.34Å; Y695-H699 PolarHBondContact O-N 2.87Å; H699-L701 VanDerWaalsContact C-N 3.31Å; H699-L701 PolarHBondContact O-N 3.36Å; H699-W702 WeakPolarHBondContact O-CA 3.39Å; H699-W702 VanDerWaalsContact O-CB 3.28Å; H699-W702 WeakPolarHBondContact O-CB 3.36Å; H699-W702 PolarHBondContact O-N 3.43Å; H699-W702 VanDerWaalsContact O-N 3.1Å; H699-H703 AromaticContact CD2-CE1 3.59Å; H699-H703 AromaticContact CD2-NE2 3.45Å; H699-H703 PolarHBondContact CD2-NE2 3.47Å; H699-H703 AromaticContact NE2-NE2 3.47Å; H699-H703 PolarHBondContact NE2-NE2 2.96Å; H699-H703 PolarHBondContact O-N 2.9Å
700	S	93.3	Very high	86.9	Confident	6 Å²	6	37.5 Å²	37.5	4%	0.042	20%	0.195	C	C	.	.	H	α-helix	trans	-62.1	-39.2	172.3	-63.1	0	0	0	0	112.1	L527 L528 S531 Y696 Y697 W702 H703 I704	L527-S700 PolarHBondContact O-OG 3.46Å; L528-S700 WeakPolarHBondContact CA-OG 3.2Å; L528-S700 PolarHBondContact N-OG 3.06Å; S531-S700 WeakPolarHBondContact CB-O 3.2Å; Y696-S700 VanDerWaalsContact O-CB 3.23Å; Y696-S700 WeakPolarHBondContact O-CB 3.31Å; Y696-S700 PolarHBondContact O-OG 3.47Å; Y697-S700 PolarHBondContact O-N 3.07Å; S700-W702 VanDerWaalsContact C-N 3.32Å; S700-H703 PolarHBondContact O-N 3.25Å; S700-I704 WeakPolarHBondContact O-CG1 3.34Å; S700-I704 PolarHBondContact O-N 2.87Å
701	L	91.9	Very high	87.6	Confident	76 Å²	76	37.9 Å²	37.9	40%	0.398	20%	0.199	S	C	.	.	H	α-helix	trans	-66	-37.1	173.6	-178.4	58.9	0	0	0	111.4	L685 Y697 T698 H699 I704 L705	L685-L701 HydrophobicContact CD1-CB 4.47Å; L685-L701 HydrophobicContact CD1-CD2 3.62Å; L685-L701 HydrophobicContact CD1-CG 3.86Å; Y697-L701 WeakPolarHBondContact O-CB 3.34Å; Y697-L701 PolarHBondContact O-N 3.37Å; T698-L701 PolarHBondContact O-N 2.72Å; H699-L701 VanDerWaalsContact C-N 3.31Å; H699-L701 PolarHBondContact O-N 3.36Å; L701-I704 PolarHBondContact O-N 2.66Å; L701-L705 HydrophobicContact CD1-CD1 4.35Å; L701-L705 HydrophobicContact CD1-CG 4.27Å; L701-L705 HydrophobicContact CG-CD1 4Å; L701-L705 HydrophobicContact CG-CG 4.39Å; L701-L705 WeakPolarHBondContact O-CB 3.34Å; L701-L705 VanDerWaalsContact O-CG 3.29Å; L701-L705 WeakPolarHBondContact O-CG 3.26Å; L701-L705 PolarHBondContact O-N 3.46Å
702	W	90	Very high	88	Confident	30 Å²	30	39.6 Å²	39.6	11%	0.114	20%	0.203	C	C	.	.	H	α-helix	trans	-58.4	-46.2	173.2	179	90	0	0	0	112	G682 T698 H699 S700 I704 L705 V706	G682-W702 VanDerWaalsContact O-CD1 3.26Å; T698-W702 PolarHBondContact O-N 2.87Å; H699-W702 WeakPolarHBondContact O-CA 3.39Å; H699-W702 VanDerWaalsContact O-CB 3.28Å; H699-W702 WeakPolarHBondContact O-CB 3.36Å; H699-W702 PolarHBondContact O-N 3.43Å; H699-W702 VanDerWaalsContact O-N 3.1Å; S700-W702 VanDerWaalsContact C-N 3.32Å; W702-I704 VanDerWaalsContact C-N 3.34Å; W702-I704 PolarHBondContact O-N 2.95Å; W702-L705 PolarHBondContact O-N 3.37Å; W702-V706 HydrophobicContact CD2-CG2 3.97Å; W702-V706 HydrophobicContact CG-CG2 4.35Å; W702-V706 HydrophobicContact CH2-CG2 4.38Å; W702-V706 HydrophobicContact CZ2-CG2 3.77Å; W702-V706 WeakPolarHBondContact O-CG2 3.22Å; W702-V706 PolarHBondContact O-N 2.76Å
703	H	92.4	Very high	88.7	Confident	2 Å²	2	35 Å²	35	1%	0.009	18%	0.182	C	C	.	.	H	α-helix	trans	-54.3	-49	174.3	-65.5	153.1	0	0	0	112.3	S531 N532 H565 H699 S700 L705 V706 A707	S531-H703 PolarHBondContact OG-ND1 3.23Å; N532-H703 PolarHBondContact ND2-CE1 3.12Å; N532-H703 PolarHBondContact ND2-ND1 2.87Å; H565-H703 AromaticContact CD2-CE1 3.5Å; H565-H703 PolarHBondContact CD2-CE1 3.42Å; H565-H703 VanDerWaalsContact CD2-CE1 3.5Å; H565-H703 AromaticContact CD2-NE2 3.98Å; H565-H703 AromaticContact NE2-CE1 3.28Å; H565-H703 PolarHBondContact NE2-CE1 3.02Å; H565-H703 VanDerWaalsContact NE2-CE1 3.28Å; H565-H703 AromaticContact NE2-NE2 3.4Å; H565-H703 PolarHBondContact NE2-NE2 3.28Å; H699-H703 AromaticContact CD2-CE1 3.59Å; H699-H703 AromaticContact CD2-NE2 3.45Å; H699-H703 PolarHBondContact CD2-NE2 3.47Å; H699-H703 AromaticContact NE2-NE2 3.47Å; H699-H703 PolarHBondContact NE2-NE2 2.96Å; H699-H703 PolarHBondContact O-N 2.9Å; S700-H703 PolarHBondContact O-N 3.25Å; H703-L705 VanDerWaalsContact C-N 3.33Å; H703-L705 PolarHBondContact O-N 3.5Å; H703-V706 PolarHBondContact O-N 2.9Å; H703-A707 VanDerWaalsContact O-CB 3.26Å; H703-A707 WeakPolarHBondContact O-CB 3.27Å; H703-A707 PolarHBondContact O-N 2.95Å
704	I	93.3	Very high	89.3	Confident	56 Å²	56	31.4 Å²	31.4	29%	0.287	16%	0.157	S	C	.	.	H	α-helix	trans	-61.7	-43.9	-178.3	-63.5	168.9	0	0	0	110.5	F534 S700 L701 W702 G708	F534-I704 HydrophobicContact CD1-CG1 4.45Å; F534-I704 HydrophobicContact CD1-CG2 3.94Å; F534-I704 HydrophobicContact CD2-CD1 4.35Å; F534-I704 HydrophobicContact CD2-CG1 3.72Å; F534-I704 HydrophobicContact CE1-CG2 4Å; F534-I704 HydrophobicContact CE2-CD1 4.04Å; F534-I704 HydrophobicContact CE2-CG1 3.91Å; F534-I704 HydrophobicContact CG-CB 4.45Å; F534-I704 HydrophobicContact CG-CG1 3.99Å; F534-I704 HydrophobicContact CG-CG2 4.27Å; F534-I704 HydrophobicContact CZ-CD1 4.38Å; F534-I704 HydrophobicContact CZ-CG1 4.36Å; F534-I704 HydrophobicContact CZ-CG2 4.39Å; S700-I704 WeakPolarHBondContact O-CG1 3.34Å; S700-I704 PolarHBondContact O-N 2.87Å; L701-I704 PolarHBondContact O-N 2.66Å; W702-I704 VanDerWaalsContact C-N 3.34Å; W702-I704 PolarHBondContact O-N 2.95Å; I704-G708 PolarHBondContact O-N 3.39Å
705	L	91.7	Very high	89.3	Confident	27 Å²	27	29.2 Å²	29.2	14%	0.141	15%	0.145	C	C	.	.	H	α-helix	trans	-67.9	-43	-179.6	-71.2	171.2	0	0	0	112.3	C678 I681 L685 L701 W702 H703 C709	C678-L705 HydrophobicContact CB-CD2 4.38Å; I681-L705 HydrophobicContact CB-CD1 4.25Å; I681-L705 HydrophobicContact CG2-CD1 3.67Å; L685-L705 HydrophobicContact CD1-CD1 3.6Å; L701-L705 HydrophobicContact CD1-CD1 4.35Å; L701-L705 HydrophobicContact CD1-CG 4.27Å; L701-L705 HydrophobicContact CG-CD1 4Å; L701-L705 HydrophobicContact CG-CG 4.39Å; L701-L705 WeakPolarHBondContact O-CB 3.34Å; L701-L705 VanDerWaalsContact O-CG 3.29Å; L701-L705 WeakPolarHBondContact O-CG 3.26Å; L701-L705 PolarHBondContact O-N 3.46Å; W702-L705 PolarHBondContact O-N 3.37Å; H703-L705 VanDerWaalsContact C-N 3.33Å; H703-L705 PolarHBondContact O-N 3.5Å; L705-C709 WeakPolarHBondContact O-CB 3.42Å; L705-C709 PolarHBondContact O-N 3.03Å
706	V	88.9	Confident	89	Confident	20 Å²	20	30.6 Å²	30.6	12%	0.121	16%	0.158	C	C	.	.	H	α-helix	trans	-67.3	-47.5	178.5	172.8	0	0	0	0	110.8	F535 W702 H703 G708 C709 V710	F535-V706 HydrophobicContact CZ-CG1 4.35Å; W702-V706 HydrophobicContact CD2-CG2 3.97Å; W702-V706 HydrophobicContact CG-CG2 4.35Å; W702-V706 HydrophobicContact CH2-CG2 4.38Å; W702-V706 HydrophobicContact CZ2-CG2 3.77Å; W702-V706 WeakPolarHBondContact O-CG2 3.22Å; W702-V706 PolarHBondContact O-N 2.76Å; H703-V706 PolarHBondContact O-N 2.9Å; V706-G708 PolarHBondContact O-N 3.21Å; V706-C709 WeakPolarHBondContact O-CB 3.34Å; V706-C709 PolarHBondContact O-N 2.91Å; V706-V710 PolarHBondContact O-N 3.39Å
707	A	90.6	Very high	88.4	Confident	0 Å²	0	35 Å²	35	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-63.5	-42.8	177.3	0	0	0	0	0	111.9	F534 F535 H703 C709 V710 V711	F534-A707 HydrophobicContact CB-CB 3.99Å; F534-A707 WeakPolarHBondContact O-CB 3.25Å; F535-A707 HydrophobicContact CD1-CB 4Å; F535-A707 HydrophobicContact CD2-CB 3.94Å; F535-A707 HydrophobicContact CE1-CB 4.14Å; F535-A707 HydrophobicContact CE2-CB 4.07Å; F535-A707 HydrophobicContact CG-CB 3.9Å; F535-A707 HydrophobicContact CZ-CB 4.17Å; H703-A707 VanDerWaalsContact O-CB 3.26Å; H703-A707 WeakPolarHBondContact O-CB 3.27Å; H703-A707 PolarHBondContact O-N 2.95Å; A707-C709 VanDerWaalsContact C-N 3.33Å; A707-C709 PolarHBondContact O-N 3.42Å; A707-V710 PolarHBondContact O-N 2.91Å; A707-V711 PolarHBondContact O-N 3.14Å
708	G	90.1	Very high	87.2	Confident	21 Å²	21	34.7 Å²	34.7	22%	0.216	18%	0.181	C	C	.	.	H	α-helix	trans	-61.9	-39.6	175.1	0	0	0	0	0	112.7	I704 V706 V710 V711 F712	I704-G708 PolarHBondContact O-N 3.39Å; V706-G708 PolarHBondContact O-N 3.21Å; G708-V710 VanDerWaalsContact C-N 3.33Å; G708-V710 PolarHBondContact O-N 3.49Å; G708-V711 WeakPolarHBondContact O-CB 3.45Å; G708-V711 PolarHBondContact O-N 3.03Å; G708-F712 WeakPolarHBondContact O-CD2 3.37Å; G708-F712 PolarHBondContact O-N 3.34Å
709	C	90.4	Very high	85.3	Confident	11 Å²	11	43 Å²	43	7%	0.074	22%	0.216	C	C	.	.	H	α-helix	trans	-56.8	-44.7	175.4	178.8	0	0	0	0	112	G675 C678 L705 V706 A707 V711 F712 L713	G675-C709 PolarHBondContact O-SG 3Å; C678-C709 HydrophobicContact CB-CB 4.06Å; L705-C709 WeakPolarHBondContact O-CB 3.42Å; L705-C709 PolarHBondContact O-N 3.03Å; V706-C709 WeakPolarHBondContact O-CB 3.34Å; V706-C709 PolarHBondContact O-N 2.91Å; A707-C709 VanDerWaalsContact C-N 3.33Å; A707-C709 PolarHBondContact O-N 3.42Å; C709-V711 VanDerWaalsContact C-N 3.29Å; C709-V711 PolarHBondContact O-N 3.02Å; C709-F712 PolarHBondContact O-N 3.25Å; C709-L713 WeakPolarHBondContact O-CB 3.42Å; C709-L713 WeakPolarHBondContact O-CG 3.3Å; C709-L713 PolarHBondContact O-N 2.99Å; C709-L713 WeakPolarHBondContact SG-CD1 3.27Å
710	V	89.6	Confident	83.1	Confident	6 Å²	6	49.4 Å²	49.4	4%	0.036	25%	0.25	C	S	.	.	H	α-helix	trans	-58.7	-39.8	178.4	176.1	0	0	0	0	111.9	A538 Y554 T598 V706 A707 G708 F712 L713 L714	A538-V710 HydrophobicContact CB-CB 4.14Å; A538-V710 HydrophobicContact CB-CG1 3.84Å; Y554-V710 HydrophobicContact CD2-CG1 4.38Å; Y554-V710 HydrophobicContact CE1-CG1 3.93Å; Y554-V710 HydrophobicContact CE2-CG1 3.7Å; Y554-V710 VanDerWaalsContact CZ-CG1 3.45Å; T598-V710 HydrophobicContact CG2-CG1 4.4Å; T598-V710 HydrophobicContact CG2-CG2 4.4Å; V706-V710 PolarHBondContact O-N 3.39Å; A707-V710 PolarHBondContact O-N 2.91Å; G708-V710 VanDerWaalsContact C-N 3.33Å; G708-V710 PolarHBondContact O-N 3.49Å; V710-F712 VanDerWaalsContact C-N 3.32Å; V710-F712 PolarHBondContact O-N 3.38Å; V710-L713 PolarHBondContact O-N 3.3Å; V710-L714 HydrophobicContact CG1-CD1 3.81Å; V710-L714 HydrophobicContact CG1-CG 4.18Å; V710-L714 WeakPolarHBondContact O-CB 3.4Å; V710-L714 WeakPolarHBondContact O-CG 3.43Å; V710-L714 PolarHBondContact O-N 3.01Å
711	V	88.4	Confident	80.5	Confident	37 Å²	37	58.4 Å²	58.4	22%	0.224	28%	0.283	C	S	.	.	H	α-helix	trans	-60.1	-42.1	178.8	176.7	0	0	0	0	111.8	P537 A538 V541 A707 G708 C709	P537-V711 HydrophobicContact CB-CG2 3.94Å; A538-V711 HydrophobicContact CB-CG2 3.96Å; V541-V711 HydrophobicContact CG2-CG1 4.32Å; A707-V711 PolarHBondContact O-N 3.14Å; G708-V711 WeakPolarHBondContact O-CB 3.45Å; G708-V711 PolarHBondContact O-N 3.03Å; C709-V711 VanDerWaalsContact C-N 3.29Å; C709-V711 PolarHBondContact O-N 3.02Å
712	F	87.3	Confident	77.9	Confident	80 Å²	80	64.5 Å²	64.5	35%	0.351	31%	0.307	S	S	.	.	H	α-helix	trans	-76.8	-38.4	179.5	-68.3	-66.6	0	0	0	112.8	G708 C709 V710	G708-F712 WeakPolarHBondContact O-CD2 3.37Å; G708-F712 PolarHBondContact O-N 3.34Å; C709-F712 PolarHBondContact O-N 3.25Å; V710-F712 VanDerWaalsContact C-N 3.32Å; V710-F712 PolarHBondContact O-N 3.38Å
713	L	87.1	Confident	75.4	Confident	21 Å²	21	67.4 Å²	67.4	11%	0.11	34%	0.337	C	S	.	.	H	α-helix	trans	-80.1	-26.3	-172.7	-71.6	-171	0	0	0	114.3	T598 M602 L672 C709 V710	T598-L713 HydrophobicContact CG2-CB 4.23Å; M602-L713 HydrophobicContact CE-CB 4.41Å; M602-L713 HydrophobicContact CE-CD1 3.88Å; M602-L713 WeakPolarHBondContact CG-O 3.5Å; M602-L713 HydrophobicContact SD-CB 3.69Å; M602-L713 HydrophobicContact SD-CD1 4.06Å; M602-L713 HydrophobicContact SD-CD2 3.88Å; M602-L713 HydrophobicContact SD-CG 4.08Å; L672-L713 HydrophobicContact CD2-CD2 4.13Å; C709-L713 WeakPolarHBondContact O-CB 3.42Å; C709-L713 WeakPolarHBondContact O-CG 3.3Å; C709-L713 PolarHBondContact O-N 2.99Å; C709-L713 WeakPolarHBondContact SG-CD1 3.27Å; V710-L713 PolarHBondContact O-N 3.3Å
714	L	85.6	Confident	72.6	Confident	4 Å²	4	75 Å²	75	2%	0.021	38%	0.377	C	S	.	.	S	Bend	trans	-54.3	129	176.7	-87.2	162.3	0	0	0	110.2	V541 A542 R545 Y547 Y554 V710	V541-L714 HydrophobicContact CG1-CD1 4.23Å; A542-L714 HydrophobicContact CB-CD1 4.16Å; R545-L714 VanDerWaalsContact NH1-C 3.32Å; R545-L714 PolarHBondContact NH1-O 3.39Å; Y547-L714 HydrophobicContact CD2-CD2 4.23Å; Y554-L714 HydrophobicContact CE2-CD1 4.21Å; V710-L714 HydrophobicContact CG1-CD1 3.81Å; V710-L714 HydrophobicContact CG1-CG 4.18Å; V710-L714 WeakPolarHBondContact O-CB 3.4Å; V710-L714 WeakPolarHBondContact O-CG 3.43Å; V710-L714 PolarHBondContact O-N 3.01Å
715	P	83.5	Confident	69.8	Low	0 Å²	0	76.4 Å²	76.4	0%	0	41%	0.405	C	S	.	.	P	Polyproline II helix	trans	-70.4	152.7	176.9	23.8	-29.5	0	0	0	111.8	R545 Y547	R545-P715 WeakPolarHBondContact CD-O 3.34Å; R545-P715 PolarHBondContact NH1-O 3.02Å; Y547-P715 HydrophobicContact CE2-CG 4.44Å; Y547-P715 WeakPolarHBondContact CE2-O 3.35Å
716	P	79.5	Confident	66.7	Low	65 Å²	65	86.2 Å²	86.2	42%	0.422	44%	0.44	S	S	.	.	P	Polyproline II helix	trans	-69.6	151.2	170.7	29.1	-33.8	0	0	0	110.4	E718	P716-E718 PolarHBondContact O-N 3.25Å
717	K	74	Confident	63.8	Low	114 Å²	114	90.7 Å²	90.7	50%	0.496	47%	0.473	S	S	.	.	P	Polyproline II helix	trans	-54.2	132.5	176	-175	170.3	-179.4	165.7	0	110.2	S546 K719	S546-K717 PolarHBondContact OG-NZ 3.12Å; K717-K719 PolarHBondContact O-N 2.93Å
718	E	63.3	Low	61.3	Low	121 Å²	121	100.3 Å²	100.3	57%	0.565	52%	0.518	S	S	*	.	P	Polyproline II helix	trans	-66.2	126.4	177.4	-156.8	143.4	-128.8	0	0	109	R604 P716 D720	R604-E718 IonicContact NH1-OE1 3.25Å; R604-E718 PolarHBondContact NH1-OE1 3.45Å; P716-E718 PolarHBondContact O-N 3.25Å; E718-D720 PolarHBondContact O-N 2.93Å
719	K	51.4	Low	58.4	Low	193 Å²	193	102.8 Å²	102.8	84%	0.839	54%	0.544	S	S	*	.	S	Bend	trans	-71.2	-9.2	-174.9	-82.4	-176.1	175	-178.3	0	113.3	K717	K717-K719 PolarHBondContact O-N 2.93Å
720	D	42.5	Very low	55.3	Low	148 Å²	148	111.9 Å²	111.9	79%	0.791	58%	0.582	S	S	*	*			trans	-104.4	43.9	-173.3	-60.8	-31.2	0	0	0	113.8	E718	E718-D720 PolarHBondContact O-N 2.93Å
721	R	39.4	Very low	52.2	Low	194 Å²	194	116.3 Å²	116.3	73%	0.732	61%	0.614	S	S	*	*			trans	-110	28.2	162.4	-99.8	-179.3	83.2	168.8	4.9	112.9	A723	R721-A723 VanDerWaalsContact C-N 3.32Å; R721-A723 PolarHBondContact O-N 3.49Å
722	K	36.1	Very low	49.4	Very low	204 Å²	204	125 Å²	125	89%	0.887	64%	0.643	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.8	64.8	162.6	-73.4	-170.5	177.3	-175.2	0	110
723	A	38.2	Very low	46.5	Very low	91 Å²	91	126.2 Å²	126.2	75%	0.752	66%	0.661	S	S	*	*	T	Hydrogen-bonded Turn	trans	-161.5	5.2	167.3	0	0	0	0	0	115.1	R721	R721-A723 VanDerWaalsContact C-N 3.32Å; R721-A723 PolarHBondContact O-N 3.49Å
724	L	33.9	Very low	43.9	Very low	163 Å²	163	135.3 Å²	135.3	85%	0.853	69%	0.694	S	S	*	*	S	Bend	trans	-134.7	119.3	165.8	-124.8	82.3	0	0	0	108.3	W726	L724-W726 PolarHBondContact O-N 3.39Å
725	G	34.5	Very low	41	Very low	85 Å²	85	146.8 Å²	146.8	88%	0.876	74%	0.737	S	S	*	*			trans	-59.2	122.5	-153.4	0	0	0	0	0	115.6
726	W	25.8	Very low	38.6	Very low	232 Å²	232	156.9 Å²	156.9	88%	0.879	78%	0.775	S	S	*	*			trans	-123.2	98	147.8	-128.2	-19.6	0	0	0	106.3	L724 Q728	L724-W726 PolarHBondContact O-N 3.39Å; W726-Q728 PolarHBondContact O-N 2.9Å
727	S	29.3	Very low	36	Very low	115 Å²	115	158.9 Å²	158.9	80%	0.804	79%	0.79	S	S	*	*			trans	-62.5	123.5	168.5	43.7	0	0	0	0	108.5
728	Q	37.4	Very low	33.8	Very low	201 Å²	201	164.1 Å²	164.1	94%	0.939	81%	0.807	S	S	*	*	S	Bend	trans	-53.8	135.3	171.1	-71.1	169.8	-49.9	0	0	110.7	W726	W726-Q728 PolarHBondContact O-N 2.9Å
729	G	29.1	Very low	32	Very low	74 Å²	74	168.8 Å²	168.8	76%	0.763	82%	0.82	S	S	*	*			trans	142.1	76.5	166.6	0	0	0	0	0	113.3	S731	G729-S731 PolarHBondContact O-N 3.32Å
730	F	25.5	Very low	31.1	Very low	202 Å²	202	165.4 Å²	165.4	89%	0.886	82%	0.817	S	S	*	*			trans	-92	86.6	160.9	-134.3	-93.8	0	0	0	107.4
731	S	25	Very low	30.4	Very low	99 Å²	99	169.4 Å²	169.4	69%	0.692	82%	0.822	S	S	*	*			trans	-87.3	128.9	163.1	127.3	0	0	0	0	107.3	G729 S733	G729-S731 PolarHBondContact O-N 3.32Å; S731-S733 PolarHBondContact O-N 3.37Å
732	W	30.1	Very low	29.9	Very low	220 Å²	220	166.3 Å²	166.3	83%	0.833	82%	0.824	S	S	*	*			trans	-66.1	112.8	172.6	-85.6	38.7	0	0	0	109.2
733	S	26	Very low	29.4	Very low	105 Å²	105	168.5 Å²	168.5	73%	0.734	83%	0.827	S	S	*	*			trans	-139.9	124.8	152.1	71.2	0	0	0	0	110	S731 R735	S731-S733 PolarHBondContact O-N 3.37Å; S733-R735 PolarHBondContact O-N 3.45Å
734	W	32.6	Very low	28.9	Very low	212 Å²	212	170.1 Å²	170.1	80%	0.803	83%	0.827	S	S	*	*			trans	-72.5	111.8	176.1	-82.2	71.7	0	0	0	109.3
735	R	24.4	Very low	28.7	Very low	244 Å²	244	170.1 Å²	170.1	92%	0.921	82%	0.823	S	S	*	*			trans	-159	117.8	151.8	-111.2	170.6	-159.7	-120.5	3.4	110.3	S733	S733-R735 PolarHBondContact O-N 3.45Å
736	W	32.5	Very low	28.3	Very low	212 Å²	212	174 Å²	174	80%	0.803	82%	0.823	S	S	*	*			trans	-72.5	123.7	172.8	-75.9	59.2	0	0	0	109.4
737	S	24.5	Very low	28.5	Very low	107 Å²	107	169.4 Å²	169.4	75%	0.748	81%	0.811	S	S	*	*			trans	-144.2	115.5	155.7	86.9	0	0	0	0	109.9
738	W	27.8	Very low	28.4	Very low	225 Å²	225	173.4 Å²	173.4	85%	0.852	82%	0.817	S	S	*	*			trans	-72.6	128.1	169.1	-82.7	76.1	0	0	0	110
739	R	25.2	Very low	28	Very low	218 Å²	218	172 Å²	172	82%	0.823	81%	0.808	S	S	*	*			trans	-138.5	126.5	153.5	-73.4	-162.3	-169.6	-146.9	4.5	109.1
740	P	32.6	Very low	28.2	Very low	122 Å²	122	178.1 Å²	178.1	79%	0.792	81%	0.814	S	S	*	*			trans	-75	128.1	171.9	30.6	-28.8	0	0	0	108.5
741	R	28	Very low	28.6	Very low	233 Å²	233	174.3 Å²	174.3	88%	0.879	81%	0.807	S	S	*	*			trans	-109.2	110.5	164.2	-74.1	-165.7	-161.7	-139.3	5.3	108.8
742	V	29.6	Very low	29.5	Very low	129 Å²	129	174.8 Å²	174.8	78%	0.782	81%	0.807	S	S	*	*			trans	-61.9	136.4	168	175.7	0	0	0	0	108.8
743	W	25.2	Very low	29.9	Very low	249 Å²	249	171.7 Å²	171.7	94%	0.943	81%	0.807	S	S	*	*			trans	-75	126.1	171.7	-76.2	74.6	0	0	0	109.3
744	V	27.4	Very low	30.4	Very low	125 Å²	125	175.8 Å²	175.8	76%	0.758	82%	0.815	S	S	*	*			trans	-111.3	119	161.8	176.9	0	0	0	0	107.1
745	Q	29.7	Very low	30.5	Very low	163 Å²	163	177.4 Å²	177.4	76%	0.762	84%	0.837	S	S	*	*			trans	-88.2	111.8	176.8	-170.6	166.6	-21.2	0	0	107
746	L	27.1	Very low	30.8	Very low	168 Å²	168	174.1 Å²	174.1	88%	0.88	83%	0.832	S	S	*	*			trans	-90.8	96.7	167.7	-96.2	154.4	0	0	0	107.2
747	E	29.7	Very low	30.7	Very low	134 Å²	134	172.1 Å²	172.1	63%	0.626	83%	0.834	S	S	*	*			trans	-73.5	117.4	162.6	-82.3	179	157.9	0	0	108.7	F749	E747-F749 HydrophobicContact CB-CD2 4.48Å; E747-F749 PolarHBondContact O-N 3.21Å
748	E	27.2	Very low	31	Very low	199 Å²	199	175.7 Å²	175.7	93%	0.93	84%	0.839	S	S	*	*			trans	-84.6	94.4	170.4	-143	172.1	-155.7	0	0	107.8
749	F	29.7	Very low	31.2	Very low	173 Å²	173	172.8 Å²	172.8	76%	0.759	84%	0.838	S	S	*	*			trans	-77.8	120.8	170.2	-106.3	-90.5	0	0	0	109.6	E747	E747-F749 HydrophobicContact CB-CD2 4.48Å; E747-F749 PolarHBondContact O-N 3.21Å
750	K	32.3	Very low	31.6	Very low	202 Å²	202	169.9 Å²	169.9	88%	0.878	84%	0.839	S	S	*	*			trans	-95.8	115.6	170.1	-160.7	177.3	-171.2	-179.5	0	107.9
751	T	34.4	Very low	31.5	Very low	122 Å²	122	173.1 Å²	173.1	75%	0.748	84%	0.842	S	S	*	*			trans	-104.9	143.5	168.4	43.5	0	0	0	0	110.7
752	P	42.5	Very low	31.8	Very low	108 Å²	108	168.9 Å²	168.9	70%	0.701	84%	0.839	S	S	*	*			trans	-97.2	146.2	-178	34.9	-27.2	0	0	0	114.5
753	D	40.2	Very low	32	Very low	156 Å²	156	171.9 Å²	171.9	83%	0.834	84%	0.844	S	S	*	*			trans	83.3	143.1	140.1	-58.4	-19	0	0	0	125.2
754	E	36.5	Very low	32.5	Very low	190 Å²	190	165.5 Å²	165.5	89%	0.888	84%	0.835	S	S	*	*			trans	87.5	96.9	162.5	-61.6	-171.8	162.3	0	0	119.9
755	I	33.4	Very low	33	Very low	246 Å²	246	169.2 Å²	169.2	100%	1.262	84%	0.843	S	S	*	*				-142.4	0	92.3	-74.5	173.3	0	0	0	108.7

Retrieved 755 of 755 residues in 133.2 ms (Link to these results)

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