A0A3Q0KRL7_SCHMA Loading...

Putative amiloride-sensitive sodium channel

AlphaFold DB , UniProt , Accession A0A3Q0KRL7, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 752 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	29.8	Very low	43.3	Very low	246 Å²	246	126.5 Å²	126.5	100%	1.212	74%	0.739	S	S	*	*				0	120.5	0	-82.9	172.2	150.9	0	0	107.6
2	H	32.4	Very low	46.4	Very low	191 Å²	191	120.7 Å²	120.7	88%	0.884	71%	0.709	S	S	*	*			trans	-72.1	131.3	-159.3	-83.7	-79.2	0	0	0	114.5	N4	H2-N4 PolarHBondContact O-N 3.18Å
3	S	34.8	Very low	49.2	Very low	108 Å²	108	124.2 Å²	124.2	76%	0.755	71%	0.71	S	S	*	*			trans	-72	111.7	164.2	43.1	0	0	0	0	110.7
4	N	30.6	Very low	51.7	Low	159 Å²	159	123.7 Å²	123.7	85%	0.85	70%	0.699	S	S	*	*			trans	-110.8	94.6	160.5	-90.9	-14.2	0	0	0	107.7	H2	H2-N4 PolarHBondContact O-N 3.18Å
5	S	36.6	Very low	53.9	Low	101 Å²	101	116.3 Å²	116.3	71%	0.706	66%	0.657	S	S	*	*			trans	-121	80.5	161.8	61.6	0	0	0	0	108.1
6	T	40.3	Very low	55.8	Low	119 Å²	119	113.9 Å²	113.9	73%	0.73	64%	0.641	S	S	*	*			trans	-77.1	124.9	152.6	38.2	0	0	0	0	105.8	P8	T6-P8 VanDerWaalsContact C-CD 3.48Å; T6-P8 WeakPolarHBondContact O-CD 3.13Å
7	F	40.1	Very low	57.5	Low	177 Å²	177	113.8 Å²	113.8	78%	0.776	63%	0.633	S	S	*	*			trans	-87.3	107.1	170.1	-102.8	-93.9	0	0	0	108.2
8	P	39.4	Very low	59	Low	117 Å²	117	110.1 Å²	110.1	76%	0.76	62%	0.615	S	S	*	*			trans	-121.9	106.1	154.5	35.4	-24.4	0	0	0	109	T6	T6-P8 VanDerWaalsContact C-CD 3.48Å; T6-P8 WeakPolarHBondContact O-CD 3.13Å
9	G	53	Low	60.4	Low	72 Å²	72	106 Å²	106	74%	0.742	59%	0.591	S	S	*	*			trans	153.2	-3.7	172	0	0	0	0	0	117.6	S11	G9-S11 PolarHBondContact O-N 2.88Å; G9-S11 VanDerWaalsContact O-N 3.13Å
10	S	59.7	Low	61.6	Low	33 Å²	33	101.9 Å²	101.9	23%	0.231	57%	0.569	C	S	.	*			trans	-67.3	115.3	179.9	54.8	0	0	0	0	111.2	I530	S10-I530 WeakPolarHBondContact O-CD1 3.35Å
11	S	79.6	Confident	62.6	Low	69 Å²	69	104.3 Å²	104.3	48%	0.483	57%	0.569	S	S	.	*			trans	-61.8	148.8	169.3	177.7	0	0	0	0	110.1	G9 K13 E14 V15	G9-S11 PolarHBondContact O-N 2.88Å; G9-S11 VanDerWaalsContact O-N 3.13Å; S11-K13 PolarHBondContact O-N 2.7Å; S11-E14 WeakPolarHBondContact O-CB 3.42Å; S11-E14 PolarHBondContact O-N 2.97Å; S11-V15 PolarHBondContact O-N 3.42Å
12	C	80.8	Confident	65.2	Low	56 Å²	56	102.3 Å²	102.3	38%	0.378	55%	0.548	S	S	.	.	H	α-helix	trans	-48.9	-34.2	173.6	-66.5	0	0	0	0	112.3	E14 V15 L16 L527	C12-E14 PolarHBondContact O-N 2.9Å; C12-V15 PolarHBondContact O-N 2.87Å; C12-L16 WeakPolarHBondContact O-CB 3.44Å; C12-L16 WeakPolarHBondContact O-CG 3.2Å; C12-L16 PolarHBondContact O-N 3.17Å; C12-L527 HydrophobicContact CB-CD2 4.32Å
13	K	82.7	Confident	67.7	Low	166 Å²	166	93.2 Å²	93.2	72%	0.722	51%	0.507	S	S	*	.	H	α-helix	trans	-62.5	-38.7	176.6	-172.3	177.2	-178.6	178.6	0	112.8	S11 K17	S11-K13 PolarHBondContact O-N 2.7Å; K13-K17 VanDerWaalsContact O-CB 3.28Å; K13-K17 WeakPolarHBondContact O-CB 3.37Å; K13-K17 PolarHBondContact O-N 3.47Å
14	E	83.6	Confident	70	Confident	118 Å²	118	90.3 Å²	90.3	55%	0.551	49%	0.486	S	S	*	.	H	α-helix	trans	-71.7	-40.3	178.4	-65.3	-167.9	146.7	0	0	111.5	S11 C12 K17 S18	S11-E14 WeakPolarHBondContact O-CB 3.42Å; S11-E14 PolarHBondContact O-N 2.97Å; C12-E14 PolarHBondContact O-N 2.9Å; E14-K17 PolarHBondContact O-N 3.02Å; E14-S18 WeakPolarHBondContact O-CB 3.33Å; E14-S18 PolarHBondContact O-N 2.87Å
15	V	85.3	Confident	72.6	Confident	12 Å²	12	83.4 Å²	83.4	7%	0.073	45%	0.45	C	S	.	.	H	α-helix	trans	-62.2	-46.9	175.6	176.7	0	0	0	0	110.9	S11 C12 K17 S18 F19 L523 R526 L527 I530	S11-V15 PolarHBondContact O-N 3.42Å; C12-V15 PolarHBondContact O-N 2.87Å; V15-K17 PolarHBondContact O-N 3.16Å; V15-S18 WeakPolarHBondContact O-CB 3.47Å; V15-S18 PolarHBondContact O-N 3.41Å; V15-F19 WeakPolarHBondContact O-CB 3.43Å; V15-F19 PolarHBondContact O-N 3.21Å; V15-L523 HydrophobicContact CG1-CD1 3.78Å; V15-R526 HydrophobicContact CG1-CB 3.99Å; V15-L527 HydrophobicContact CG1-CD2 4.38Å; V15-I530 HydrophobicContact CB-CD1 4.37Å; V15-I530 HydrophobicContact CG2-CD1 3.38Å
16	L	84.9	Confident	74.8	Confident	78 Å²	78	85.3 Å²	85.3	41%	0.408	44%	0.441	S	S	.	.	H	α-helix	trans	-63.2	-41.8	176.7	-73.6	168.2	0	0	0	112.2	C12 S18 F19 C20 L523	C12-L16 WeakPolarHBondContact O-CB 3.44Å; C12-L16 WeakPolarHBondContact O-CG 3.2Å; C12-L16 PolarHBondContact O-N 3.17Å; L16-S18 VanDerWaalsContact C-N 3.3Å; L16-S18 PolarHBondContact O-N 2.93Å; L16-F19 PolarHBondContact O-N 3.4Å; L16-C20 WeakPolarHBondContact O-CB 3.28Å; L16-C20 PolarHBondContact O-N 3.34Å; L16-C20 PolarHBondContact O-SG 3.34Å; L16-L523 HydrophobicContact CD2-CD1 4.25Å; L16-L523 HydrophobicContact CD2-CD2 4.39Å
17	K	84.3	Confident	76.8	Confident	113 Å²	113	79.8 Å²	79.8	49%	0.491	41%	0.409	S	S	.	.	H	α-helix	trans	-64.8	-36.6	176.3	-170.5	177.4	-177.8	-179.3	0	111.7	K13 E14 V15 R21 L32	K13-K17 VanDerWaalsContact O-CB 3.28Å; K13-K17 WeakPolarHBondContact O-CB 3.37Å; K13-K17 PolarHBondContact O-N 3.47Å; E14-K17 PolarHBondContact O-N 3.02Å; V15-K17 PolarHBondContact O-N 3.16Å; K17-R21 WeakPolarHBondContact O-CG 3.47Å; K17-R21 PolarHBondContact O-N 3.32Å; K17-L32 HydrophobicContact CG-CD1 4.12Å; K17-L32 WeakPolarHBondContact O-CD1 3.41Å
18	S	83.5	Confident	78.8	Confident	46 Å²	46	73.2 Å²	73.2	32%	0.322	38%	0.381	S	S	.	.	H	α-helix	trans	-66.9	-47.7	174.4	-167.5	0	0	0	0	110.9	E14 V15 L16 C20 R21 W22	E14-S18 WeakPolarHBondContact O-CB 3.33Å; E14-S18 PolarHBondContact O-N 2.87Å; V15-S18 WeakPolarHBondContact O-CB 3.47Å; V15-S18 PolarHBondContact O-N 3.41Å; L16-S18 VanDerWaalsContact C-N 3.3Å; L16-S18 PolarHBondContact O-N 2.93Å; S18-C20 PolarHBondContact O-N 2.68Å; S18-R21 WeakPolarHBondContact O-CB 3.17Å; S18-R21 PolarHBondContact O-N 3.13Å; S18-W22 PolarHBondContact O-N 3.27Å
19	F	86.5	Confident	80.9	Confident	33 Å²	33	71.7 Å²	71.7	15%	0.145	36%	0.364	C	S	.	.	H	α-helix	trans	-56.7	-49.6	176.6	177.1	-96.2	0	0	0	112.1	V15 L16 R21 W22 T23 L28 E519 L520 L523	V15-F19 WeakPolarHBondContact O-CB 3.43Å; V15-F19 PolarHBondContact O-N 3.21Å; L16-F19 PolarHBondContact O-N 3.4Å; F19-R21 PolarHBondContact O-N 3.42Å; F19-R21 VanDerWaalsContact O-N 3.12Å; F19-W22 PolarHBondContact O-N 2.88Å; F19-T23 HydrophobicContact CD1-CG2 4.48Å; F19-T23 HydrophobicContact CE1-CG2 4.14Å; F19-T23 WeakPolarHBondContact CZ-OG1 3.27Å; F19-T23 VanDerWaalsContact O-CB 3.31Å; F19-T23 WeakPolarHBondContact O-CB 3.38Å; F19-T23 PolarHBondContact O-N 3.09Å; F19-L28 HydrophobicContact CE1-CD2 4.36Å; F19-E519 HydrophobicContact CE2-CB 3.96Å; F19-E519 WeakPolarHBondContact CE2-O 3.22Å; F19-L520 HydrophobicContact CE1-CD2 4.4Å; F19-L520 HydrophobicContact CE2-CD2 4.41Å; F19-L520 HydrophobicContact CZ-CD2 3.71Å; F19-L520 HydrophobicContact CZ-CG 4.36Å; F19-L523 HydrophobicContact CB-CD1 3.95Å; F19-L523 HydrophobicContact CB-CD2 4.48Å; F19-L523 HydrophobicContact CD1-CD2 3.83Å; F19-L523 HydrophobicContact CD2-CB 3.78Å; F19-L523 HydrophobicContact CD2-CD1 4.26Å; F19-L523 HydrophobicContact CD2-CD2 3.9Å; F19-L523 HydrophobicContact CD2-CG 4.19Å; F19-L523 HydrophobicContact CE1-CD2 3.98Å; F19-L523 HydrophobicContact CE2-CB 3.97Å; F19-L523 HydrophobicContact CE2-CD2 4.02Å; F19-L523 HydrophobicContact CG-CB 4.4Å; F19-L523 HydrophobicContact CG-CD1 4.09Å; F19-L523 HydrophobicContact CG-CD2 3.79Å; F19-L523 HydrophobicContact CG-CG 4.31Å; F19-L523 HydrophobicContact CZ-CD2 4.07Å
20	C	84.1	Confident	82.4	Confident	24 Å²	24	72.1 Å²	72.1	16%	0.162	35%	0.346	C	S	.	.	H	α-helix	trans	-62.7	-21.5	179.3	-67	0	0	0	0	113.5	L16 S18 L28 Q29 L32	L16-C20 WeakPolarHBondContact O-CB 3.28Å; L16-C20 PolarHBondContact O-N 3.34Å; L16-C20 PolarHBondContact O-SG 3.34Å; S18-C20 PolarHBondContact O-N 2.68Å; C20-L28 HydrophobicContact CB-CD2 4.06Å; C20-L28 HydrophobicContact CB-CG 4.02Å; C20-L28 WeakPolarHBondContact SG-CD2 3.47Å; C20-Q29 WeakPolarHBondContact O-CA 3.49Å; C20-L32 HydrophobicContact CB-CD1 3.23Å; C20-L32 HydrophobicContact CB-CG 3.91Å
21	R	83.2	Confident	83.5	Confident	153 Å²	153	72.6 Å²	72.6	58%	0.577	35%	0.346	S	S	*	.	H	α-helix	trans	-77.5	-32.9	174.4	-79.8	175.3	168.2	-175.7	-5.7	112.9	K17 S18 F19 L32	K17-R21 WeakPolarHBondContact O-CG 3.47Å; K17-R21 PolarHBondContact O-N 3.32Å; S18-R21 WeakPolarHBondContact O-CB 3.17Å; S18-R21 PolarHBondContact O-N 3.13Å; F19-R21 PolarHBondContact O-N 3.42Å; F19-R21 VanDerWaalsContact O-N 3.12Å; R21-L32 HydrophobicContact CG-CD1 3.94Å
22	W	83	Confident	83.6	Confident	203 Å²	203	72.4 Å²	72.4	77%	0.769	34%	0.339	S	S	*	.	H	α-helix	trans	-109.5	-13.1	-170.7	-64.3	109.8	0	0	0	114.1	S18 F19	S18-W22 PolarHBondContact O-N 3.27Å; F19-W22 PolarHBondContact O-N 2.88Å
23	T	86	Confident	83.6	Confident	1 Å²	1	79.8 Å²	79.8	1%	0.006	36%	0.359	C	S	.	.			trans	-66.2	145	-174.4	-172.1	0	0	0	0	112.2	F19 V25 L28 Q29 E519	F19-T23 HydrophobicContact CD1-CG2 4.48Å; F19-T23 HydrophobicContact CE1-CG2 4.14Å; F19-T23 WeakPolarHBondContact CZ-OG1 3.27Å; F19-T23 VanDerWaalsContact O-CB 3.31Å; F19-T23 WeakPolarHBondContact O-CB 3.38Å; F19-T23 PolarHBondContact O-N 3.09Å; T23-V25 HydrophobicContact CG2-CB 3.99Å; T23-V25 HydrophobicContact CG2-CG2 4.37Å; T23-V25 PolarHBondContact O-N 3.14Å; T23-V25 WeakPolarHBondContact OG1-CG2 3.45Å; T23-V25 PolarHBondContact OG1-N 3.44Å; T23-L28 HydrophobicContact CG2-CB 4.15Å; T23-L28 HydrophobicContact CG2-CD2 3.74Å; T23-L28 HydrophobicContact CG2-CG 4.39Å; T23-Q29 PolarHBondContact O-NE2 2.03Å; T23-E519 WeakPolarHBondContact CA-OE2 3.47Å; T23-E519 WeakPolarHBondContact CB-OE2 3.47Å; T23-E519 PolarHBondContact OG1-OE2 3.26Å
24	S	83.9	Confident	83.5	Confident	46 Å²	46	72.9 Å²	72.9	32%	0.322	33%	0.332	S	S	.	.			trans	-77.4	0.8	173.9	43	0	0	0	0	114	R26 T516 E519	S24-R26 PolarHBondContact O-N 3.27Å; S24-T516 WeakPolarHBondContact OG-CG2 3.27Å; S24-E519 WeakPolarHBondContact CB-OE1 3Å; S24-E519 PolarHBondContact N-OE1 3.02Å; S24-E519 PolarHBondContact N-OE2 2.82Å; S24-E519 VanDerWaalsContact OG-CD 3.23Å; S24-E519 PolarHBondContact OG-OE1 3.39Å; S24-E519 PolarHBondContact OG-OE2 2.96Å
25	V	84.4	Confident	83.2	Confident	15 Å²	15	75.9 Å²	75.9	9%	0.091	35%	0.346	C	S	.	.	S	Bend	trans	-67.7	122	175.7	-177.9	0	0	0	0	111.4	T23 L28 L510 F512 T516	T23-V25 HydrophobicContact CG2-CB 3.99Å; T23-V25 HydrophobicContact CG2-CG2 4.37Å; T23-V25 PolarHBondContact O-N 3.14Å; T23-V25 WeakPolarHBondContact OG1-CG2 3.45Å; T23-V25 PolarHBondContact OG1-N 3.44Å; V25-L28 PolarHBondContact O-N 3.45Å; V25-L510 WeakPolarHBondContact CA-O 3.23Å; V25-F512 HydrophobicContact CB-CE1 4.45Å; V25-F512 HydrophobicContact CG1-CE1 4.17Å; V25-F512 HydrophobicContact CG2-CD1 3.99Å; V25-F512 HydrophobicContact CG2-CE1 3.45Å; V25-F512 VanDerWaalsContact CG2-CE1 3.45Å; V25-F512 HydrophobicContact CG2-CZ 4.46Å; V25-T516 HydrophobicContact CG2-CG2 4.37Å
26	R	81.7	Confident	83.3	Confident	140 Å²	140	81.7 Å²	81.7	53%	0.528	37%	0.372	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.4	139.5	-178.4	-77.3	-176.8	-175.6	151.4	9.2	111.9	S24 L28 I508 L510 S511	S24-R26 PolarHBondContact O-N 3.27Å; R26-L28 PolarHBondContact O-N 2.98Å; R26-L28 VanDerWaalsContact O-N 3.13Å; R26-I508 PolarHBondContact NH1-O 3.24Å; R26-L510 PolarHBondContact N-O 2.8Å; R26-S511 VanDerWaalsContact CD-OG 3.28Å; R26-S511 WeakPolarHBondContact CD-OG 3.46Å; R26-S511 WeakPolarHBondContact CG-OG 3.42Å; R26-S511 PolarHBondContact NE-OG 2.82Å; R26-S511 PolarHBondContact NH2-OG 2.94Å
27	G	82.3	Confident	83.3	Confident	4 Å²	4	82.6 Å²	82.6	4%	0.041	38%	0.382	C	S	.	.	T	Hydrogen-bonded Turn	trans	79.8	-26.3	176.5	0	0	0	0	0	115.2	Q29 H30 L31	G27-Q29 PolarHBondContact O-N 3.22Å; G27-H30 PolarHBondContact O-N 3.44Å; G27-H30 VanDerWaalsContact O-N 3.14Å; G27-L31 PolarHBondContact O-N 2.85Å
28	L	83.5	Confident	83.5	Confident	38 Å²	38	83.5 Å²	83.5	20%	0.199	39%	0.392	C	S	.	.	H	α-helix	trans	-67.1	-37	-179.2	-160.9	65.5	0	0	0	112.4	F19 C20 T23 V25 R26 H30 L31 L32	F19-L28 HydrophobicContact CE1-CD2 4.36Å; C20-L28 HydrophobicContact CB-CD2 4.06Å; C20-L28 HydrophobicContact CB-CG 4.02Å; C20-L28 WeakPolarHBondContact SG-CD2 3.47Å; T23-L28 HydrophobicContact CG2-CB 4.15Å; T23-L28 HydrophobicContact CG2-CD2 3.74Å; T23-L28 HydrophobicContact CG2-CG 4.39Å; V25-L28 PolarHBondContact O-N 3.45Å; R26-L28 PolarHBondContact O-N 2.98Å; R26-L28 VanDerWaalsContact O-N 3.13Å; L28-H30 VanDerWaalsContact C-N 3.32Å; L28-H30 PolarHBondContact O-N 3.23Å; L28-L31 HydrophobicContact CD1-CD2 4.2Å; L28-L31 WeakPolarHBondContact O-CB 3.43Å; L28-L31 PolarHBondContact O-N 3.45Å; L28-L32 PolarHBondContact O-N 2.99Å
29	Q	84.1	Confident	83.6	Confident	86 Å²	86	85.1 Å²	85.1	40%	0.402	40%	0.397	S	S	.	.	H	α-helix	trans	-61.3	-40.6	172.5	-61.7	-177.5	-4	0	0	111.8	C20 T23 G27 L32 R33	C20-Q29 WeakPolarHBondContact O-CA 3.49Å; T23-Q29 PolarHBondContact O-NE2 2.03Å; G27-Q29 PolarHBondContact O-N 3.22Å; Q29-L32 PolarHBondContact O-N 3.21Å; Q29-R33 WeakPolarHBondContact O-CB 3.14Å; Q29-R33 PolarHBondContact O-N 3.39Å
30	H	83.3	Confident	83.7	Confident	80 Å²	80	89.9 Å²	89.9	37%	0.37	41%	0.414	S	S	.	.	H	α-helix	trans	-70.8	-32.4	-180	-68.3	-67.3	0	0	0	112.4	G27 L28 L32 R33 S34 W43	G27-H30 PolarHBondContact O-N 3.44Å; G27-H30 VanDerWaalsContact O-N 3.14Å; L28-H30 VanDerWaalsContact C-N 3.32Å; L28-H30 PolarHBondContact O-N 3.23Å; H30-L32 PolarHBondContact O-N 3.26Å; H30-R33 PolarHBondContact O-N 3.31Å; H30-S34 VanDerWaalsContact O-CB 3.27Å; H30-S34 WeakPolarHBondContact O-CB 3.4Å; H30-S34 PolarHBondContact O-N 2.9Å; H30-W43 HydrophobicContact CB-CD2 3.56Å; H30-W43 HydrophobicContact CB-CE3 4.06Å; H30-W43 HydrophobicContact CB-CG 3.78Å; H30-W43 HydrophobicContact CB-CZ2 4.09Å; H30-W43 AromaticContact CD2-CH2 3.7Å; H30-W43 AromaticContact CD2-CZ2 3.83Å; H30-W43 AromaticContact CD2-CZ3 3.99Å; H30-W43 AromaticContact CG-CE2 3.79Å; H30-W43 AromaticContact CG-CZ2 3.77Å
31	L	83.5	Confident	84	Confident	43 Å²	43	92.3 Å²	92.3	23%	0.225	43%	0.428	C	S	.	.	H	α-helix	trans	-60.8	-32.3	174.8	-169.7	71.8	0	0	0	112.6	G27 L28 R40 A44	G27-L31 PolarHBondContact O-N 2.85Å; L28-L31 HydrophobicContact CD1-CD2 4.2Å; L28-L31 WeakPolarHBondContact O-CB 3.43Å; L28-L31 PolarHBondContact O-N 3.45Å; L31-R40 HydrophobicContact CD1-CG 3.8Å; L31-R40 WeakPolarHBondContact CD1-O 3.42Å; L31-R40 PolarHBondContact O-NE 2.62Å; L31-A44 HydrophobicContact CD1-CB 3.72Å
32	L	81.5	Confident	84.3	Confident	65 Å²	65	90 Å²	90	34%	0.34	43%	0.426	S	S	.	.	H	α-helix	trans	-89.7	-28.8	175.5	-74.9	-168.9	0	0	0	114.3	K17 C20 R21 L28 Q29 H30	K17-L32 HydrophobicContact CG-CD1 4.12Å; K17-L32 WeakPolarHBondContact O-CD1 3.41Å; C20-L32 HydrophobicContact CB-CD1 3.23Å; C20-L32 HydrophobicContact CB-CG 3.91Å; R21-L32 HydrophobicContact CG-CD1 3.94Å; L28-L32 PolarHBondContact O-N 2.99Å; Q29-L32 PolarHBondContact O-N 3.21Å; H30-L32 PolarHBondContact O-N 3.26Å
33	R	81	Confident	84.6	Confident	211 Å²	211	83.6 Å²	83.6	80%	0.796	40%	0.402	S	S	*	.	H	α-helix	trans	-84.2	-23.7	-177.1	-170.9	173.5	177.8	174.3	-0.7	113.2	Q29 H30 E35	Q29-R33 WeakPolarHBondContact O-CB 3.14Å; Q29-R33 PolarHBondContact O-N 3.39Å; H30-R33 PolarHBondContact O-N 3.31Å; R33-E35 PolarHBondContact O-N 3.18Å
34	S	80.9	Confident	84.8	Confident	21 Å²	21	85.5 Å²	85.5	15%	0.147	42%	0.418	C	S	.	.			trans	-71	119.6	-178	-173.4	0	0	0	0	112.1	H30 H36 L39 R40	H30-S34 VanDerWaalsContact O-CB 3.27Å; H30-S34 WeakPolarHBondContact O-CB 3.4Å; H30-S34 PolarHBondContact O-N 2.9Å; S34-H36 PolarHBondContact OG-O 3.04Å; S34-L39 WeakPolarHBondContact OG-CB 3.48Å; S34-L39 WeakPolarHBondContact OG-CG 3.37Å; S34-R40 PolarHBondContact OG-N 3.08Å
35	E	77.5	Confident	85.2	Confident	182 Å²	182	88.4 Å²	88.4	85%	0.85	43%	0.428	S	S	*	.			trans	-78.5	-35.4	178.5	-62.4	-177.6	172.4	0	0	112.3	R33	R33-E35 PolarHBondContact O-N 3.18Å
36	H	86.4	Confident	85.5	Confident	133 Å²	133	91.6 Å²	91.6	62%	0.616	44%	0.441	S	S	*	.	S	Bend	trans	-82.9	131.4	-177.9	-67.1	-62.7	0	0	0	112.2	S34 L38 L39 R40	S34-H36 PolarHBondContact OG-O 3.04Å; H36-L38 VanDerWaalsContact C-N 3.31Å; H36-L38 PolarHBondContact O-N 3.4Å; H36-L39 HydrophobicContact CB-CB 4.35Å; H36-L39 PolarHBondContact O-N 3.4Å; H36-R40 PolarHBondContact O-N 2.59Å
37	P	85	Confident	85.9	Confident	97 Å²	97	86.3 Å²	86.3	63%	0.63	43%	0.425	S	S	*	.	H	α-helix	trans	-61.6	-37.5	-177	24	-33.4	0	0	0	112.5	R40 T41	P37-R40 WeakPolarHBondContact O-CB 3.29Å; P37-R40 PolarHBondContact O-N 3.06Å; P37-T41 WeakPolarHBondContact O-CG2 3.32Å; P37-T41 PolarHBondContact O-N 3.2Å; P37-T41 PolarHBondContact O-OG1 2.77Å
38	L	87.8	Confident	86.4	Confident	133 Å²	133	88.4 Å²	88.4	70%	0.696	44%	0.442	S	S	*	.	H	α-helix	trans	-62.3	-48.6	177.5	-69.3	177.6	0	0	0	112	H36 R40 T41 I42	H36-L38 VanDerWaalsContact C-N 3.31Å; H36-L38 PolarHBondContact O-N 3.4Å; L38-R40 VanDerWaalsContact C-N 3.27Å; L38-R40 PolarHBondContact O-N 3.13Å; L38-T41 WeakPolarHBondContact CA-OG1 3.27Å; L38-T41 PolarHBondContact O-N 3.38Å; L38-T41 VanDerWaalsContact O-N 3.11Å; L38-T41 PolarHBondContact O-OG1 3.46Å; L38-I42 WeakPolarHBondContact O-CG1 3.25Å; L38-I42 PolarHBondContact O-N 3.22Å
39	L	87	Confident	86.9	Confident	79 Å²	79	91.6 Å²	91.6	41%	0.414	46%	0.458	S	S	.	.	H	α-helix	trans	-65.3	-35.5	179.5	-172.7	66.8	0	0	0	111	S34 H36 I42 W43	S34-L39 WeakPolarHBondContact OG-CB 3.48Å; S34-L39 WeakPolarHBondContact OG-CG 3.37Å; H36-L39 HydrophobicContact CB-CB 4.35Å; H36-L39 PolarHBondContact O-N 3.4Å; L39-I42 PolarHBondContact O-N 3.16Å; L39-W43 PolarHBondContact O-N 3.38Å
40	R	88.3	Confident	87.2	Confident	133 Å²	133	90 Å²	90	50%	0.502	45%	0.451	S	S	.	.	H	α-helix	trans	-62.6	-40.3	172	-169.7	175.6	177.8	-166.6	-5.9	112.5	L31 S34 H36 P37 L38 A44	L31-R40 HydrophobicContact CD1-CG 3.8Å; L31-R40 WeakPolarHBondContact CD1-O 3.42Å; L31-R40 PolarHBondContact O-NE 2.62Å; S34-R40 PolarHBondContact OG-N 3.08Å; H36-R40 PolarHBondContact O-N 2.59Å; P37-R40 WeakPolarHBondContact O-CB 3.29Å; P37-R40 PolarHBondContact O-N 3.06Å; L38-R40 VanDerWaalsContact C-N 3.27Å; L38-R40 PolarHBondContact O-N 3.13Å; R40-A44 WeakPolarHBondContact O-CB 3.37Å; R40-A44 PolarHBondContact O-N 3.11Å
41	T	88.9	Confident	87.6	Confident	75 Å²	75	88.4 Å²	88.4	46%	0.46	45%	0.449	S	S	.	.	H	α-helix	trans	-66.4	-39.5	174.6	54.4	0	0	0	0	112.5	P37 L38 A44 I45	P37-T41 WeakPolarHBondContact O-CG2 3.32Å; P37-T41 PolarHBondContact O-N 3.2Å; P37-T41 PolarHBondContact O-OG1 2.77Å; L38-T41 WeakPolarHBondContact CA-OG1 3.27Å; L38-T41 PolarHBondContact O-N 3.38Å; L38-T41 VanDerWaalsContact O-N 3.11Å; L38-T41 PolarHBondContact O-OG1 3.46Å; T41-A44 WeakPolarHBondContact O-CB 3.38Å; T41-A44 PolarHBondContact O-N 3.37Å; T41-I45 VanDerWaalsContact O-CG1 3.32Å; T41-I45 WeakPolarHBondContact O-CG1 3.42Å; T41-I45 PolarHBondContact O-N 3.35Å
42	I	91	Very high	88.2	Confident	106 Å²	106	92 Å²	92	54%	0.544	47%	0.468	S	S	.	.	H	α-helix	trans	-61.9	-46.9	176.2	-67	167.1	0	0	0	110.4	L38 L39 A44 I45 F46	L38-I42 WeakPolarHBondContact O-CG1 3.25Å; L38-I42 PolarHBondContact O-N 3.22Å; L39-I42 PolarHBondContact O-N 3.16Å; I42-A44 VanDerWaalsContact C-N 3.34Å; I42-A44 PolarHBondContact O-N 2.89Å; I42-I45 PolarHBondContact O-N 3.47Å; I42-F46 WeakPolarHBondContact O-CB 3.45Å; I42-F46 PolarHBondContact O-N 3.08Å
43	W	89.4	Confident	88.8	Confident	67 Å²	67	90.6 Å²	90.6	25%	0.254	47%	0.466	S	S	.	.	H	α-helix	trans	-63.5	-37.7	175.9	-79.9	113.2	0	0	0	112.8	H30 L39 F46 V47	H30-W43 HydrophobicContact CB-CD2 3.56Å; H30-W43 HydrophobicContact CB-CE3 4.06Å; H30-W43 HydrophobicContact CB-CG 3.78Å; H30-W43 HydrophobicContact CB-CZ2 4.09Å; H30-W43 AromaticContact CD2-CH2 3.7Å; H30-W43 AromaticContact CD2-CZ2 3.83Å; H30-W43 AromaticContact CD2-CZ3 3.99Å; H30-W43 AromaticContact CG-CE2 3.79Å; H30-W43 AromaticContact CG-CZ2 3.77Å; L39-W43 PolarHBondContact O-N 3.38Å; W43-F46 AromaticContact CE3-CD1 3.97Å; W43-F46 HydrophobicContact CE3-CD1 3.97Å; W43-F46 AromaticContact CZ3-CD1 3.89Å; W43-F46 HydrophobicContact CZ3-CD1 3.89Å; W43-F46 HydrophobicContact CZ3-CE1 4.16Å; W43-F46 PolarHBondContact O-N 3.19Å; W43-V47 WeakPolarHBondContact O-CB 2.98Å; W43-V47 VanDerWaalsContact O-CG2 3.29Å; W43-V47 WeakPolarHBondContact O-CG2 3.46Å; W43-V47 PolarHBondContact O-N 2.99Å
44	A	89.4	Confident	89.4	Confident	42 Å²	42	81.2 Å²	81.2	35%	0.347	43%	0.431	S	S	.	.	H	α-helix	trans	-62.3	-46	175.3	0	0	0	0	0	111.8	L31 R40 T41 I42 V47 A48	L31-A44 HydrophobicContact CD1-CB 3.72Å; R40-A44 WeakPolarHBondContact O-CB 3.37Å; R40-A44 PolarHBondContact O-N 3.11Å; T41-A44 WeakPolarHBondContact O-CB 3.38Å; T41-A44 PolarHBondContact O-N 3.37Å; I42-A44 VanDerWaalsContact C-N 3.34Å; I42-A44 PolarHBondContact O-N 2.89Å; A44-V47 PolarHBondContact O-N 3.02Å; A44-A48 WeakPolarHBondContact O-CB 3.35Å; A44-A48 PolarHBondContact O-N 3.27Å
45	I	92.2	Very high	90	Very high	106 Å²	106	84.6 Å²	84.6	54%	0.544	45%	0.446	S	S	.	.	H	α-helix	trans	-62.8	-45.1	176.8	-67.7	165.7	0	0	0	110.2	T41 I42 V47 A48 L49	T41-I45 VanDerWaalsContact O-CG1 3.32Å; T41-I45 WeakPolarHBondContact O-CG1 3.42Å; T41-I45 PolarHBondContact O-N 3.35Å; I42-I45 PolarHBondContact O-N 3.47Å; I45-V47 PolarHBondContact O-N 3.31Å; I45-A48 PolarHBondContact O-N 3.43Å; I45-L49 HydrophobicContact CG2-CD1 3.85Å; I45-L49 HydrophobicContact CG2-CG 4.26Å; I45-L49 WeakPolarHBondContact O-CB 3.5Å; I45-L49 WeakPolarHBondContact O-CG 3.27Å; I45-L49 PolarHBondContact O-N 3.49Å
46	F	91	Very high	90.9	Very high	82 Å²	82	77.4 Å²	77.4	36%	0.36	42%	0.422	S	S	.	.	H	α-helix	trans	-59.2	-49	177.7	177.4	-96.3	0	0	0	112.1	I42 W43 A48 L49 M50	I42-F46 WeakPolarHBondContact O-CB 3.45Å; I42-F46 PolarHBondContact O-N 3.08Å; W43-F46 AromaticContact CE3-CD1 3.97Å; W43-F46 HydrophobicContact CE3-CD1 3.97Å; W43-F46 AromaticContact CZ3-CD1 3.89Å; W43-F46 HydrophobicContact CZ3-CD1 3.89Å; W43-F46 HydrophobicContact CZ3-CE1 4.16Å; W43-F46 PolarHBondContact O-N 3.19Å; F46-A48 VanDerWaalsContact C-N 3.33Å; F46-A48 PolarHBondContact O-N 2.95Å; F46-L49 PolarHBondContact O-N 2.8Å; F46-M50 HydrophobicContact CD1-CG 4.27Å; F46-M50 HydrophobicContact CD2-CE 4.42Å; F46-M50 HydrophobicContact CD2-CG 4.42Å; F46-M50 HydrophobicContact CE1-CG 3.85Å; F46-M50 HydrophobicContact CE2-CE 3.78Å; F46-M50 HydrophobicContact CE2-CG 4.02Å; F46-M50 HydrophobicContact CE2-SD 4.35Å; F46-M50 HydrophobicContact CZ-CE 4.18Å; F46-M50 HydrophobicContact CZ-CG 3.71Å; F46-M50 HydrophobicContact CZ-SD 4.15Å; F46-M50 WeakPolarHBondContact O-CB 3.28Å; F46-M50 VanDerWaalsContact O-CG 3.3Å; F46-M50 WeakPolarHBondContact O-CG 3.27Å; F46-M50 PolarHBondContact O-N 2.97Å
47	V	90.7	Very high	91.3	Very high	30 Å²	30	74.5 Å²	74.5	18%	0.182	41%	0.41	C	S	.	.	H	α-helix	trans	-62.1	-41.7	177.7	171.6	0	0	0	0	111	W43 A44 I45 M50 C51	W43-V47 WeakPolarHBondContact O-CB 2.98Å; W43-V47 VanDerWaalsContact O-CG2 3.29Å; W43-V47 WeakPolarHBondContact O-CG2 3.46Å; W43-V47 PolarHBondContact O-N 2.99Å; A44-V47 PolarHBondContact O-N 3.02Å; I45-V47 PolarHBondContact O-N 3.31Å; V47-M50 PolarHBondContact O-N 3.17Å; V47-C51 VanDerWaalsContact O-CB 3.25Å; V47-C51 WeakPolarHBondContact O-CB 3.38Å; V47-C51 PolarHBondContact O-N 2.75Å
48	A	91.8	Very high	91.8	Very high	48 Å²	48	71 Å²	71	40%	0.397	39%	0.387	S	S	.	.	H	α-helix	trans	-63.3	-45.6	177	0	0	0	0	0	112	A44 I45 F46 C51 L52	A44-A48 WeakPolarHBondContact O-CB 3.35Å; A44-A48 PolarHBondContact O-N 3.27Å; I45-A48 PolarHBondContact O-N 3.43Å; F46-A48 VanDerWaalsContact C-N 3.33Å; F46-A48 PolarHBondContact O-N 2.95Å; A48-C51 PolarHBondContact O-N 3.28Å; A48-L52 WeakPolarHBondContact O-CB 3.41Å; A48-L52 VanDerWaalsContact O-CG 3.3Å; A48-L52 WeakPolarHBondContact O-CG 3.25Å; A48-L52 PolarHBondContact O-N 3.49Å
49	L	93.5	Very high	92.2	Very high	104 Å²	104	68 Å²	68	55%	0.545	37%	0.374	S	S	.	.	H	α-helix	trans	-62.7	-44.9	177.1	-74.2	173.9	0	0	0	111.9	I45 F46 C51 L52 A53	I45-L49 HydrophobicContact CG2-CD1 3.85Å; I45-L49 HydrophobicContact CG2-CG 4.26Å; I45-L49 WeakPolarHBondContact O-CB 3.5Å; I45-L49 WeakPolarHBondContact O-CG 3.27Å; I45-L49 PolarHBondContact O-N 3.49Å; F46-L49 PolarHBondContact O-N 2.8Å; L49-C51 VanDerWaalsContact C-N 3.32Å; L49-C51 PolarHBondContact O-N 2.91Å; L49-L52 PolarHBondContact O-N 3.11Å; L49-A53 VanDerWaalsContact O-CB 3.28Å; L49-A53 WeakPolarHBondContact O-CB 3.43Å; L49-A53 PolarHBondContact O-N 3.39Å
50	M	92	Very high	92.6	Very high	53 Å²	53	69.7 Å²	69.7	26%	0.261	38%	0.383	S	S	.	.	H	α-helix	trans	-63.6	-39.2	177.2	-70.2	-68	130.5	0	0	111.8	F46 V47 N54 F509	F46-M50 HydrophobicContact CD1-CG 4.27Å; F46-M50 HydrophobicContact CD2-CE 4.42Å; F46-M50 HydrophobicContact CD2-CG 4.42Å; F46-M50 HydrophobicContact CE1-CG 3.85Å; F46-M50 HydrophobicContact CE2-CE 3.78Å; F46-M50 HydrophobicContact CE2-CG 4.02Å; F46-M50 HydrophobicContact CE2-SD 4.35Å; F46-M50 HydrophobicContact CZ-CE 4.18Å; F46-M50 HydrophobicContact CZ-CG 3.71Å; F46-M50 HydrophobicContact CZ-SD 4.15Å; F46-M50 WeakPolarHBondContact O-CB 3.28Å; F46-M50 VanDerWaalsContact O-CG 3.3Å; F46-M50 WeakPolarHBondContact O-CG 3.27Å; F46-M50 PolarHBondContact O-N 2.97Å; V47-M50 PolarHBondContact O-N 3.17Å; M50-N54 VanDerWaalsContact O-CB 3.25Å; M50-N54 WeakPolarHBondContact O-CB 3.35Å; M50-N54 PolarHBondContact O-N 3.38Å; M50-F509 HydrophobicContact CB-CD1 4.48Å; M50-F509 HydrophobicContact SD-CD1 3.53Å; M50-F509 VanDerWaalsContact SD-CD1 3.53Å; M50-F509 HydrophobicContact SD-CE1 4.12Å; M50-F509 HydrophobicContact SD-CG 4.48Å
51	C	91.7	Very high	92.8	Very high	47 Å²	47	64 Å²	64	32%	0.318	36%	0.363	S	S	.	.	H	α-helix	trans	-66.1	-46.2	175.6	-173.2	0	0	0	0	111.8	V47 A48 L49 N54 I55 L510	V47-C51 VanDerWaalsContact O-CB 3.25Å; V47-C51 WeakPolarHBondContact O-CB 3.38Å; V47-C51 PolarHBondContact O-N 2.75Å; A48-C51 PolarHBondContact O-N 3.28Å; L49-C51 VanDerWaalsContact C-N 3.32Å; L49-C51 PolarHBondContact O-N 2.91Å; C51-N54 PolarHBondContact O-N 3.43Å; C51-I55 VanDerWaalsContact O-CG1 3.27Å; C51-I55 WeakPolarHBondContact O-CG1 3.43Å; C51-I55 PolarHBondContact O-N 3.36Å; C51-L510 HydrophobicContact CB-CD2 4.27Å
52	L	94.7	Very high	93.1	Very high	118 Å²	118	63.2 Å²	63.2	62%	0.618	36%	0.355	S	S	*	.	H	α-helix	trans	-62.8	-43	176.7	-73.3	171	0	0	0	112	A48 L49 I55 G56	A48-L52 WeakPolarHBondContact O-CB 3.41Å; A48-L52 VanDerWaalsContact O-CG 3.3Å; A48-L52 WeakPolarHBondContact O-CG 3.25Å; A48-L52 PolarHBondContact O-N 3.49Å; L49-L52 PolarHBondContact O-N 3.11Å; L52-I55 PolarHBondContact O-N 2.88Å; L52-G56 PolarHBondContact O-N 3.15Å
53	A	93.8	Very high	93.2	Very high	36 Å²	36	62.4 Å²	62.4	30%	0.298	35%	0.351	S	S	.	.	H	α-helix	trans	-63.7	-43	176.3	0	0	0	0	0	111.6	L49 G56 L57 F509	L49-A53 VanDerWaalsContact O-CB 3.28Å; L49-A53 WeakPolarHBondContact O-CB 3.43Å; L49-A53 PolarHBondContact O-N 3.39Å; A53-G56 PolarHBondContact O-N 3.38Å; A53-L57 WeakPolarHBondContact O-CB 3.25Å; A53-L57 WeakPolarHBondContact O-CG 3.46Å; A53-L57 PolarHBondContact O-N 2.7Å; A53-F509 HydrophobicContact CB-CD1 3.85Å; A53-F509 HydrophobicContact CB-CE1 3.52Å; A53-F509 HydrophobicContact CB-CZ 4.24Å
54	N	94	Very high	93.3	Very high	13 Å²	13	62 Å²	62	7%	0.07	35%	0.352	C	S	.	.	H	α-helix	trans	-59.8	-50.8	175.3	-177.3	-86.5	0	0	0	111.5	M50 C51 G56 L57 V58 I505 C506 F509 L510	M50-N54 VanDerWaalsContact O-CB 3.25Å; M50-N54 WeakPolarHBondContact O-CB 3.35Å; M50-N54 PolarHBondContact O-N 3.38Å; C51-N54 PolarHBondContact O-N 3.43Å; N54-G56 VanDerWaalsContact C-N 3.35Å; N54-G56 PolarHBondContact O-N 3.05Å; N54-L57 PolarHBondContact O-N 2.97Å; N54-V58 WeakPolarHBondContact O-CB 3.49Å; N54-V58 VanDerWaalsContact O-CG2 3.27Å; N54-V58 WeakPolarHBondContact O-CG2 3.44Å; N54-V58 PolarHBondContact O-N 3.48Å; N54-I505 PolarHBondContact ND2-O 3.43Å; N54-I505 VanDerWaalsContact ND2-O 3.16Å; N54-C506 WeakPolarHBondContact ND2-CA 3.34Å; N54-C506 PolarHBondContact ND2-N 2.9Å; N54-F509 HydrophobicContact CB-CB 3.82Å; N54-F509 HydrophobicContact CB-CG 4.22Å; N54-L510 HydrophobicContact CB-CD1 4.29Å; N54-L510 HydrophobicContact CB-CG 4.39Å
55	I	94.4	Very high	93.3	Very high	92 Å²	92	62.2 Å²	62.2	47%	0.472	34%	0.344	S	S	.	.	H	α-helix	trans	-60.4	-45.6	178.7	-67.6	165.4	0	0	0	110.5	C51 L52 T59	C51-I55 VanDerWaalsContact O-CG1 3.27Å; C51-I55 WeakPolarHBondContact O-CG1 3.43Å; C51-I55 PolarHBondContact O-N 3.36Å; L52-I55 PolarHBondContact O-N 2.88Å; I55-T59 VanDerWaalsContact O-CB 3.27Å; I55-T59 WeakPolarHBondContact O-CB 3.49Å; I55-T59 PolarHBondContact O-N 3.36Å; I55-T59 PolarHBondContact O-OG1 2.75Å
56	G	95.7	Very high	93.2	Very high	32 Å²	32	64.2 Å²	64.2	33%	0.33	35%	0.346	S	S	.	.	H	α-helix	trans	-60.7	-48	179.2	0	0	0	0	0	112.9	L52 A53 N54 T59 L60	L52-G56 PolarHBondContact O-N 3.15Å; A53-G56 PolarHBondContact O-N 3.38Å; N54-G56 VanDerWaalsContact C-N 3.35Å; N54-G56 PolarHBondContact O-N 3.05Å; G56-T59 PolarHBondContact O-N 3.02Å; G56-L60 WeakPolarHBondContact O-CG 3.38Å; G56-L60 PolarHBondContact O-N 3.38Å
57	L	95.8	Very high	93.1	Very high	72 Å²	72	65.5 Å²	65.5	38%	0.377	35%	0.353	S	S	.	.	H	α-helix	trans	-68.2	-42.2	179.6	-71.5	170.8	0	0	0	112.6	A53 N54 T59 L60 L61 I505 F509	A53-L57 WeakPolarHBondContact O-CB 3.25Å; A53-L57 WeakPolarHBondContact O-CG 3.46Å; A53-L57 PolarHBondContact O-N 2.7Å; N54-L57 PolarHBondContact O-N 2.97Å; L57-T59 VanDerWaalsContact C-N 3.29Å; L57-T59 PolarHBondContact O-N 3.15Å; L57-L60 PolarHBondContact O-N 2.96Å; L57-L61 WeakPolarHBondContact O-CB 3.38Å; L57-L61 PolarHBondContact O-N 2.99Å; L57-I505 HydrophobicContact CB-CD1 4.27Å; L57-I505 HydrophobicContact CB-CG2 4.1Å; L57-I505 HydrophobicContact CD1-CG2 4.47Å; L57-F509 HydrophobicContact CD1-CD2 4.43Å; L57-F509 HydrophobicContact CD1-CE2 3.42Å; L57-F509 VanDerWaalsContact CD1-CE2 3.42Å; L57-F509 HydrophobicContact CD1-CZ 3.49Å; L57-F509 VanDerWaalsContact CD1-CZ 3.49Å
58	V	95.2	Very high	92.9	Very high	24 Å²	24	69.5 Å²	69.5	15%	0.145	37%	0.368	C	S	.	.	H	α-helix	trans	-62.6	-40.1	174.6	171.8	0	0	0	0	110.5	N54 L61 L62 I505	N54-V58 WeakPolarHBondContact O-CB 3.49Å; N54-V58 VanDerWaalsContact O-CG2 3.27Å; N54-V58 WeakPolarHBondContact O-CG2 3.44Å; N54-V58 PolarHBondContact O-N 3.48Å; V58-L61 PolarHBondContact O-N 3.25Å; V58-L62 HydrophobicContact CG1-CD1 4.04Å; V58-L62 HydrophobicContact CG1-CG 4.39Å; V58-L62 WeakPolarHBondContact O-CB 3.24Å; V58-L62 WeakPolarHBondContact O-CG 3.35Å; V58-L62 PolarHBondContact O-N 3.21Å; V58-I505 HydrophobicContact CG2-CB 4.44Å; V58-I505 HydrophobicContact CG2-CG2 3.93Å
59	T	95.5	Very high	92.7	Very high	68 Å²	68	70.3 Å²	70.3	42%	0.417	37%	0.366	S	S	.	.	H	α-helix	trans	-63.1	-45.7	176.5	-57	0	0	0	0	111.4	I55 G56 L57 L61 L62 I63	I55-T59 VanDerWaalsContact O-CB 3.27Å; I55-T59 WeakPolarHBondContact O-CB 3.49Å; I55-T59 PolarHBondContact O-N 3.36Å; I55-T59 PolarHBondContact O-OG1 2.75Å; G56-T59 PolarHBondContact O-N 3.02Å; L57-T59 VanDerWaalsContact C-N 3.29Å; L57-T59 PolarHBondContact O-N 3.15Å; T59-L61 VanDerWaalsContact C-N 3.3Å; T59-L61 PolarHBondContact O-N 3.11Å; T59-L62 PolarHBondContact O-N 3.33Å; T59-I63 HydrophobicContact CG2-CD1 4.03Å; T59-I63 VanDerWaalsContact O-CG1 3.29Å; T59-I63 WeakPolarHBondContact O-CG1 3.36Å; T59-I63 PolarHBondContact O-N 3.08Å
60	L	95	Very high	92.5	Very high	115 Å²	115	67.5 Å²	67.5	60%	0.602	35%	0.353	S	S	*	.	H	α-helix	trans	-59.5	-42.8	175.4	-73.9	171.6	0	0	0	111.8	G56 L57 I63 H64	G56-L60 WeakPolarHBondContact O-CG 3.38Å; G56-L60 PolarHBondContact O-N 3.38Å; L57-L60 PolarHBondContact O-N 2.96Å; L60-I63 PolarHBondContact O-N 3.37Å; L60-H64 PolarHBondContact O-N 3.34Å
61	L	94	Very high	92.4	Very high	15 Å²	15	69 Å²	69	8%	0.079	36%	0.361	C	S	.	.	H	α-helix	trans	-65.8	-40.1	178.9	-173	66.4	0	0	0	112.1	L57 V58 T59 H64 Y65 Y493 L498 Q501 I502 I505	L57-L61 WeakPolarHBondContact O-CB 3.38Å; L57-L61 PolarHBondContact O-N 2.99Å; V58-L61 PolarHBondContact O-N 3.25Å; T59-L61 VanDerWaalsContact C-N 3.3Å; T59-L61 PolarHBondContact O-N 3.11Å; L61-H64 PolarHBondContact O-N 3.18Å; L61-Y65 WeakPolarHBondContact O-CB 3.47Å; L61-Y65 PolarHBondContact O-N 2.97Å; L61-Y493 HydrophobicContact CD1-CE1 3.74Å; L61-L498 HydrophobicContact CD2-CD1 3.85Å; L61-L498 HydrophobicContact CG-CD1 3.72Å; L61-Q501 HydrophobicContact CD2-CB 3.68Å; L61-I502 HydrophobicContact CD2-CG1 3.78Å; L61-I505 HydrophobicContact CD2-CD1 4.16Å
62	L	94	Very high	92.4	Very high	57 Å²	57	73.5 Å²	73.5	30%	0.298	38%	0.377	S	S	.	.	H	α-helix	trans	-64.3	-43.2	174.1	-73.9	171.7	0	0	0	111.3	V58 T59 H64 Y65 Y66 L498 I502	V58-L62 HydrophobicContact CG1-CD1 4.04Å; V58-L62 HydrophobicContact CG1-CG 4.39Å; V58-L62 WeakPolarHBondContact O-CB 3.24Å; V58-L62 WeakPolarHBondContact O-CG 3.35Å; V58-L62 PolarHBondContact O-N 3.21Å; T59-L62 PolarHBondContact O-N 3.33Å; L62-H64 VanDerWaalsContact C-N 3.31Å; L62-H64 PolarHBondContact O-N 3.06Å; L62-Y65 PolarHBondContact O-N 2.94Å; L62-Y66 HydrophobicContact CB-CD2 4.29Å; L62-Y66 HydrophobicContact CB-CE2 4.2Å; L62-Y66 HydrophobicContact CD2-CE2 4.18Å; L62-Y66 WeakPolarHBondContact O-CB 3.2Å; L62-Y66 WeakPolarHBondContact O-CD2 3.38Å; L62-Y66 PolarHBondContact O-N 3.5Å; L62-L498 HydrophobicContact CD2-CD2 4.49Å; L62-I502 HydrophobicContact CD2-CD1 4.36Å
63	I	93.5	Very high	92.3	Very high	89 Å²	89	71.1 Å²	71.1	46%	0.456	37%	0.365	S	S	.	.	H	α-helix	trans	-58	-46.6	175.1	-69.1	164.7	0	0	0	110.2	T59 L60 Y65 Y66 Q67	T59-I63 HydrophobicContact CG2-CD1 4.03Å; T59-I63 VanDerWaalsContact O-CG1 3.29Å; T59-I63 WeakPolarHBondContact O-CG1 3.36Å; T59-I63 PolarHBondContact O-N 3.08Å; L60-I63 PolarHBondContact O-N 3.37Å; I63-Y65 VanDerWaalsContact C-N 3.34Å; I63-Y65 PolarHBondContact O-N 3.33Å; I63-Y66 PolarHBondContact O-N 3.35Å; I63-Q67 WeakPolarHBondContact O-CG 3.33Å; I63-Q67 PolarHBondContact O-N 2.89Å; I63-Q67 VanDerWaalsContact O-N 3.14Å
64	H	91	Very high	92.2	Very high	58 Å²	58	76.8 Å²	76.8	27%	0.269	39%	0.388	S	S	.	.	H	α-helix	trans	-60.8	-42.9	177.7	-166.6	-98.9	0	0	0	112.1	L60 L61 L62 Q67 E492 Y493	L60-H64 PolarHBondContact O-N 3.34Å; L61-H64 PolarHBondContact O-N 3.18Å; L62-H64 VanDerWaalsContact C-N 3.31Å; L62-H64 PolarHBondContact O-N 3.06Å; H64-Q67 PolarHBondContact O-N 2.86Å; H64-E492 IonicContact CE1-OE1 3.57Å; H64-E492 IonicContact CE1-OE2 2.61Å; H64-E492 IonicContact NE2-OE1 3.25Å; H64-Y493 AromaticContact CE1-CD2 3.48Å; H64-Y493 VanDerWaalsContact CE1-CD2 3.48Å; H64-Y493 WeakPolarHBondContact CE1-CD2 3.32Å; H64-Y493 AromaticContact CE1-CE2 3.62Å; H64-Y493 AromaticContact ND1-CD2 3.27Å; H64-Y493 VanDerWaalsContact ND1-CD2 3.27Å; H64-Y493 WeakPolarHBondContact ND1-CD2 3.44Å; H64-Y493 AromaticContact ND1-CE2 3.45Å; H64-Y493 WeakPolarHBondContact ND1-CE2 3.37Å
65	Y	90.7	Very high	92.2	Very high	48 Å²	48	83.4 Å²	83.4	19%	0.188	41%	0.412	C	S	.	.	H	α-helix	trans	-62.5	-43.3	176	179	-106.2	0	0	0	112.6	L61 L62 I63 Q67 F68 L498	L61-Y65 WeakPolarHBondContact O-CB 3.47Å; L61-Y65 PolarHBondContact O-N 2.97Å; L62-Y65 PolarHBondContact O-N 2.94Å; I63-Y65 VanDerWaalsContact C-N 3.34Å; I63-Y65 PolarHBondContact O-N 3.33Å; Y65-Q67 PolarHBondContact O-N 3.1Å; Y65-F68 PolarHBondContact O-N 3.33Å; Y65-F68 VanDerWaalsContact O-N 3.12Å; Y65-L498 HydrophobicContact CD1-CD2 3.67Å; Y65-L498 HydrophobicContact CD2-CB 4.22Å; Y65-L498 HydrophobicContact CD2-CD2 3.85Å; Y65-L498 HydrophobicContact CD2-CG 4.42Å; Y65-L498 HydrophobicContact CE1-CD2 3.87Å; Y65-L498 HydrophobicContact CE2-CB 4.5Å; Y65-L498 HydrophobicContact CE2-CD2 4.07Å; Y65-L498 HydrophobicContact CG-CD1 4.25Å; Y65-L498 HydrophobicContact CG-CD2 3.65Å; Y65-L498 HydrophobicContact CG-CG 4.4Å
66	Y	90	Very high	92	Very high	147 Å²	147	83.8 Å²	83.8	58%	0.576	42%	0.418	S	S	*	.	H	α-helix	trans	-75	-6.4	180	-72.2	-59.3	0	0	0	114.5	L62 I63 F68	L62-Y66 HydrophobicContact CB-CD2 4.29Å; L62-Y66 HydrophobicContact CB-CE2 4.2Å; L62-Y66 HydrophobicContact CD2-CE2 4.18Å; L62-Y66 WeakPolarHBondContact O-CB 3.2Å; L62-Y66 WeakPolarHBondContact O-CD2 3.38Å; L62-Y66 PolarHBondContact O-N 3.5Å; I63-Y66 PolarHBondContact O-N 3.35Å; Y66-F68 HydrophobicContact CD1-CE2 4.46Å; Y66-F68 HydrophobicContact CD1-CZ 4.13Å; Y66-F68 WeakPolarHBondContact O-CD2 3.29Å; Y66-F68 WeakPolarHBondContact O-CE2 3Å
67	Q	88.7	Confident	91.8	Very high	109 Å²	109	85.1 Å²	85.1	51%	0.509	42%	0.418	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.6	-19.2	167	-73.2	174.6	-14.2	0	0	112.1	I63 H64 Y65 N69	I63-Q67 WeakPolarHBondContact O-CG 3.33Å; I63-Q67 PolarHBondContact O-N 2.89Å; I63-Q67 VanDerWaalsContact O-N 3.14Å; H64-Q67 PolarHBondContact O-N 2.86Å; Y65-Q67 PolarHBondContact O-N 3.1Å; Q67-N69 PolarHBondContact O-N 3.33Å; Q67-N69 PolarHBondContact OE1-ND2 3.08Å
68	F	85.8	Confident	91.4	Very high	115 Å²	115	91.8 Å²	91.8	50%	0.504	44%	0.438	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.9	37.3	-178	-57.6	-74	0	0	0	113.1	Y65 Y66 M297	Y65-F68 PolarHBondContact O-N 3.33Å; Y65-F68 VanDerWaalsContact O-N 3.12Å; Y66-F68 HydrophobicContact CD1-CE2 4.46Å; Y66-F68 HydrophobicContact CD1-CZ 4.13Å; Y66-F68 WeakPolarHBondContact O-CD2 3.29Å; Y66-F68 WeakPolarHBondContact O-CE2 3Å; F68-M297 HydrophobicContact CB-CE 3.59Å; F68-M297 WeakPolarHBondContact O-CE 3.46Å
69	N	88.3	Confident	90.8	Very high	65 Å²	65	93.1 Å²	93.1	35%	0.348	46%	0.456	S	S	.	.			trans	-62.4	147	178.2	-65.7	-19.6	0	0	0	111.2	Q67 E492	Q67-N69 PolarHBondContact O-N 3.33Å; Q67-N69 PolarHBondContact OE1-ND2 3.08Å; N69-E492 HydrophobicContact CB-CB 4.3Å; N69-E492 WeakPolarHBondContact CB-OE2 3.3Å; N69-E492 WeakPolarHBondContact O-CB 3.49Å; N69-E492 PolarHBondContact O-N 2.77Å
70	T	88.5	Confident	90.3	Very high	45 Å²	45	93 Å²	93	28%	0.276	45%	0.452	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	150.4	-179.7	51.8	0	0	0	0	110.5	M297 E489 N490	T70-M297 HydrophobicContact CG2-CE 4.07Å; T70-M297 HydrophobicContact CG2-SD 3.59Å; T70-M297 VanDerWaalsContact CG2-SD 3.59Å; T70-E489 VanDerWaalsContact CB-CG 3.46Å; T70-E489 VanDerWaalsContact CB-OE1 3.28Å; T70-E489 WeakPolarHBondContact CB-OE1 3.25Å; T70-E489 HydrophobicContact CG2-CG 3.9Å; T70-E489 PolarHBondContact OG1-OE1 3.45Å; T70-N490 CarbonylContact C-O 3.55Å; T70-N490 WeakPolarHBondContact CA-O 3.48Å; T70-N490 WeakPolarHBondContact CB-O 3.16Å
71	I	90.9	Very high	89.6	Confident	85 Å²	85	91.9 Å²	91.9	44%	0.436	44%	0.444	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	137.8	175.3	-169.9	167.9	0	0	0	110.1	N490	I71-N490 HydrophobicContact CG2-CB 4.5Å; I71-N490 PolarHBondContact N-O 3.13Å; I71-N490 PolarHBondContact O-N 3.34Å
72	E	91	Very high	89.3	Confident	141 Å²	141	91.8 Å²	91.8	66%	0.659	44%	0.444	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91	117.9	177.3	-64.6	-175.1	175.6	0	0	110.5
73	N	92	Very high	89.1	Confident	67 Å²	67	90.1 Å²	90.1	36%	0.358	44%	0.438	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	118.3	174.6	-75	-43.6	0	0	0	109.8	R488 N490	N73-R488 PolarHBondContact N-O 3.19Å; N73-R488 PolarHBondContact O-N 3.1Å; N73-N490 PolarHBondContact ND2-ND2 3.13Å
74	M	93.1	Very high	89	Confident	156 Å²	156	86 Å²	86	77%	0.768	42%	0.417	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.3	133.9	173	62.7	177.5	179.8	0	0	111.3	S486 Y487	M74-S486 CarbonylContact C-O 3.47Å; M74-S486 WeakPolarHBondContact CA-O 3.12Å; M74-Y487 HydrophobicContact CB-CD1 4.21Å; M74-Y487 HydrophobicContact CB-CE1 4.19Å
75	R	93	Very high	89.2	Confident	152 Å²	152	83.3 Å²	83.3	57%	0.574	40%	0.404	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-136.7	127.6	173.7	-66.7	-174.6	179.6	179.8	-0	110.4	S486	R75-S486 PolarHBondContact N-O 2.96Å; R75-S486 PolarHBondContact O-N 3.1Å
76	T	91.6	Very high	89.3	Confident	100 Å²	100	81.8 Å²	81.8	61%	0.613	40%	0.399	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.7	111	171.1	58.7	0	0	0	0	109.5	M485	T76-M485 HydrophobicContact CG2-CE 4.44Å; T76-M485 HydrophobicContact CG2-CG 4.4Å
77	L	90	Very high	89.6	Confident	60 Å²	60	74.9 Å²	74.9	31%	0.314	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	125	177.8	-55.1	171.9	0	0	0	108.9	I80 T483 L484	L77-I80 HydrophobicContact CB-CD1 3.48Å; L77-I80 VanDerWaalsContact CB-CD1 3.48Å; L77-I80 HydrophobicContact CB-CG1 4.13Å; L77-I80 HydrophobicContact CD1-CD1 3.53Å; L77-I80 HydrophobicContact CG-CD1 4.04Å; L77-T483 WeakPolarHBondContact O-CA 3.49Å; L77-L484 HydrophobicContact CB-CB 4.47Å; L77-L484 WeakPolarHBondContact CB-O 3.23Å; L77-L484 PolarHBondContact N-O 3.37Å; L77-L484 PolarHBondContact O-N 3.01Å
78	R	87.6	Confident	90	Very high	212 Å²	212	69.7 Å²	69.7	80%	0.8	35%	0.348	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-108	147.9	177.2	-65.2	-177	177.8	161.6	-0.2	110.5	I80 D482 T483	R78-I80 VanDerWaalsContact C-N 3.31Å; R78-D482 CarbonylContact C-O 3.56Å; R78-D482 WeakPolarHBondContact CA-O 3.22Å; R78-T483 HydrophobicContact CG-CG2 4.39Å
79	G	83.7	Confident	90.6	Very high	51 Å²	51	64.2 Å²	64.2	53%	0.526	32%	0.324	S	S	.	.	S	Bend	trans	77.7	13.6	-177.8	0	0	0	0	0	114.1	D482	G79-D482 PolarHBondContact N-O 3.33Å
80	I	84.4	Confident	91	Very high	66 Å²	66	61.2 Å²	61.2	34%	0.338	31%	0.308	S	S	.	.			trans	-96.6	110.5	172.4	-59.1	-172.6	0	0	0	107.3	L77 R78 V82 D482 L484	L77-I80 HydrophobicContact CB-CD1 3.48Å; L77-I80 VanDerWaalsContact CB-CD1 3.48Å; L77-I80 HydrophobicContact CB-CG1 4.13Å; L77-I80 HydrophobicContact CD1-CD1 3.53Å; L77-I80 HydrophobicContact CG-CD1 4.04Å; R78-I80 VanDerWaalsContact C-N 3.31Å; I80-V82 HydrophobicContact CG2-CG2 4.45Å; I80-D482 PolarHBondContact N-O 2.64Å; I80-D482 CarbonylContact O-C 3.58Å; I80-L484 HydrophobicContact CB-CB 4.48Å; I80-L484 HydrophobicContact CG2-CD2 4.09Å
81	H	80.5	Confident	91.4	Very high	92 Å²	92	59.2 Å²	59.2	43%	0.426	30%	0.295	S	S	.	.			trans	-73.6	129.8	172	-58.4	-70.5	0	0	0	109.3	H223 F481	H81-H223 HydrophobicContact CB-CB 3.99Å; H81-H223 PolarHBondContact O-CD2 3.09Å; H81-F481 AromaticContact CE1-CE2 3.75Å; H81-F481 AromaticContact ND1-CD2 3.93Å; H81-F481 AromaticContact ND1-CE2 3.61Å
82	V	86.4	Confident	91.6	Very high	13 Å²	13	55.6 Å²	55.6	8%	0.079	28%	0.278	C	S	.	.			trans	-113.1	142.2	174.4	-179	0	0	0	0	107.8	I80 M289 L406 R478 L484	I80-V82 HydrophobicContact CG2-CG2 4.45Å; V82-M289 HydrophobicContact CB-CE 3.97Å; V82-M289 HydrophobicContact CB-SD 3.7Å; V82-M289 HydrophobicContact CG1-SD 3.86Å; V82-M289 HydrophobicContact CG2-CE 4.11Å; V82-M289 HydrophobicContact CG2-SD 4.27Å; V82-L406 HydrophobicContact CG1-CD1 4.35Å; V82-L406 HydrophobicContact CG1-CD2 3.74Å; V82-R478 PolarHBondContact O-NH1 3.38Å; V82-R478 PolarHBondContact O-NH2 2.95Å; V82-L484 HydrophobicContact CG2-CB 4.29Å; V82-L484 HydrophobicContact CG2-CD1 4.08Å; V82-L484 HydrophobicContact CG2-CD2 4.22Å; V82-L484 HydrophobicContact CG2-CG 4.43Å
83	A	90.2	Very high	91.7	Very high	22 Å²	22	49.6 Å²	49.6	18%	0.182	25%	0.25	C	S	.	.	P	Polyproline II helix	trans	-55.4	142.3	173.8	0	0	0	0	0	111.1	S222 H223 P263 Y408 R478	A83-S222 WeakPolarHBondContact CA-OG 3.31Å; A83-S222 WeakPolarHBondContact CB-OG 3.19Å; A83-H223 PolarHBondContact N-CD2 2.99Å; A83-P263 HydrophobicContact CB-CG 4.14Å; A83-Y408 PolarHBondContact O-OH 3.05Å; A83-R478 PolarHBondContact O-NH1 2.94Å
84	F	92.4	Very high	91.8	Very high	1 Å²	1	46.6 Å²	46.6	0%	0.004	23%	0.234	C	C	.	.	P	Polyproline II helix	trans	-62.3	136.9	173.7	-165.5	-95.2	0	0	0	109.1	I87 M216 S222 A225 L228 V476 R478	F84-I87 HydrophobicContact CE1-CD1 3.6Å; F84-I87 HydrophobicContact CE1-CG1 4.45Å; F84-I87 HydrophobicContact CZ-CD1 4.16Å; F84-M216 HydrophobicContact CB-SD 3.81Å; F84-M216 HydrophobicContact CD1-CE 3.37Å; F84-M216 HydrophobicContact CD1-SD 3.76Å; F84-M216 HydrophobicContact CE1-CE 3.63Å; F84-M216 HydrophobicContact CG-CE 3.97Å; F84-M216 HydrophobicContact CG-SD 3.93Å; F84-M216 HydrophobicContact CZ-CE 4.42Å; F84-S222 WeakPolarHBondContact CB-O 3.16Å; F84-S222 PolarHBondContact N-O 3.4Å; F84-S222 PolarHBondContact N-OG 3.28Å; F84-A225 HydrophobicContact CB-CB 4.06Å; F84-A225 HydrophobicContact CD2-CB 3.66Å; F84-A225 HydrophobicContact CE2-CB 4.35Å; F84-A225 HydrophobicContact CG-CB 3.97Å; F84-L228 HydrophobicContact CE1-CB 4.2Å; F84-L228 HydrophobicContact CE1-CD2 4.45Å; F84-L228 HydrophobicContact CZ-CB 3.95Å; F84-V476 HydrophobicContact CZ-CB 4.34Å; F84-V476 HydrophobicContact CZ-CG1 3.99Å; F84-R478 HydrophobicContact CE2-CB 4.37Å
85	P	94	Very high	91.8	Very high	2 Å²	2	39.3 Å²	39.3	1%	0.013	20%	0.198	C	C	.	.	P	Polyproline II helix	trans	-63.1	154.8	179.5	26.4	-33.2	0	0	0	111	V260 H261 I286 Y408	P85-V260 HydrophobicContact CB-CG1 3.67Å; P85-V260 HydrophobicContact CG-CG1 3.69Å; P85-H261 WeakPolarHBondContact CB-O 3.35Å; P85-I286 HydrophobicContact CG-CD1 3.6Å; P85-Y408 HydrophobicContact CB-CD1 4Å; P85-Y408 HydrophobicContact CB-CD2 4.12Å; P85-Y408 HydrophobicContact CB-CE1 3.78Å; P85-Y408 HydrophobicContact CB-CE2 3.94Å; P85-Y408 HydrophobicContact CB-CG 4.15Å; P85-Y408 HydrophobicContact CG-CD1 4.01Å; P85-Y408 HydrophobicContact CG-CE1 3.95Å; P85-Y408 HydrophobicContact CG-CG 4.49Å
86	H	94.2	Very high	91.6	Very high	17 Å²	17	32.3 Å²	32.3	8%	0.079	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	143.6	169.2	-76.1	-162.1	0	0	0	109.2	T213 S215 H261	H86-T213 HydrophobicContact CB-CG2 3.78Å; H86-S215 PolarHBondContact CE1-OG 2.96Å; H86-H261 WeakPolarHBondContact CB-NE2 3.34Å; H86-H261 PolarHBondContact N-O 3.45Å; H86-H261 PolarHBondContact O-CD2 2.96Å; H86-H261 VanDerWaalsContact O-CD2 3.3Å; H86-H261 PolarHBondContact O-N 3.16Å
87	I	95.8	Very high	91.5	Very high	1 Å²	1	27.8 Å²	27.8	1%	0.005	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	115.8	-177.7	-65.1	162.2	0	0	0	108	F84 L89 T213 L214 L228 M230 I258 V259 V476	F84-I87 HydrophobicContact CE1-CD1 3.6Å; F84-I87 HydrophobicContact CE1-CG1 4.45Å; F84-I87 HydrophobicContact CZ-CD1 4.16Å; I87-L89 HydrophobicContact CG2-CD2 4.23Å; I87-L89 HydrophobicContact CG2-CG 4.17Å; I87-T213 CarbonylContact O-C 3.54Å; I87-T213 WeakPolarHBondContact O-CA 3.34Å; I87-L214 PolarHBondContact O-N 2.86Å; I87-L228 HydrophobicContact CD1-CD2 3.45Å; I87-L228 VanDerWaalsContact CD1-CD2 3.45Å; I87-M230 HydrophobicContact CG2-CE 4.38Å; I87-I258 HydrophobicContact CG2-CD1 3.58Å; I87-I258 HydrophobicContact CG2-CG1 3.63Å; I87-V259 WeakPolarHBondContact CA-O 3.23Å; I87-V476 HydrophobicContact CD1-CB 3.97Å; I87-V476 HydrophobicContact CD1-CG1 4.04Å; I87-V476 HydrophobicContact CD1-CG2 3.63Å
88	T	97	Very high	91.2	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	131.1	172.9	-50.2	0	0	0	0	110	C211 Y212 T213 I258 V259 H261 P267 I269	T88-C211 HydrophobicContact CG2-CB 4.14Å; T88-Y212 CarbonylContact C-O 2.89Å; T88-Y212 WeakPolarHBondContact CA-O 3.46Å; T88-T213 WeakPolarHBondContact CG2-OG1 3.26Å; T88-T213 PolarHBondContact OG1-OG1 2.75Å; T88-I258 CarbonylContact O-C 3.54Å; T88-I258 VanDerWaalsContact O-CA 3.29Å; T88-I258 WeakPolarHBondContact O-CA 3.5Å; T88-V259 PolarHBondContact N-O 3.14Å; T88-V259 PolarHBondContact O-N 3.41Å; T88-H261 PolarHBondContact OG1-CD2 2.88Å; T88-H261 PolarHBondContact OG1-NE2 3.3Å; T88-P267 HydrophobicContact CG2-CB 4.2Å; T88-P267 HydrophobicContact CG2-CG 4Å; T88-P267 WeakPolarHBondContact OG1-CB 3.4Å; T88-P267 WeakPolarHBondContact OG1-CG 3.39Å; T88-I269 HydrophobicContact CG2-CD1 4.33Å; T88-I269 HydrophobicContact CG2-CG1 4.46Å
89	L	97.5	Very high	91.2	Very high	0 Å²	0	18.8 Å²	18.8	0%	0	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	138.1	177.2	-61.7	162.8	0	0	0	109.9	I87 F171 I172 C211 Y212 L214 M230 L232 K257 I258 L276	I87-L89 HydrophobicContact CG2-CD2 4.23Å; I87-L89 HydrophobicContact CG2-CG 4.17Å; L89-F171 HydrophobicContact CB-CE1 3.75Å; L89-F171 HydrophobicContact CB-CZ 4.27Å; L89-I172 HydrophobicContact CD1-CD1 3.9Å; L89-I172 HydrophobicContact CD1-CG1 4.37Å; L89-C211 CarbonylContact O-C 3.02Å; L89-C211 VanDerWaalsContact O-CA 3.25Å; L89-C211 WeakPolarHBondContact O-CA 3.29Å; L89-C211 WeakPolarHBondContact O-CB 3.12Å; L89-Y212 PolarHBondContact N-O 3.25Å; L89-Y212 PolarHBondContact O-N 2.68Å; L89-L214 HydrophobicContact CD1-CD1 4.18Å; L89-M230 HydrophobicContact CD1-CE 3.58Å; L89-M230 HydrophobicContact CD1-SD 3.51Å; L89-M230 VanDerWaalsContact CD1-SD 3.51Å; L89-M230 HydrophobicContact CD2-CE 4.29Å; L89-M230 HydrophobicContact CG-CE 4.4Å; L89-L232 HydrophobicContact CD1-CD1 4.37Å; L89-L232 HydrophobicContact CD1-CD2 4.09Å; L89-L232 HydrophobicContact CD2-CD1 4.15Å; L89-K257 WeakPolarHBondContact CA-O 3.33Å; L89-I258 HydrophobicContact CD2-CB 3.93Å; L89-I258 HydrophobicContact CD2-CD1 3.9Å; L89-I258 HydrophobicContact CD2-CG1 3.71Å; L89-L276 HydrophobicContact CD2-CD1 4.19Å
90	C	97.4	Very high	91.4	Very high	2 Å²	2	17.2 Å²	17.2	1%	0.014	9%	0.087	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	138.1	174	-56.6	0	0	0	0	109.1	Y208 C211 S256 K257 I269	C90-Y208 HydrophobicContact CB-CD1 4.41Å; C90-Y208 HydrophobicContact CB-CD2 3.97Å; C90-Y208 HydrophobicContact CB-CG 3.79Å; C90-C211 HydrophobicContact CB-CB 4.12Å; C90-C211 WeakPolarHBondContact CB-SG 3.41Å; C90-C211 WeakPolarHBondContact SG-CB 3.42Å; C90-C211 CovalentContact SG-SG 2.03Å; C90-C211 PolarHBondContact SG-SG 2.86Å; C90-S256 CarbonylContact O-C 3.52Å; C90-S256 VanDerWaalsContact O-CA 3.29Å; C90-S256 WeakPolarHBondContact O-CA 3.38Å; C90-S256 WeakPolarHBondContact O-CB 3.44Å; C90-S256 PolarHBondContact O-OG 3.14Å; C90-K257 HydrophobicContact CB-CB 4.41Å; C90-K257 PolarHBondContact N-O 2.88Å; C90-K257 PolarHBondContact O-N 2.62Å; C90-I269 VanDerWaalsContact SG-CD1 3.53Å
91	N	96.5	Very high	91.3	Very high	3 Å²	3	17.9 Å²	17.9	2%	0.016	9%	0.086	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	140.9	163.7	-164.1	-12.6	0	0	0	108.4	D93 H166 F171 Y208 L234 G255	N91-D93 VanDerWaalsContact C-N 3.31Å; N91-D93 PolarHBondContact OD1-N 2.74Å; N91-H166 PolarHBondContact ND2-CD2 2.73Å; N91-H166 PolarHBondContact ND2-CE1 3.22Å; N91-H166 PolarHBondContact ND2-ND1 3.14Å; N91-H166 PolarHBondContact ND2-NE2 3.48Å; N91-F171 HydrophobicContact CB-CD2 4.1Å; N91-F171 HydrophobicContact CB-CE2 3.72Å; N91-F171 HydrophobicContact CB-CZ 4.14Å; N91-Y208 WeakPolarHBondContact O-CB 3.16Å; N91-Y208 VanDerWaalsContact O-CD1 3.24Å; N91-Y208 WeakPolarHBondContact O-CD1 3.33Å; N91-L234 PolarHBondContact ND2-O 2.84Å; N91-G255 PolarHBondContact OD1-O 2.86Å; N91-G255 VanDerWaalsContact OD1-O 3.12Å
92	V	94.9	Very high	91.6	Very high	10 Å²	10	13.6 Å²	13.6	6%	0.061	7%	0.066	C	C	.	.	S	Bend	trans	-70.6	-32.9	174.8	175.9	0	0	0	0	110.7	P94 T251 W253 G255 K257	V92-P94 WeakPolarHBondContact O-CD 3.35Å; V92-T251 HydrophobicContact CG1-CG2 4.26Å; V92-W253 HydrophobicContact CG1-CB 3.84Å; V92-W253 HydrophobicContact CG1-CE3 4.48Å; V92-W253 VanDerWaalsContact CG1-O 3.32Å; V92-W253 WeakPolarHBondContact CG1-O 3.29Å; V92-G255 WeakPolarHBondContact CB-O 3.27Å; V92-G255 WeakPolarHBondContact CG2-O 3.32Å; V92-G255 PolarHBondContact N-O 2.73Å; V92-G255 VanDerWaalsContact N-O 3.07Å; V92-K257 HydrophobicContact CG2-CG 4.12Å
93	D	93.9	Very high	91.6	Very high	15 Å²	15	13.7 Å²	13.7	8%	0.08	7%	0.066	C	C	.	.	S	Bend	trans	-72.6	119.5	167.5	-166.2	-17.9	0	0	0	109.4	N91 V95 H166 T247	N91-D93 VanDerWaalsContact C-N 3.31Å; N91-D93 PolarHBondContact OD1-N 2.74Å; D93-V95 VanDerWaalsContact C-N 3.26Å; D93-V95 PolarHBondContact O-N 3.11Å; D93-V95 PolarHBondContact OD1-N 2.77Å; D93-H166 PolarHBondContact O-CD2 3.17Å; D93-H166 PolarHBondContact O-NE2 2.99Å; D93-H166 VanDerWaalsContact O-NE2 3.1Å; D93-T247 WeakPolarHBondContact OD2-CB 3.24Å; D93-T247 PolarHBondContact OD2-OG1 3.4Å
94	P	93.8	Very high	91.4	Very high	3 Å²	3	16.2 Å²	16.2	2%	0.019	7%	0.074	C	C	.	.	S	Bend	trans	-72.4	-15.4	178.1	28.6	-36.6	0	0	0	113.9	V92 V149 G165 S209 F250	V92-P94 WeakPolarHBondContact O-CD 3.35Å; P94-V149 HydrophobicContact CB-CG2 3.96Å; P94-V149 HydrophobicContact CG-CB 4.46Å; P94-V149 HydrophobicContact CG-CG2 3.68Å; P94-G165 VanDerWaalsContact O-CA 3.32Å; P94-G165 WeakPolarHBondContact O-CA 3.35Å; P94-S209 WeakPolarHBondContact O-CB 3.38Å; P94-S209 PolarHBondContact O-OG 3.12Å; P94-F250 HydrophobicContact CG-CB 3.72Å; P94-F250 HydrophobicContact CG-CD2 4.08Å; P94-F250 HydrophobicContact CG-CG 3.88Å
95	V	92	Very high	91	Very high	4 Å²	4	19.4 Å²	19.4	2%	0.024	9%	0.091	C	C	.	.	S	Bend	trans	-128.4	129.2	-169.9	177.8	0	0	0	0	110.8	D93 V100 F152 I164 H166 T247 F250	D93-V95 VanDerWaalsContact C-N 3.26Å; D93-V95 PolarHBondContact O-N 3.11Å; D93-V95 PolarHBondContact OD1-N 2.77Å; V95-V100 HydrophobicContact CG1-CG2 3.36Å; V95-F152 HydrophobicContact CG2-CE1 4.37Å; V95-I164 HydrophobicContact CG1-CB 4.41Å; V95-I164 HydrophobicContact CG2-CD1 3.94Å; V95-I164 HydrophobicContact CG2-CG1 4.35Å; V95-H166 PolarHBondContact O-NE2 2.59Å; V95-T247 HydrophobicContact CB-CG2 4.06Å; V95-T247 HydrophobicContact CG1-CG2 3.91Å; V95-F250 HydrophobicContact CB-CD2 4.27Å; V95-F250 HydrophobicContact CB-CE2 3.95Å; V95-F250 HydrophobicContact CG2-CD2 3.96Å; V95-F250 HydrophobicContact CG2-CE2 3.46Å; V95-F250 VanDerWaalsContact CG2-CE2 3.46Å; V95-F250 HydrophobicContact CG2-CZ 4Å
96	N	90.7	Very high	90.4	Very high	4 Å²	4	23.3 Å²	23.3	2%	0.021	12%	0.117	C	C	.	.			trans	-79.2	124.6	174.9	-179	-28.4	0	0	0	110.2	Y98 R99 V100 I164 D170 D235	N96-Y98 VanDerWaalsContact C-N 3.28Å; N96-Y98 PolarHBondContact O-N 2.86Å; N96-Y98 WeakPolarHBondContact OD1-CB 3.45Å; N96-Y98 PolarHBondContact OD1-N 3.33Å; N96-R99 HydrophobicContact CB-CB 4.32Å; N96-R99 HydrophobicContact CB-CG 4.09Å; N96-R99 WeakPolarHBondContact O-CB 3.27Å; N96-R99 PolarHBondContact O-N 2.97Å; N96-V100 PolarHBondContact O-N 3.4Å; N96-I164 PolarHBondContact N-O 3.21Å; N96-D170 PolarHBondContact ND2-OD2 3.04Å; N96-D235 PolarHBondContact OD1-OD2 3.39Å
97	S	87.8	Confident	89.8	Confident	5 Å²	5	30.2 Å²	30.2	4%	0.035	15%	0.154	C	C	.	.	H	α-helix	trans	-61.9	-35	-177.7	67.9	0	0	0	0	112.3	R99 V100 Y101 D235 E237 Y436	S97-R99 PolarHBondContact O-N 2.92Å; S97-V100 WeakPolarHBondContact O-CB 3.43Å; S97-V100 PolarHBondContact O-N 3.22Å; S97-Y101 PolarHBondContact O-N 3.07Å; S97-D235 WeakPolarHBondContact CB-OD2 3.33Å; S97-D235 PolarHBondContact N-OD2 2.81Å; S97-D235 PolarHBondContact OG-OD1 2.85Å; S97-D235 PolarHBondContact OG-OD2 3.23Å; S97-E237 VanDerWaalsContact CB-OE2 3.27Å; S97-E237 WeakPolarHBondContact CB-OE2 3.38Å; S97-Y436 PolarHBondContact OG-OH 3.03Å
98	Y	84.9	Confident	89.2	Confident	54 Å²	54	31.4 Å²	31.4	21%	0.212	16%	0.162	C	C	.	.	H	α-helix	trans	-56.7	-40	173.5	-179.8	-122.6	0	0	0	112.1	N96 Y101 C102 Y110 Y436	N96-Y98 VanDerWaalsContact C-N 3.28Å; N96-Y98 PolarHBondContact O-N 2.86Å; N96-Y98 WeakPolarHBondContact OD1-CB 3.45Å; N96-Y98 PolarHBondContact OD1-N 3.33Å; Y98-Y101 HydrophobicContact CD2-CD1 4.44Å; Y98-Y101 WeakPolarHBondContact O-CB 3.26Å; Y98-Y101 PolarHBondContact O-N 3.18Å; Y98-C102 VanDerWaalsContact CZ-SG 3.58Å; Y98-C102 WeakPolarHBondContact O-CB 3.33Å; Y98-C102 PolarHBondContact O-N 3.15Å; Y98-C102 PolarHBondContact O-SG 3.25Å; Y98-Y110 WeakPolarHBondContact OH-CB 3.06Å; Y98-Y110 PolarHBondContact OH-O 3.41Å; Y98-Y436 VanDerWaalsContact CA-CZ 3.5Å; Y98-Y436 WeakPolarHBondContact CA-OH 3.27Å; Y98-Y436 WeakPolarHBondContact CB-OH 3.4Å; Y98-Y436 AromaticContact CD2-CD1 3.43Å; Y98-Y436 HydrophobicContact CD2-CD1 3.43Å; Y98-Y436 VanDerWaalsContact CD2-CD1 3.43Å; Y98-Y436 AromaticContact CD2-CD2 3.43Å; Y98-Y436 HydrophobicContact CD2-CD2 3.43Å; Y98-Y436 VanDerWaalsContact CD2-CD2 3.43Å; Y98-Y436 AromaticContact CD2-CE1 3.64Å; Y98-Y436 HydrophobicContact CD2-CE1 3.64Å; Y98-Y436 AromaticContact CD2-CE2 3.56Å; Y98-Y436 HydrophobicContact CD2-CE2 3.56Å; Y98-Y436 AromaticContact CD2-CG 3.33Å; Y98-Y436 HydrophobicContact CD2-CG 3.33Å; Y98-Y436 AromaticContact CD2-CZ 3.7Å; Y98-Y436 AromaticContact CE2-CD1 3.95Å; Y98-Y436 HydrophobicContact CE2-CD1 3.95Å; Y98-Y436 HydrophobicContact CE2-CD2 4.06Å; Y98-Y436 AromaticContact CE2-CG 3.67Å; Y98-Y436 HydrophobicContact CE2-CG 3.67Å; Y98-Y436 HydrophobicContact CG-CD1 4.12Å; Y98-Y436 HydrophobicContact CG-CD2 4.47Å; Y98-Y436 AromaticContact CG-CE1 3.92Å; Y98-Y436 HydrophobicContact CG-CE1 3.92Å; Y98-Y436 HydrophobicContact CG-CE2 4.21Å; Y98-Y436 HydrophobicContact CG-CG 4.39Å; Y98-Y436 AromaticContact CG-CZ 3.97Å; Y98-Y436 PolarHBondContact N-OH 3.44Å
99	R	87.5	Confident	88.4	Confident	29 Å²	29	40.6 Å²	40.6	11%	0.109	20%	0.202	C	C	.	.	H	α-helix	trans	-74.3	-35.6	-177.2	-68	-178.8	147.9	-161.1	-15.2	111.2	N96 S97 C102 L103 I113 I162 Q163 G165 Q167	N96-R99 HydrophobicContact CB-CB 4.32Å; N96-R99 HydrophobicContact CB-CG 4.09Å; N96-R99 WeakPolarHBondContact O-CB 3.27Å; N96-R99 PolarHBondContact O-N 2.97Å; S97-R99 PolarHBondContact O-N 2.92Å; R99-C102 PolarHBondContact O-N 2.99Å; R99-L103 WeakPolarHBondContact O-CG 3.47Å; R99-L103 PolarHBondContact O-N 3.44Å; R99-I113 HydrophobicContact CB-CD1 4.45Å; R99-I113 WeakPolarHBondContact O-CD1 3.36Å; R99-I162 PolarHBondContact NH1-O 3.35Å; R99-Q163 VanDerWaalsContact CD-O 3.25Å; R99-Q163 WeakPolarHBondContact CD-O 3.35Å; R99-Q163 PolarHBondContact NE-O 3.45Å; R99-Q163 PolarHBondContact NH1-O 3.45Å; R99-G165 PolarHBondContact NH1-O 2.99Å; R99-Q167 VanDerWaalsContact CZ-NE2 3.29Å; R99-Q167 VanDerWaalsContact NH1-CD 3.33Å
100	V	86.8	Confident	87.2	Confident	18 Å²	18	46.7 Å²	46.7	11%	0.109	23%	0.227	C	C	.	.	H	α-helix	trans	-62.3	-47.2	169.8	-179.1	0	0	0	0	110.4	V95 N96 S97 C102 L103 Q104 L121 T247	V95-V100 HydrophobicContact CG1-CG2 3.36Å; N96-V100 PolarHBondContact O-N 3.4Å; S97-V100 WeakPolarHBondContact O-CB 3.43Å; S97-V100 PolarHBondContact O-N 3.22Å; V100-C102 VanDerWaalsContact C-N 3.28Å; V100-C102 PolarHBondContact O-N 3.31Å; V100-L103 WeakPolarHBondContact O-CB 3.45Å; V100-L103 PolarHBondContact O-N 3.11Å; V100-L103 VanDerWaalsContact O-N 3.11Å; V100-Q104 WeakPolarHBondContact O-CG 3.4Å; V100-Q104 PolarHBondContact O-N 3.49Å; V100-L121 HydrophobicContact CG1-CD2 4.43Å; V100-T247 HydrophobicContact CG2-CG2 4.23Å
101	Y	84	Confident	86.3	Confident	80 Å²	80	47.5 Å²	47.5	31%	0.314	23%	0.232	S	C	.	.	H	α-helix	trans	-55.6	-43.7	175	169.9	-99.6	0	0	0	111.7	S97 Y98 L103 Q104 N105 Y436	S97-Y101 PolarHBondContact O-N 3.07Å; Y98-Y101 HydrophobicContact CD2-CD1 4.44Å; Y98-Y101 WeakPolarHBondContact O-CB 3.26Å; Y98-Y101 PolarHBondContact O-N 3.18Å; Y101-L103 PolarHBondContact O-N 3.41Å; Y101-Q104 PolarHBondContact O-N 2.97Å; Y101-N105 WeakPolarHBondContact CD2-ND2 3.47Å; Y101-N105 HydrophobicContact CE2-CB 4.4Å; Y101-N105 VanDerWaalsContact CE2-ND2 3.27Å; Y101-N105 WeakPolarHBondContact CE2-ND2 3.31Å; Y101-N105 WeakPolarHBondContact O-CB 3.04Å; Y101-N105 PolarHBondContact O-N 2.91Å; Y101-N105 PolarHBondContact O-ND2 3.29Å; Y101-Y436 HydrophobicContact CD1-CD2 4.25Å
102	C	86.2	Confident	85.3	Confident	2 Å²	2	55.1 Å²	55.1	1%	0.014	27%	0.272	C	S	.	.	H	α-helix	trans	-70.3	-28.6	177.9	-77.7	0	0	0	0	114.5	Y98 R99 V100 N105 P106 C111 I113	Y98-C102 VanDerWaalsContact CZ-SG 3.58Å; Y98-C102 WeakPolarHBondContact O-CB 3.33Å; Y98-C102 PolarHBondContact O-N 3.15Å; Y98-C102 PolarHBondContact O-SG 3.25Å; R99-C102 PolarHBondContact O-N 2.99Å; V100-C102 VanDerWaalsContact C-N 3.28Å; V100-C102 PolarHBondContact O-N 3.31Å; C102-N105 CarbonylContact O-C 3.41Å; C102-P106 WeakPolarHBondContact O-CA 2.99Å; C102-C111 WeakPolarHBondContact CA-SG 3.45Å; C102-C111 HydrophobicContact CB-CB 3.51Å; C102-C111 WeakPolarHBondContact CB-SG 3.46Å; C102-C111 WeakPolarHBondContact SG-CA 3.39Å; C102-C111 WeakPolarHBondContact SG-CB 3.02Å; C102-C111 CovalentContact SG-SG 2.04Å; C102-C111 PolarHBondContact SG-SG 2.04Å; C102-I113 HydrophobicContact CB-CD1 3.33Å; C102-I113 HydrophobicContact CB-CG1 3.88Å
103	L	87.1	Confident	84.3	Confident	16 Å²	16	56.7 Å²	56.7	8%	0.084	28%	0.28	C	S	.	.	H	α-helix	trans	-70.9	-34.6	170.9	-74.3	170	0	0	0	111.9	R99 V100 Y101 I113 Y117 I120 L121 I164	R99-L103 WeakPolarHBondContact O-CG 3.47Å; R99-L103 PolarHBondContact O-N 3.44Å; V100-L103 WeakPolarHBondContact O-CB 3.45Å; V100-L103 PolarHBondContact O-N 3.11Å; V100-L103 VanDerWaalsContact O-N 3.11Å; Y101-L103 PolarHBondContact O-N 3.41Å; L103-I113 HydrophobicContact CD2-CD1 4.22Å; L103-I113 HydrophobicContact CD2-CG2 3.78Å; L103-I113 HydrophobicContact CG-CD1 3.93Å; L103-Y117 WeakPolarHBondContact CD2-O 3.45Å; L103-I120 HydrophobicContact CD1-CB 4.09Å; L103-I120 HydrophobicContact CD1-CD1 4.38Å; L103-I120 HydrophobicContact CD1-CG2 4.04Å; L103-L121 HydrophobicContact CB-CD1 4.11Å; L103-L121 HydrophobicContact CB-CD2 4.13Å; L103-L121 HydrophobicContact CB-CG 4.05Å; L103-I164 HydrophobicContact CD1-CG2 3.84Å
104	Q	84.1	Confident	83.6	Confident	75 Å²	75	59.8 Å²	59.8	35%	0.35	30%	0.297	S	S	.	.	H	α-helix	trans	-74.4	-35.9	175.9	-68	172.5	-4.1	0	0	112.2	V100 Y101 P106 L121 Y245	V100-Q104 WeakPolarHBondContact O-CG 3.4Å; V100-Q104 PolarHBondContact O-N 3.49Å; Y101-Q104 PolarHBondContact O-N 2.97Å; Q104-P106 VanDerWaalsContact O-CD 3.25Å; Q104-P106 WeakPolarHBondContact O-CD 3.03Å; Q104-L121 HydrophobicContact CG-CD1 3.96Å; Q104-L121 HydrophobicContact CG-CD2 4.41Å; Q104-Y245 HydrophobicContact CG-CD2 4.33Å
105	N	84.4	Confident	82.9	Confident	67 Å²	67	64.6 Å²	64.6	36%	0.358	33%	0.328	S	S	.	.			trans	-120.8	62.5	-175.4	-58.8	-76.1	0	0	0	111.1	Y101 C102 N107 S108	Y101-N105 WeakPolarHBondContact CD2-ND2 3.47Å; Y101-N105 HydrophobicContact CE2-CB 4.4Å; Y101-N105 VanDerWaalsContact CE2-ND2 3.27Å; Y101-N105 WeakPolarHBondContact CE2-ND2 3.31Å; Y101-N105 WeakPolarHBondContact O-CB 3.04Å; Y101-N105 PolarHBondContact O-N 2.91Å; Y101-N105 PolarHBondContact O-ND2 3.29Å; C102-N105 CarbonylContact O-C 3.41Å; N105-N107 PolarHBondContact O-N 3.5Å; N105-S108 VanDerWaalsContact O-CB 3.25Å; N105-S108 WeakPolarHBondContact O-CB 3.25Å; N105-S108 PolarHBondContact O-N 2.92Å
106	P	81.9	Confident	82.5	Confident	84 Å²	84	70 Å²	70	55%	0.545	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-21.4	-173.8	26.1	-35.8	0	0	0	113.5	C102 Q104 S108	C102-P106 WeakPolarHBondContact O-CA 2.99Å; Q104-P106 VanDerWaalsContact O-CD 3.25Å; Q104-P106 WeakPolarHBondContact O-CD 3.03Å; P106-S108 VanDerWaalsContact C-N 3.33Å
107	N	82.5	Confident	82.2	Confident	163 Å²	163	70.1 Å²	70.1	87%	0.872	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86	-0.8	178.4	-62.7	-26.4	0	0	0	113.6	N105	N105-N107 PolarHBondContact O-N 3.5Å
108	S	82.8	Confident	81.9	Confident	25 Å²	25	73.7 Å²	73.7	18%	0.175	38%	0.376	C	S	.	.	S	Bend	trans	-65.8	136.1	177.1	176.9	0	0	0	0	110.3	N105 P106 Y110 C111	N105-S108 VanDerWaalsContact O-CB 3.25Å; N105-S108 WeakPolarHBondContact O-CB 3.25Å; N105-S108 PolarHBondContact O-N 2.92Å; P106-S108 VanDerWaalsContact C-N 3.33Å; S108-Y110 PolarHBondContact O-N 2.86Å; S108-C111 PolarHBondContact O-N 3.47Å
109	K	78.9	Confident	82.1	Confident	193 Å²	193	74.2 Å²	74.2	84%	0.839	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.4	-28.1	-178.3	-174.7	-177.4	175.9	-170.3	0	113.4
110	Y	72.9	Confident	82.3	Confident	129 Å²	129	73 Å²	73	51%	0.506	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.2	-15.5	-176.2	-55.6	-81.2	0	0	0	112.8	Y98 S108	Y98-Y110 WeakPolarHBondContact OH-CB 3.06Å; Y98-Y110 PolarHBondContact OH-O 3.41Å; S108-Y110 PolarHBondContact O-N 2.86Å
111	C	79.4	Confident	82.4	Confident	18 Å²	18	73.3 Å²	73.3	12%	0.122	38%	0.379	C	S	.	.			trans	-94.6	120.1	-172.4	-66.3	0	0	0	0	111	C102 S108	C102-C111 WeakPolarHBondContact CA-SG 3.45Å; C102-C111 HydrophobicContact CB-CB 3.51Å; C102-C111 WeakPolarHBondContact CB-SG 3.46Å; C102-C111 WeakPolarHBondContact SG-CA 3.39Å; C102-C111 WeakPolarHBondContact SG-CB 3.02Å; C102-C111 CovalentContact SG-SG 2.04Å; C102-C111 PolarHBondContact SG-SG 2.04Å; S108-C111 PolarHBondContact O-N 3.47Å
112	N	73.9	Confident	82.8	Confident	163 Å²	163	72.9 Å²	72.9	87%	0.872	39%	0.385	S	S	*	.			trans	-122.1	60.4	174.7	-169.4	14.7	0	0	0	109.8
113	I	75.5	Confident	83.1	Confident	43 Å²	43	75 Å²	75	22%	0.221	39%	0.394	C	S	.	.			trans	-98.4	129.5	174.8	-60.9	-174.5	0	0	0	108.8	R99 C102 L103 Y117	R99-I113 HydrophobicContact CB-CD1 4.45Å; R99-I113 WeakPolarHBondContact O-CD1 3.36Å; C102-I113 HydrophobicContact CB-CD1 3.33Å; C102-I113 HydrophobicContact CB-CG1 3.88Å; L103-I113 HydrophobicContact CD2-CD1 4.22Å; L103-I113 HydrophobicContact CD2-CG2 3.78Å; L103-I113 HydrophobicContact CG-CD1 3.93Å; I113-Y117 HydrophobicContact CG2-CD2 4.45Å
114	N	79.4	Confident	83.4	Confident	81 Å²	81	74.8 Å²	74.8	43%	0.433	39%	0.392	S	S	.	.			trans	-60.2	127.5	176	-175.5	-29	0	0	0	109.9	K116 Y117	N114-K116 PolarHBondContact O-N 2.73Å; N114-K116 VanDerWaalsContact OD1-CB 3.29Å; N114-K116 WeakPolarHBondContact OD1-CB 3.07Å; N114-K116 PolarHBondContact OD1-N 2.04Å; N114-Y117 HydrophobicContact CB-CD2 3.9Å; N114-Y117 HydrophobicContact CB-CE2 3.91Å; N114-Y117 PolarHBondContact O-N 2.04Å
115	P	78	Confident	83.8	Confident	104 Å²	104	75.2 Å²	75.2	68%	0.675	39%	0.394	S	S	*	.	G	3₁₀ helix	trans	-58	-17.7	-178.9	22.9	-34.9	0	0	0	114.1	Y117 S118	P115-Y117 PolarHBondContact O-N 3.43Å; P115-Y117 VanDerWaalsContact O-N 3.1Å; P115-S118 VanDerWaalsContact O-CB 3.32Å; P115-S118 WeakPolarHBondContact O-CB 3.25Å; P115-S118 PolarHBondContact O-N 2.91Å; P115-S118 VanDerWaalsContact O-N 3.1Å; P115-S118 PolarHBondContact O-OG 3.39Å
116	K	84.1	Confident	84.3	Confident	117 Å²	117	75.4 Å²	75.4	51%	0.509	39%	0.393	S	S	.	.	G	3₁₀ helix	trans	-50.3	-30.5	170.3	-175.3	-176.2	173.2	-168.6	0	112.8	N114 E159	N114-K116 PolarHBondContact O-N 2.73Å; N114-K116 VanDerWaalsContact OD1-CB 3.29Å; N114-K116 WeakPolarHBondContact OD1-CB 3.07Å; N114-K116 PolarHBondContact OD1-N 2.04Å; K116-E159 IonicContact NZ-OE1 2.85Å; K116-E159 PolarHBondContact NZ-OE1 3.47Å; K116-E159 IonicContact NZ-OE2 3.38Å; K116-E159 PolarHBondContact NZ-OE2 3.42Å; K116-E159 VanDerWaalsContact NZ-OE2 3.07Å
117	Y	84.1	Confident	84.8	Confident	7 Å²	7	71.4 Å²	71.4	3%	0.027	37%	0.367	C	S	.	.	G	3₁₀ helix	trans	-95.7	7.9	-175.6	-56.7	-60.6	0	0	0	114.3	L103 I113 N114 P115 N119 I120 E159 Q163 Q319	L103-Y117 WeakPolarHBondContact CD2-O 3.45Å; I113-Y117 HydrophobicContact CG2-CD2 4.45Å; N114-Y117 HydrophobicContact CB-CD2 3.9Å; N114-Y117 HydrophobicContact CB-CE2 3.91Å; N114-Y117 PolarHBondContact O-N 2.04Å; P115-Y117 PolarHBondContact O-N 3.43Å; P115-Y117 VanDerWaalsContact O-N 3.1Å; Y117-N119 PolarHBondContact O-N 3.05Å; Y117-I120 HydrophobicContact CD1-CD1 4.42Å; Y117-I120 HydrophobicContact CG-CD1 4.43Å; Y117-I120 WeakPolarHBondContact O-CB 3.3Å; Y117-I120 WeakPolarHBondContact O-CG1 3.48Å; Y117-I120 PolarHBondContact O-N 3.37Å; Y117-I120 VanDerWaalsContact O-N 3.13Å; Y117-E159 HydrophobicContact CE1-CG 4.04Å; Y117-E159 PolarHBondContact OH-OE1 3.07Å; Y117-E159 VanDerWaalsContact OH-OE1 3.05Å; Y117-Q163 HydrophobicContact CD1-CG 4.35Å; Y117-Q163 HydrophobicContact CD2-CB 4.27Å; Y117-Q163 HydrophobicContact CD2-CG 3.98Å; Y117-Q163 HydrophobicContact CE1-CG 3.98Å; Y117-Q163 HydrophobicContact CE2-CB 4.36Å; Y117-Q163 HydrophobicContact CE2-CG 3.57Å; Y117-Q163 HydrophobicContact CG-CB 4.4Å; Y117-Q163 HydrophobicContact CG-CG 4.36Å; Y117-Q319 PolarHBondContact OH-OE1 3.38Å
118	S	81.5	Confident	85.3	Confident	79 Å²	79	64.9 Å²	64.9	55%	0.552	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.4	-27.7	178.2	52.7	0	0	0	0	113.8	P115 I120	P115-S118 VanDerWaalsContact O-CB 3.32Å; P115-S118 WeakPolarHBondContact O-CB 3.25Å; P115-S118 PolarHBondContact O-N 2.91Å; P115-S118 VanDerWaalsContact O-N 3.1Å; P115-S118 PolarHBondContact O-OG 3.39Å; S118-I120 PolarHBondContact O-N 2.91Å
119	N	88.7	Confident	85.8	Confident	66 Å²	66	71.5 Å²	71.5	35%	0.353	35%	0.353	S	S	.	.	H	α-helix	trans	-68.5	-11.4	178.3	68.6	-2.5	0	0	0	113.9	Y117 L121 T122 K123	Y117-N119 PolarHBondContact O-N 3.05Å; N119-L121 VanDerWaalsContact C-N 3.3Å; N119-L121 PolarHBondContact O-N 3.29Å; N119-T122 PolarHBondContact O-N 3.3Å; N119-T122 VanDerWaalsContact O-N 3.13Å; N119-T122 PolarHBondContact O-OG1 3.4Å; N119-K123 PolarHBondContact O-N 2.97Å
120	I	91.6	Very high	86.6	Confident	4 Å²	4	64.9 Å²	64.9	2%	0.021	32%	0.323	C	S	.	.	H	α-helix	trans	-60.4	-40.7	-177.8	-67.9	177.7	0	0	0	111.5	L103 Y117 S118 T122 K123 Y124 F152 A160 I164	L103-I120 HydrophobicContact CD1-CB 4.09Å; L103-I120 HydrophobicContact CD1-CD1 4.38Å; L103-I120 HydrophobicContact CD1-CG2 4.04Å; Y117-I120 HydrophobicContact CD1-CD1 4.42Å; Y117-I120 HydrophobicContact CG-CD1 4.43Å; Y117-I120 WeakPolarHBondContact O-CB 3.3Å; Y117-I120 WeakPolarHBondContact O-CG1 3.48Å; Y117-I120 PolarHBondContact O-N 3.37Å; Y117-I120 VanDerWaalsContact O-N 3.13Å; S118-I120 PolarHBondContact O-N 2.91Å; I120-T122 VanDerWaalsContact C-N 3.3Å; I120-T122 PolarHBondContact O-N 3.14Å; I120-K123 PolarHBondContact O-N 3.02Å; I120-Y124 PolarHBondContact O-N 2.85Å; I120-F152 HydrophobicContact CG2-CE2 4.27Å; I120-F152 HydrophobicContact CG2-CZ 3.75Å; I120-A160 HydrophobicContact CD1-CB 3.91Å; I120-A160 HydrophobicContact CG1-CB 4.17Å; I120-I164 HydrophobicContact CD1-CG2 3.56Å; I120-I164 HydrophobicContact CG2-CD1 4.32Å; I120-I164 HydrophobicContact CG2-CG2 4.09Å
121	L	89.6	Confident	87.5	Confident	23 Å²	23	61.3 Å²	61.3	12%	0.12	31%	0.311	C	S	.	.	H	α-helix	trans	-62.8	-38.8	177.8	-63.8	-179.1	0	0	0	111.7	V100 L103 Q104 N119 Y124 Q125 Y245	V100-L121 HydrophobicContact CG1-CD2 4.43Å; L103-L121 HydrophobicContact CB-CD1 4.11Å; L103-L121 HydrophobicContact CB-CD2 4.13Å; L103-L121 HydrophobicContact CB-CG 4.05Å; Q104-L121 HydrophobicContact CG-CD1 3.96Å; Q104-L121 HydrophobicContact CG-CD2 4.41Å; N119-L121 VanDerWaalsContact C-N 3.3Å; N119-L121 PolarHBondContact O-N 3.29Å; L121-Y124 WeakPolarHBondContact O-CB 3.36Å; L121-Y124 PolarHBondContact O-N 3.2Å; L121-Q125 PolarHBondContact O-N 3.45Å; L121-Y245 HydrophobicContact CB-CD1 4.43Å; L121-Y245 HydrophobicContact CB-CE1 3.78Å; L121-Y245 HydrophobicContact CD2-CD1 3.81Å; L121-Y245 HydrophobicContact CD2-CD2 4.41Å; L121-Y245 HydrophobicContact CD2-CE1 3.99Å; L121-Y245 HydrophobicContact CD2-CG 4.01Å; L121-Y245 HydrophobicContact CG-CE1 4.39Å; L121-Y245 WeakPolarHBondContact O-CE1 3.48Å
122	T	92.4	Very high	88.1	Confident	72 Å²	72	67.1 Å²	67.1	44%	0.442	33%	0.334	S	S	.	.	H	α-helix	trans	-64.6	-42.5	175.2	64.4	0	0	0	0	111.4	N119 I120 Y124 Q125 E126	N119-T122 PolarHBondContact O-N 3.3Å; N119-T122 VanDerWaalsContact O-N 3.13Å; N119-T122 PolarHBondContact O-OG1 3.4Å; I120-T122 VanDerWaalsContact C-N 3.3Å; I120-T122 PolarHBondContact O-N 3.14Å; T122-Y124 VanDerWaalsContact C-N 3.3Å; T122-Y124 PolarHBondContact O-N 3.47Å; T122-Q125 PolarHBondContact O-N 3.09Å; T122-E126 WeakPolarHBondContact O-CG 3.5Å; T122-E126 PolarHBondContact O-N 3.33Å
123	K	93.3	Very high	89	Confident	47 Å²	47	64 Å²	64	20%	0.204	32%	0.321	C	S	.	.	H	α-helix	trans	-65.9	-30.8	176.8	-69.3	-176.7	174.7	-169.1	0	112.8	N119 I120 E126 A127 F152 L155 I156	N119-K123 PolarHBondContact O-N 2.97Å; I120-K123 PolarHBondContact O-N 3.02Å; K123-E126 PolarHBondContact O-N 3.03Å; K123-A127 WeakPolarHBondContact O-CB 3.38Å; K123-A127 PolarHBondContact O-N 3.37Å; K123-F152 HydrophobicContact CB-CE2 4.38Å; K123-L155 WeakPolarHBondContact CD-O 3.27Å; K123-L155 WeakPolarHBondContact CE-O 3.46Å; K123-L155 PolarHBondContact NZ-O 3.31Å; K123-I156 HydrophobicContact CB-CG2 3.75Å; K123-I156 HydrophobicContact CD-CB 4.21Å; K123-I156 HydrophobicContact CD-CG2 3.69Å; K123-I156 HydrophobicContact CG-CG2 4.39Å
124	Y	92.5	Very high	89.8	Confident	10 Å²	10	64.4 Å²	64.4	4%	0.039	32%	0.32	C	S	.	.	H	α-helix	trans	-61.6	-49.1	172.6	-177	-73.7	0	0	0	110.6	I120 L121 T122 E126 A127 N128 M148 F152 P244 Y245 C246 E249 F250	I120-Y124 PolarHBondContact O-N 2.85Å; L121-Y124 WeakPolarHBondContact O-CB 3.36Å; L121-Y124 PolarHBondContact O-N 3.2Å; T122-Y124 VanDerWaalsContact C-N 3.3Å; T122-Y124 PolarHBondContact O-N 3.47Å; Y124-E126 VanDerWaalsContact C-N 3.32Å; Y124-E126 PolarHBondContact O-N 3.4Å; Y124-A127 WeakPolarHBondContact O-CB 3.5Å; Y124-A127 PolarHBondContact O-N 3.07Å; Y124-N128 PolarHBondContact O-N 2.7Å; Y124-M148 HydrophobicContact CD2-CE 4.47Å; Y124-M148 HydrophobicContact CE1-CE 4.39Å; Y124-M148 HydrophobicContact CE2-CE 3.72Å; Y124-F152 HydrophobicContact CD2-CE2 4.33Å; Y124-F152 HydrophobicContact CD2-CZ 4.33Å; Y124-F152 HydrophobicContact CG-CE2 4.5Å; Y124-P244 WeakPolarHBondContact CE1-O 3.29Å; Y124-Y245 AromaticContact CD1-CD1 3.77Å; Y124-Y245 HydrophobicContact CD1-CD1 3.77Å; Y124-Y245 HydrophobicContact CD1-CE1 4.43Å; Y124-Y245 HydrophobicContact CE1-CD1 4.36Å; Y124-Y245 AromaticContact CG-CD1 3.98Å; Y124-Y245 HydrophobicContact CG-CD1 3.98Å; Y124-C246 PolarHBondContact OH-N 2.94Å; Y124-C246 PolarHBondContact OH-O 3Å; Y124-E249 PolarHBondContact OH-OE2 3.08Å; Y124-E249 VanDerWaalsContact OH-OE2 3.14Å; Y124-F250 HydrophobicContact CD2-CE1 4.49Å; Y124-F250 HydrophobicContact CD2-CE2 4.24Å; Y124-F250 AromaticContact CD2-CZ 3.63Å; Y124-F250 HydrophobicContact CD2-CZ 3.63Å; Y124-F250 HydrophobicContact CE2-CE1 4.23Å; Y124-F250 AromaticContact CE2-CE2 3.67Å; Y124-F250 HydrophobicContact CE2-CE2 3.67Å; Y124-F250 AromaticContact CE2-CZ 3.39Å; Y124-F250 HydrophobicContact CE2-CZ 3.39Å
125	Q	92.6	Very high	90.4	Very high	84 Å²	84	67.3 Å²	67.3	39%	0.393	33%	0.329	S	S	.	.	H	α-helix	trans	-64.3	-38.6	178.4	-66.4	-178.8	-19.9	0	0	112	L121 T122 N128 R129 Y245	L121-Q125 PolarHBondContact O-N 3.45Å; T122-Q125 PolarHBondContact O-N 3.09Å; Q125-N128 PolarHBondContact O-N 3.47Å; Q125-R129 WeakPolarHBondContact O-CB 3.42Å; Q125-R129 PolarHBondContact O-N 3.26Å; Q125-Y245 HydrophobicContact CG-CE1 3.84Å; Q125-Y245 PolarHBondContact NE2-OH 3.12Å
126	E	93.9	Very high	91	Very high	71 Å²	71	65.2 Å²	65.2	33%	0.332	33%	0.326	S	S	.	.	H	α-helix	trans	-61.5	-45.5	172.6	-71.8	177.8	-178.3	0	0	111.8	T122 K123 Y124 N128 R129 Y130	T122-E126 WeakPolarHBondContact O-CG 3.5Å; T122-E126 PolarHBondContact O-N 3.33Å; K123-E126 PolarHBondContact O-N 3.03Å; Y124-E126 VanDerWaalsContact C-N 3.32Å; Y124-E126 PolarHBondContact O-N 3.4Å; E126-N128 PolarHBondContact O-N 3.41Å; E126-R129 WeakPolarHBondContact O-CB 3.45Å; E126-R129 PolarHBondContact O-N 3.41Å; E126-Y130 HydrophobicContact CB-CD2 4.4Å; E126-Y130 HydrophobicContact CB-CE2 4.13Å; E126-Y130 WeakPolarHBondContact O-CD2 2.97Å; E126-Y130 PolarHBondContact O-N 2.92Å
127	A	93.8	Very high	91.4	Very high	0 Å²	0	61.1 Å²	61.1	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-58.3	-46.9	176.5	0	0	0	0	0	111.6	K123 Y124 R129 Y130 F131 M148 I151 F152 L155	K123-A127 WeakPolarHBondContact O-CB 3.38Å; K123-A127 PolarHBondContact O-N 3.37Å; Y124-A127 WeakPolarHBondContact O-CB 3.5Å; Y124-A127 PolarHBondContact O-N 3.07Å; A127-R129 VanDerWaalsContact C-N 3.32Å; A127-R129 PolarHBondContact O-N 3.4Å; A127-Y130 PolarHBondContact O-N 2.9Å; A127-F131 VanDerWaalsContact O-CB 3.28Å; A127-F131 WeakPolarHBondContact O-CB 3.48Å; A127-F131 PolarHBondContact O-N 2.64Å; A127-M148 HydrophobicContact CB-SD 4.4Å; A127-I151 HydrophobicContact CB-CG2 4.05Å; A127-F152 HydrophobicContact CB-CB 3.82Å; A127-F152 HydrophobicContact CB-CD2 4.06Å; A127-F152 HydrophobicContact CB-CG 4.41Å; A127-L155 HydrophobicContact CB-CD1 3.78Å
128	N	92.4	Very high	91.7	Very high	27 Å²	27	65.8 Å²	65.8	14%	0.144	34%	0.342	C	S	.	.	H	α-helix	trans	-61.7	-40	176.7	-167.5	-11.4	0	0	0	111.6	Y124 Q125 E126 K132 E249	Y124-N128 PolarHBondContact O-N 2.7Å; Q125-N128 PolarHBondContact O-N 3.47Å; E126-N128 PolarHBondContact O-N 3.41Å; N128-K132 WeakPolarHBondContact O-CG 3.49Å; N128-K132 PolarHBondContact O-N 2.89Å; N128-K132 VanDerWaalsContact O-N 3.13Å; N128-K132 WeakPolarHBondContact OD1-CE 3.42Å; N128-K132 PolarHBondContact OD1-NZ 2.91Å; N128-E249 PolarHBondContact ND2-OE2 3.3Å
129	R	94.1	Very high	92.2	Very high	163 Å²	163	63.1 Å²	63.1	62%	0.615	32%	0.321	S	S	*	.	H	α-helix	trans	-63.6	-47.2	174.1	-173.4	-173.8	-62.4	157.4	2.7	111.5	Q125 E126 A127 K132 T133	Q125-R129 WeakPolarHBondContact O-CB 3.42Å; Q125-R129 PolarHBondContact O-N 3.26Å; E126-R129 WeakPolarHBondContact O-CB 3.45Å; E126-R129 PolarHBondContact O-N 3.41Å; A127-R129 VanDerWaalsContact C-N 3.32Å; A127-R129 PolarHBondContact O-N 3.4Å; R129-K132 PolarHBondContact O-N 3.26Å; R129-T133 WeakPolarHBondContact O-CB 3.31Å; R129-T133 PolarHBondContact O-N 3.42Å; R129-T133 PolarHBondContact O-OG1 3.09Å
130	Y	94.2	Very high	92.3	Very high	54 Å²	54	61.9 Å²	61.9	21%	0.212	31%	0.311	C	S	.	.	H	α-helix	trans	-64.7	-42.9	179.2	-71.5	-48.1	0	0	0	112	E126 A127 K132 T133 Y134 L155 L372	E126-Y130 HydrophobicContact CB-CD2 4.4Å; E126-Y130 HydrophobicContact CB-CE2 4.13Å; E126-Y130 WeakPolarHBondContact O-CD2 2.97Å; E126-Y130 PolarHBondContact O-N 2.92Å; A127-Y130 PolarHBondContact O-N 2.9Å; Y130-K132 VanDerWaalsContact C-N 3.28Å; Y130-K132 PolarHBondContact O-N 3.28Å; Y130-T133 PolarHBondContact O-N 3.48Å; Y130-Y134 HydrophobicContact CD1-CD2 4.12Å; Y130-Y134 AromaticContact CD1-CE2 3.68Å; Y130-Y134 HydrophobicContact CD1-CE2 3.68Å; Y130-Y134 HydrophobicContact CE1-CE2 4.33Å; Y130-Y134 HydrophobicContact CG-CE2 4.42Å; Y130-Y134 WeakPolarHBondContact O-CB 3.48Å; Y130-Y134 WeakPolarHBondContact O-CD2 3.49Å; Y130-Y134 PolarHBondContact O-N 3.17Å; Y130-L155 HydrophobicContact CD2-CD1 3.87Å; Y130-L155 HydrophobicContact CD2-CD2 4.37Å; Y130-L155 HydrophobicContact CE2-CD1 4.18Å; Y130-L155 HydrophobicContact CE2-CD2 4Å; Y130-L372 HydrophobicContact CD1-CB 4.36Å; Y130-L372 HydrophobicContact CD2-CB 4.27Å; Y130-L372 HydrophobicContact CG-CB 4.12Å; Y130-L372 HydrophobicContact CG-CD1 4.43Å
131	F	92.2	Very high	92.2	Very high	55 Å²	55	68.8 Å²	68.8	24%	0.241	34%	0.343	C	S	.	.	H	α-helix	trans	-53.8	-46.3	174.2	-179.7	-95.6	0	0	0	111.1	A127 K135 W140 M148 I151	A127-F131 VanDerWaalsContact O-CB 3.28Å; A127-F131 WeakPolarHBondContact O-CB 3.48Å; A127-F131 PolarHBondContact O-N 2.64Å; F131-K135 WeakPolarHBondContact O-CB 3.26Å; F131-K135 PolarHBondContact O-N 3.2Å; F131-W140 AromaticContact CD2-CH2 3.66Å; F131-W140 HydrophobicContact CD2-CH2 3.66Å; F131-W140 HydrophobicContact CD2-CZ3 4.09Å; F131-W140 AromaticContact CE2-CH2 3.53Å; F131-W140 HydrophobicContact CE2-CH2 3.53Å; F131-W140 HydrophobicContact CE2-CZ2 4.37Å; F131-W140 HydrophobicContact CE2-CZ3 4.41Å; F131-W140 HydrophobicContact CG-CH2 4.35Å; F131-W140 HydrophobicContact CZ-CH2 4.13Å; F131-W140 WeakPolarHBondContact O-CZ3 3.49Å; F131-M148 HydrophobicContact CD2-CB 4.17Å; F131-M148 HydrophobicContact CE2-CB 4.38Å; F131-I151 HydrophobicContact CB-CD1 4.06Å; F131-I151 HydrophobicContact CD2-CD1 4.05Å
132	K	92.6	Very high	92.3	Very high	139 Å²	139	70 Å²	70	60%	0.604	35%	0.347	S	S	*	.	H	α-helix	trans	-69.6	-40.7	176.5	-71.5	168.6	178.3	154.9	0	113.4	N128 R129 Y130	N128-K132 WeakPolarHBondContact O-CG 3.49Å; N128-K132 PolarHBondContact O-N 2.89Å; N128-K132 VanDerWaalsContact O-N 3.13Å; N128-K132 WeakPolarHBondContact OD1-CE 3.42Å; N128-K132 PolarHBondContact OD1-NZ 2.91Å; R129-K132 PolarHBondContact O-N 3.26Å; Y130-K132 VanDerWaalsContact C-N 3.28Å; Y130-K132 PolarHBondContact O-N 3.28Å
133	T	93.6	Very high	92.3	Very high	97 Å²	97	67 Å²	67	60%	0.595	33%	0.329	S	S	*	.	H	α-helix	trans	-72.5	-42.7	-174.1	-55.8	0	0	0	0	112.2	R129 Y130	R129-T133 WeakPolarHBondContact O-CB 3.31Å; R129-T133 PolarHBondContact O-N 3.42Å; R129-T133 PolarHBondContact O-OG1 3.09Å; Y130-T133 PolarHBondContact O-N 3.48Å
134	Y	91.7	Very high	92.1	Very high	52 Å²	52	68.4 Å²	68.4	20%	0.204	34%	0.336	C	S	.	.	H	α-helix	trans	-86.4	-10.5	-177.2	-75.6	-77.3	0	0	0	113.1	Y130 G136 S137 I139 W140 L372	Y130-Y134 HydrophobicContact CD1-CD2 4.12Å; Y130-Y134 AromaticContact CD1-CE2 3.68Å; Y130-Y134 HydrophobicContact CD1-CE2 3.68Å; Y130-Y134 HydrophobicContact CE1-CE2 4.33Å; Y130-Y134 HydrophobicContact CG-CE2 4.42Å; Y130-Y134 WeakPolarHBondContact O-CB 3.48Å; Y130-Y134 WeakPolarHBondContact O-CD2 3.49Å; Y130-Y134 PolarHBondContact O-N 3.17Å; Y134-G136 PolarHBondContact O-N 3.32Å; Y134-G136 VanDerWaalsContact O-N 3.09Å; Y134-S137 VanDerWaalsContact O-CB 3.22Å; Y134-S137 WeakPolarHBondContact O-CB 3.22Å; Y134-S137 PolarHBondContact O-N 3Å; Y134-S137 PolarHBondContact O-OG 2.82Å; Y134-I139 HydrophobicContact CD1-CB 4.15Å; Y134-I139 HydrophobicContact CD1-CD1 4.11Å; Y134-I139 HydrophobicContact CD1-CG2 4.3Å; Y134-I139 HydrophobicContact CE1-CB 4.45Å; Y134-I139 HydrophobicContact CE1-CD1 3.58Å; Y134-W140 WeakPolarHBondContact O-CB 3.45Å; Y134-L372 HydrophobicContact CD2-CB 4.5Å; Y134-L372 HydrophobicContact CD2-CD1 3.87Å; Y134-L372 HydrophobicContact CD2-CD2 4.23Å; Y134-L372 HydrophobicContact CD2-CG 4.44Å; Y134-L372 HydrophobicContact CE2-CB 4.05Å; Y134-L372 HydrophobicContact CE2-CD1 4.26Å; Y134-L372 HydrophobicContact CE2-CD2 4.16Å; Y134-L372 HydrophobicContact CE2-CG 4.4Å; Y134-L372 HydrophobicContact CG-CD1 4.49Å
135	K	91.6	Very high	92	Very high	142 Å²	142	69.5 Å²	69.5	62%	0.617	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.3	117	177.2	-169.9	170.4	-177.5	174.1	0	110.9	F131 W140	F131-K135 WeakPolarHBondContact O-CB 3.26Å; F131-K135 PolarHBondContact O-N 3.2Å; K135-W140 HydrophobicContact CB-CE3 4.36Å; K135-W140 HydrophobicContact CB-CH2 4.3Å; K135-W140 HydrophobicContact CB-CZ3 4.17Å; K135-W140 HydrophobicContact CG-CH2 4.34Å; K135-W140 HydrophobicContact CG-CZ2 4.26Å
136	G	90	Very high	92	Very high	60 Å²	60	67.4 Å²	67.4	62%	0.619	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.3	3.7	-178	0	0	0	0	0	115.7	Y134	Y134-G136 PolarHBondContact O-N 3.32Å; Y134-G136 VanDerWaalsContact O-N 3.09Å
137	S	92.7	Very high	91.9	Very high	31 Å²	31	65.2 Å²	65.2	22%	0.217	33%	0.329	C	S	.	.	S	Bend	trans	-76.7	168.5	171.1	71.2	0	0	0	0	112.2	Y134 I139 W140 H141	Y134-S137 VanDerWaalsContact O-CB 3.22Å; Y134-S137 WeakPolarHBondContact O-CB 3.22Å; Y134-S137 PolarHBondContact O-N 3Å; Y134-S137 PolarHBondContact O-OG 2.82Å; S137-I139 VanDerWaalsContact C-N 3.29Å; S137-I139 PolarHBondContact O-N 2.97Å; S137-W140 WeakPolarHBondContact O-CB 3.44Å; S137-W140 PolarHBondContact O-N 3.38Å; S137-W140 PolarHBondContact OG-N 3.38Å; S137-H141 PolarHBondContact O-CD2 2.98Å; S137-H141 VanDerWaalsContact O-CD2 3.27Å
138	T	91.7	Very high	91.8	Very high	106 Å²	106	65.7 Å²	65.7	65%	0.65	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.8	-35.2	173.6	52.8	0	0	0	0	112.8	W140 H141	T138-W140 VanDerWaalsContact C-N 3.28Å; T138-W140 PolarHBondContact O-N 3.39Å; T138-H141 PolarHBondContact O-N 2.9Å
139	I	91.6	Very high	91.9	Very high	22 Å²	22	64.8 Å²	64.8	11%	0.113	33%	0.327	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-36	176.9	-69.9	161.2	0	0	0	110.7	Y134 S137 H141 K142 L143 L372 V377 N378 L381	Y134-I139 HydrophobicContact CD1-CB 4.15Å; Y134-I139 HydrophobicContact CD1-CD1 4.11Å; Y134-I139 HydrophobicContact CD1-CG2 4.3Å; Y134-I139 HydrophobicContact CE1-CB 4.45Å; Y134-I139 HydrophobicContact CE1-CD1 3.58Å; S137-I139 VanDerWaalsContact C-N 3.29Å; S137-I139 PolarHBondContact O-N 2.97Å; I139-H141 VanDerWaalsContact C-N 3.26Å; I139-H141 PolarHBondContact O-N 3.07Å; I139-K142 PolarHBondContact O-N 3.17Å; I139-L143 PolarHBondContact O-N 2.68Å; I139-L143 VanDerWaalsContact O-N 3.11Å; I139-L372 HydrophobicContact CG2-CD2 3.8Å; I139-V377 HydrophobicContact CD1-CG1 4.11Å; I139-N378 HydrophobicContact CD1-CB 4.44Å; I139-N378 HydrophobicContact CG1-CB 4.24Å; I139-L381 HydrophobicContact CG2-CD1 4.05Å
140	W	90.9	Very high	91.9	Very high	40 Å²	40	57 Å²	57	15%	0.152	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.6	-42.5	177.5	-169.5	-94.1	0	0	0	112.9	F131 Y134 K135 S137 T138 K142 L143 P146	F131-W140 AromaticContact CD2-CH2 3.66Å; F131-W140 HydrophobicContact CD2-CH2 3.66Å; F131-W140 HydrophobicContact CD2-CZ3 4.09Å; F131-W140 AromaticContact CE2-CH2 3.53Å; F131-W140 HydrophobicContact CE2-CH2 3.53Å; F131-W140 HydrophobicContact CE2-CZ2 4.37Å; F131-W140 HydrophobicContact CE2-CZ3 4.41Å; F131-W140 HydrophobicContact CG-CH2 4.35Å; F131-W140 HydrophobicContact CZ-CH2 4.13Å; F131-W140 WeakPolarHBondContact O-CZ3 3.49Å; Y134-W140 WeakPolarHBondContact O-CB 3.45Å; K135-W140 HydrophobicContact CB-CE3 4.36Å; K135-W140 HydrophobicContact CB-CH2 4.3Å; K135-W140 HydrophobicContact CB-CZ3 4.17Å; K135-W140 HydrophobicContact CG-CH2 4.34Å; K135-W140 HydrophobicContact CG-CZ2 4.26Å; S137-W140 WeakPolarHBondContact O-CB 3.44Å; S137-W140 PolarHBondContact O-N 3.38Å; S137-W140 PolarHBondContact OG-N 3.38Å; T138-W140 VanDerWaalsContact C-N 3.28Å; T138-W140 PolarHBondContact O-N 3.39Å; W140-K142 VanDerWaalsContact C-N 3.26Å; W140-K142 PolarHBondContact O-N 3.27Å; W140-L143 PolarHBondContact O-N 3.29Å; W140-P146 HydrophobicContact CD2-CB 3.9Å; W140-P146 HydrophobicContact CE3-CB 4.29Å; W140-P146 HydrophobicContact CG-CB 4.43Å; W140-P146 HydrophobicContact CH2-CB 4.18Å; W140-P146 VanDerWaalsContact CH2-O 3.27Å; W140-P146 WeakPolarHBondContact CH2-O 3.42Å; W140-P146 HydrophobicContact CZ2-CB 3.76Å; W140-P146 HydrophobicContact CZ2-CG 4.36Å; W140-P146 WeakPolarHBondContact CZ2-O 3.39Å; W140-P146 HydrophobicContact CZ3-CB 4.43Å
141	H	89.8	Confident	91.9	Very high	150 Å²	150	54.6 Å²	54.6	69%	0.694	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.3	-13.5	179.9	-62.5	-69.1	0	0	0	113.5	S137 T138 I139	S137-H141 PolarHBondContact O-CD2 2.98Å; S137-H141 VanDerWaalsContact O-CD2 3.27Å; T138-H141 PolarHBondContact O-N 2.9Å; I139-H141 VanDerWaalsContact C-N 3.26Å; I139-H141 PolarHBondContact O-N 3.07Å
142	K	91.4	Very high	92.1	Very high	47 Å²	47	52.3 Å²	52.3	20%	0.204	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.5	-20.6	175.3	-66.9	-170.1	176.8	-162.8	0	113.1	I139 W140 E144 N378 L381 D382 Q385	I139-K142 PolarHBondContact O-N 3.17Å; W140-K142 VanDerWaalsContact C-N 3.26Å; W140-K142 PolarHBondContact O-N 3.27Å; K142-E144 PolarHBondContact O-N 3.32Å; K142-N378 WeakPolarHBondContact CD-OD1 3.48Å; K142-N378 WeakPolarHBondContact CE-OD1 3.32Å; K142-N378 PolarHBondContact NZ-OD1 3.43Å; K142-L381 HydrophobicContact CB-CB 4.31Å; K142-L381 HydrophobicContact CB-CD1 4.17Å; K142-D382 IonicContact NZ-OD1 2.8Å; K142-D382 PolarHBondContact NZ-OD1 3.12Å; K142-Q385 PolarHBondContact O-NE2 3.26Å
143	L	91.9	Very high	92.2	Very high	11 Å²	11	46.1 Å²	46.1	6%	0.058	25%	0.251	C	S	.	.			trans	-67	126.2	174	-69.3	171.1	0	0	0	109.4	I139 W140 D145 P146 L381	I139-L143 PolarHBondContact O-N 2.68Å; I139-L143 VanDerWaalsContact O-N 3.11Å; W140-L143 PolarHBondContact O-N 3.29Å; L143-D145 VanDerWaalsContact C-N 3.31Å; L143-D145 PolarHBondContact O-N 2.98Å; L143-P146 HydrophobicContact CB-CB 4.21Å; L143-P146 HydrophobicContact CD1-CB 4.43Å; L143-L381 HydrophobicContact CD2-CD1 3.86Å; L143-L381 HydrophobicContact CD2-CD2 4.14Å; L143-L381 HydrophobicContact CG-CD1 4.36Å
144	E	88.3	Confident	92.2	Very high	75 Å²	75	41.7 Å²	41.7	35%	0.35	22%	0.223	S	C	.	.	S	Bend	trans	-65.8	-36.6	179.5	-62	-170.2	141.5	0	0	111.9	K142 L352 R388	K142-E144 PolarHBondContact O-N 3.32Å; E144-L352 HydrophobicContact CB-CD1 4.13Å; E144-L352 WeakPolarHBondContact OE2-CD1 3.47Å; E144-L352 WeakPolarHBondContact OE2-CG 3.36Å; E144-R388 IonicContact OE1-CZ 2.97Å; E144-R388 IonicContact OE1-NE 3.1Å; E144-R388 IonicContact OE1-NH1 2.84Å; E144-R388 PolarHBondContact OE1-NH1 3.43Å; E144-R388 IonicContact OE1-NH2 3.64Å; E144-R388 IonicContact OE2-CZ 2.86Å; E144-R388 IonicContact OE2-NH1 2.9Å; E144-R388 PolarHBondContact OE2-NH1 3.41Å; E144-R388 IonicContact OE2-NH2 3.03Å; E144-R388 PolarHBondContact OE2-NH2 3.44Å
145	D	91.4	Very high	92.3	Very high	33 Å²	33	39.9 Å²	39.9	18%	0.176	22%	0.217	C	C	.	.			trans	-128.6	105.2	166	-177.2	7.6	0	0	0	109.9	L143 S147 A150 Y206 F351	L143-D145 VanDerWaalsContact C-N 3.31Å; L143-D145 PolarHBondContact O-N 2.98Å; D145-S147 PolarHBondContact O-N 3.22Å; D145-S147 WeakPolarHBondContact OD1-CB 3.46Å; D145-S147 PolarHBondContact OD1-N 2.84Å; D145-S147 VanDerWaalsContact OD1-N 3.08Å; D145-S147 PolarHBondContact OD1-OG 3.18Å; D145-S147 VanDerWaalsContact OD1-OG 3.11Å; D145-S147 PolarHBondContact OD2-OG 3.22Å; D145-A150 HydrophobicContact CB-CB 4.02Å; D145-A150 WeakPolarHBondContact O-CB 3.24Å; D145-Y206 HydrophobicContact CB-CE2 4.29Å; D145-Y206 WeakPolarHBondContact OD2-CE2 3.49Å; D145-F351 HydrophobicContact CB-CZ 4.42Å
146	P	91.2	Very high	92.4	Very high	40 Å²	40	33.8 Å²	33.8	26%	0.26	19%	0.191	S	C	.	.			trans	-84.7	36	177	36.4	-35.8	0	0	0	112.8	W140 L143	W140-P146 HydrophobicContact CD2-CB 3.9Å; W140-P146 HydrophobicContact CE3-CB 4.29Å; W140-P146 HydrophobicContact CG-CB 4.43Å; W140-P146 HydrophobicContact CH2-CB 4.18Å; W140-P146 VanDerWaalsContact CH2-O 3.27Å; W140-P146 WeakPolarHBondContact CH2-O 3.42Å; W140-P146 HydrophobicContact CZ2-CB 3.76Å; W140-P146 HydrophobicContact CZ2-CG 4.36Å; W140-P146 WeakPolarHBondContact CZ2-O 3.39Å; W140-P146 HydrophobicContact CZ3-CB 4.43Å; L143-P146 HydrophobicContact CB-CB 4.21Å; L143-P146 HydrophobicContact CD1-CB 4.43Å
147	S	92.7	Very high	92.5	Very high	25 Å²	25	31.5 Å²	31.5	18%	0.175	17%	0.168	C	C	.	.	S	Bend	trans	-83.9	157.6	175.9	66.9	0	0	0	0	112.8	D145 V149 A150 I151	D145-S147 PolarHBondContact O-N 3.22Å; D145-S147 WeakPolarHBondContact OD1-CB 3.46Å; D145-S147 PolarHBondContact OD1-N 2.84Å; D145-S147 VanDerWaalsContact OD1-N 3.08Å; D145-S147 PolarHBondContact OD1-OG 3.18Å; D145-S147 VanDerWaalsContact OD1-OG 3.11Å; D145-S147 PolarHBondContact OD2-OG 3.22Å; S147-V149 VanDerWaalsContact C-N 3.28Å; S147-V149 PolarHBondContact O-N 3.43Å; S147-V149 WeakPolarHBondContact OG-CG1 3.32Å; S147-A150 PolarHBondContact O-N 3.1Å; S147-A150 VanDerWaalsContact OG-CB 3.31Å; S147-A150 WeakPolarHBondContact OG-CB 3.44Å; S147-A150 PolarHBondContact OG-N 2.82Å; S147-A150 VanDerWaalsContact OG-N 3.17Å; S147-I151 WeakPolarHBondContact O-CG1 3.09Å; S147-I151 PolarHBondContact O-N 2.67Å
148	M	92.3	Very high	92.4	Very high	10 Å²	10	31.2 Å²	31.2	5%	0.049	16%	0.164	C	C	.	.	H	α-helix	trans	-60.9	-40.7	175.3	-161.1	-76.7	-96.5	0	0	110.8	Y124 A127 F131 I151 F152 E249 F250	Y124-M148 HydrophobicContact CD2-CE 4.47Å; Y124-M148 HydrophobicContact CE1-CE 4.39Å; Y124-M148 HydrophobicContact CE2-CE 3.72Å; A127-M148 HydrophobicContact CB-SD 4.4Å; F131-M148 HydrophobicContact CD2-CB 4.17Å; F131-M148 HydrophobicContact CE2-CB 4.38Å; M148-I151 PolarHBondContact O-N 3.15Å; M148-F152 VanDerWaalsContact O-CB 3.28Å; M148-F152 WeakPolarHBondContact O-CB 3.32Å; M148-F152 PolarHBondContact O-N 2.79Å; M148-F152 HydrophobicContact SD-CB 4.16Å; M148-E249 HydrophobicContact CE-CB 3.74Å; M148-F250 HydrophobicContact CE-CD1 3.29Å; M148-F250 HydrophobicContact CE-CD2 4.41Å; M148-F250 HydrophobicContact CE-CE1 3.17Å; M148-F250 HydrophobicContact CE-CE2 4.28Å; M148-F250 HydrophobicContact CE-CG 3.95Å; M148-F250 HydrophobicContact CE-CZ 3.7Å; M148-F250 HydrophobicContact SD-CD1 3.56Å; M148-F250 VanDerWaalsContact SD-CD1 3.56Å; M148-F250 HydrophobicContact SD-CE1 3.27Å; M148-F250 WeakPolarHBondContact SD-CE1 3.28Å; M148-F250 HydrophobicContact SD-CZ 4.22Å
149	V	93.7	Very high	92.3	Very high	9 Å²	9	28.4 Å²	28.4	6%	0.055	14%	0.143	C	C	.	.	H	α-helix	trans	-61.7	-44.9	177.7	62.2	0	0	0	0	112.4	P94 S147 I151 F152 Y153 Y206 F250	P94-V149 HydrophobicContact CB-CG2 3.96Å; P94-V149 HydrophobicContact CG-CB 4.46Å; P94-V149 HydrophobicContact CG-CG2 3.68Å; S147-V149 VanDerWaalsContact C-N 3.28Å; S147-V149 PolarHBondContact O-N 3.43Å; S147-V149 WeakPolarHBondContact OG-CG1 3.32Å; V149-I151 PolarHBondContact O-N 2.99Å; V149-F152 PolarHBondContact O-N 3.01Å; V149-Y153 VanDerWaalsContact O-CB 3.27Å; V149-Y153 WeakPolarHBondContact O-CB 3.5Å; V149-Y153 PolarHBondContact O-N 3.04Å; V149-Y206 WeakPolarHBondContact CG2-O 2.86Å; V149-F250 HydrophobicContact CB-CB 4.25Å; V149-F250 HydrophobicContact CB-CD1 3.84Å; V149-F250 HydrophobicContact CB-CG 4.43Å; V149-F250 HydrophobicContact CG2-CD1 4.33Å
150	A	94.3	Very high	92.3	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-66.5	-39	179.3	0	0	0	0	0	112.4	D145 S147 Q154 Y206 F351	D145-A150 HydrophobicContact CB-CB 4.02Å; D145-A150 WeakPolarHBondContact O-CB 3.24Å; S147-A150 PolarHBondContact O-N 3.1Å; S147-A150 VanDerWaalsContact OG-CB 3.31Å; S147-A150 WeakPolarHBondContact OG-CB 3.44Å; S147-A150 PolarHBondContact OG-N 2.82Å; S147-A150 VanDerWaalsContact OG-N 3.17Å; A150-Q154 VanDerWaalsContact O-CG 3.27Å; A150-Q154 WeakPolarHBondContact O-CG 3.44Å; A150-Q154 PolarHBondContact O-N 2.86Å; A150-Q154 PolarHBondContact O-NE2 3.28Å; A150-Y206 HydrophobicContact CB-CD2 4.04Å; A150-Y206 HydrophobicContact CB-CE2 4.21Å; A150-F351 HydrophobicContact CB-CE2 4.31Å; A150-F351 HydrophobicContact CB-CZ 4.08Å
151	I	94.8	Very high	92.4	Very high	2 Å²	2	25.8 Å²	25.8	1%	0.01	13%	0.133	C	C	.	.	H	α-helix	trans	-64.5	-48.4	174.8	-66.6	172.1	0	0	0	110.2	A127 F131 S147 M148 V149 Q154 L155 L372	A127-I151 HydrophobicContact CB-CG2 4.05Å; F131-I151 HydrophobicContact CB-CD1 4.06Å; F131-I151 HydrophobicContact CD2-CD1 4.05Å; S147-I151 WeakPolarHBondContact O-CG1 3.09Å; S147-I151 PolarHBondContact O-N 2.67Å; M148-I151 PolarHBondContact O-N 3.15Å; V149-I151 PolarHBondContact O-N 2.99Å; I151-Q154 PolarHBondContact O-N 2.68Å; I151-L155 HydrophobicContact CG2-CD1 3.97Å; I151-L155 WeakPolarHBondContact O-CG 3.27Å; I151-L155 PolarHBondContact O-N 2.96Å; I151-L372 HydrophobicContact CD1-CD1 3.91Å; I151-L372 HydrophobicContact CG1-CD1 3.95Å; I151-L372 HydrophobicContact CG2-CD1 3.93Å
152	F	94.9	Very high	92.5	Very high	7 Å²	7	18.8 Å²	18.8	3%	0.031	10%	0.101	C	C	.	.	H	α-helix	trans	-61.2	-46.9	-179.6	177.9	-121.4	0	0	0	111.8	V95 I120 K123 Y124 A127 M148 V149 Q154 L155 I156 I164 F250	V95-F152 HydrophobicContact CG2-CE1 4.37Å; I120-F152 HydrophobicContact CG2-CE2 4.27Å; I120-F152 HydrophobicContact CG2-CZ 3.75Å; K123-F152 HydrophobicContact CB-CE2 4.38Å; Y124-F152 HydrophobicContact CD2-CE2 4.33Å; Y124-F152 HydrophobicContact CD2-CZ 4.33Å; Y124-F152 HydrophobicContact CG-CE2 4.5Å; A127-F152 HydrophobicContact CB-CB 3.82Å; A127-F152 HydrophobicContact CB-CD2 4.06Å; A127-F152 HydrophobicContact CB-CG 4.41Å; M148-F152 VanDerWaalsContact O-CB 3.28Å; M148-F152 WeakPolarHBondContact O-CB 3.32Å; M148-F152 PolarHBondContact O-N 2.79Å; M148-F152 HydrophobicContact SD-CB 4.16Å; V149-F152 PolarHBondContact O-N 3.01Å; F152-Q154 VanDerWaalsContact C-N 3.33Å; F152-Q154 PolarHBondContact O-N 3.16Å; F152-L155 WeakPolarHBondContact O-CB 3.15Å; F152-L155 PolarHBondContact O-N 3.47Å; F152-L155 VanDerWaalsContact O-N 3.08Å; F152-I156 HydrophobicContact CD1-CD1 4.1Å; F152-I156 HydrophobicContact CD2-CG2 3.79Å; F152-I156 HydrophobicContact CE1-CD1 3.75Å; F152-I156 HydrophobicContact CE1-CG2 4.41Å; F152-I156 HydrophobicContact CE2-CG2 3.37Å; F152-I156 HydrophobicContact CG-CG2 4.46Å; F152-I156 HydrophobicContact CZ-CD1 4Å; F152-I156 HydrophobicContact CZ-CG2 3.75Å; F152-I156 WeakPolarHBondContact O-CG1 3.14Å; F152-I156 PolarHBondContact O-N 3.43Å; F152-I164 HydrophobicContact CE1-CD1 3.46Å; F152-I164 VanDerWaalsContact CE1-CD1 3.46Å; F152-I164 HydrophobicContact CZ-CD1 3.81Å; F152-F250 HydrophobicContact CB-CE1 3.9Å; F152-F250 AromaticContact CD1-CE1 3.38Å; F152-F250 HydrophobicContact CD1-CE1 3.38Å; F152-F250 AromaticContact CD1-CZ 3.44Å; F152-F250 HydrophobicContact CD1-CZ 3.44Å; F152-F250 VanDerWaalsContact CD1-CZ 3.44Å; F152-F250 HydrophobicContact CE1-CE1 4.03Å; F152-F250 AromaticContact CE1-CZ 3.57Å; F152-F250 HydrophobicContact CE1-CZ 3.57Å; F152-F250 AromaticContact CG-CE1 3.81Å; F152-F250 HydrophobicContact CG-CE1 3.81Å; F152-F250 HydrophobicContact CG-CZ 4.1Å; F152-F250 HydrophobicContact CZ-CZ 4.35Å
153	Y	95.1	Very high	92.3	Very high	9 Å²	9	17.6 Å²	17.6	4%	0.035	10%	0.096	C	C	.	.	H	α-helix	trans	-55.7	-46.2	177.6	-177	-93.1	0	0	0	112.3	V149 L155 I156 G157 M158 A161 I204 F351 F368	V149-Y153 VanDerWaalsContact O-CB 3.27Å; V149-Y153 WeakPolarHBondContact O-CB 3.5Å; V149-Y153 PolarHBondContact O-N 3.04Å; Y153-L155 VanDerWaalsContact C-N 3.26Å; Y153-L155 PolarHBondContact O-N 2.88Å; Y153-I156 PolarHBondContact O-N 2.78Å; Y153-G157 WeakPolarHBondContact O-CA 3.2Å; Y153-G157 PolarHBondContact O-N 2.78Å; Y153-M158 VanDerWaalsContact OH-CG 3.27Å; Y153-M158 WeakPolarHBondContact OH-CG 3.29Å; Y153-A161 HydrophobicContact CD2-CB 3.74Å; Y153-A161 HydrophobicContact CE2-CB 3.59Å; Y153-I204 HydrophobicContact CE2-CD1 3.9Å; Y153-I204 HydrophobicContact CE2-CG1 4.04Å; Y153-I204 WeakPolarHBondContact OH-CG1 3.48Å; Y153-F351 HydrophobicContact CD1-CB 4.24Å; Y153-F351 HydrophobicContact CE1-CB 4.05Å; Y153-F368 HydrophobicContact CE1-CE1 4.21Å; Y153-F368 HydrophobicContact CE1-CZ 4.14Å
154	Q	94.4	Very high	92.3	Very high	4 Å²	4	17.2 Å²	17.2	2%	0.019	9%	0.094	C	C	.	.	H	α-helix	trans	-68.5	-22.7	179.7	-70.1	178.1	90.9	0	0	113.6	A150 I151 F152 F351 F368 G370 N371	A150-Q154 VanDerWaalsContact O-CG 3.27Å; A150-Q154 WeakPolarHBondContact O-CG 3.44Å; A150-Q154 PolarHBondContact O-N 2.86Å; A150-Q154 PolarHBondContact O-NE2 3.28Å; I151-Q154 PolarHBondContact O-N 2.68Å; F152-Q154 VanDerWaalsContact C-N 3.33Å; F152-Q154 PolarHBondContact O-N 3.16Å; Q154-F351 HydrophobicContact CG-CD1 3.62Å; Q154-F351 HydrophobicContact CG-CE1 4.12Å; Q154-F351 HydrophobicContact CG-CG 4.2Å; Q154-F351 VanDerWaalsContact NE2-CE1 3.29Å; Q154-F368 HydrophobicContact CB-CB 3.95Å; Q154-F368 HydrophobicContact CB-CD2 4.44Å; Q154-F368 HydrophobicContact CB-CG 4.27Å; Q154-F368 HydrophobicContact CG-CB 3.85Å; Q154-F368 HydrophobicContact CG-CG 4.09Å; Q154-G370 PolarHBondContact OE1-O 2.82Å; Q154-N371 PolarHBondContact O-ND2 2.9Å
155	L	94.2	Very high	92.5	Very high	14 Å²	14	13.6 Å²	13.6	7%	0.073	8%	0.077	C	C	.	.	H	α-helix	trans	-82.2	-43.8	174.3	-69.1	165.7	0	0	0	112	K123 A127 Y130 I151 F152 Y153 N371	K123-L155 WeakPolarHBondContact CD-O 3.27Å; K123-L155 WeakPolarHBondContact CE-O 3.46Å; K123-L155 PolarHBondContact NZ-O 3.31Å; A127-L155 HydrophobicContact CB-CD1 3.78Å; Y130-L155 HydrophobicContact CD2-CD1 3.87Å; Y130-L155 HydrophobicContact CD2-CD2 4.37Å; Y130-L155 HydrophobicContact CE2-CD1 4.18Å; Y130-L155 HydrophobicContact CE2-CD2 4Å; I151-L155 HydrophobicContact CG2-CD1 3.97Å; I151-L155 WeakPolarHBondContact O-CG 3.27Å; I151-L155 PolarHBondContact O-N 2.96Å; F152-L155 WeakPolarHBondContact O-CB 3.15Å; F152-L155 PolarHBondContact O-N 3.47Å; F152-L155 VanDerWaalsContact O-N 3.08Å; Y153-L155 VanDerWaalsContact C-N 3.26Å; Y153-L155 PolarHBondContact O-N 2.88Å; L155-N371 WeakPolarHBondContact CD2-OD1 3.5Å
156	I	93.2	Very high	92.6	Very high	14 Å²	14	12.1 Å²	12.1	7%	0.072	7%	0.069	C	C	.	.	H	α-helix	trans	-77.3	-37.1	-177.6	68	177	0	0	0	112.2	K123 F152 Y153 A160 A161 I164	K123-I156 HydrophobicContact CB-CG2 3.75Å; K123-I156 HydrophobicContact CD-CB 4.21Å; K123-I156 HydrophobicContact CD-CG2 3.69Å; K123-I156 HydrophobicContact CG-CG2 4.39Å; F152-I156 HydrophobicContact CD1-CD1 4.1Å; F152-I156 HydrophobicContact CD2-CG2 3.79Å; F152-I156 HydrophobicContact CE1-CD1 3.75Å; F152-I156 HydrophobicContact CE1-CG2 4.41Å; F152-I156 HydrophobicContact CE2-CG2 3.37Å; F152-I156 HydrophobicContact CG-CG2 4.46Å; F152-I156 HydrophobicContact CZ-CD1 4Å; F152-I156 HydrophobicContact CZ-CG2 3.75Å; F152-I156 WeakPolarHBondContact O-CG1 3.14Å; F152-I156 PolarHBondContact O-N 3.43Å; Y153-I156 PolarHBondContact O-N 2.78Å; I156-A160 HydrophobicContact CB-CB 3.83Å; I156-A160 HydrophobicContact CD1-CB 4.48Å; I156-A160 HydrophobicContact CG1-CB 4.27Å; I156-A160 WeakPolarHBondContact O-CB 3.25Å; I156-A161 HydrophobicContact CD1-CB 3.89Å; I156-A161 HydrophobicContact CG1-CB 4.42Å; I156-I164 HydrophobicContact CD1-CD1 3.51Å; I156-I164 HydrophobicContact CD1-CG1 4.45Å
157	G	92.1	Very high	92.6	Very high	13 Å²	13	11.5 Å²	11.5	13%	0.134	6%	0.063	C	C	.	.			trans	79.1	171	-174.4	0	0	0	0	0	114.8	Y153 E159 A160 A161	Y153-G157 WeakPolarHBondContact O-CA 3.2Å; Y153-G157 PolarHBondContact O-N 2.78Å; G157-E159 PolarHBondContact O-N 3.5Å; G157-A160 PolarHBondContact O-N 3.05Å; G157-A161 WeakPolarHBondContact O-CB 3.37Å; G157-A161 PolarHBondContact O-N 3.47Å
158	M	91.2	Very high	92.7	Very high	25 Å²	25	12.7 Å²	12.7	12%	0.123	7%	0.066	C	C	.	.	H	α-helix	trans	-57.8	-46.9	-172.2	-75	179	-70	0	0	113.6	Y153 A160 A161 I162 I204 F321 I355 V363 F368	Y153-M158 VanDerWaalsContact OH-CG 3.27Å; Y153-M158 WeakPolarHBondContact OH-CG 3.29Å; M158-A160 VanDerWaalsContact C-N 3.35Å; M158-A160 PolarHBondContact O-N 2.67Å; M158-A161 PolarHBondContact O-N 2.78Å; M158-I162 WeakPolarHBondContact O-CG1 3.34Å; M158-I162 PolarHBondContact O-N 3.41Å; M158-I204 HydrophobicContact CB-CD1 3.97Å; M158-I204 HydrophobicContact CG-CD1 4.14Å; M158-I204 VanDerWaalsContact O-CD1 3.27Å; M158-I204 WeakPolarHBondContact O-CD1 3.5Å; M158-F321 HydrophobicContact CB-CE1 4.22Å; M158-F321 HydrophobicContact CB-CZ 4.22Å; M158-F321 HydrophobicContact CE-CE1 3.88Å; M158-F321 HydrophobicContact CE-CZ 4.06Å; M158-F321 HydrophobicContact SD-CE1 4.34Å; M158-I355 HydrophobicContact CE-CD1 3.43Å; M158-I355 VanDerWaalsContact CE-CD1 3.43Å; M158-I355 HydrophobicContact SD-CD1 3.97Å; M158-V363 HydrophobicContact CE-CG1 3.34Å; M158-F368 HydrophobicContact CE-CZ 4.47Å; M158-F368 HydrophobicContact CG-CZ 4.14Å
159	E	89.9	Confident	92.5	Very high	47 Å²	47	16.7 Å²	16.7	22%	0.22	9%	0.088	C	C	.	.	H	α-helix	trans	-57.5	-48.1	-177.7	179.2	-179.4	-167.5	0	0	111.3	K116 Y117 G157 I162 F314	K116-E159 IonicContact NZ-OE1 2.85Å; K116-E159 PolarHBondContact NZ-OE1 3.47Å; K116-E159 IonicContact NZ-OE2 3.38Å; K116-E159 PolarHBondContact NZ-OE2 3.42Å; K116-E159 VanDerWaalsContact NZ-OE2 3.07Å; Y117-E159 HydrophobicContact CE1-CG 4.04Å; Y117-E159 PolarHBondContact OH-OE1 3.07Å; Y117-E159 VanDerWaalsContact OH-OE1 3.05Å; G157-E159 PolarHBondContact O-N 3.5Å; E159-I162 PolarHBondContact O-N 2.98Å; E159-F314 HydrophobicContact CB-CD2 4.46Å; E159-F314 HydrophobicContact CB-CE2 4.11Å; E159-F314 HydrophobicContact CB-CZ 4.49Å; E159-F314 HydrophobicContact CG-CE1 4.49Å; E159-F314 HydrophobicContact CG-CE2 3.72Å; E159-F314 HydrophobicContact CG-CZ 3.71Å
160	A	90.7	Very high	92.3	Very high	7 Å²	7	18.8 Å²	18.8	6%	0.058	10%	0.099	C	C	.	.	H	α-helix	trans	-69.4	-38	-179.8	0	0	0	0	0	112.4	I120 I156 G157 M158 I162 Q163 I164	I120-A160 HydrophobicContact CD1-CB 3.91Å; I120-A160 HydrophobicContact CG1-CB 4.17Å; I156-A160 HydrophobicContact CB-CB 3.83Å; I156-A160 HydrophobicContact CD1-CB 4.48Å; I156-A160 HydrophobicContact CG1-CB 4.27Å; I156-A160 WeakPolarHBondContact O-CB 3.25Å; G157-A160 PolarHBondContact O-N 3.05Å; M158-A160 VanDerWaalsContact C-N 3.35Å; M158-A160 PolarHBondContact O-N 2.67Å; A160-I162 PolarHBondContact O-N 2.91Å; A160-Q163 PolarHBondContact O-N 3.25Å; A160-Q163 VanDerWaalsContact O-N 3.14Å; A160-I164 PolarHBondContact O-N 2.93Å
161	A	92.7	Very high	92.3	Very high	0 Å²	0	18.9 Å²	18.9	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-58.7	-36.4	177.7	0	0	0	0	0	112.4	Y153 I156 G157 M158 Q163 I164 G165 I204	Y153-A161 HydrophobicContact CD2-CB 3.74Å; Y153-A161 HydrophobicContact CE2-CB 3.59Å; I156-A161 HydrophobicContact CD1-CB 3.89Å; I156-A161 HydrophobicContact CG1-CB 4.42Å; G157-A161 WeakPolarHBondContact O-CB 3.37Å; G157-A161 PolarHBondContact O-N 3.47Å; M158-A161 PolarHBondContact O-N 2.78Å; A161-Q163 VanDerWaalsContact C-N 3.3Å; A161-Q163 PolarHBondContact O-N 3.25Å; A161-I164 WeakPolarHBondContact O-CG1 3.31Å; A161-I164 PolarHBondContact O-N 3.47Å; A161-G165 PolarHBondContact O-N 2.92Å; A161-I204 HydrophobicContact CB-CD1 3.79Å
162	I	91.4	Very high	92.3	Very high	2 Å²	2	19.1 Å²	19.1	1%	0.01	10%	0.101	C	C	.	.	H	α-helix	trans	-66	-36.1	178.7	-64.8	170.4	0	0	0	112.2	R99 M158 E159 A160 I164 Q167 I204 N210 F314	R99-I162 PolarHBondContact NH1-O 3.35Å; M158-I162 WeakPolarHBondContact O-CG1 3.34Å; M158-I162 PolarHBondContact O-N 3.41Å; E159-I162 PolarHBondContact O-N 2.98Å; A160-I162 PolarHBondContact O-N 2.91Å; I162-I164 VanDerWaalsContact C-N 3.29Å; I162-I164 PolarHBondContact O-N 3.36Å; I162-Q167 PolarHBondContact O-NE2 2.67Å; I162-I204 HydrophobicContact CD1-CD1 4.04Å; I162-I204 HydrophobicContact CG1-CB 4.46Å; I162-I204 HydrophobicContact CG1-CD1 3.53Å; I162-I204 HydrophobicContact CG1-CG1 4.47Å; I162-N210 WeakPolarHBondContact CA-OD1 3.33Å; I162-N210 PolarHBondContact O-ND2 3.38Å; I162-F314 HydrophobicContact CD1-CB 3.31Å; I162-F314 HydrophobicContact CD1-CD1 3.58Å; I162-F314 HydrophobicContact CD1-CG 3.69Å
163	Q	88.7	Confident	92.3	Very high	22 Å²	22	18.9 Å²	18.9	10%	0.103	10%	0.1	C	C	.	.	H	α-helix	trans	-75.8	-16.9	-177.4	-64.2	-62	-34.9	0	0	113.4	R99 Y117 A160 A161 H316	R99-Q163 VanDerWaalsContact CD-O 3.25Å; R99-Q163 WeakPolarHBondContact CD-O 3.35Å; R99-Q163 PolarHBondContact NE-O 3.45Å; R99-Q163 PolarHBondContact NH1-O 3.45Å; Y117-Q163 HydrophobicContact CD1-CG 4.35Å; Y117-Q163 HydrophobicContact CD2-CB 4.27Å; Y117-Q163 HydrophobicContact CD2-CG 3.98Å; Y117-Q163 HydrophobicContact CE1-CG 3.98Å; Y117-Q163 HydrophobicContact CE2-CB 4.36Å; Y117-Q163 HydrophobicContact CE2-CG 3.57Å; Y117-Q163 HydrophobicContact CG-CB 4.4Å; Y117-Q163 HydrophobicContact CG-CG 4.36Å; A160-Q163 PolarHBondContact O-N 3.25Å; A160-Q163 VanDerWaalsContact O-N 3.14Å; A161-Q163 VanDerWaalsContact C-N 3.3Å; A161-Q163 PolarHBondContact O-N 3.25Å; Q163-H316 PolarHBondContact NE2-CD2 3.46Å; Q163-H316 PolarHBondContact NE2-NE2 3.38Å; Q163-H316 VanDerWaalsContact NE2-NE2 3.15Å
164	I	90.6	Very high	92.2	Very high	3 Å²	3	21.1 Å²	21.1	2%	0.015	12%	0.115	C	C	.	.	H	α-helix	trans	-107.6	-24.7	177.6	61.5	175.9	0	0	0	113.7	V95 N96 L103 I120 F152 I156 A160 A161 I162	V95-I164 HydrophobicContact CG1-CB 4.41Å; V95-I164 HydrophobicContact CG2-CD1 3.94Å; V95-I164 HydrophobicContact CG2-CG1 4.35Å; N96-I164 PolarHBondContact N-O 3.21Å; L103-I164 HydrophobicContact CD1-CG2 3.84Å; I120-I164 HydrophobicContact CD1-CG2 3.56Å; I120-I164 HydrophobicContact CG2-CD1 4.32Å; I120-I164 HydrophobicContact CG2-CG2 4.09Å; F152-I164 HydrophobicContact CE1-CD1 3.46Å; F152-I164 VanDerWaalsContact CE1-CD1 3.46Å; F152-I164 HydrophobicContact CZ-CD1 3.81Å; I156-I164 HydrophobicContact CD1-CD1 3.51Å; I156-I164 HydrophobicContact CD1-CG1 4.45Å; A160-I164 PolarHBondContact O-N 2.93Å; A161-I164 WeakPolarHBondContact O-CG1 3.31Å; A161-I164 PolarHBondContact O-N 3.47Å; I162-I164 VanDerWaalsContact C-N 3.29Å; I162-I164 PolarHBondContact O-N 3.36Å
165	G	92.9	Very high	92.1	Very high	0 Å²	0	25 Å²	25	0%	0	14%	0.135	C	C	.	.	S	Bend	trans	-66.3	165.9	177.2	0	0	0	0	0	113.2	P94 R99 A161 Q167 N210	P94-G165 VanDerWaalsContact O-CA 3.32Å; P94-G165 WeakPolarHBondContact O-CA 3.35Å; R99-G165 PolarHBondContact NH1-O 2.99Å; A161-G165 PolarHBondContact O-N 2.92Å; G165-Q167 PolarHBondContact O-N 2.96Å; G165-Q167 PolarHBondContact O-NE2 3.38Å; G165-N210 PolarHBondContact O-ND2 3.29Å
166	H	93.7	Very high	92.1	Very high	1 Å²	1	25.6 Å²	25.6	1%	0.005	14%	0.137	C	C	.	.	P	Polyproline II helix	trans	-59.4	137.3	177.9	-59	-91.9	0	0	0	111	N91 D93 V95 F171 N210 Y212	N91-H166 PolarHBondContact ND2-CD2 2.73Å; N91-H166 PolarHBondContact ND2-CE1 3.22Å; N91-H166 PolarHBondContact ND2-ND1 3.14Å; N91-H166 PolarHBondContact ND2-NE2 3.48Å; D93-H166 PolarHBondContact O-CD2 3.17Å; D93-H166 PolarHBondContact O-NE2 2.99Å; D93-H166 VanDerWaalsContact O-NE2 3.1Å; V95-H166 PolarHBondContact O-NE2 2.59Å; H166-F171 HydrophobicContact CB-CB 4.05Å; H166-F171 HydrophobicContact CB-CG 4.5Å; H166-N210 WeakPolarHBondContact O-CB 3.41Å; H166-N210 PolarHBondContact O-ND2 2.82Å; H166-Y212 PolarHBondContact O-OH 3.04Å
167	Q	92.1	Very high	92.3	Very high	28 Å²	28	25.2 Å²	25.2	13%	0.131	14%	0.136	C	C	.	.	P	Polyproline II helix	trans	-84.4	158.2	172.6	-64.9	-57	-87.6	0	0	111	R99 I162 G165 D169 D170 F171 N210 Y212	R99-Q167 VanDerWaalsContact CZ-NE2 3.29Å; R99-Q167 VanDerWaalsContact NH1-CD 3.33Å; I162-Q167 PolarHBondContact O-NE2 2.67Å; G165-Q167 PolarHBondContact O-N 2.96Å; G165-Q167 PolarHBondContact O-NE2 3.38Å; Q167-D169 VanDerWaalsContact C-N 3.3Å; Q167-D169 PolarHBondContact O-N 2.92Å; Q167-D170 HydrophobicContact CB-CB 4.42Å; Q167-D170 PolarHBondContact O-N 3.15Å; Q167-F171 WeakPolarHBondContact O-CB 3.44Å; Q167-F171 PolarHBondContact O-N 2.87Å; Q167-N210 PolarHBondContact NE2-ND2 2.86Å; Q167-Y212 VanDerWaalsContact CA-OH 3.32Å; Q167-Y212 WeakPolarHBondContact CA-OH 3.29Å
168	I	92.8	Very high	92.5	Very high	49 Å²	49	27.7 Å²	27.7	25%	0.251	14%	0.144	S	C	.	.	H	α-helix	trans	-57.5	-46.6	-178.6	-172	171.9	0	0	0	111.3	F171 I172 Y212	I168-F171 PolarHBondContact O-N 2.9Å; I168-I172 HydrophobicContact CG1-CD1 4.27Å; I168-I172 PolarHBondContact O-N 3.4Å; I168-Y212 HydrophobicContact CB-CD1 3.78Å; I168-Y212 HydrophobicContact CB-CD2 4.24Å; I168-Y212 HydrophobicContact CB-CE1 3.6Å; I168-Y212 HydrophobicContact CB-CE2 4.06Å; I168-Y212 HydrophobicContact CB-CG 4.1Å; I168-Y212 HydrophobicContact CD1-CD1 4.04Å; I168-Y212 HydrophobicContact CD1-CG 4.35Å; I168-Y212 HydrophobicContact CG1-CD1 4.03Å; I168-Y212 HydrophobicContact CG1-CD2 4.44Å; I168-Y212 HydrophobicContact CG1-CE1 4.36Å; I168-Y212 HydrophobicContact CG1-CG 4.07Å; I168-Y212 HydrophobicContact CG2-CE1 4.47Å; I168-Y212 PolarHBondContact N-OH 3.08Å; I168-Y212 VanDerWaalsContact N-OH 3.1Å
169	D	89.4	Confident	92.7	Very high	94 Å²	94	26.5 Å²	26.5	50%	0.503	14%	0.138	S	C	.	.	H	α-helix	trans	-65.7	-48.4	-178.5	-62.5	-35.6	0	0	0	109.2	Q167 F171 I172 R433	Q167-D169 VanDerWaalsContact C-N 3.3Å; Q167-D169 PolarHBondContact O-N 2.92Å; D169-F171 VanDerWaalsContact C-N 3.33Å; D169-F171 PolarHBondContact O-N 3.41Å; D169-I172 VanDerWaalsContact O-O 3.05Å; D169-R433 PolarHBondContact O-NH1 3.47Å; D169-R433 PolarHBondContact O-NH2 3.23Å
170	D	89	Confident	93	Very high	54 Å²	54	24.8 Å²	24.8	29%	0.289	13%	0.131	S	C	.	.	H	α-helix	trans	-58.9	-44.7	179.5	-59.4	-25.6	0	0	0	112	N96 Q167 Y233 R433	N96-D170 PolarHBondContact ND2-OD2 3.04Å; Q167-D170 HydrophobicContact CB-CB 4.42Å; Q167-D170 PolarHBondContact O-N 3.15Å; D170-Y233 WeakPolarHBondContact O-CB 3.36Å; D170-R433 PolarHBondContact O-NH1 3.24Å
171	F	94.9	Very high	93.2	Very high	1 Å²	1	24.4 Å²	24.4	0%	0.004	13%	0.128	C	C	.	.	H	α-helix	trans	-77.4	-48.5	-174.3	-179.6	-134	0	0	0	113.5	L89 N91 H166 Q167 I168 D169 Y212 L232 Y233 L234 S256	L89-F171 HydrophobicContact CB-CE1 3.75Å; L89-F171 HydrophobicContact CB-CZ 4.27Å; N91-F171 HydrophobicContact CB-CD2 4.1Å; N91-F171 HydrophobicContact CB-CE2 3.72Å; N91-F171 HydrophobicContact CB-CZ 4.14Å; H166-F171 HydrophobicContact CB-CB 4.05Å; H166-F171 HydrophobicContact CB-CG 4.5Å; Q167-F171 WeakPolarHBondContact O-CB 3.44Å; Q167-F171 PolarHBondContact O-N 2.87Å; I168-F171 PolarHBondContact O-N 2.9Å; D169-F171 VanDerWaalsContact C-N 3.33Å; D169-F171 PolarHBondContact O-N 3.41Å; F171-Y212 HydrophobicContact CD1-CD2 4.05Å; F171-L232 HydrophobicContact CE1-CD1 4.5Å; F171-L232 HydrophobicContact CE2-CB 4.14Å; F171-L232 HydrophobicContact CE2-CD1 4.09Å; F171-L232 HydrophobicContact CZ-CD1 3.8Å; F171-L232 CarbonylContact O-C 3.59Å; F171-L232 WeakPolarHBondContact O-CA 3.18Å; F171-Y233 WeakPolarHBondContact CD2-O 3.33Å; F171-Y233 PolarHBondContact O-N 3.1Å; F171-L234 HydrophobicContact CE2-CD2 4.29Å; F171-S256 WeakPolarHBondContact CZ-OG 3.27Å
172	I	95.1	Very high	93.1	Very high	8 Å²	8	29.6 Å²	29.6	4%	0.041	15%	0.147	C	C	.	.	B	Isolated β-bridge	trans	-103.5	109.9	179.6	-53.7	178.4	0	0	0	107.7	L89 I168 D169 P174 L214 M230 L232	L89-I172 HydrophobicContact CD1-CD1 3.9Å; L89-I172 HydrophobicContact CD1-CG1 4.37Å; I168-I172 HydrophobicContact CG1-CD1 4.27Å; I168-I172 PolarHBondContact O-N 3.4Å; D169-I172 VanDerWaalsContact O-O 3.05Å; I172-P174 WeakPolarHBondContact O-CD 3.32Å; I172-P174 VanDerWaalsContact O-N 3.13Å; I172-L214 HydrophobicContact CD1-CD1 4.39Å; I172-L214 HydrophobicContact CD1-CD2 3.87Å; I172-L214 HydrophobicContact CD1-CG 4.38Å; I172-M230 HydrophobicContact CG2-CB 4.43Å; I172-M230 HydrophobicContact CG2-SD 4.4Å; I172-L232 HydrophobicContact CB-CD2 4.26Å; I172-L232 HydrophobicContact CG1-CD2 3.83Å; I172-L232 HydrophobicContact CG2-CD2 4.29Å
173	I	94.3	Very high	93	Very high	1 Å²	1	31.4 Å²	31.4	1%	0.005	16%	0.156	C	C	.	.			trans	-70.6	111.2	-175.2	-51.1	-180	0	0	0	109.9	I175 F176 C177 I231 L430 F471	I173-I175 VanDerWaalsContact C-N 3.29Å; I173-I175 PolarHBondContact O-N 3.03Å; I173-F176 HydrophobicContact CB-CD2 4.01Å; I173-F176 HydrophobicContact CD1-CD2 4.17Å; I173-F176 HydrophobicContact CG2-CD2 3.58Å; I173-F176 HydrophobicContact CG2-CE2 4.1Å; I173-F176 PolarHBondContact O-N 3.35Å; I173-F176 VanDerWaalsContact O-N 3.1Å; I173-C177 PolarHBondContact O-N 3.05Å; I173-I231 HydrophobicContact CD1-CB 4.17Å; I173-I231 HydrophobicContact CD1-CG2 3.62Å; I173-I231 HydrophobicContact CG1-CG2 4.44Å; I173-I231 WeakPolarHBondContact CG1-O 3.48Å; I173-I231 PolarHBondContact N-O 3.3Å; I173-L430 HydrophobicContact CD1-CD1 4.21Å; I173-L430 HydrophobicContact CD1-CD2 4.04Å; I173-L430 HydrophobicContact CG2-CD2 3.78Å; I173-F471 HydrophobicContact CD1-CD1 3.73Å; I173-F471 HydrophobicContact CD1-CE1 3.47Å; I173-F471 VanDerWaalsContact CD1-CE1 3.47Å
174	P	92.4	Very high	92.9	Very high	56 Å²	56	39.8 Å²	39.8	36%	0.364	19%	0.192	S	C	.	.	G	3₁₀ helix	trans	-62.5	-35.2	-169.4	-25.8	36.5	0	0	0	113.4	I172 F176 C177 R433	I172-P174 WeakPolarHBondContact O-CD 3.32Å; I172-P174 VanDerWaalsContact O-N 3.13Å; P174-F176 PolarHBondContact O-N 3.4Å; P174-C177 PolarHBondContact O-N 3.4Å; P174-R433 VanDerWaalsContact CD-NH2 3.33Å
175	I	92.6	Very high	92.6	Very high	85 Å²	85	43.7 Å²	43.7	44%	0.436	23%	0.233	S	C	.	.	G	3₁₀ helix	trans	-61.5	-30	-178.9	-59.8	171.2	0	0	0	111.8	I173	I173-I175 VanDerWaalsContact C-N 3.29Å; I173-I175 PolarHBondContact O-N 3.03Å
176	F	94.5	Very high	92.2	Very high	28 Å²	28	45.2 Å²	45.2	12%	0.123	25%	0.249	C	C	.	.	G	3₁₀ helix	trans	-102.8	2.7	-177.5	-59.9	-55.1	0	0	0	113.7	I173 P174 E178 M230 I231 Y426 Q429 L430	I173-F176 HydrophobicContact CB-CD2 4.01Å; I173-F176 HydrophobicContact CD1-CD2 4.17Å; I173-F176 HydrophobicContact CG2-CD2 3.58Å; I173-F176 HydrophobicContact CG2-CE2 4.1Å; I173-F176 PolarHBondContact O-N 3.35Å; I173-F176 VanDerWaalsContact O-N 3.1Å; P174-F176 PolarHBondContact O-N 3.4Å; F176-E178 PolarHBondContact O-N 2.61Å; F176-M230 WeakPolarHBondContact O-CA 3.44Å; F176-I231 HydrophobicContact CB-CB 3.97Å; F176-I231 HydrophobicContact CB-CD1 3.89Å; F176-I231 HydrophobicContact CB-CG1 3.88Å; F176-I231 HydrophobicContact CD1-CD1 4.21Å; F176-I231 HydrophobicContact CD2-CB 4.11Å; F176-I231 HydrophobicContact CD2-CD1 3.68Å; F176-I231 HydrophobicContact CD2-CG1 4.29Å; F176-I231 HydrophobicContact CE2-CD1 4.25Å; F176-I231 HydrophobicContact CG-CB 4.37Å; F176-I231 HydrophobicContact CG-CD1 3.67Å; F176-I231 HydrophobicContact CG-CG1 4.21Å; F176-Y426 HydrophobicContact CE1-CD1 4.09Å; F176-Y426 HydrophobicContact CE1-CE1 4.26Å; F176-Y426 HydrophobicContact CE2-CD1 4.24Å; F176-Y426 AromaticContact CZ-CD1 3.76Å; F176-Y426 HydrophobicContact CZ-CD1 3.76Å; F176-Y426 HydrophobicContact CZ-CE1 4.36Å; F176-Q429 VanDerWaalsContact CE1-OE1 3.3Å; F176-Q429 HydrophobicContact CZ-CB 4.01Å; F176-L430 HydrophobicContact CE2-CD1 4.12Å; F176-L430 HydrophobicContact CE2-CD2 3.92Å; F176-L430 HydrophobicContact CE2-CG 4.01Å
177	C	96.6	Very high	92.1	Very high	5 Å²	5	50.7 Å²	50.7	3%	0.034	28%	0.276	C	S	.	.			trans	-85	110.3	175.9	-167	0	0	0	0	109.8	I173 P174 K192 C193 S229 M230	I173-C177 PolarHBondContact O-N 3.05Å; P174-C177 PolarHBondContact O-N 3.4Å; C177-K192 WeakPolarHBondContact O-CA 3.33Å; C177-C193 VanDerWaalsContact CA-SG 3.59Å; C177-C193 HydrophobicContact CB-CB 3.67Å; C177-C193 WeakPolarHBondContact CB-SG 3.46Å; C177-C193 PolarHBondContact O-N 2.66Å; C177-C193 PolarHBondContact O-SG 2.87Å; C177-C193 WeakPolarHBondContact SG-CB 3.18Å; C177-C193 CovalentContact SG-SG 2.03Å; C177-C193 PolarHBondContact SG-SG 3.19Å; C177-S229 CarbonylContact C-O 3.53Å; C177-S229 WeakPolarHBondContact CA-O 3.05Å; C177-M230 HydrophobicContact CB-CB 4.38Å
178	E	96.7	Very high	92.2	Very high	66 Å²	66	54.6 Å²	54.6	31%	0.308	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	136.5	-177.9	-63.5	-175.6	172.7	0	0	111.6	F176 K190 R191 S229	F176-E178 PolarHBondContact O-N 2.61Å; E178-K190 IonicContact OE2-NZ 3.54Å; E178-R191 WeakPolarHBondContact CA-O 3.36Å; E178-S229 PolarHBondContact N-O 3.46Å; E178-S229 PolarHBondContact O-N 2.92Å
179	V	96.3	Very high	92.2	Very high	0 Å²	0	56.4 Å²	56.4	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	134.8	167.9	65.5	0	0	0	0	109.9	K190 R191 A196 I198 M216 A225 R227 L228	V179-K190 WeakPolarHBondContact O-CA 3.11Å; V179-R191 HydrophobicContact CG1-CB 4.31Å; V179-R191 PolarHBondContact N-O 2.8Å; V179-R191 PolarHBondContact O-N 3.27Å; V179-A196 HydrophobicContact CG1-CB 3.42Å; V179-A196 VanDerWaalsContact CG1-CB 3.42Å; V179-I198 HydrophobicContact CB-CD1 3.93Å; V179-I198 HydrophobicContact CG1-CD1 4.02Å; V179-I198 HydrophobicContact CG2-CD1 4.47Å; V179-M216 HydrophobicContact CG2-CE 3.9Å; V179-A225 HydrophobicContact CG2-CB 4.03Å; V179-R227 WeakPolarHBondContact CA-O 3.34Å; V179-L228 HydrophobicContact CB-CD1 4.2Å
180	T	95.8	Very high	92.5	Very high	10 Å²	10	58 Å²	58	6%	0.061	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	124.7	172.4	-49.8	0	0	0	0	109.3	L188 M189 K190 V226 R227	T180-L188 HydrophobicContact CG2-CB 3.92Å; T180-L188 HydrophobicContact CG2-CD2 4.37Å; T180-M189 CarbonylContact C-O 3.54Å; T180-M189 WeakPolarHBondContact CA-O 3.43Å; T180-K190 HydrophobicContact CG2-CG 4.24Å; T180-V226 HydrophobicContact CG2-CG2 4.05Å; T180-V226 WeakPolarHBondContact O-CG2 3.24Å; T180-V226 PolarHBondContact O-N 3.38Å; T180-R227 PolarHBondContact N-O 3.49Å; T180-R227 PolarHBondContact O-N 2.91Å
181	T	94.3	Very high	92.8	Very high	0 Å²	0	57.7 Å²	57.7	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	150.8	172.3	63.5	0	0	0	0	110.8	E183 L188 M189 R191 I221 N224	T181-E183 PolarHBondContact OG1-OE1 3.03Å; T181-L188 WeakPolarHBondContact O-CA 3.25Å; T181-M189 PolarHBondContact N-O 3.34Å; T181-M189 PolarHBondContact O-N 3.07Å; T181-R191 PolarHBondContact OG1-NH1 2.96Å; T181-I221 HydrophobicContact CG2-CB 4.5Å; T181-I221 HydrophobicContact CG2-CG2 3.91Å; T181-N224 CarbonylContact C-O 3.56Å; T181-N224 VanDerWaalsContact CA-O 3.27Å; T181-N224 WeakPolarHBondContact CA-O 3.33Å
182	R	92.3	Very high	92.8	Very high	109 Å²	109	62.3 Å²	62.3	41%	0.411	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	107.6	170.5	-172.8	170.3	178	-175.3	-1.3	109.6	L188 N224 V226 F481	R182-L188 HydrophobicContact CB-CD2 4.05Å; R182-L188 HydrophobicContact CG-CD2 4.18Å; R182-N224 PolarHBondContact N-O 2.99Å; R182-V226 HydrophobicContact CB-CG1 3.81Å; R182-F481 HydrophobicContact CB-CE1 4.49Å; R182-F481 HydrophobicContact CB-CZ 4.2Å; R182-F481 HydrophobicContact CG-CZ 4.23Å
183	E	88.5	Confident	92.8	Very high	40 Å²	40	62.4 Å²	62.4	19%	0.187	33%	0.325	C	S	.	.			trans	-87.7	175.7	-179.3	-58.1	-63.6	166.5	0	0	111.5	T181 G185 G186 I187 M189 R191 H220	T181-E183 PolarHBondContact OG1-OE1 3.03Å; E183-G185 PolarHBondContact O-N 3.26Å; E183-G186 PolarHBondContact O-N 2.72Å; E183-I187 PolarHBondContact N-O 3.32Å; E183-M189 HydrophobicContact CG-CB 3.94Å; E183-R191 IonicContact OE1-CZ 3.3Å; E183-R191 IonicContact OE1-NH1 2.91Å; E183-R191 PolarHBondContact OE1-NH1 3.07Å; E183-R191 IonicContact OE1-NH2 2.67Å; E183-R191 PolarHBondContact OE1-NH2 3.35Å; E183-H220 IonicContact OE1-CE1 2.62Å; E183-H220 IonicContact OE2-CE1 3.17Å; E183-H220 PolarHBondContact OE2-CE1 3.32Å; E183-H220 VanDerWaalsContact OE2-CE1 3.29Å; E183-H220 IonicContact OE2-NE2 3.07Å
184	K	85.4	Confident	92.7	Very high	198 Å²	198	70.5 Å²	70.5	86%	0.861	36%	0.363	S	S	*	.	G	3₁₀ helix	trans	-52.7	139.8	175.7	-69.2	-178.4	-179.2	175.3	0	111.1	G186	K184-G186 VanDerWaalsContact C-N 3.26Å; K184-G186 PolarHBondContact O-N 2.97Å
185	G	84.8	Confident	92.6	Very high	85 Å²	85	74.1 Å²	74.1	88%	0.876	38%	0.375	S	S	*	.	G	3₁₀ helix	trans	81.6	-0.4	-174.4	0	0	0	0	0	114.3	E183 I187	E183-G185 PolarHBondContact O-N 3.26Å; G185-I187 VanDerWaalsContact C-N 3.33Å
186	G	85.4	Confident	92.6	Very high	32 Å²	32	70.3 Å²	70.3	33%	0.33	36%	0.356	S	S	.	.	G	3₁₀ helix	trans	80.9	13.9	-179.1	0	0	0	0	0	113.9	E183 K184	E183-G186 PolarHBondContact O-N 2.72Å; K184-G186 VanDerWaalsContact C-N 3.26Å; K184-G186 PolarHBondContact O-N 2.97Å
187	I	91.2	Very high	92.4	Very high	115 Å²	115	70.7 Å²	70.7	59%	0.59	37%	0.368	S	S	*	.			trans	-69.5	129.5	177.1	-59.6	171.6	0	0	0	108.5	E183 G185	E183-I187 PolarHBondContact N-O 3.32Å; G185-I187 VanDerWaalsContact C-N 3.33Å
188	L	93.2	Very high	92.2	Very high	111 Å²	111	71.3 Å²	71.3	58%	0.581	37%	0.371	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.7	120.4	173.5	-61.8	-179	0	0	0	109	T180 T181 R182 V226	T180-L188 HydrophobicContact CG2-CB 3.92Å; T180-L188 HydrophobicContact CG2-CD2 4.37Å; T181-L188 WeakPolarHBondContact O-CA 3.25Å; R182-L188 HydrophobicContact CB-CD2 4.05Å; R182-L188 HydrophobicContact CG-CD2 4.18Å; L188-V226 HydrophobicContact CD2-CG2 4.02Å
189	M	94.2	Very high	91.8	Very high	87 Å²	87	72.7 Å²	72.7	43%	0.429	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	121.5	177.5	-173.4	167.6	177.9	0	0	109.7	T180 T181 E183 R191	T180-M189 CarbonylContact C-O 3.54Å; T180-M189 WeakPolarHBondContact CA-O 3.43Å; T181-M189 PolarHBondContact N-O 3.34Å; T181-M189 PolarHBondContact O-N 3.07Å; E183-M189 HydrophobicContact CG-CB 3.94Å; M189-R191 HydrophobicContact CE-CG 4.37Å; M189-R191 HydrophobicContact CG-CG 4.47Å; M189-R191 PolarHBondContact SD-NH2 3.31Å
190	K	95.3	Very high	91.5	Very high	127 Å²	127	74 Å²	74	55%	0.552	39%	0.39	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91	138.6	173.8	-64.8	-172.8	169.6	-160.3	0	110.2	E178 V179 T180	E178-K190 IonicContact OE2-NZ 3.54Å; V179-K190 WeakPolarHBondContact O-CA 3.11Å; T180-K190 HydrophobicContact CG2-CG 4.24Å
191	R	95	Very high	91.2	Very high	47 Å²	47	75.7 Å²	75.7	18%	0.177	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	148.9	173.5	-61.5	-176.5	-170.7	81.4	-8.7	109	E178 V179 T181 E183 M189 A196	E178-R191 WeakPolarHBondContact CA-O 3.36Å; V179-R191 HydrophobicContact CG1-CB 4.31Å; V179-R191 PolarHBondContact N-O 2.8Å; V179-R191 PolarHBondContact O-N 3.27Å; T181-R191 PolarHBondContact OG1-NH1 2.96Å; E183-R191 IonicContact OE1-CZ 3.3Å; E183-R191 IonicContact OE1-NH1 2.91Å; E183-R191 PolarHBondContact OE1-NH1 3.07Å; E183-R191 IonicContact OE1-NH2 2.67Å; E183-R191 PolarHBondContact OE1-NH2 3.35Å; M189-R191 HydrophobicContact CE-CG 4.37Å; M189-R191 HydrophobicContact CG-CG 4.47Å; M189-R191 PolarHBondContact SD-NH2 3.31Å; R191-A196 HydrophobicContact CB-CB 4.35Å
192	K	95.1	Very high	91.1	Very high	99 Å²	99	76.8 Å²	76.8	43%	0.43	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.4	152.1	169.4	-65.7	-178.1	177.2	178.4	0	109.7	C177 E194 E195 A196	C177-K192 WeakPolarHBondContact O-CA 3.33Å; K192-E194 VanDerWaalsContact C-N 3.27Å; K192-E194 PolarHBondContact O-N 3.22Å; K192-E195 HydrophobicContact CB-CB 4.4Å; K192-E195 HydrophobicContact CB-CG 4.09Å; K192-E195 PolarHBondContact N-OE2 3.19Å; K192-E195 PolarHBondContact O-N 3.26Å; K192-A196 WeakPolarHBondContact O-CB 3.36Å; K192-A196 PolarHBondContact O-N 2.79Å
193	C	94.6	Very high	91.1	Very high	10 Å²	10	72.4 Å²	72.4	7%	0.068	39%	0.388	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.8	-40.1	-179.6	-70.3	0	0	0	0	112.7	C177 A196 G197 I198	C177-C193 VanDerWaalsContact CA-SG 3.59Å; C177-C193 HydrophobicContact CB-CB 3.67Å; C177-C193 WeakPolarHBondContact CB-SG 3.46Å; C177-C193 PolarHBondContact O-N 2.66Å; C177-C193 PolarHBondContact O-SG 2.87Å; C177-C193 WeakPolarHBondContact SG-CB 3.18Å; C177-C193 CovalentContact SG-SG 2.03Å; C177-C193 PolarHBondContact SG-SG 3.19Å; C193-A196 PolarHBondContact O-N 3.26Å; C193-G197 PolarHBondContact O-N 2.63Å; C193-I198 HydrophobicContact CB-CB 4.1Å; C193-I198 HydrophobicContact CB-CD1 4.13Å; C193-I198 HydrophobicContact CB-CG1 4.46Å; C193-I198 WeakPolarHBondContact O-CB 3.35Å; C193-I198 PolarHBondContact O-N 3.31Å
194	E	91.9	Very high	91.3	Very high	170 Å²	170	71.7 Å²	71.7	79%	0.794	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.7	-48.3	176	-172.7	-179.4	-176.6	0	0	111.9	K192 A196 G197	K192-E194 VanDerWaalsContact C-N 3.27Å; K192-E194 PolarHBondContact O-N 3.22Å; E194-A196 PolarHBondContact O-N 3.38Å; E194-G197 PolarHBondContact O-N 3Å
195	E	91.9	Very high	91.6	Very high	132 Å²	132	63.2 Å²	63.2	62%	0.617	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.3	-30.3	177.3	-64.6	169	-175.8	0	0	112.5	K192 G197	K192-E195 HydrophobicContact CB-CB 4.4Å; K192-E195 HydrophobicContact CB-CG 4.09Å; K192-E195 PolarHBondContact N-OE2 3.19Å; K192-E195 PolarHBondContact O-N 3.26Å; E195-G197 VanDerWaalsContact C-N 3.28Å
196	A	91.7	Very high	92	Very high	5 Å²	5	60.4 Å²	60.4	4%	0.041	31%	0.313	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.3	-4.4	177	0	0	0	0	0	113.6	V179 R191 K192 C193 E194 I198 I221	V179-A196 HydrophobicContact CG1-CB 3.42Å; V179-A196 VanDerWaalsContact CG1-CB 3.42Å; R191-A196 HydrophobicContact CB-CB 4.35Å; K192-A196 WeakPolarHBondContact O-CB 3.36Å; K192-A196 PolarHBondContact O-N 2.79Å; C193-A196 PolarHBondContact O-N 3.26Å; E194-A196 PolarHBondContact O-N 3.38Å; A196-I198 VanDerWaalsContact C-N 3.31Å; A196-I198 HydrophobicContact CB-CD1 4.29Å; A196-I198 HydrophobicContact CB-CG1 4.01Å; A196-I221 HydrophobicContact CB-CD1 4.07Å; A196-I221 HydrophobicContact CB-CG2 4.47Å; A196-I221 WeakPolarHBondContact O-CD1 3.29Å
197	G	90.7	Very high	92.4	Very high	36 Å²	36	61.1 Å²	61.1	37%	0.371	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	68.6	28.5	-177	0	0	0	0	0	113.3	C193 E194 E195 Q199	C193-G197 PolarHBondContact O-N 2.63Å; E194-G197 PolarHBondContact O-N 3Å; E195-G197 VanDerWaalsContact C-N 3.28Å; G197-Q199 PolarHBondContact O-N 3.16Å
198	I	91.9	Very high	92.5	Very high	19 Å²	19	55.8 Å²	55.8	10%	0.097	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	118	174.9	-57.9	-176.9	0	0	0	108.1	V179 C193 A196 L214 S215 M216 L228	V179-I198 HydrophobicContact CB-CD1 3.93Å; V179-I198 HydrophobicContact CG1-CD1 4.02Å; V179-I198 HydrophobicContact CG2-CD1 4.47Å; C193-I198 HydrophobicContact CB-CB 4.1Å; C193-I198 HydrophobicContact CB-CD1 4.13Å; C193-I198 HydrophobicContact CB-CG1 4.46Å; C193-I198 WeakPolarHBondContact O-CB 3.35Å; C193-I198 PolarHBondContact O-N 3.31Å; A196-I198 VanDerWaalsContact C-N 3.31Å; A196-I198 HydrophobicContact CB-CD1 4.29Å; A196-I198 HydrophobicContact CB-CG1 4.01Å; I198-L214 HydrophobicContact CG2-CB 4.02Å; I198-L214 HydrophobicContact CG2-CD2 4.29Å; I198-S215 WeakPolarHBondContact CA-O 3.36Å; I198-M216 HydrophobicContact CD1-CE 3.9Å; I198-M216 HydrophobicContact CD1-CG 4.26Å; I198-M216 HydrophobicContact CG1-CG 4.12Å; I198-L228 HydrophobicContact CD1-CD1 4.01Å
199	Q	87.4	Confident	92.5	Very high	95 Å²	95	50.7 Å²	50.7	44%	0.444	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	138.4	179.1	-63.7	179.5	29.8	0	0	110.3	G197 S215 E217	G197-Q199 PolarHBondContact O-N 3.16Å; Q199-S215 PolarHBondContact N-O 2.92Å; Q199-S215 VanDerWaalsContact N-O 3.08Å; Q199-S215 PolarHBondContact O-N 2.93Å; Q199-E217 PolarHBondContact NE2-OE2 3.41Å
200	G	90.1	Very high	92.6	Very high	26 Å²	26	46.6 Å²	46.6	27%	0.268	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	105	172.9	0	0	0	0	0	111.7	H202	G200-H202 PolarHBondContact O-N 3.49Å
201	L	90.4	Very high	92.6	Very high	46 Å²	46	40.6 Å²	40.6	24%	0.241	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	109.8	172.9	-63	174.5	0	0	0	109.1	T213	L201-T213 PolarHBondContact N-O 3.41Å; L201-T213 PolarHBondContact O-N 2.73Å
202	H	92.1	Very high	92.7	Very high	24 Å²	24	38.8 Å²	38.8	11%	0.111	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.3	136.5	175.5	174.5	-107.1	0	0	0	111.4	G200 N210 Y212 R324	G200-H202 PolarHBondContact O-N 3.49Å; H202-N210 PolarHBondContact NE2-OD1 2.78Å; H202-Y212 HydrophobicContact CB-CD1 4.27Å; H202-Y212 HydrophobicContact CB-CE1 3.99Å; H202-Y212 AromaticContact CD2-CE1 3.76Å; H202-R324 PolarHBondContact O-NH1 2.95Å
203	L	92	Very high	92.7	Very high	17 Å²	17	34.5 Å²	34.5	9%	0.089	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	134.3	172.3	175.9	67.9	0	0	0	108.1	T205 C211 Y266 P267 I269	L203-T205 HydrophobicContact CD2-CG2 4.48Å; L203-T205 HydrophobicContact CG-CG2 4.47Å; L203-C211 HydrophobicContact CB-CB 4.31Å; L203-C211 PolarHBondContact N-O 2.62Å; L203-C211 PolarHBondContact O-N 3.13Å; L203-Y266 HydrophobicContact CD1-CE2 3.66Å; L203-Y266 HydrophobicContact CD2-CE2 4.48Å; L203-P267 HydrophobicContact CD2-CG 3.55Å; L203-I269 HydrophobicContact CD2-CD1 3.75Å
204	I	92.1	Very high	92.7	Very high	25 Å²	25	34.5 Å²	34.5	13%	0.128	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	136.8	174.6	179.4	156.9	0	0	0	111.1	Y153 M158 A161 I162 S209	Y153-I204 HydrophobicContact CE2-CD1 3.9Å; Y153-I204 HydrophobicContact CE2-CG1 4.04Å; Y153-I204 WeakPolarHBondContact OH-CG1 3.48Å; M158-I204 HydrophobicContact CB-CD1 3.97Å; M158-I204 HydrophobicContact CG-CD1 4.14Å; M158-I204 VanDerWaalsContact O-CD1 3.27Å; M158-I204 WeakPolarHBondContact O-CD1 3.5Å; A161-I204 HydrophobicContact CB-CD1 3.79Å; I162-I204 HydrophobicContact CD1-CD1 4.04Å; I162-I204 HydrophobicContact CG1-CB 4.46Å; I162-I204 HydrophobicContact CG1-CD1 3.53Å; I162-I204 HydrophobicContact CG1-CG1 4.47Å; I204-S209 CarbonylContact C-O 3.5Å; I204-S209 WeakPolarHBondContact CA-O 3.43Å; I204-S209 WeakPolarHBondContact CG1-O 3.43Å
205	T	93.1	Very high	92.7	Very high	20 Å²	20	27 Å²	27	12%	0.123	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	153	171.2	69.3	0	0	0	0	110.1	L203 K207 Y208 S209 I269	L203-T205 HydrophobicContact CD2-CG2 4.48Å; L203-T205 HydrophobicContact CG-CG2 4.47Å; T205-K207 VanDerWaalsContact C-N 3.29Å; T205-K207 PolarHBondContact O-N 2.95Å; T205-Y208 WeakPolarHBondContact OG1-CB 3.34Å; T205-Y208 WeakPolarHBondContact OG1-CD2 3.3Å; T205-Y208 PolarHBondContact OG1-N 2.94Å; T205-Y208 VanDerWaalsContact OG1-N 3.16Å; T205-S209 PolarHBondContact N-O 3.23Å; T205-S209 WeakPolarHBondContact O-CA 3.15Å; T205-S209 PolarHBondContact O-N 3.07Å; T205-I269 HydrophobicContact CG2-CD1 3.54Å
206	Y	92.9	Very high	92.7	Very high	25 Å²	25	21.2 Å²	21.2	10%	0.098	12%	0.121	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-30.7	179	76.7	-86.1	0	0	0	113.1	D145 V149 A150 F351 L352	D145-Y206 HydrophobicContact CB-CE2 4.29Å; D145-Y206 WeakPolarHBondContact OD2-CE2 3.49Å; V149-Y206 WeakPolarHBondContact CG2-O 2.86Å; A150-Y206 HydrophobicContact CB-CD2 4.04Å; A150-Y206 HydrophobicContact CB-CE2 4.21Å; Y206-F351 AromaticContact CD1-CD2 3.41Å; Y206-F351 HydrophobicContact CD1-CD2 3.41Å; Y206-F351 VanDerWaalsContact CD1-CD2 3.41Å; Y206-F351 AromaticContact CD1-CE2 3.67Å; Y206-F351 HydrophobicContact CD1-CE2 3.67Å; Y206-F351 AromaticContact CD2-CD2 3.74Å; Y206-F351 HydrophobicContact CD2-CD2 3.74Å; Y206-F351 AromaticContact CD2-CE2 3.43Å; Y206-F351 HydrophobicContact CD2-CE2 3.43Å; Y206-F351 VanDerWaalsContact CD2-CE2 3.43Å; Y206-F351 HydrophobicContact CE1-CD2 4.01Å; Y206-F351 AromaticContact CE1-CE2 3.85Å; Y206-F351 HydrophobicContact CE1-CE2 3.85Å; Y206-F351 HydrophobicContact CE2-CD2 4.3Å; Y206-F351 AromaticContact CE2-CE2 3.62Å; Y206-F351 HydrophobicContact CE2-CE2 3.62Å; Y206-F351 AromaticContact CG-CD2 3.24Å; Y206-F351 HydrophobicContact CG-CD2 3.24Å; Y206-F351 AromaticContact CG-CE2 3.45Å; Y206-F351 HydrophobicContact CG-CE2 3.45Å; Y206-F351 VanDerWaalsContact CG-CE2 3.45Å; Y206-F351 HydrophobicContact CG-CG 4.42Å; Y206-F351 AromaticContact CZ-CE2 3.81Å; Y206-L352 HydrophobicContact CD1-CD2 3.95Å; Y206-L352 HydrophobicContact CE1-CD2 3.26Å
207	K	93.2	Very high	92.4	Very high	47 Å²	47	26.8 Å²	26.8	20%	0.204	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.4	-29.9	-171.3	-167.5	165.6	174	175.4	0	113.7	T205 E270	T205-K207 VanDerWaalsContact C-N 3.29Å; T205-K207 PolarHBondContact O-N 2.95Å; K207-E270 IonicContact NZ-OE1 2.92Å; K207-E270 IonicContact NZ-OE2 3.07Å; K207-E270 PolarHBondContact NZ-OE2 2.87Å
208	Y	94.1	Very high	92.4	Very high	3 Å²	3	28.9 Å²	28.9	1%	0.012	15%	0.149	C	C	.	.	T	Hydrogen-bonded Turn	trans	-119.5	1.1	-176.7	-47.5	-63.6	0	0	0	113	C90 N91 T205 N210 K257 I269 E270	C90-Y208 HydrophobicContact CB-CD1 4.41Å; C90-Y208 HydrophobicContact CB-CD2 3.97Å; C90-Y208 HydrophobicContact CB-CG 3.79Å; N91-Y208 WeakPolarHBondContact O-CB 3.16Å; N91-Y208 VanDerWaalsContact O-CD1 3.24Å; N91-Y208 WeakPolarHBondContact O-CD1 3.33Å; T205-Y208 WeakPolarHBondContact OG1-CB 3.34Å; T205-Y208 WeakPolarHBondContact OG1-CD2 3.3Å; T205-Y208 PolarHBondContact OG1-N 2.94Å; T205-Y208 VanDerWaalsContact OG1-N 3.16Å; Y208-N210 VanDerWaalsContact C-N 3.34Å; Y208-N210 PolarHBondContact O-N 3.25Å; Y208-K257 HydrophobicContact CE1-CD 4.08Å; Y208-K257 HydrophobicContact CE2-CD 4.34Å; Y208-K257 WeakPolarHBondContact OH-CD 3.22Å; Y208-K257 WeakPolarHBondContact OH-CE 3.45Å; Y208-K257 PolarHBondContact OH-NZ 3.16Å; Y208-I269 HydrophobicContact CD2-CG2 4.02Å; Y208-I269 HydrophobicContact CE2-CG2 3.49Å; Y208-I269 VanDerWaalsContact CE2-CG2 3.49Å; Y208-E270 WeakPolarHBondContact CE2-OE1 3.38Å; Y208-E270 VanDerWaalsContact CZ-OE1 3.31Å; Y208-E270 PolarHBondContact OH-OE1 3.07Å
209	S	93.6	Very high	92.3	Very high	5 Å²	5	31.6 Å²	31.6	4%	0.035	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	53.1	-87.6	-168.5	-57.1	0	0	0	0	112.4	P94 I204 T205	P94-S209 WeakPolarHBondContact O-CB 3.38Å; P94-S209 PolarHBondContact O-OG 3.12Å; I204-S209 CarbonylContact C-O 3.5Å; I204-S209 WeakPolarHBondContact CA-O 3.43Å; I204-S209 WeakPolarHBondContact CG1-O 3.43Å; T205-S209 PolarHBondContact N-O 3.23Å; T205-S209 WeakPolarHBondContact O-CA 3.15Å; T205-S209 PolarHBondContact O-N 3.07Å
210	N	95.1	Very high	92.5	Very high	1 Å²	1	31.7 Å²	31.7	1%	0.005	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	123.3	-176.5	-66.8	-23.2	0	0	0	111.7	I162 G165 H166 Q167 H202 Y208 Y212	I162-N210 WeakPolarHBondContact CA-OD1 3.33Å; I162-N210 PolarHBondContact O-ND2 3.38Å; G165-N210 PolarHBondContact O-ND2 3.29Å; H166-N210 WeakPolarHBondContact O-CB 3.41Å; H166-N210 PolarHBondContact O-ND2 2.82Å; Q167-N210 PolarHBondContact NE2-ND2 2.86Å; H202-N210 PolarHBondContact NE2-OD1 2.78Å; Y208-N210 VanDerWaalsContact C-N 3.34Å; Y208-N210 PolarHBondContact O-N 3.25Å; N210-Y212 HydrophobicContact CB-CE2 4.09Å
211	C	96.4	Very high	92.6	Very high	0 Å²	0	31 Å²	31	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	155.1	167.6	-61.3	0	0	0	0	110	T88 L89 C90 L203 I269	T88-C211 HydrophobicContact CG2-CB 4.14Å; L89-C211 CarbonylContact O-C 3.02Å; L89-C211 VanDerWaalsContact O-CA 3.25Å; L89-C211 WeakPolarHBondContact O-CA 3.29Å; L89-C211 WeakPolarHBondContact O-CB 3.12Å; C90-C211 HydrophobicContact CB-CB 4.12Å; C90-C211 WeakPolarHBondContact CB-SG 3.41Å; C90-C211 WeakPolarHBondContact SG-CB 3.42Å; C90-C211 CovalentContact SG-SG 2.03Å; C90-C211 PolarHBondContact SG-SG 2.86Å; L203-C211 HydrophobicContact CB-CB 4.31Å; L203-C211 PolarHBondContact N-O 2.62Å; L203-C211 PolarHBondContact O-N 3.13Å; C211-I269 HydrophobicContact CB-CD1 4.29Å
212	Y	96	Very high	92.6	Very high	10 Å²	10	29.1 Å²	29.1	4%	0.039	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	124.1	-177.4	-63.1	-74.9	0	0	0	111	T88 L89 H166 Q167 I168 F171 H202 N210	T88-Y212 CarbonylContact C-O 2.89Å; T88-Y212 WeakPolarHBondContact CA-O 3.46Å; L89-Y212 PolarHBondContact N-O 3.25Å; L89-Y212 PolarHBondContact O-N 2.68Å; H166-Y212 PolarHBondContact O-OH 3.04Å; Q167-Y212 VanDerWaalsContact CA-OH 3.32Å; Q167-Y212 WeakPolarHBondContact CA-OH 3.29Å; I168-Y212 HydrophobicContact CB-CD1 3.78Å; I168-Y212 HydrophobicContact CB-CD2 4.24Å; I168-Y212 HydrophobicContact CB-CE1 3.6Å; I168-Y212 HydrophobicContact CB-CE2 4.06Å; I168-Y212 HydrophobicContact CB-CG 4.1Å; I168-Y212 HydrophobicContact CD1-CD1 4.04Å; I168-Y212 HydrophobicContact CD1-CG 4.35Å; I168-Y212 HydrophobicContact CG1-CD1 4.03Å; I168-Y212 HydrophobicContact CG1-CD2 4.44Å; I168-Y212 HydrophobicContact CG1-CE1 4.36Å; I168-Y212 HydrophobicContact CG1-CG 4.07Å; I168-Y212 HydrophobicContact CG2-CE1 4.47Å; I168-Y212 PolarHBondContact N-OH 3.08Å; I168-Y212 VanDerWaalsContact N-OH 3.1Å; F171-Y212 HydrophobicContact CD1-CD2 4.05Å; H202-Y212 HydrophobicContact CB-CD1 4.27Å; H202-Y212 HydrophobicContact CB-CE1 3.99Å; H202-Y212 AromaticContact CD2-CE1 3.76Å; N210-Y212 HydrophobicContact CB-CE2 4.09Å
213	T	95.6	Very high	92.6	Very high	9 Å²	9	30.7 Å²	30.7	6%	0.055	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	112.5	173.9	-56	0	0	0	0	109.7	H86 I87 T88 L201 S215 H261	H86-T213 HydrophobicContact CB-CG2 3.78Å; I87-T213 CarbonylContact O-C 3.54Å; I87-T213 WeakPolarHBondContact O-CA 3.34Å; T88-T213 WeakPolarHBondContact CG2-OG1 3.26Å; T88-T213 PolarHBondContact OG1-OG1 2.75Å; L201-T213 PolarHBondContact N-O 3.41Å; L201-T213 PolarHBondContact O-N 2.73Å; T213-S215 PolarHBondContact O-N 3.35Å; T213-H261 WeakPolarHBondContact CG2-NE2 3.32Å
214	L	95.4	Very high	92.6	Very high	10 Å²	10	30.9 Å²	30.9	5%	0.052	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	109	177.5	-60.6	-179.4	0	0	0	109.5	I87 L89 I172 I198 L228 M230	I87-L214 PolarHBondContact O-N 2.86Å; L89-L214 HydrophobicContact CD1-CD1 4.18Å; I172-L214 HydrophobicContact CD1-CD1 4.39Å; I172-L214 HydrophobicContact CD1-CD2 3.87Å; I172-L214 HydrophobicContact CD1-CG 4.38Å; I198-L214 HydrophobicContact CG2-CB 4.02Å; I198-L214 HydrophobicContact CG2-CD2 4.29Å; L214-L228 HydrophobicContact CD1-CD2 3.95Å; L214-M230 HydrophobicContact CD1-CE 4.07Å; L214-M230 HydrophobicContact CD1-SD 3.58Å; L214-M230 VanDerWaalsContact CD1-SD 3.58Å
215	S	91.9	Very high	92.7	Very high	11 Å²	11	29.7 Å²	29.7	8%	0.077	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	131.9	-178.6	-179.9	0	0	0	0	110.4	H86 I198 Q199 T213	H86-S215 PolarHBondContact CE1-OG 2.96Å; I198-S215 WeakPolarHBondContact CA-O 3.36Å; Q199-S215 PolarHBondContact N-O 2.92Å; Q199-S215 VanDerWaalsContact N-O 3.08Å; Q199-S215 PolarHBondContact O-N 2.93Å; T213-S215 PolarHBondContact O-N 3.35Å
216	M	91.5	Very high	92.7	Very high	12 Å²	12	29.7 Å²	29.7	6%	0.059	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	88.4	175.5	-59.9	-173	-177.1	0	0	109.5	F84 V179 I198 N218 A225 L228	F84-M216 HydrophobicContact CB-SD 3.81Å; F84-M216 HydrophobicContact CD1-CE 3.37Å; F84-M216 HydrophobicContact CD1-SD 3.76Å; F84-M216 HydrophobicContact CE1-CE 3.63Å; F84-M216 HydrophobicContact CG-CE 3.97Å; F84-M216 HydrophobicContact CG-SD 3.93Å; F84-M216 HydrophobicContact CZ-CE 4.42Å; V179-M216 HydrophobicContact CG2-CE 3.9Å; I198-M216 HydrophobicContact CD1-CE 3.9Å; I198-M216 HydrophobicContact CD1-CG 4.26Å; I198-M216 HydrophobicContact CG1-CG 4.12Å; M216-N218 VanDerWaalsContact C-N 3.31Å; M216-N218 PolarHBondContact O-N 3.17Å; M216-A225 HydrophobicContact CE-CB 4.49Å; M216-A225 HydrophobicContact SD-CB 4.08Å; M216-L228 HydrophobicContact CE-CD1 4.23Å; M216-L228 HydrophobicContact CE-CD2 4.45Å
217	E	84.6	Confident	92.9	Very high	122 Å²	122	32.3 Å²	32.3	57%	0.57	16%	0.163	S	C	*	.			trans	-67.5	-31.7	-175.7	-63.3	-171.3	160.9	0	0	112.9	Q199 S219	Q199-E217 PolarHBondContact NE2-OE2 3.41Å; E217-S219 PolarHBondContact O-N 3.18Å
218	N	90.9	Very high	93	Very high	79 Å²	79	30 Å²	30	42%	0.422	15%	0.153	S	C	.	.			trans	-71.9	106	178.5	-173.5	-22.3	0	0	0	110.5	M216 H220 I221 S222	M216-N218 VanDerWaalsContact C-N 3.31Å; M216-N218 PolarHBondContact O-N 3.17Å; N218-H220 VanDerWaalsContact C-N 3.25Å; N218-H220 PolarHBondContact O-N 2.03Å; N218-H220 WeakPolarHBondContact OD1-CB 3.45Å; N218-H220 PolarHBondContact OD1-N 2.81Å; N218-I221 HydrophobicContact CB-CB 4.16Å; N218-I221 HydrophobicContact CB-CD1 4.01Å; N218-I221 HydrophobicContact CB-CG1 4.14Å; N218-I221 PolarHBondContact O-N 2.84Å; N218-S222 PolarHBondContact O-N 3.36Å
219	S	90.2	Very high	93.2	Very high	76 Å²	76	30.5 Å²	30.5	53%	0.531	16%	0.157	S	C	.	.	H	α-helix	trans	-52.3	-40	179.7	-178.3	0	0	0	0	113.1	E217 I221 S222 H223	E217-S219 PolarHBondContact O-N 3.18Å; S219-I221 PolarHBondContact O-N 3.43Å; S219-S222 PolarHBondContact O-N 3.45Å; S219-H223 WeakPolarHBondContact O-CB 3.47Å; S219-H223 PolarHBondContact O-N 3.37Å; S219-H223 PolarHBondContact O-ND1 3.35Å; S219-H223 PolarHBondContact OG-CE1 2.8Å; S219-H223 PolarHBondContact OG-ND1 2.88Å; S219-H223 VanDerWaalsContact OG-ND1 3.17Å
220	H	90.6	Very high	93.3	Very high	98 Å²	98	30.3 Å²	30.3	45%	0.454	16%	0.155	S	C	.	.	H	α-helix	trans	-64.6	-43.2	179	179.5	-89.7	0	0	0	112	E183 N218 N224	E183-H220 IonicContact OE1-CE1 2.62Å; E183-H220 IonicContact OE2-CE1 3.17Å; E183-H220 PolarHBondContact OE2-CE1 3.32Å; E183-H220 VanDerWaalsContact OE2-CE1 3.29Å; E183-H220 IonicContact OE2-NE2 3.07Å; N218-H220 VanDerWaalsContact C-N 3.25Å; N218-H220 PolarHBondContact O-N 2.03Å; N218-H220 WeakPolarHBondContact OD1-CB 3.45Å; N218-H220 PolarHBondContact OD1-N 2.81Å; H220-N224 PolarHBondContact CE1-ND2 3.45Å; H220-N224 PolarHBondContact NE2-ND2 3.2Å; H220-N224 WeakPolarHBondContact O-CB 3.18Å; H220-N224 PolarHBondContact O-N 3.01Å; H220-N224 PolarHBondContact O-ND2 3.03Å
221	I	91.9	Very high	93.4	Very high	11 Å²	11	30.4 Å²	30.4	6%	0.056	16%	0.156	C	C	.	.	H	α-helix	trans	-68.2	-47.5	178.6	-64.7	176.8	0	0	0	109.7	T181 A196 N218 S219 H223 N224 A225	T181-I221 HydrophobicContact CG2-CB 4.5Å; T181-I221 HydrophobicContact CG2-CG2 3.91Å; A196-I221 HydrophobicContact CB-CD1 4.07Å; A196-I221 HydrophobicContact CB-CG2 4.47Å; A196-I221 WeakPolarHBondContact O-CD1 3.29Å; N218-I221 HydrophobicContact CB-CB 4.16Å; N218-I221 HydrophobicContact CB-CD1 4.01Å; N218-I221 HydrophobicContact CB-CG1 4.14Å; N218-I221 PolarHBondContact O-N 2.84Å; S219-I221 PolarHBondContact O-N 3.43Å; I221-H223 PolarHBondContact O-N 3.09Å; I221-N224 CarbonylContact O-C 3.49Å; I221-N224 PolarHBondContact O-N 3.1Å; I221-A225 VanDerWaalsContact O-CB 3.29Å; I221-A225 WeakPolarHBondContact O-CB 3.41Å; I221-A225 PolarHBondContact O-N 3.44Å
222	S	92.3	Very high	93.5	Very high	6 Å²	6	30.4 Å²	30.4	4%	0.042	16%	0.156	C	C	.	.	H	α-helix	trans	-58.3	-45.6	-179.7	-179	0	0	0	0	112.4	A83 F84 N218 S219 N224 R478	A83-S222 WeakPolarHBondContact CA-OG 3.31Å; A83-S222 WeakPolarHBondContact CB-OG 3.19Å; F84-S222 WeakPolarHBondContact CB-O 3.16Å; F84-S222 PolarHBondContact N-O 3.4Å; F84-S222 PolarHBondContact N-OG 3.28Å; N218-S222 PolarHBondContact O-N 3.36Å; S219-S222 PolarHBondContact O-N 3.45Å; S222-N224 VanDerWaalsContact C-N 3.33Å; S222-N224 PolarHBondContact O-N 3.09Å; S222-R478 PolarHBondContact O-NH2 3.47Å
223	H	91.5	Very high	93.4	Very high	58 Å²	58	30.3 Å²	30.3	27%	0.269	16%	0.155	S	C	.	.	H	α-helix	trans	-70.6	-28.1	-180	-74.1	89.1	0	0	0	113.4	H81 A83 S219 I221 R478	H81-H223 HydrophobicContact CB-CB 3.99Å; H81-H223 PolarHBondContact O-CD2 3.09Å; A83-H223 PolarHBondContact N-CD2 2.99Å; S219-H223 WeakPolarHBondContact O-CB 3.47Å; S219-H223 PolarHBondContact O-N 3.37Å; S219-H223 PolarHBondContact O-ND1 3.35Å; S219-H223 PolarHBondContact OG-CE1 2.8Å; S219-H223 PolarHBondContact OG-ND1 2.88Å; S219-H223 VanDerWaalsContact OG-ND1 3.17Å; I221-H223 PolarHBondContact O-N 3.09Å; H223-R478 PolarHBondContact O-NH2 2.83Å
224	N	92	Very high	93.3	Very high	21 Å²	21	30.1 Å²	30.1	11%	0.112	15%	0.154	C	C	.	.	H	α-helix	trans	-100.6	-4.7	-177.5	-65.9	-22.1	0	0	0	114.1	T181 R182 H220 I221 S222 V226	T181-N224 CarbonylContact C-O 3.56Å; T181-N224 VanDerWaalsContact CA-O 3.27Å; T181-N224 WeakPolarHBondContact CA-O 3.33Å; R182-N224 PolarHBondContact N-O 2.99Å; H220-N224 PolarHBondContact CE1-ND2 3.45Å; H220-N224 PolarHBondContact NE2-ND2 3.2Å; H220-N224 WeakPolarHBondContact O-CB 3.18Å; H220-N224 PolarHBondContact O-N 3.01Å; H220-N224 PolarHBondContact O-ND2 3.03Å; I221-N224 CarbonylContact O-C 3.49Å; I221-N224 PolarHBondContact O-N 3.1Å; S222-N224 VanDerWaalsContact C-N 3.33Å; S222-N224 PolarHBondContact O-N 3.09Å; N224-V226 PolarHBondContact O-N 2.92Å
225	A	93.7	Very high	93.1	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.4	128.3	-179.5	0	0	0	0	0	111.1	F84 V179 M216 I221 R478	F84-A225 HydrophobicContact CB-CB 4.06Å; F84-A225 HydrophobicContact CD2-CB 3.66Å; F84-A225 HydrophobicContact CE2-CB 4.35Å; F84-A225 HydrophobicContact CG-CB 3.97Å; V179-A225 HydrophobicContact CG2-CB 4.03Å; M216-A225 HydrophobicContact CE-CB 4.49Å; M216-A225 HydrophobicContact SD-CB 4.08Å; I221-A225 VanDerWaalsContact O-CB 3.29Å; I221-A225 WeakPolarHBondContact O-CB 3.41Å; I221-A225 PolarHBondContact O-N 3.44Å; A225-R478 VanDerWaalsContact O-CZ 3.27Å; A225-R478 PolarHBondContact O-NE 2.98Å; A225-R478 VanDerWaalsContact O-NE 3.12Å; A225-R478 PolarHBondContact O-NH2 3.16Å
226	V	94.1	Very high	93	Very high	20 Å²	20	31.7 Å²	31.7	12%	0.121	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	-20.4	178.6	-66.3	0	0	0	0	112.5	T180 R182 L188 N224 R478 F481	T180-V226 HydrophobicContact CG2-CG2 4.05Å; T180-V226 WeakPolarHBondContact O-CG2 3.24Å; T180-V226 PolarHBondContact O-N 3.38Å; R182-V226 HydrophobicContact CB-CG1 3.81Å; L188-V226 HydrophobicContact CD2-CG2 4.02Å; N224-V226 PolarHBondContact O-N 2.92Å; V226-R478 PolarHBondContact O-N 2.9Å; V226-F481 HydrophobicContact CG1-CB 4.24Å; V226-F481 HydrophobicContact CG1-CD1 3.76Å; V226-F481 HydrophobicContact CG1-CD2 4.48Å; V226-F481 HydrophobicContact CG1-CE1 4.33Å; V226-F481 HydrophobicContact CG1-CG 3.88Å
227	R	95.8	Very high	92.5	Very high	79 Å²	79	33 Å²	33	30%	0.298	17%	0.165	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.5	137.7	-178.7	176.9	176	-179.4	178.8	-0.3	111.8	V179 T180 D475 V476 N477	V179-R227 WeakPolarHBondContact CA-O 3.34Å; T180-R227 PolarHBondContact N-O 3.49Å; T180-R227 PolarHBondContact O-N 2.91Å; R227-D475 WeakPolarHBondContact CG-OD1 3.48Å; R227-D475 IonicContact CZ-OD1 3.8Å; R227-D475 IonicContact CZ-OD2 3.65Å; R227-D475 IonicContact NE-OD1 3.94Å; R227-D475 PolarHBondContact NE-OD1 2.87Å; R227-D475 IonicContact NE-OD2 2.87Å; R227-D475 PolarHBondContact NE-OD2 2.98Å; R227-D475 VanDerWaalsContact NH2-CG 3.3Å; R227-D475 IonicContact NH2-OD1 3.5Å; R227-D475 PolarHBondContact NH2-OD1 3.33Å; R227-D475 IonicContact NH2-OD2 3.48Å; R227-D475 PolarHBondContact NH2-OD2 3.31Å; R227-V476 CarbonylContact C-O 3.51Å; R227-V476 VanDerWaalsContact CA-O 3.23Å; R227-V476 WeakPolarHBondContact CA-O 3.45Å; R227-N477 WeakPolarHBondContact CD-OD1 3.24Å; R227-N477 WeakPolarHBondContact CG-OD1 3.18Å
228	L	96.7	Very high	92.2	Very high	0 Å²	0	31 Å²	31	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	120.5	166.8	-179.4	70.7	0	0	0	109	F84 I87 V179 I198 L214 M216 M230 V476	F84-L228 HydrophobicContact CE1-CB 4.2Å; F84-L228 HydrophobicContact CE1-CD2 4.45Å; F84-L228 HydrophobicContact CZ-CB 3.95Å; I87-L228 HydrophobicContact CD1-CD2 3.45Å; I87-L228 VanDerWaalsContact CD1-CD2 3.45Å; V179-L228 HydrophobicContact CB-CD1 4.2Å; I198-L228 HydrophobicContact CD1-CD1 4.01Å; L214-L228 HydrophobicContact CD1-CD2 3.95Å; M216-L228 HydrophobicContact CE-CD1 4.23Å; M216-L228 HydrophobicContact CE-CD2 4.45Å; L228-M230 HydrophobicContact CD2-CE 4.1Å; L228-V476 HydrophobicContact CB-CB 4.43Å; L228-V476 PolarHBondContact N-O 3.4Å; L228-V476 PolarHBondContact O-N 2.89Å
229	S	97.3	Very high	91.5	Very high	13 Å²	13	31.1 Å²	31.1	9%	0.091	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	135.5	-178.5	-144.5	0	0	0	0	109.1	C177 E178 H473 V474	C177-S229 CarbonylContact C-O 3.53Å; C177-S229 WeakPolarHBondContact CA-O 3.05Å; E178-S229 PolarHBondContact N-O 3.46Å; E178-S229 PolarHBondContact O-N 2.92Å; S229-H473 PolarHBondContact OG-CE1 3.16Å; S229-H473 PolarHBondContact OG-NE2 3.39Å; S229-V474 CarbonylContact C-O 3.52Å; S229-V474 WeakPolarHBondContact CA-O 3.29Å
230	M	96.7	Very high	91	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.2	159.7	176.6	60.2	-162.1	146	0	0	111.8	I87 L89 I172 F176 C177 L214 L228 L232 H473 V474	I87-M230 HydrophobicContact CG2-CE 4.38Å; L89-M230 HydrophobicContact CD1-CE 3.58Å; L89-M230 HydrophobicContact CD1-SD 3.51Å; L89-M230 VanDerWaalsContact CD1-SD 3.51Å; L89-M230 HydrophobicContact CD2-CE 4.29Å; L89-M230 HydrophobicContact CG-CE 4.4Å; I172-M230 HydrophobicContact CG2-CB 4.43Å; I172-M230 HydrophobicContact CG2-SD 4.4Å; F176-M230 WeakPolarHBondContact O-CA 3.44Å; C177-M230 HydrophobicContact CB-CB 4.38Å; L214-M230 HydrophobicContact CD1-CE 4.07Å; L214-M230 HydrophobicContact CD1-SD 3.58Å; L214-M230 VanDerWaalsContact CD1-SD 3.58Å; L228-M230 HydrophobicContact CD2-CE 4.1Å; M230-L232 HydrophobicContact CG-CD2 4.19Å; M230-L232 HydrophobicContact SD-CD2 4.34Å; M230-H473 PolarHBondContact O-CD2 2.93Å; M230-V474 HydrophobicContact CE-CB 3.95Å; M230-V474 HydrophobicContact CE-CG1 3.73Å; M230-V474 HydrophobicContact CG-CB 3.91Å; M230-V474 PolarHBondContact N-O 3.5Å; M230-V474 PolarHBondContact O-N 3.47Å
231	I	96.9	Very high	90.5	Very high	4 Å²	4	35 Å²	35	2%	0.021	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	132.1	170.6	-64	177.5	0	0	0	108	I173 F176 W417 Y426 F471 L472 H473	I173-I231 HydrophobicContact CD1-CB 4.17Å; I173-I231 HydrophobicContact CD1-CG2 3.62Å; I173-I231 HydrophobicContact CG1-CG2 4.44Å; I173-I231 WeakPolarHBondContact CG1-O 3.48Å; I173-I231 PolarHBondContact N-O 3.3Å; F176-I231 HydrophobicContact CB-CB 3.97Å; F176-I231 HydrophobicContact CB-CD1 3.89Å; F176-I231 HydrophobicContact CB-CG1 3.88Å; F176-I231 HydrophobicContact CD1-CD1 4.21Å; F176-I231 HydrophobicContact CD2-CB 4.11Å; F176-I231 HydrophobicContact CD2-CD1 3.68Å; F176-I231 HydrophobicContact CD2-CG1 4.29Å; F176-I231 HydrophobicContact CE2-CD1 4.25Å; F176-I231 HydrophobicContact CG-CB 4.37Å; F176-I231 HydrophobicContact CG-CD1 3.67Å; F176-I231 HydrophobicContact CG-CG1 4.21Å; I231-W417 HydrophobicContact CD1-CH2 3.74Å; I231-W417 HydrophobicContact CD1-CZ2 3.57Å; I231-W417 HydrophobicContact CG1-CH2 4.09Å; I231-W417 HydrophobicContact CG1-CZ2 4.16Å; I231-W417 HydrophobicContact CG2-CH2 4.02Å; I231-Y426 HydrophobicContact CD1-CD1 4.12Å; I231-Y426 HydrophobicContact CD1-CE1 3.7Å; I231-F471 HydrophobicContact CG2-CB 4.36Å; I231-F471 HydrophobicContact CG2-CD1 3.95Å; I231-L472 WeakPolarHBondContact CA-O 3.47Å; I231-H473 HydrophobicContact CG1-CB 4.48Å
232	L	97.1	Very high	90	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	143.2	175.8	-49.6	-173.5	0	0	0	110.2	L89 F171 I172 M230 L276 F471 L472 V474	L89-L232 HydrophobicContact CD1-CD1 4.37Å; L89-L232 HydrophobicContact CD1-CD2 4.09Å; L89-L232 HydrophobicContact CD2-CD1 4.15Å; F171-L232 HydrophobicContact CE1-CD1 4.5Å; F171-L232 HydrophobicContact CE2-CB 4.14Å; F171-L232 HydrophobicContact CE2-CD1 4.09Å; F171-L232 HydrophobicContact CZ-CD1 3.8Å; F171-L232 CarbonylContact O-C 3.59Å; F171-L232 WeakPolarHBondContact O-CA 3.18Å; I172-L232 HydrophobicContact CB-CD2 4.26Å; I172-L232 HydrophobicContact CG1-CD2 3.83Å; I172-L232 HydrophobicContact CG2-CD2 4.29Å; M230-L232 HydrophobicContact CG-CD2 4.19Å; M230-L232 HydrophobicContact SD-CD2 4.34Å; L232-L276 HydrophobicContact CD1-CD1 4.33Å; L232-F471 WeakPolarHBondContact O-CA 3.45Å; L232-L472 HydrophobicContact CB-CD1 3.89Å; L232-L472 HydrophobicContact CB-CG 4.12Å; L232-L472 HydrophobicContact CD1-CD1 3.72Å; L232-L472 HydrophobicContact CG-CD1 3.78Å; L232-L472 PolarHBondContact N-O 3.29Å; L232-L472 PolarHBondContact O-N 3.46Å; L232-L472 VanDerWaalsContact O-N 3.16Å; L232-V474 HydrophobicContact CD1-CG2 3.94Å; L232-V474 HydrophobicContact CG-CG2 4.11Å
233	Y	95.1	Very high	89.4	Confident	8 Å²	8	43.3 Å²	43.3	3%	0.031	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	118.6	171.7	176	-116.4	0	0	0	109.6	D170 F171 D235 F434 F440 N470 F471	D170-Y233 WeakPolarHBondContact O-CB 3.36Å; F171-Y233 WeakPolarHBondContact CD2-O 3.33Å; F171-Y233 PolarHBondContact O-N 3.1Å; Y233-D235 HydrophobicContact CD1-CB 4.11Å; Y233-D235 HydrophobicContact CE1-CB 3.46Å; Y233-D235 VanDerWaalsContact CE1-CB 3.46Å; Y233-D235 WeakPolarHBondContact CE1-OD1 3.4Å; Y233-D235 PolarHBondContact OH-OD1 2.83Å; Y233-F434 AromaticContact CD1-CE1 3.61Å; Y233-F434 HydrophobicContact CD1-CE1 3.61Å; Y233-F434 HydrophobicContact CD1-CZ 4.01Å; Y233-F434 HydrophobicContact CD2-CE1 4.11Å; Y233-F434 AromaticContact CD2-CZ 3.91Å; Y233-F434 HydrophobicContact CD2-CZ 3.91Å; Y233-F434 HydrophobicContact CE1-CD1 4.18Å; Y233-F434 AromaticContact CE1-CE1 3.46Å; Y233-F434 HydrophobicContact CE1-CE1 3.46Å; Y233-F434 VanDerWaalsContact CE1-CE1 3.46Å; Y233-F434 HydrophobicContact CE1-CZ 4.22Å; Y233-F434 AromaticContact CE2-CE1 3.96Å; Y233-F434 HydrophobicContact CE2-CE1 3.96Å; Y233-F434 HydrophobicContact CE2-CZ 4.09Å; Y233-F434 AromaticContact CG-CE1 3.94Å; Y233-F434 HydrophobicContact CG-CE1 3.94Å; Y233-F434 AromaticContact CG-CZ 3.86Å; Y233-F434 HydrophobicContact CG-CZ 3.86Å; Y233-F434 AromaticContact CZ-CE1 3.65Å; Y233-F440 HydrophobicContact CE2-CE2 4.06Å; Y233-F440 AromaticContact CE2-CZ 3.87Å; Y233-F440 HydrophobicContact CE2-CZ 3.87Å; Y233-N470 WeakPolarHBondContact CA-O 3.42Å; Y233-N470 HydrophobicContact CD2-CB 4.2Å; Y233-N470 HydrophobicContact CE2-CB 3.88Å; Y233-F471 AromaticContact CD2-CD1 3.99Å; Y233-F471 HydrophobicContact CD2-CD1 3.99Å; Y233-F471 AromaticContact CD2-CE1 3.4Å; Y233-F471 HydrophobicContact CD2-CE1 3.4Å; Y233-F471 VanDerWaalsContact CD2-CE1 3.4Å; Y233-F471 HydrophobicContact CD2-CE2 4.13Å; Y233-F471 AromaticContact CD2-CZ 3.48Å; Y233-F471 HydrophobicContact CD2-CZ 3.48Å; Y233-F471 VanDerWaalsContact CD2-CZ 3.48Å; Y233-F471 HydrophobicContact CE2-CE1 4.34Å; Y233-F471 HydrophobicContact CE2-CE2 4.41Å; Y233-F471 AromaticContact CE2-CZ 3.98Å; Y233-F471 HydrophobicContact CE2-CZ 3.98Å; Y233-F471 AromaticContact CG-CE1 3.97Å; Y233-F471 HydrophobicContact CG-CE1 3.97Å; Y233-F471 HydrophobicContact CG-CZ 4.38Å
234	L	94.1	Very high	88.9	Confident	4 Å²	4	43.5 Å²	43.5	2%	0.021	21%	0.212	C	C	.	.			trans	-88.5	-20.1	-172.8	-58.3	-177.9	0	0	0	113.7	N91 F171 E236 P278 N470 L472	N91-L234 PolarHBondContact ND2-O 2.84Å; F171-L234 HydrophobicContact CE2-CD2 4.29Å; L234-E236 PolarHBondContact O-N 3.35Å; L234-P278 HydrophobicContact CD1-CB 3.79Å; L234-P278 HydrophobicContact CD1-CG 4.02Å; L234-N470 PolarHBondContact N-O 3.48Å; L234-L472 HydrophobicContact CD1-CD2 4.11Å; L234-L472 HydrophobicContact CD2-CD2 4Å; L234-L472 HydrophobicContact CD2-CG 4.48Å; L234-L472 HydrophobicContact CG-CD2 4.41Å
235	D	91	Very high	88.5	Confident	0 Å²	0	44.4 Å²	44.4	0%	0	22%	0.215	C	C	.	.			trans	53.6	47.3	-177.8	-164	51.2	0	0	0	113.5	N96 S97 Y233 E237 Y436	N96-D235 PolarHBondContact OD1-OD2 3.39Å; S97-D235 WeakPolarHBondContact CB-OD2 3.33Å; S97-D235 PolarHBondContact N-OD2 2.81Å; S97-D235 PolarHBondContact OG-OD1 2.85Å; S97-D235 PolarHBondContact OG-OD2 3.23Å; Y233-D235 HydrophobicContact CD1-CB 4.11Å; Y233-D235 HydrophobicContact CE1-CB 3.46Å; Y233-D235 VanDerWaalsContact CE1-CB 3.46Å; Y233-D235 WeakPolarHBondContact CE1-OD1 3.4Å; Y233-D235 PolarHBondContact OH-OD1 2.83Å; D235-E237 PolarHBondContact O-N 2.98Å; D235-E237 VanDerWaalsContact O-N 3.14Å; D235-Y436 PolarHBondContact OD1-OH 3.28Å
236	E	89.2	Confident	88.1	Confident	55 Å²	55	44.4 Å²	44.4	26%	0.257	22%	0.215	S	C	.	.			trans	-67.4	109.9	-176.8	-177.1	175.1	179.2	0	0	111.2	L234 E238 A254 K439 K469 N470	L234-E236 PolarHBondContact O-N 3.35Å; E236-E238 PolarHBondContact O-N 3.36Å; E236-A254 HydrophobicContact CG-CB 4.43Å; E236-K439 PolarHBondContact O-NZ 3.39Å; E236-K469 WeakPolarHBondContact OE2-CB 3.17Å; E236-N470 PolarHBondContact N-OD1 2.86Å
237	E	81.3	Confident	87.5	Confident	38 Å²	38	43.6 Å²	43.6	18%	0.178	21%	0.21	C	C	.	.			trans	-69.6	113.5	-179	-176.4	63.5	-89.6	0	0	111.8	S97 D235 D239 C242 T247	S97-E237 VanDerWaalsContact CB-OE2 3.27Å; S97-E237 WeakPolarHBondContact CB-OE2 3.38Å; D235-E237 PolarHBondContact O-N 2.98Å; D235-E237 VanDerWaalsContact O-N 3.14Å; E237-D239 VanDerWaalsContact OE1-CB 3.32Å; E237-D239 WeakPolarHBondContact OE1-CB 3.21Å; E237-D239 PolarHBondContact OE1-N 3.15Å; E237-C242 HydrophobicContact CG-CB 4.19Å; E237-T247 WeakPolarHBondContact CB-OG1 3.41Å
238	E	77.7	Confident	86.9	Confident	82 Å²	82	43.4 Å²	43.4	38%	0.383	21%	0.212	S	C	.	.			trans	-106.5	-11.4	175.5	-66	-171.8	134.6	0	0	112.4	E236 L240 K469	E236-E238 PolarHBondContact O-N 3.36Å; E238-L240 PolarHBondContact O-N 3.14Å; E238-K469 WeakPolarHBondContact OE1-CD 3.26Å; E238-K469 VanDerWaalsContact OE1-CE 3.29Å; E238-K469 WeakPolarHBondContact OE1-CE 3.47Å; E238-K469 IonicContact OE1-NZ 2.75Å; E238-K469 PolarHBondContact OE1-NZ 2.93Å
239	D	76.3	Confident	86.3	Confident	81 Å²	81	46.9 Å²	46.9	43%	0.433	23%	0.228	S	C	.	.			trans	-75	112.2	-177.9	-172.5	3.4	0	0	0	110.8	E237 N241 C242	E237-D239 VanDerWaalsContact OE1-CB 3.32Å; E237-D239 WeakPolarHBondContact OE1-CB 3.21Å; E237-D239 PolarHBondContact OE1-N 3.15Å; D239-N241 PolarHBondContact O-N 3.06Å; D239-N241 VanDerWaalsContact O-N 3.16Å; D239-N241 VanDerWaalsContact OD1-CB 3.27Å; D239-N241 WeakPolarHBondContact OD1-CB 3.21Å; D239-N241 PolarHBondContact OD1-N 2.88Å; D239-N241 PolarHBondContact OD1-ND2 3.45Å; D239-C242 WeakPolarHBondContact O-CB 3.36Å; D239-C242 PolarHBondContact O-N 3.27Å; D239-C242 VanDerWaalsContact O-N 3.16Å; D239-C242 PolarHBondContact O-SG 3.25Å
240	L	78.9	Confident	85.9	Confident	118 Å²	118	47 Å²	47	62%	0.618	23%	0.227	S	C	*	.	G	3₁₀ helix	trans	-66.6	-14.4	176.1	-63.9	176.9	0	0	0	113.4	E238 C242	E238-L240 PolarHBondContact O-N 3.14Å; L240-C242 PolarHBondContact O-N 3.32Å
241	N	80.8	Confident	85.6	Confident	137 Å²	137	48.4 Å²	48.4	73%	0.733	24%	0.236	S	C	*	.	G	3₁₀ helix	trans	-77.8	-2.2	175.4	-56.3	-54.9	0	0	0	113.2	D239 R243	D239-N241 PolarHBondContact O-N 3.06Å; D239-N241 VanDerWaalsContact O-N 3.16Å; D239-N241 VanDerWaalsContact OD1-CB 3.27Å; D239-N241 WeakPolarHBondContact OD1-CB 3.21Å; D239-N241 PolarHBondContact OD1-N 2.88Å; D239-N241 PolarHBondContact OD1-ND2 3.45Å; N241-R243 PolarHBondContact O-N 3.03Å
242	C	80.8	Confident	85.3	Confident	14 Å²	14	57.3 Å²	57.3	10%	0.095	28%	0.277	C	S	.	.	G	3₁₀ helix	trans	-61.1	-10.9	173.2	57	0	0	0	0	113.9	E237 D239 L240 Y245 C246 H248	E237-C242 HydrophobicContact CG-CB 4.19Å; D239-C242 WeakPolarHBondContact O-CB 3.36Å; D239-C242 PolarHBondContact O-N 3.27Å; D239-C242 VanDerWaalsContact O-N 3.16Å; D239-C242 PolarHBondContact O-SG 3.25Å; L240-C242 PolarHBondContact O-N 3.32Å; C242-Y245 CarbonylContact O-C 3.4Å; C242-Y245 WeakPolarHBondContact O-CA 3.32Å; C242-Y245 PolarHBondContact O-N 3.04Å; C242-C246 HydrophobicContact CB-CB 4.08Å; C242-C246 WeakPolarHBondContact CB-SG 3.37Å; C242-C246 WeakPolarHBondContact SG-CA 3.28Å; C242-C246 WeakPolarHBondContact SG-CB 3.46Å; C242-C246 CovalentContact SG-SG 2.03Å; C242-C246 PolarHBondContact SG-SG 3.34Å; C242-H248 VanDerWaalsContact SG-CE1 3.57Å
243	R	80.5	Confident	85	Confident	177 Å²	177	64.9 Å²	64.9	67%	0.668	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	137.1	-177.4	-69.6	-179.1	-178.5	173.5	3.6	111.1	N241 C246	N241-R243 PolarHBondContact O-N 3.03Å; R243-C246 PolarHBondContact N-SG 3.03Å
244	P	81.3	Confident	84.8	Confident	62 Å²	62	66.8 Å²	66.8	40%	0.403	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	cis	-94.2	16.1	9.7	37.6	-38.1	0	0	0	115	Y124	Y124-P244 WeakPolarHBondContact CE1-O 3.29Å
245	Y	83.9	Confident	84.9	Confident	41 Å²	41	66.7 Å²	66.7	16%	0.161	32%	0.324	C	S	.	.	S	Bend	trans	-118.6	43.8	-168.8	-51.4	-75	0	0	0	112.8	Q104 L121 Y124 Q125 C242	Q104-Y245 HydrophobicContact CG-CD2 4.33Å; L121-Y245 HydrophobicContact CB-CD1 4.43Å; L121-Y245 HydrophobicContact CB-CE1 3.78Å; L121-Y245 HydrophobicContact CD2-CD1 3.81Å; L121-Y245 HydrophobicContact CD2-CD2 4.41Å; L121-Y245 HydrophobicContact CD2-CE1 3.99Å; L121-Y245 HydrophobicContact CD2-CG 4.01Å; L121-Y245 HydrophobicContact CG-CE1 4.39Å; L121-Y245 WeakPolarHBondContact O-CE1 3.48Å; Y124-Y245 AromaticContact CD1-CD1 3.77Å; Y124-Y245 HydrophobicContact CD1-CD1 3.77Å; Y124-Y245 HydrophobicContact CD1-CE1 4.43Å; Y124-Y245 HydrophobicContact CE1-CD1 4.36Å; Y124-Y245 AromaticContact CG-CD1 3.98Å; Y124-Y245 HydrophobicContact CG-CD1 3.98Å; Q125-Y245 HydrophobicContact CG-CE1 3.84Å; Q125-Y245 PolarHBondContact NE2-OH 3.12Å; C242-Y245 CarbonylContact O-C 3.4Å; C242-Y245 WeakPolarHBondContact O-CA 3.32Å; C242-Y245 PolarHBondContact O-N 3.04Å
246	C	84.4	Confident	85.2	Confident	0 Å²	0	66.8 Å²	66.8	0%	0	32%	0.324	C	S	.	.			trans	-76.6	131.9	-175.7	-68.2	0	0	0	0	112.1	Y124 C242 R243 H248 E249	Y124-C246 PolarHBondContact OH-N 2.94Å; Y124-C246 PolarHBondContact OH-O 3Å; C242-C246 HydrophobicContact CB-CB 4.08Å; C242-C246 WeakPolarHBondContact CB-SG 3.37Å; C242-C246 WeakPolarHBondContact SG-CA 3.28Å; C242-C246 WeakPolarHBondContact SG-CB 3.46Å; C242-C246 CovalentContact SG-SG 2.03Å; C242-C246 PolarHBondContact SG-SG 3.34Å; R243-C246 PolarHBondContact N-SG 3.03Å; C246-H248 VanDerWaalsContact C-N 3.32Å; C246-H248 WeakPolarHBondContact CB-CE1 3.47Å; C246-H248 PolarHBondContact O-N 3Å; C246-H248 PolarHBondContact SG-CE1 3Å; C246-E249 HydrophobicContact CB-CG 4.18Å; C246-E249 PolarHBondContact O-N 3.33Å
247	T	82.6	Confident	85.5	Confident	2 Å²	2	65.1 Å²	65.1	1%	0.012	32%	0.316	C	S	.	.	G	3₁₀ helix	trans	-70.6	-30.3	179.9	68.8	0	0	0	0	112	D93 V95 V100 E237 E249 F250	D93-T247 WeakPolarHBondContact OD2-CB 3.24Å; D93-T247 PolarHBondContact OD2-OG1 3.4Å; V95-T247 HydrophobicContact CB-CG2 4.06Å; V95-T247 HydrophobicContact CG1-CG2 3.91Å; V100-T247 HydrophobicContact CG2-CG2 4.23Å; E237-T247 WeakPolarHBondContact CB-OG1 3.41Å; T247-E249 PolarHBondContact O-N 2.83Å; T247-F250 WeakPolarHBondContact O-CB 3.37Å; T247-F250 VanDerWaalsContact O-CD2 3.26Å; T247-F250 WeakPolarHBondContact O-CD2 3.46Å; T247-F250 PolarHBondContact O-N 3.28Å
248	H	82.4	Confident	86.3	Confident	76 Å²	76	63.4 Å²	63.4	35%	0.352	31%	0.308	S	S	.	.	G	3₁₀ helix	trans	-61.9	-9.4	174.3	66	-107.4	0	0	0	114.6	C242 C246 F250	C242-H248 VanDerWaalsContact SG-CE1 3.57Å; C246-H248 VanDerWaalsContact C-N 3.32Å; C246-H248 WeakPolarHBondContact CB-CE1 3.47Å; C246-H248 PolarHBondContact O-N 3Å; C246-H248 PolarHBondContact SG-CE1 3Å; H248-F250 VanDerWaalsContact C-N 3.27Å
249	E	84.6	Confident	87.1	Confident	72 Å²	72	59.5 Å²	59.5	34%	0.336	29%	0.29	S	S	.	.	G	3₁₀ helix	trans	-74.6	-15.8	170.5	-65.7	-169	-178	0	0	112.9	Y124 N128 M148 C246 T247	Y124-E249 PolarHBondContact OH-OE2 3.08Å; Y124-E249 VanDerWaalsContact OH-OE2 3.14Å; N128-E249 PolarHBondContact ND2-OE2 3.3Å; M148-E249 HydrophobicContact CE-CB 3.74Å; C246-E249 HydrophobicContact CB-CG 4.18Å; C246-E249 PolarHBondContact O-N 3.33Å; T247-E249 PolarHBondContact O-N 2.83Å
250	F	89.1	Confident	88	Confident	16 Å²	16	56.1 Å²	56.1	7%	0.07	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.3	-36	-179.3	-67.9	-62.6	0	0	0	113.7	P94 V95 Y124 M148 V149 F152 T247 H248	P94-F250 HydrophobicContact CG-CB 3.72Å; P94-F250 HydrophobicContact CG-CD2 4.08Å; P94-F250 HydrophobicContact CG-CG 3.88Å; V95-F250 HydrophobicContact CB-CD2 4.27Å; V95-F250 HydrophobicContact CB-CE2 3.95Å; V95-F250 HydrophobicContact CG2-CD2 3.96Å; V95-F250 HydrophobicContact CG2-CE2 3.46Å; V95-F250 VanDerWaalsContact CG2-CE2 3.46Å; V95-F250 HydrophobicContact CG2-CZ 4Å; Y124-F250 HydrophobicContact CD2-CE1 4.49Å; Y124-F250 HydrophobicContact CD2-CE2 4.24Å; Y124-F250 AromaticContact CD2-CZ 3.63Å; Y124-F250 HydrophobicContact CD2-CZ 3.63Å; Y124-F250 HydrophobicContact CE2-CE1 4.23Å; Y124-F250 AromaticContact CE2-CE2 3.67Å; Y124-F250 HydrophobicContact CE2-CE2 3.67Å; Y124-F250 AromaticContact CE2-CZ 3.39Å; Y124-F250 HydrophobicContact CE2-CZ 3.39Å; M148-F250 HydrophobicContact CE-CD1 3.29Å; M148-F250 HydrophobicContact CE-CD2 4.41Å; M148-F250 HydrophobicContact CE-CE1 3.17Å; M148-F250 HydrophobicContact CE-CE2 4.28Å; M148-F250 HydrophobicContact CE-CG 3.95Å; M148-F250 HydrophobicContact CE-CZ 3.7Å; M148-F250 HydrophobicContact SD-CD1 3.56Å; M148-F250 VanDerWaalsContact SD-CD1 3.56Å; M148-F250 HydrophobicContact SD-CE1 3.27Å; M148-F250 WeakPolarHBondContact SD-CE1 3.28Å; M148-F250 HydrophobicContact SD-CZ 4.22Å; V149-F250 HydrophobicContact CB-CB 4.25Å; V149-F250 HydrophobicContact CB-CD1 3.84Å; V149-F250 HydrophobicContact CB-CG 4.43Å; V149-F250 HydrophobicContact CG2-CD1 4.33Å; F152-F250 HydrophobicContact CB-CE1 3.9Å; F152-F250 AromaticContact CD1-CE1 3.38Å; F152-F250 HydrophobicContact CD1-CE1 3.38Å; F152-F250 AromaticContact CD1-CZ 3.44Å; F152-F250 HydrophobicContact CD1-CZ 3.44Å; F152-F250 VanDerWaalsContact CD1-CZ 3.44Å; F152-F250 HydrophobicContact CE1-CE1 4.03Å; F152-F250 AromaticContact CE1-CZ 3.57Å; F152-F250 HydrophobicContact CE1-CZ 3.57Å; F152-F250 AromaticContact CG-CE1 3.81Å; F152-F250 HydrophobicContact CG-CE1 3.81Å; F152-F250 HydrophobicContact CG-CZ 4.1Å; F152-F250 HydrophobicContact CZ-CZ 4.35Å; T247-F250 WeakPolarHBondContact O-CB 3.37Å; T247-F250 VanDerWaalsContact O-CD2 3.26Å; T247-F250 WeakPolarHBondContact O-CD2 3.46Å; T247-F250 PolarHBondContact O-N 3.28Å; H248-F250 VanDerWaalsContact C-N 3.27Å
251	T	89.8	Confident	88.7	Confident	30 Å²	30	51.3 Å²	51.3	18%	0.184	25%	0.246	C	C	.	.			trans	-149.3	140.5	-174.9	176.6	0	0	0	0	110.8	V92 W253	V92-T251 HydrophobicContact CG1-CG2 4.26Å; T251-W253 VanDerWaalsContact C-N 3.29Å; T251-W253 PolarHBondContact OG1-N 3.13Å; T251-W253 VanDerWaalsContact OG1-N 3.12Å; T251-W253 PolarHBondContact OG1-O 2.94Å
252	E	89.6	Confident	89.2	Confident	190 Å²	190	46.4 Å²	46.4	89%	0.888	22%	0.223	S	C	*	.	S	Bend	trans	-83.9	-7	173.1	-62.5	-178.4	169.3	0	0	112.4
253	W	91.1	Very high	89.6	Confident	160 Å²	160	47.7 Å²	47.7	61%	0.606	23%	0.231	S	C	*	.			trans	-104.4	133.3	-174	-55.4	-28.1	0	0	0	111.3	V92 T251	V92-W253 HydrophobicContact CG1-CB 3.84Å; V92-W253 HydrophobicContact CG1-CE3 4.48Å; V92-W253 VanDerWaalsContact CG1-O 3.32Å; V92-W253 WeakPolarHBondContact CG1-O 3.29Å; T251-W253 VanDerWaalsContact C-N 3.29Å; T251-W253 PolarHBondContact OG1-N 3.13Å; T251-W253 VanDerWaalsContact OG1-N 3.12Å; T251-W253 PolarHBondContact OG1-O 2.94Å
254	A	91.8	Very high	89.8	Confident	47 Å²	47	42.9 Å²	42.9	39%	0.388	23%	0.225	S	C	.	.			trans	-104.4	135.4	168.4	0	0	0	0	0	110.2	E236 P278	E236-A254 HydrophobicContact CG-CB 4.43Å; A254-P278 HydrophobicContact CB-CG 4.38Å
255	G	95.3	Very high	90.3	Very high	3 Å²	3	40.5 Å²	40.5	3%	0.031	21%	0.209	C	C	.	.	S	Bend	trans	148.7	-166.7	180	0	0	0	0	0	112.7	N91 V92 L276	N91-G255 PolarHBondContact OD1-O 2.86Å; N91-G255 VanDerWaalsContact OD1-O 3.12Å; V92-G255 WeakPolarHBondContact CB-O 3.27Å; V92-G255 WeakPolarHBondContact CG2-O 3.32Å; V92-G255 PolarHBondContact N-O 2.73Å; V92-G255 VanDerWaalsContact N-O 3.07Å; G255-L276 WeakPolarHBondContact CA-O 3.33Å
256	S	96.7	Very high	90.7	Very high	1 Å²	1	40.3 Å²	40.3	1%	0.007	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	160.6	175	176.3	0	0	0	0	110.3	C90 F171 L276	C90-S256 CarbonylContact O-C 3.52Å; C90-S256 VanDerWaalsContact O-CA 3.29Å; C90-S256 WeakPolarHBondContact O-CA 3.38Å; C90-S256 WeakPolarHBondContact O-CB 3.44Å; C90-S256 PolarHBondContact O-OG 3.14Å; F171-S256 WeakPolarHBondContact CZ-OG 3.27Å; S256-L276 PolarHBondContact N-O 3.44Å; S256-L276 WeakPolarHBondContact O-CA 3.21Å; S256-L276 WeakPolarHBondContact O-CB 3.46Å; S256-L276 PolarHBondContact O-N 3.36Å
257	K	96.6	Very high	91.2	Very high	21 Å²	21	40.5 Å²	40.5	9%	0.091	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	143	170.4	-70.4	-158.8	176.8	-163.8	0	111.2	L89 C90 V92 Y208 I269 A273 L274 N275	L89-K257 WeakPolarHBondContact CA-O 3.33Å; C90-K257 HydrophobicContact CB-CB 4.41Å; C90-K257 PolarHBondContact N-O 2.88Å; C90-K257 PolarHBondContact O-N 2.62Å; V92-K257 HydrophobicContact CG2-CG 4.12Å; Y208-K257 HydrophobicContact CE1-CD 4.08Å; Y208-K257 HydrophobicContact CE2-CD 4.34Å; Y208-K257 WeakPolarHBondContact OH-CD 3.22Å; Y208-K257 WeakPolarHBondContact OH-CE 3.45Å; Y208-K257 PolarHBondContact OH-NZ 3.16Å; K257-I269 HydrophobicContact CD-CG2 4.48Å; K257-A273 HydrophobicContact CB-CB 4.06Å; K257-A273 HydrophobicContact CD-CB 3.95Å; K257-A273 HydrophobicContact CG-CB 4.5Å; K257-L274 WeakPolarHBondContact CA-O 3.29Å; K257-N275 VanDerWaalsContact CE-OD1 3.29Å; K257-N275 WeakPolarHBondContact CE-OD1 3.47Å
258	I	97.1	Very high	91.6	Very high	1 Å²	1	42.4 Å²	42.4	1%	0.005	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	137.3	175.2	-167.7	169.7	0	0	0	111.3	I87 T88 L89 A273 L274 L276 I284 V474 V476	I87-I258 HydrophobicContact CG2-CD1 3.58Å; I87-I258 HydrophobicContact CG2-CG1 3.63Å; T88-I258 CarbonylContact O-C 3.54Å; T88-I258 VanDerWaalsContact O-CA 3.29Å; T88-I258 WeakPolarHBondContact O-CA 3.5Å; L89-I258 HydrophobicContact CD2-CB 3.93Å; L89-I258 HydrophobicContact CD2-CD1 3.9Å; L89-I258 HydrophobicContact CD2-CG1 3.71Å; I258-A273 CarbonylContact O-C 3.52Å; I258-A273 VanDerWaalsContact O-CA 3.23Å; I258-A273 WeakPolarHBondContact O-CA 3.5Å; I258-L274 HydrophobicContact CG2-CB 3.93Å; I258-L274 PolarHBondContact N-O 2.98Å; I258-L274 PolarHBondContact O-N 3.3Å; I258-L276 HydrophobicContact CB-CD1 3.97Å; I258-L276 HydrophobicContact CB-CD2 4.29Å; I258-L276 HydrophobicContact CB-CG 4.22Å; I258-L276 HydrophobicContact CG2-CD1 4.29Å; I258-L276 HydrophobicContact CG2-CD2 3.69Å; I258-L276 HydrophobicContact CG2-CG 4.03Å; I258-I284 HydrophobicContact CD1-CD1 3.96Å; I258-I284 HydrophobicContact CD1-CG1 4.34Å; I258-V474 HydrophobicContact CD1-CG1 3.87Å; I258-V476 HydrophobicContact CD1-CG2 4.2Å
259	V	95.8	Very high	92.1	Very high	1 Å²	1	39.3 Å²	39.3	1%	0.006	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	128.6	169.8	-179.3	0	0	0	0	108.6	I87 T88 H261 P267 I269 S272 A273	I87-V259 WeakPolarHBondContact CA-O 3.23Å; T88-V259 PolarHBondContact N-O 3.14Å; T88-V259 PolarHBondContact O-N 3.41Å; V259-H261 HydrophobicContact CG1-CB 4.2Å; V259-P267 HydrophobicContact CB-CB 4.41Å; V259-P267 HydrophobicContact CG1-CB 4.15Å; V259-I269 HydrophobicContact CG2-CB 4.31Å; V259-I269 HydrophobicContact CG2-CG1 4Å; V259-S272 WeakPolarHBondContact CG1-OG 2.97Å; V259-A273 HydrophobicContact CG2-CB 3.62Å
260	V	94.8	Very high	92.4	Very high	10 Å²	10	40.1 Å²	40.1	6%	0.061	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	114.9	171.3	-177.5	0	0	0	0	107.9	P85 I284 I286 Y410	P85-V260 HydrophobicContact CB-CG1 3.67Å; P85-V260 HydrophobicContact CG-CG1 3.69Å; V260-I284 HydrophobicContact CG2-CG2 4.28Å; V260-I286 HydrophobicContact CG1-CD1 4.41Å; V260-Y410 HydrophobicContact CB-CD1 3.91Å; V260-Y410 HydrophobicContact CB-CE1 3.72Å; V260-Y410 HydrophobicContact CB-CE2 4.38Å; V260-Y410 HydrophobicContact CB-CG 4.34Å; V260-Y410 HydrophobicContact CG1-CD1 4.11Å; V260-Y410 HydrophobicContact CG1-CE1 4.27Å; V260-Y410 HydrophobicContact CG2-CD1 4.45Å; V260-Y410 HydrophobicContact CG2-CD2 4.36Å; V260-Y410 HydrophobicContact CG2-CE2 4.39Å; V260-Y410 HydrophobicContact CG2-CG 4.39Å
261	H	93.3	Very high	92.4	Very high	17 Å²	17	43.1 Å²	43.1	8%	0.079	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	164.4	-174.2	68.4	102.9	0	0	0	112	P85 H86 T88 T213 V259 S265	P85-H261 WeakPolarHBondContact CB-O 3.35Å; H86-H261 WeakPolarHBondContact CB-NE2 3.34Å; H86-H261 PolarHBondContact N-O 3.45Å; H86-H261 PolarHBondContact O-CD2 2.96Å; H86-H261 VanDerWaalsContact O-CD2 3.3Å; H86-H261 PolarHBondContact O-N 3.16Å; T88-H261 PolarHBondContact OG1-CD2 2.88Å; T88-H261 PolarHBondContact OG1-NE2 3.3Å; T213-H261 WeakPolarHBondContact CG2-NE2 3.32Å; V259-H261 HydrophobicContact CG1-CB 4.2Å; H261-S265 PolarHBondContact CE1-O 3.49Å; H261-S265 PolarHBondContact ND1-O 3.2Å; H261-S265 VanDerWaalsContact ND1-O 3.17Å; H261-S265 PolarHBondContact ND1-OG 3.02Å
262	S	91.2	Very high	92.5	Very high	34 Å²	34	43.8 Å²	43.8	24%	0.238	24%	0.243	C	C	.	.			trans	-67.1	147.7	-179.2	59.6	0	0	0	0	111.6	S264 S265	S262-S264 PolarHBondContact O-N 3Å; S262-S265 PolarHBondContact N-OG 3.09Å; S262-S265 PolarHBondContact O-N 3.49Å; S262-S265 VanDerWaalsContact O-N 3.13Å; S262-S265 PolarHBondContact O-OG 2.87Å; S262-S265 WeakPolarHBondContact OG-CB 3.49Å; S262-S265 PolarHBondContact OG-OG 2.85Å; S262-S265 VanDerWaalsContact OG-OG 3.07Å
263	P	89.8	Confident	92.7	Very high	41 Å²	41	35.8 Å²	35.8	27%	0.266	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51.8	140.6	174.8	-26.7	35.3	0	0	0	111.5	A83 S265	A83-P263 HydrophobicContact CB-CG 4.14Å; P263-S265 PolarHBondContact O-N 2.98Å; P263-S265 VanDerWaalsContact O-N 3.12Å
264	S	85.1	Confident	92.9	Very high	76 Å²	76	30.7 Å²	30.7	53%	0.531	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	66.6	-2.8	-178.2	-50	0	0	0	0	116.7	S262 G327	S262-S264 PolarHBondContact O-N 3Å; S264-G327 PolarHBondContact O-N 2.63Å
265	S	91.2	Very high	93.1	Very high	11 Å²	11	33.3 Å²	33.3	8%	0.077	20%	0.202	C	C	.	.	S	Bend	trans	-81.2	154.5	173.6	65.2	0	0	0	0	112.3	H261 S262 P263	H261-S265 PolarHBondContact CE1-O 3.49Å; H261-S265 PolarHBondContact ND1-O 3.2Å; H261-S265 VanDerWaalsContact ND1-O 3.17Å; H261-S265 PolarHBondContact ND1-OG 3.02Å; S262-S265 PolarHBondContact N-OG 3.09Å; S262-S265 PolarHBondContact O-N 3.49Å; S262-S265 VanDerWaalsContact O-N 3.13Å; S262-S265 PolarHBondContact O-OG 2.87Å; S262-S265 WeakPolarHBondContact OG-CB 3.49Å; S262-S265 PolarHBondContact OG-OG 2.85Å; S262-S265 VanDerWaalsContact OG-OG 3.07Å; P263-S265 PolarHBondContact O-N 2.98Å; P263-S265 VanDerWaalsContact O-N 3.12Å
266	Y	93.2	Very high	93.2	Very high	37 Å²	37	33.4 Å²	33.4	15%	0.145	20%	0.201	C	C	.	.			trans	-76.5	129.3	172	-177.4	-94.8	0	0	0	110.2	L203 D268 I311 L332 P354	L203-Y266 HydrophobicContact CD1-CE2 3.66Å; L203-Y266 HydrophobicContact CD2-CE2 4.48Å; Y266-D268 PolarHBondContact O-N 2.83Å; Y266-I311 HydrophobicContact CD2-CD1 3.87Å; Y266-I311 HydrophobicContact CE2-CD1 3.96Å; Y266-L332 HydrophobicContact CD1-CD1 4.38Å; Y266-L332 HydrophobicContact CD2-CD1 4.42Å; Y266-L332 HydrophobicContact CG-CD1 4.07Å; Y266-P354 HydrophobicContact CE1-CG 4.48Å; Y266-P354 HydrophobicContact CE2-CB 4.17Å; Y266-P354 HydrophobicContact CE2-CG 4.36Å
267	P	94.1	Very high	93.2	Very high	5 Å²	5	37.6 Å²	37.6	3%	0.032	22%	0.223	C	C	.	.			trans	-78.9	113.8	-178.9	31.5	-34.3	0	0	0	110.9	T88 L203 V259 I269	T88-P267 HydrophobicContact CG2-CB 4.2Å; T88-P267 HydrophobicContact CG2-CG 4Å; T88-P267 WeakPolarHBondContact OG1-CB 3.4Å; T88-P267 WeakPolarHBondContact OG1-CG 3.39Å; L203-P267 HydrophobicContact CD2-CG 3.55Å; V259-P267 HydrophobicContact CB-CB 4.41Å; V259-P267 HydrophobicContact CG1-CB 4.15Å; P267-I269 PolarHBondContact O-N 2.94Å; P267-I269 VanDerWaalsContact O-N 3.09Å
268	D	91.7	Very high	93.2	Very high	42 Å²	42	37.9 Å²	37.9	23%	0.225	23%	0.227	C	C	.	.			trans	-81.1	87.7	173.5	-168	-19	0	0	0	110.5	Y266 E270 A271 S272	Y266-D268 PolarHBondContact O-N 2.83Å; D268-E270 PolarHBondContact O-N 2.91Å; D268-A271 HydrophobicContact CB-CB 4.29Å; D268-A271 VanDerWaalsContact CG-CB 3.42Å; D268-A271 PolarHBondContact O-N 3.34Å; D268-A271 WeakPolarHBondContact OD1-CB 3.4Å; D268-A271 PolarHBondContact OD1-N 3.49Å; D268-A271 WeakPolarHBondContact OD2-CB 3.43Å; D268-S272 WeakPolarHBondContact O-CB 3.28Å; D268-S272 PolarHBondContact O-N 3.21Å; D268-S272 PolarHBondContact O-OG 2.59Å
269	I	93.1	Very high	93.2	Very high	10 Å²	10	38.5 Å²	38.5	5%	0.051	23%	0.234	C	C	.	.	H	α-helix	trans	-66.4	-37.4	-172.3	-61.4	157	0	0	0	112.2	T88 C90 L203 T205 Y208 C211 K257 V259 P267 A273	T88-I269 HydrophobicContact CG2-CD1 4.33Å; T88-I269 HydrophobicContact CG2-CG1 4.46Å; C90-I269 VanDerWaalsContact SG-CD1 3.53Å; L203-I269 HydrophobicContact CD2-CD1 3.75Å; T205-I269 HydrophobicContact CG2-CD1 3.54Å; Y208-I269 HydrophobicContact CD2-CG2 4.02Å; Y208-I269 HydrophobicContact CE2-CG2 3.49Å; Y208-I269 VanDerWaalsContact CE2-CG2 3.49Å; C211-I269 HydrophobicContact CB-CD1 4.29Å; K257-I269 HydrophobicContact CD-CG2 4.48Å; V259-I269 HydrophobicContact CG2-CB 4.31Å; V259-I269 HydrophobicContact CG2-CG1 4Å; P267-I269 PolarHBondContact O-N 2.94Å; P267-I269 VanDerWaalsContact O-N 3.09Å; I269-A273 HydrophobicContact CG2-CB 4.09Å; I269-A273 WeakPolarHBondContact O-CB 3.42Å; I269-A273 PolarHBondContact O-N 3.31Å
270	E	89	Confident	93.2	Very high	90 Å²	90	38.7 Å²	38.7	42%	0.421	24%	0.235	S	C	.	.	H	α-helix	trans	-76.4	-32.4	-178.5	-67.9	-59	113.4	0	0	112.1	K207 Y208 D268	K207-E270 IonicContact NZ-OE1 2.92Å; K207-E270 IonicContact NZ-OE2 3.07Å; K207-E270 PolarHBondContact NZ-OE2 2.87Å; Y208-E270 WeakPolarHBondContact CE2-OE1 3.38Å; Y208-E270 VanDerWaalsContact CZ-OE1 3.31Å; Y208-E270 PolarHBondContact OH-OE1 3.07Å; D268-E270 PolarHBondContact O-N 2.91Å
271	A	89.5	Confident	93.4	Very high	79 Å²	79	38.7 Å²	38.7	65%	0.653	24%	0.236	S	C	*	.	H	α-helix	trans	-84.9	-32.9	-179.1	0	0	0	0	0	114.1	D268	D268-A271 HydrophobicContact CB-CB 4.29Å; D268-A271 VanDerWaalsContact CG-CB 3.42Å; D268-A271 PolarHBondContact O-N 3.34Å; D268-A271 WeakPolarHBondContact OD1-CB 3.4Å; D268-A271 PolarHBondContact OD1-N 3.49Å; D268-A271 WeakPolarHBondContact OD2-CB 3.43Å
272	S	91.5	Very high	93.6	Very high	44 Å²	44	37.9 Å²	37.9	31%	0.308	23%	0.232	S	C	.	.	H	α-helix	trans	-123.9	-2.4	-165.3	68.8	0	0	0	0	115.7	V259 D268 Y410	V259-S272 WeakPolarHBondContact CG1-OG 2.97Å; D268-S272 WeakPolarHBondContact O-CB 3.28Å; D268-S272 PolarHBondContact O-N 3.21Å; D268-S272 PolarHBondContact O-OG 2.59Å; S272-Y410 PolarHBondContact O-OH 2.96Å
273	A	94.7	Very high	93.9	Very high	22 Å²	22	37.9 Å²	37.9	18%	0.182	23%	0.228	C	C	.	.	P	Polyproline II helix	trans	-74.7	143	-178	0	0	0	0	0	113.7	K257 I258 V259 I269	K257-A273 HydrophobicContact CB-CB 4.06Å; K257-A273 HydrophobicContact CD-CB 3.95Å; K257-A273 HydrophobicContact CG-CB 4.5Å; I258-A273 CarbonylContact O-C 3.52Å; I258-A273 VanDerWaalsContact O-CA 3.23Å; I258-A273 WeakPolarHBondContact O-CA 3.5Å; V259-A273 HydrophobicContact CG2-CB 3.62Å; I269-A273 HydrophobicContact CG2-CB 4.09Å; I269-A273 WeakPolarHBondContact O-CB 3.42Å; I269-A273 PolarHBondContact O-N 3.31Å
274	L	95.8	Very high	94.3	Very high	52 Å²	52	36 Å²	36	27%	0.272	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	147.2	167.1	-57.9	-179.1	0	0	0	110.4	K257 I258 Y410 L412	K257-L274 WeakPolarHBondContact CA-O 3.29Å; I258-L274 HydrophobicContact CG2-CB 3.93Å; I258-L274 PolarHBondContact N-O 2.98Å; I258-L274 PolarHBondContact O-N 3.3Å; L274-Y410 HydrophobicContact CD1-CD2 3.81Å; L274-Y410 HydrophobicContact CD1-CE2 3.58Å; L274-Y410 HydrophobicContact CG-CE2 4.08Å; L274-L412 HydrophobicContact CB-CD2 4.24Å; L274-L412 HydrophobicContact CD1-CB 3.82Å
275	N	96.2	Very high	94.8	Very high	103 Å²	103	35.5 Å²	35.5	55%	0.551	21%	0.207	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-86.4	134.2	177.3	-58.1	-41.2	0	0	0	110.6	K257 L412	K257-N275 VanDerWaalsContact CE-OD1 3.29Å; K257-N275 WeakPolarHBondContact CE-OD1 3.47Å; N275-L412 VanDerWaalsContact O-CD2 3.27Å; N275-L412 WeakPolarHBondContact O-CD2 3.33Å
276	L	97.5	Very high	94.9	Very high	4 Å²	4	35.1 Å²	35.1	2%	0.021	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	128.3	177.9	-56.9	178.7	0	0	0	109.7	L89 L232 G255 S256 I258 N282 I284 L412 L472 V474	L89-L276 HydrophobicContact CD2-CD1 4.19Å; L232-L276 HydrophobicContact CD1-CD1 4.33Å; G255-L276 WeakPolarHBondContact CA-O 3.33Å; S256-L276 PolarHBondContact N-O 3.44Å; S256-L276 WeakPolarHBondContact O-CA 3.21Å; S256-L276 WeakPolarHBondContact O-CB 3.46Å; S256-L276 PolarHBondContact O-N 3.36Å; I258-L276 HydrophobicContact CB-CD1 3.97Å; I258-L276 HydrophobicContact CB-CD2 4.29Å; I258-L276 HydrophobicContact CB-CG 4.22Å; I258-L276 HydrophobicContact CG2-CD1 4.29Å; I258-L276 HydrophobicContact CG2-CD2 3.69Å; I258-L276 HydrophobicContact CG2-CG 4.03Å; L276-N282 WeakPolarHBondContact CA-OD1 3.47Å; L276-N282 HydrophobicContact CD2-CB 3.57Å; L276-I284 HydrophobicContact CD2-CD1 4.33Å; L276-L412 HydrophobicContact CD2-CD1 4.32Å; L276-L472 HydrophobicContact CB-CD1 4.35Å; L276-L472 HydrophobicContact CB-CD2 3.81Å; L276-L472 HydrophobicContact CD1-CD1 4.21Å; L276-V474 HydrophobicContact CD1-CG2 3.64Å
277	L	96.5	Very high	94.6	Very high	90 Å²	90	37.8 Å²	37.8	47%	0.471	22%	0.221	S	C	.	.			trans	-84.9	134.1	-176.7	-168.3	74.1	0	0	0	110.8	A280 N282 L472	L277-A280 HydrophobicContact CB-CB 4.04Å; L277-A280 HydrophobicContact CD2-CB 4.12Å; L277-A280 HydrophobicContact CG-CB 4.38Å; L277-N282 PolarHBondContact N-OD1 3.46Å; L277-N282 PolarHBondContact O-ND2 3.24Å; L277-L472 WeakPolarHBondContact O-CB 3Å
278	P	96.8	Very high	94.1	Very high	26 Å²	26	37.9 Å²	37.9	17%	0.169	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.7	150.3	165	5.8	-3	0	0	0	112	L234 A254 A280 E468 K469	L234-P278 HydrophobicContact CD1-CB 3.79Å; L234-P278 HydrophobicContact CD1-CG 4.02Å; A254-P278 HydrophobicContact CB-CG 4.38Å; P278-A280 PolarHBondContact O-N 2.98Å; P278-A280 VanDerWaalsContact O-N 3.16Å; P278-E468 CarbonylContact C-O 3.59Å; P278-E468 WeakPolarHBondContact CB-O 3.47Å; P278-K469 WeakPolarHBondContact CB-O 3.47Å
279	G	95.9	Very high	94.1	Very high	15 Å²	15	36.1 Å²	36.1	16%	0.155	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	66.2	22.5	176.4	0	0	0	0	0	113	W417 E468 F471	G279-W417 CarbonylContact C-O 3.53Å; G279-W417 WeakPolarHBondContact CA-O 3.25Å; G279-W417 PolarHBondContact O-N 3.19Å; G279-W417 VanDerWaalsContact O-N 3.14Å; G279-E468 WeakPolarHBondContact CA-O 3.28Å; G279-E468 PolarHBondContact N-O 3.33Å; G279-F471 PolarHBondContact N-O 2.93Å
280	A	97.2	Very high	94	Very high	4 Å²	4	36.7 Å²	36.7	3%	0.033	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	152.3	-179.6	0	0	0	0	0	111.6	L277 P278 N282 L415 H473	L277-A280 HydrophobicContact CB-CB 4.04Å; L277-A280 HydrophobicContact CD2-CB 4.12Å; L277-A280 HydrophobicContact CG-CB 4.38Å; P278-A280 PolarHBondContact O-N 2.98Å; P278-A280 VanDerWaalsContact O-N 3.16Å; A280-N282 PolarHBondContact O-ND2 2.86Å; A280-L415 CarbonylContact C-O 3.46Å; A280-L415 VanDerWaalsContact CA-O 3.24Å; A280-L415 WeakPolarHBondContact CA-O 3.06Å; A280-L415 WeakPolarHBondContact CB-O 3.33Å; A280-H473 PolarHBondContact O-N 3.44Å
281	S	97.6	Very high	94.2	Very high	11 Å²	11	37.2 Å²	37.2	8%	0.077	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	105.9	165.1	-177.5	0	0	0	0	107	Q283 Q414 L415 H473	S281-Q283 PolarHBondContact OG-NE2 2.92Å; S281-Q414 WeakPolarHBondContact O-CA 3.27Å; S281-L415 PolarHBondContact N-O 3.21Å; S281-L415 PolarHBondContact O-N 2.82Å; S281-H473 PolarHBondContact OG-ND1 3.09Å
282	N	98.2	Very high	94.3	Very high	0 Å²	0	35 Å²	35	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	110.3	179.1	-63	-87.6	0	0	0	108.2	L276 L277 A280 L412 Q414 H473 V474 D475	L276-N282 WeakPolarHBondContact CA-OD1 3.47Å; L276-N282 HydrophobicContact CD2-CB 3.57Å; L277-N282 PolarHBondContact N-OD1 3.46Å; L277-N282 PolarHBondContact O-ND2 3.24Å; A280-N282 PolarHBondContact O-ND2 2.86Å; N282-L412 HydrophobicContact CB-CD1 3.96Å; N282-Q414 PolarHBondContact OD1-NE2 2.79Å; N282-H473 PolarHBondContact N-O 3.31Å; N282-H473 PolarHBondContact ND2-O 3.04Å; N282-V474 WeakPolarHBondContact O-CA 3.07Å; N282-D475 PolarHBondContact O-N 2.85Å
283	Q	97.4	Very high	94.4	Very high	33 Å²	33	34.2 Å²	34.2	15%	0.154	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	109.3	-172.7	-64	-72.4	-42.9	0	0	108.9	S281 L412 T413 L415 D475 N477	S281-Q283 PolarHBondContact OG-NE2 2.92Å; Q283-L412 WeakPolarHBondContact O-CA 3.46Å; Q283-T413 WeakPolarHBondContact CB-O 3.48Å; Q283-T413 VanDerWaalsContact CB-OG1 3.31Å; Q283-T413 WeakPolarHBondContact CB-OG1 3.45Å; Q283-T413 PolarHBondContact N-O 2.92Å; Q283-T413 PolarHBondContact O-N 2.86Å; Q283-T413 PolarHBondContact O-OG1 2.82Å; Q283-L415 HydrophobicContact CG-CD1 4.32Å; Q283-D475 CarbonylContact C-O 3.5Å; Q283-D475 WeakPolarHBondContact CA-O 3.44Å; Q283-D475 PolarHBondContact NE2-OD2 3.16Å; Q283-D475 PolarHBondContact OE1-OD2 3.44Å; Q283-N477 PolarHBondContact OE1-ND2 2.87Å
284	I	97.2	Very high	94.2	Very high	1 Å²	1	36.8 Å²	36.8	1%	0.005	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	113.1	177.7	-61.8	85.1	0	0	0	107.8	I258 V260 L276 Y410 E411 L412 V474 D475 V476 N477	I258-I284 HydrophobicContact CD1-CD1 3.96Å; I258-I284 HydrophobicContact CD1-CG1 4.34Å; V260-I284 HydrophobicContact CG2-CG2 4.28Å; L276-I284 HydrophobicContact CD2-CD1 4.33Å; I284-Y410 HydrophobicContact CG2-CD2 4.3Å; I284-Y410 HydrophobicContact CG2-CG 4.46Å; I284-E411 CarbonylContact C-O 3.54Å; I284-E411 WeakPolarHBondContact CA-O 3.08Å; I284-L412 HydrophobicContact CD1-CD1 4.08Å; I284-L412 HydrophobicContact CG1-CD1 4.07Å; I284-V474 HydrophobicContact CD1-CG1 3.79Å; I284-D475 PolarHBondContact N-O 2.8Å; I284-V476 HydrophobicContact CB-CG1 4.37Å; I284-V476 HydrophobicContact CB-CG2 4.15Å; I284-V476 HydrophobicContact CD1-CG2 4.24Å; I284-V476 HydrophobicContact CG2-CG1 4.32Å; I284-V476 CarbonylContact O-C 3.52Å; I284-V476 WeakPolarHBondContact O-CA 3.41Å; I284-N477 PolarHBondContact O-N 3.46Å
285	L	95.9	Very high	93.8	Very high	67 Å²	67	37.4 Å²	37.4	35%	0.351	19%	0.19	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	115.1	176.9	-178.7	65.2	0	0	0	109.6	D287 Y410 E411 N477 P479	L285-D287 PolarHBondContact O-N 2.96Å; L285-Y410 CarbonylContact O-C 3.58Å; L285-Y410 WeakPolarHBondContact O-CA 3.27Å; L285-E411 PolarHBondContact N-O 2.82Å; L285-E411 PolarHBondContact O-N 3.31Å; L285-N477 HydrophobicContact CD1-CB 4.4Å; L285-P479 HydrophobicContact CD1-CG 3.77Å
286	I	94.1	Very high	93.4	Very high	2 Å²	2	36.3 Å²	36.3	1%	0.01	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	96.6	170.9	-58.5	162.1	0	0	0	107.6	P85 V260 M289 Y408 N409 V476 N477 R478	P85-I286 HydrophobicContact CG-CD1 3.6Å; V260-I286 HydrophobicContact CG1-CD1 4.41Å; I286-M289 HydrophobicContact CG2-CG 4.5Å; I286-Y408 HydrophobicContact CG2-CD1 4.2Å; I286-N409 WeakPolarHBondContact CA-O 3.39Å; I286-V476 HydrophobicContact CD1-CG1 3.61Å; I286-V476 HydrophobicContact CG1-CG1 4.25Å; I286-N477 PolarHBondContact N-O 3.16Å; I286-R478 HydrophobicContact CB-CB 4.33Å; I286-R478 HydrophobicContact CB-CG 4.35Å; I286-R478 HydrophobicContact CD1-CB 4.4Å; I286-R478 HydrophobicContact CG2-CG 4.38Å
287	D	86.1	Confident	92.8	Very high	93 Å²	93	37.6 Å²	37.6	50%	0.497	19%	0.19	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	-38.3	-175.6	-174.3	38.2	0	0	0	112.4	L285 N409 N480	L285-D287 PolarHBondContact O-N 2.96Å; D287-N409 PolarHBondContact N-O 2.88Å; D287-N409 VanDerWaalsContact N-O 3.09Å; D287-N480 PolarHBondContact O-ND2 3.3Å
288	G	84.4	Confident	92.1	Very high	8 Å²	8	42.3 Å²	42.3	8%	0.082	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	137.2	-173	0	0	0	0	0	113.6	N409	G288-N409 PolarHBondContact O-N 3.03Å
289	M	91	Very high	91.3	Very high	4 Å²	4	45.5 Å²	45.5	2%	0.02	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	119.6	167.6	-64.3	178.8	-66.2	0	0	108.1	V82 I286 Y408 T483 L484 M485	V82-M289 HydrophobicContact CB-CE 3.97Å; V82-M289 HydrophobicContact CB-SD 3.7Å; V82-M289 HydrophobicContact CG1-SD 3.86Å; V82-M289 HydrophobicContact CG2-CE 4.11Å; V82-M289 HydrophobicContact CG2-SD 4.27Å; I286-M289 HydrophobicContact CG2-CG 4.5Å; M289-Y408 HydrophobicContact CG-CD1 3.81Å; M289-Y408 HydrophobicContact CG-CE1 3.94Å; M289-Y408 HydrophobicContact SD-CD1 4.37Å; M289-Y408 HydrophobicContact SD-CE1 3.96Å; M289-T483 VanDerWaalsContact CE-O 3.31Å; M289-T483 WeakPolarHBondContact CE-O 3.38Å; M289-L484 HydrophobicContact CB-CD1 4.08Å; M289-L484 WeakPolarHBondContact O-CD1 3.32Å; M289-M485 PolarHBondContact O-N 2.85Å
290	H	91.9	Very high	90.8	Very high	22 Å²	22	52.2 Å²	52.2	10%	0.102	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	123.7	-175	-67	-174.4	0	0	0	109.8	L406 Q407 N409 M485 Y487	H290-L406 CarbonylContact O-C 3.56Å; H290-L406 WeakPolarHBondContact O-CA 3.32Å; H290-Q407 HydrophobicContact CB-CB 4.28Å; H290-Q407 PolarHBondContact N-O 3.05Å; H290-Q407 PolarHBondContact O-N 3.49Å; H290-N409 PolarHBondContact CE1-ND2 3.19Å; H290-M485 CarbonylContact C-O 3.49Å; H290-M485 VanDerWaalsContact CA-O 3.29Å; H290-M485 WeakPolarHBondContact CA-O 3.44Å; H290-M485 PolarHBondContact NE2-SD 2.91Å; H290-M485 VanDerWaalsContact NE2-SD 3.41Å; H290-Y487 HydrophobicContact CB-CD2 4.24Å; H290-Y487 HydrophobicContact CB-CE2 3.89Å; H290-Y487 AromaticContact CD2-CE2 3.94Å; H290-Y487 AromaticContact CE1-CE2 3.92Å; H290-Y487 PolarHBondContact CE1-OH 3.03Å; H290-Y487 AromaticContact CG-CE2 3.55Å; H290-Y487 AromaticContact ND1-CE2 3.56Å
291	R	92.8	Very high	90.4	Very high	102 Å²	102	55.5 Å²	55.5	39%	0.385	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	108.6	169.1	176.6	175.1	169.7	151.3	0.8	108.2	E293 V404 Q405 L406 L484 M485 S486 Y487	R291-E293 HydrophobicContact CG-CG 4.2Å; R291-E293 IonicContact CZ-OE1 3.95Å; R291-E293 IonicContact NE-OE1 3.29Å; R291-E293 PolarHBondContact NE-OE1 3.38Å; R291-E293 IonicContact NH2-OE1 3.89Å; R291-E293 PolarHBondContact NH2-OE1 3.03Å; R291-V404 HydrophobicContact CG-CG1 4.38Å; R291-Q405 WeakPolarHBondContact CA-O 3.3Å; R291-L406 HydrophobicContact CB-CD1 4.35Å; R291-L484 HydrophobicContact CB-CD1 3.87Å; R291-L484 HydrophobicContact CB-CD2 4.16Å; R291-L484 HydrophobicContact CB-CG 4.2Å; R291-M485 PolarHBondContact N-O 2.86Å; R291-S486 CarbonylContact O-C 3.53Å; R291-S486 WeakPolarHBondContact O-CA 3.48Å; R291-Y487 PolarHBondContact O-N 2.88Å
292	I	92.3	Very high	90.1	Very high	31 Å²	31	55.6 Å²	55.6	16%	0.159	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	119	-180	-56.7	162.5	0	0	0	107.6	K294 V404 Q405 Y487	I292-K294 HydrophobicContact CG2-CG 4.19Å; I292-V404 WeakPolarHBondContact O-CA 3.4Å; I292-Q405 HydrophobicContact CB-CG 3.63Å; I292-Q405 HydrophobicContact CD1-CG 4.19Å; I292-Q405 VanDerWaalsContact CD1-NE2 3.29Å; I292-Q405 HydrophobicContact CG1-CG 4.37Å; I292-Q405 HydrophobicContact CG2-CG 4.3Å; I292-Q405 PolarHBondContact N-O 3.49Å; I292-Q405 PolarHBondContact O-N 2.75Å; I292-Y487 WeakPolarHBondContact CA-O 3.47Å; I292-Y487 HydrophobicContact CG1-CD2 4.14Å; I292-Y487 HydrophobicContact CG1-CG 4.49Å
293	E	92.8	Very high	89.8	Confident	28 Å²	28	56.4 Å²	56.4	13%	0.131	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	98.2	178.1	-60.2	-173.2	159.3	0	0	108.5	R291 C403 V404 Y487 R488 E489	R291-E293 HydrophobicContact CG-CG 4.2Å; R291-E293 IonicContact CZ-OE1 3.95Å; R291-E293 IonicContact NE-OE1 3.29Å; R291-E293 PolarHBondContact NE-OE1 3.38Å; R291-E293 IonicContact NH2-OE1 3.89Å; R291-E293 PolarHBondContact NH2-OE1 3.03Å; E293-C403 CarbonylContact C-O 3.58Å; E293-C403 VanDerWaalsContact CA-O 3.32Å; E293-C403 WeakPolarHBondContact CA-O 3.32Å; E293-V404 HydrophobicContact CG-CG2 4.39Å; E293-Y487 PolarHBondContact N-O 3.33Å; E293-R488 HydrophobicContact CB-CB 4.44Å; E293-R488 HydrophobicContact CB-CG 4.33Å; E293-R488 IonicContact OE1-NH2 3.93Å; E293-R488 IonicContact OE2-CZ 3.12Å; E293-R488 IonicContact OE2-NE 2.74Å; E293-R488 PolarHBondContact OE2-NE 2.77Å; E293-R488 IonicContact OE2-NH2 2.74Å; E293-R488 PolarHBondContact OE2-NH2 2.99Å; E293-E489 PolarHBondContact O-N 3Å
294	K	91	Very high	89.1	Confident	76 Å²	76	59.7 Å²	59.7	33%	0.33	30%	0.301	S	S	.	.	P	Polyproline II helix	trans	-81.5	148.3	174.5	-65.4	-174	176.6	-177.4	0	110.5	I292 C403 E489	I292-K294 HydrophobicContact CG2-CG 4.19Å; K294-C403 PolarHBondContact N-O 3.44Å; K294-E489 WeakPolarHBondContact CA-OE2 3.38Å
295	K	87.6	Confident	88	Confident	66 Å²	66	64.5 Å²	64.5	29%	0.287	33%	0.327	S	S	.	.	P	Polyproline II helix	trans	-86.7	130.2	176.6	-173.7	165.1	-174.4	162.8	0	110	M297 E489 E491	K295-M297 HydrophobicContact CB-CG 4.42Å; K295-M297 HydrophobicContact CG-CG 4.17Å; K295-M297 PolarHBondContact O-N 2.77Å; K295-E489 HydrophobicContact CB-CB 4.35Å; K295-E489 HydrophobicContact CB-CG 4.21Å; K295-E489 PolarHBondContact N-OE2 2.93Å; K295-E491 HydrophobicContact CD-CG 4.34Å; K295-E491 VanDerWaalsContact NZ-CG 3.26Å; K295-E491 IonicContact NZ-OE1 2.73Å; K295-E491 PolarHBondContact NZ-OE1 3.48Å; K295-E491 IonicContact NZ-OE2 2.66Å
296	N	88.2	Confident	87.2	Confident	80 Å²	80	70.3 Å²	70.3	43%	0.428	35%	0.353	S	S	.	.	P	Polyproline II helix	trans	-71.6	117.4	173.1	-168.5	24.5	0	0	0	110.1	P301 C302 N304	N296-P301 WeakPolarHBondContact OD1-CA 3.33Å; N296-C302 WeakPolarHBondContact CA-SG 3.3Å; N296-C302 VanDerWaalsContact CB-SG 3.57Å; N296-C302 PolarHBondContact N-SG 2.85Å; N296-C302 VanDerWaalsContact N-SG 3.44Å; N296-C302 PolarHBondContact OD1-N 2.84Å; N296-C302 PolarHBondContact OD1-O 3.37Å; N296-N304 PolarHBondContact ND2-ND2 2.84Å
297	M	83.7	Confident	86.8	Confident	31 Å²	31	75.9 Å²	75.9	15%	0.153	37%	0.373	C	S	.	.			trans	-129.7	150.9	-177.1	-63.6	177.3	75.5	0	0	110.4	F68 T70 K295 S299 K300 P301	F68-M297 HydrophobicContact CB-CE 3.59Å; F68-M297 WeakPolarHBondContact O-CE 3.46Å; T70-M297 HydrophobicContact CG2-CE 4.07Å; T70-M297 HydrophobicContact CG2-SD 3.59Å; T70-M297 VanDerWaalsContact CG2-SD 3.59Å; K295-M297 HydrophobicContact CB-CG 4.42Å; K295-M297 HydrophobicContact CG-CG 4.17Å; K295-M297 PolarHBondContact O-N 2.77Å; M297-S299 VanDerWaalsContact C-N 3.28Å; M297-S299 PolarHBondContact O-N 2.87Å; M297-K300 PolarHBondContact N-O 2.91Å; M297-K300 CarbonylContact O-C 3.59Å; M297-K300 PolarHBondContact O-N 2.78Å; M297-K300 VanDerWaalsContact O-O 3.12Å; M297-P301 WeakPolarHBondContact O-CA 3.47Å; M297-P301 VanDerWaalsContact O-N 3.08Å
298	E	81.7	Confident	87	Confident	189 Å²	189	76.2 Å²	76.2	88%	0.883	38%	0.375	S	S	*	.	S	Bend	trans	-61.9	-35.9	177.9	-68.2	-178.5	179.3	0	0	112.5
299	S	81.5	Confident	87.5	Confident	92 Å²	92	78.1 Å²	78.1	64%	0.643	38%	0.381	S	S	*	.	S	Bend	trans	-74.8	-25.5	178.2	59.5	0	0	0	0	113.7	M297	M297-S299 VanDerWaalsContact C-N 3.28Å; M297-S299 PolarHBondContact O-N 2.87Å
300	K	84.2	Confident	87.6	Confident	156 Å²	156	79.6 Å²	79.6	68%	0.678	39%	0.392	S	S	*	.	S	Bend	trans	-143.8	80.1	-177.3	-68.5	-178	-176.1	172.5	0	108.5	M297	M297-K300 PolarHBondContact N-O 2.91Å; M297-K300 CarbonylContact O-C 3.59Å; M297-K300 PolarHBondContact O-N 2.78Å; M297-K300 VanDerWaalsContact O-O 3.12Å
301	P	89.1	Confident	87.8	Confident	74 Å²	74	78.8 Å²	78.8	48%	0.481	39%	0.388	S	S	.	.			trans	-65.9	144	-179.2	26.9	-33.8	0	0	0	109.8	N296 M297 P400	N296-P301 WeakPolarHBondContact OD1-CA 3.33Å; M297-P301 WeakPolarHBondContact O-CA 3.47Å; M297-P301 VanDerWaalsContact O-N 3.08Å; P301-P400 HydrophobicContact CB-CB 4.46Å; P301-P400 HydrophobicContact CG-CB 4.43Å; P301-P400 VanDerWaalsContact O-CB 3.27Å; P301-P400 WeakPolarHBondContact O-CB 3.29Å
302	C	91.8	Very high	87.8	Confident	12 Å²	12	74.7 Å²	74.7	8%	0.081	38%	0.375	C	S	.	.			trans	-125.8	152.1	168.5	66.3	0	0	0	0	109.9	N296 N304 I401 C403	N296-C302 WeakPolarHBondContact CA-SG 3.3Å; N296-C302 VanDerWaalsContact CB-SG 3.57Å; N296-C302 PolarHBondContact N-SG 2.85Å; N296-C302 VanDerWaalsContact N-SG 3.44Å; N296-C302 PolarHBondContact OD1-N 2.84Å; N296-C302 PolarHBondContact OD1-O 3.37Å; C302-N304 PolarHBondContact O-N 3.5Å; C302-I401 CarbonylContact C-O 3.59Å; C302-I401 WeakPolarHBondContact CA-O 3.41Å; C302-I401 WeakPolarHBondContact CB-O 3.43Å; C302-C403 HydrophobicContact CB-CB 3.95Å; C302-C403 WeakPolarHBondContact CB-SG 3.48Å; C302-C403 PolarHBondContact O-SG 2.92Å; C302-C403 VanDerWaalsContact SG-CA 3.51Å; C302-C403 WeakPolarHBondContact SG-CB 3.5Å; C302-C403 CovalentContact SG-SG 2.02Å; C302-C403 PolarHBondContact SG-SG 3.32Å
303	E	90.3	Very high	87.7	Confident	18 Å²	18	75 Å²	75	8%	0.084	37%	0.374	C	S	.	.	B	Isolated β-bridge	trans	-80.5	114.7	178.7	-172.6	66.8	-126.5	0	0	110.2	N305 R307 Y328 P400 I401 C403	E303-N305 VanDerWaalsContact OE1-CB 3.28Å; E303-N305 WeakPolarHBondContact OE1-CB 3.48Å; E303-N305 PolarHBondContact OE1-N 3.37Å; E303-N305 PolarHBondContact OE1-ND2 2.93Å; E303-R307 VanDerWaalsContact CD-CZ 3.44Å; E303-R307 IonicContact OE1-CZ 2.81Å; E303-R307 VanDerWaalsContact OE1-CZ 3.3Å; E303-R307 IonicContact OE1-NE 3.58Å; E303-R307 PolarHBondContact OE1-NE 3.37Å; E303-R307 IonicContact OE1-NH2 3.07Å; E303-R307 PolarHBondContact OE1-NH2 3.48Å; E303-R307 IonicContact OE2-CZ 2.54Å; E303-R307 IonicContact OE2-NE 3.21Å; E303-R307 PolarHBondContact OE2-NE 2.87Å; E303-R307 VanDerWaalsContact OE2-NE 3.1Å; E303-R307 IonicContact OE2-NH1 3.99Å; E303-R307 IonicContact OE2-NH2 2.79Å; E303-R307 PolarHBondContact OE2-NH2 3.1Å; E303-Y328 HydrophobicContact CB-CD1 4.24Å; E303-Y328 HydrophobicContact CB-CE1 3.82Å; E303-Y328 HydrophobicContact CG-CD1 4.23Å; E303-Y328 HydrophobicContact CG-CE1 4.15Å; E303-P400 HydrophobicContact CB-CG 4.29Å; E303-I401 PolarHBondContact N-O 3.34Å; E303-C403 PolarHBondContact O-N 2.02Å; E303-C403 PolarHBondContact O-SG 2.95Å
304	N	84.2	Confident	87.5	Confident	101 Å²	101	74 Å²	74	54%	0.54	37%	0.369	S	S	.	.			trans	-87.8	-22.8	174.6	-79.1	-54.7	0	0	0	112.8	N296 C302 C403	N296-N304 PolarHBondContact ND2-ND2 2.84Å; C302-N304 PolarHBondContact O-N 3.5Å; N304-C403 WeakPolarHBondContact OD1-CB 3.24Å; N304-C403 PolarHBondContact OD1-SG 3.17Å
305	N	74	Confident	87.3	Confident	102 Å²	102	71.6 Å²	71.6	55%	0.545	36%	0.36	S	S	.	.	S	Bend	trans	-81.6	139.1	-172.6	-60.1	-28.2	0	0	0	109.9	E303 R307	E303-N305 VanDerWaalsContact OE1-CB 3.28Å; E303-N305 WeakPolarHBondContact OE1-CB 3.48Å; E303-N305 PolarHBondContact OE1-N 3.37Å; E303-N305 PolarHBondContact OE1-ND2 2.93Å; N305-R307 HydrophobicContact CB-CG 3.94Å; N305-R307 PolarHBondContact O-N 3.21Å
306	E	78	Confident	87	Confident	189 Å²	189	72 Å²	72	88%	0.883	36%	0.363	S	S	*	.			trans	-70.3	67.3	165.8	-65.2	179	-178.4	0	0	109.1
307	R	86.4	Confident	86.7	Confident	119 Å²	119	72.6 Å²	72.6	45%	0.449	38%	0.379	S	S	.	.			trans	-72	142	171.5	-62.1	-170.2	-166.7	-173.3	9	107.9	E303 N305 Y328	E303-R307 VanDerWaalsContact CD-CZ 3.44Å; E303-R307 IonicContact OE1-CZ 2.81Å; E303-R307 VanDerWaalsContact OE1-CZ 3.3Å; E303-R307 IonicContact OE1-NE 3.58Å; E303-R307 PolarHBondContact OE1-NE 3.37Å; E303-R307 IonicContact OE1-NH2 3.07Å; E303-R307 PolarHBondContact OE1-NH2 3.48Å; E303-R307 IonicContact OE2-CZ 2.54Å; E303-R307 IonicContact OE2-NE 3.21Å; E303-R307 PolarHBondContact OE2-NE 2.87Å; E303-R307 VanDerWaalsContact OE2-NE 3.1Å; E303-R307 IonicContact OE2-NH1 3.99Å; E303-R307 IonicContact OE2-NH2 2.79Å; E303-R307 PolarHBondContact OE2-NH2 3.1Å; N305-R307 HydrophobicContact CB-CG 3.94Å; N305-R307 PolarHBondContact O-N 3.21Å; R307-Y328 HydrophobicContact CB-CD2 4.12Å; R307-Y328 HydrophobicContact CB-CG 4.45Å; R307-Y328 WeakPolarHBondContact O-CB 3.34Å; R307-Y328 PolarHBondContact O-N 2.96Å
308	N	91.4	Very high	86.8	Confident	100 Å²	100	76.1 Å²	76.1	54%	0.535	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	146.5	170	-64.1	-39.4	0	0	0	108.8	T325 M326	N308-T325 HydrophobicContact CB-CG2 3.4Å; N308-T325 VanDerWaalsContact CB-CG2 3.4Å; N308-M326 CarbonylContact C-O 3.55Å; N308-M326 VanDerWaalsContact CA-O 3.26Å; N308-M326 WeakPolarHBondContact CA-O 3.38Å
309	F	93.6	Very high	86.9	Confident	48 Å²	48	71 Å²	71	21%	0.211	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	142.5	173.6	-64.9	-61.1	0	0	0	110	T325 M326 Y328 L332 C333 L336	F309-T325 CarbonylContact O-C 3.53Å; F309-T325 WeakPolarHBondContact O-CA 3.46Å; F309-M326 PolarHBondContact N-O 3.23Å; F309-M326 PolarHBondContact O-N 3.47Å; F309-Y328 HydrophobicContact CD2-CD2 4.35Å; F309-Y328 AromaticContact CE2-CD2 3.26Å; F309-Y328 HydrophobicContact CE2-CD2 3.26Å; F309-Y328 AromaticContact CE2-CE2 3.79Å; F309-Y328 HydrophobicContact CE2-CE2 3.79Å; F309-Y328 HydrophobicContact CE2-CG 4.11Å; F309-Y328 AromaticContact CZ-CD2 3.42Å; F309-Y328 HydrophobicContact CZ-CD2 3.42Å; F309-Y328 VanDerWaalsContact CZ-CD2 3.42Å; F309-Y328 AromaticContact CZ-CE2 3.64Å; F309-Y328 HydrophobicContact CZ-CE2 3.64Å; F309-L332 HydrophobicContact CB-CD2 4.26Å; F309-L332 HydrophobicContact CD2-CD2 3.9Å; F309-L332 HydrophobicContact CD2-CG 4.11Å; F309-C333 HydrophobicContact CE2-CB 3.77Å; F309-C333 HydrophobicContact CZ-CB 3.67Å; F309-L336 HydrophobicContact CB-CD1 3.58Å; F309-L336 HydrophobicContact CD1-CD1 4.03Å; F309-L336 HydrophobicContact CD2-CD1 4.16Å; F309-L336 HydrophobicContact CG-CD1 3.68Å
310	S	94.3	Very high	87.3	Confident	35 Å²	35	71.6 Å²	71.6	25%	0.245	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	130	165.4	56.2	0	0	0	0	109.1	R324 G357	S310-R324 WeakPolarHBondContact CA-O 3.17Å; S310-G357 PolarHBondContact O-N 3.3Å
311	I	94.4	Very high	87.6	Confident	5 Å²	5	65.4 Å²	65.4	3%	0.026	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	147.9	171.6	69.2	168.3	0	0	0	109.5	Y266 Q323 R324 M326 L332 L336 P354 I355	Y266-I311 HydrophobicContact CD2-CD1 3.87Å; Y266-I311 HydrophobicContact CE2-CD1 3.96Å; I311-Q323 CarbonylContact O-C 3.4Å; I311-Q323 VanDerWaalsContact O-CA 3.3Å; I311-Q323 WeakPolarHBondContact O-CA 3.49Å; I311-R324 HydrophobicContact CG1-CB 4.43Å; I311-R324 PolarHBondContact N-O 3.2Å; I311-R324 PolarHBondContact O-N 3.42Å; I311-M326 HydrophobicContact CD1-CE 3.46Å; I311-M326 VanDerWaalsContact CD1-CE 3.46Å; I311-M326 HydrophobicContact CD1-CG 3.81Å; I311-M326 HydrophobicContact CG1-CE 4.21Å; I311-M326 HydrophobicContact CG1-CG 3.99Å; I311-M326 HydrophobicContact CG2-CG 4.28Å; I311-L332 HydrophobicContact CG2-CD1 4.29Å; I311-L336 HydrophobicContact CG2-CD1 4.34Å; I311-L336 HydrophobicContact CG2-CD2 4.15Å; I311-P354 HydrophobicContact CG2-CB 4.41Å; I311-I355 WeakPolarHBondContact CA-O 3.33Å
312	V	93.3	Very high	87.8	Confident	16 Å²	16	64.1 Å²	64.1	10%	0.097	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	135.2	172.7	-177.1	0	0	0	0	109.6	F321 N322 I355 M360 V363	V312-F321 HydrophobicContact CG1-CB 4.08Å; V312-F321 HydrophobicContact CG1-CD1 3.69Å; V312-F321 HydrophobicContact CG1-CG 4.23Å; V312-N322 WeakPolarHBondContact CA-O 3.45Å; V312-I355 HydrophobicContact CB-CB 4.14Å; V312-I355 HydrophobicContact CB-CG2 4.39Å; V312-I355 HydrophobicContact CG2-CB 4.13Å; V312-I355 HydrophobicContact CG2-CG2 3.86Å; V312-I355 PolarHBondContact N-O 3.41Å; V312-M360 HydrophobicContact CG1-CG 4.12Å; V312-M360 HydrophobicContact CG2-CB 3.8Å; V312-M360 HydrophobicContact CG2-CG 4.03Å; V312-V363 HydrophobicContact CG1-CG2 4.25Å; V312-V363 HydrophobicContact CG2-CG2 4.37Å
313	Y	91.2	Very high	87.8	Confident	39 Å²	39	68.6 Å²	68.6	15%	0.153	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	163.3	165.1	76.8	-78.2	0	0	0	108.9	D315 F321 N322 Q323 R324	Y313-D315 HydrophobicContact CE2-CB 3.8Å; Y313-D315 PolarHBondContact OH-OD2 2.82Å; Y313-F321 WeakPolarHBondContact O-CA 3.49Å; Y313-N322 HydrophobicContact CD1-CB 4.44Å; Y313-N322 WeakPolarHBondContact CD1-O 3.34Å; Y313-N322 HydrophobicContact CE1-CB 3.76Å; Y313-N322 PolarHBondContact N-O 2.04Å; Y313-N322 PolarHBondContact O-N 3.05Å; Y313-N322 PolarHBondContact OH-ND2 3.36Å; Y313-Q323 VanDerWaalsContact CE1-C 3.46Å; Y313-Q323 WeakPolarHBondContact CE1-O 3.39Å; Y313-R324 HydrophobicContact CD1-CB 3.61Å; Y313-R324 HydrophobicContact CE1-CB 3.78Å
314	F	88	Confident	87.8	Confident	5 Å²	5	70.2 Å²	70.2	2%	0.022	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	119.8	172.7	-175.5	-89.9	0	0	0	109.1	E159 I162 H316 F321	E159-F314 HydrophobicContact CB-CD2 4.46Å; E159-F314 HydrophobicContact CB-CE2 4.11Å; E159-F314 HydrophobicContact CB-CZ 4.49Å; E159-F314 HydrophobicContact CG-CE1 4.49Å; E159-F314 HydrophobicContact CG-CE2 3.72Å; E159-F314 HydrophobicContact CG-CZ 3.71Å; I162-F314 HydrophobicContact CD1-CB 3.31Å; I162-F314 HydrophobicContact CD1-CD1 3.58Å; I162-F314 HydrophobicContact CD1-CG 3.69Å; F314-H316 PolarHBondContact O-N 3.17Å; F314-F321 HydrophobicContact CB-CD1 4Å; F314-F321 HydrophobicContact CB-CE1 3.93Å; F314-F321 AromaticContact CD2-CD1 3.96Å; F314-F321 HydrophobicContact CD2-CD1 3.96Å; F314-F321 HydrophobicContact CD2-CD2 4.22Å; F314-F321 AromaticContact CD2-CE1 3.86Å; F314-F321 HydrophobicContact CD2-CE1 3.86Å; F314-F321 HydrophobicContact CD2-CE2 4.1Å; F314-F321 HydrophobicContact CD2-CG 4.15Å; F314-F321 AromaticContact CD2-CZ 3.92Å; F314-F321 HydrophobicContact CD2-CZ 3.92Å; F314-F321 HydrophobicContact CG-CE1 4.39Å
315	D	86.8	Confident	88.2	Confident	26 Å²	26	69.9 Å²	69.9	14%	0.139	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	106	177.2	-170.7	-36	0	0	0	109.2	Y313 A317 Q318 Q319 K320 N322	Y313-D315 HydrophobicContact CE2-CB 3.8Å; Y313-D315 PolarHBondContact OH-OD2 2.82Å; D315-A317 VanDerWaalsContact C-N 3.29Å; D315-A317 PolarHBondContact O-N 3.06Å; D315-A317 WeakPolarHBondContact OD1-CB 3.4Å; D315-A317 PolarHBondContact OD1-N 3.21Å; D315-Q318 HydrophobicContact CB-CB 4.13Å; D315-Q318 PolarHBondContact O-N 3.14Å; D315-Q318 PolarHBondContact OD1-N 2.8Å; D315-Q319 WeakPolarHBondContact O-CA 3.33Å; D315-Q319 PolarHBondContact O-N 3.49Å; D315-K320 WeakPolarHBondContact CB-O 3.43Å; D315-K320 PolarHBondContact N-O 3.5Å; D315-K320 PolarHBondContact O-N 3.3Å; D315-N322 HydrophobicContact CB-CB 4.28Å
316	H	80.2	Confident	89.1	Confident	74 Å²	74	65.9 Å²	65.9	34%	0.343	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-36	-179.4	-172.9	-96.9	0	0	0	112.6	Q163 F314 Q319	Q163-H316 PolarHBondContact NE2-CD2 3.46Å; Q163-H316 PolarHBondContact NE2-NE2 3.38Å; Q163-H316 VanDerWaalsContact NE2-NE2 3.15Å; F314-H316 PolarHBondContact O-N 3.17Å; H316-Q319 PolarHBondContact O-NE2 3.14Å
317	A	82.5	Confident	89.7	Confident	93 Å²	93	57.5 Å²	57.5	77%	0.769	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72	-37.8	-179.2	0	0	0	0	0	111.4	D315	D315-A317 VanDerWaalsContact C-N 3.29Å; D315-A317 PolarHBondContact O-N 3.06Å; D315-A317 WeakPolarHBondContact OD1-CB 3.4Å; D315-A317 PolarHBondContact OD1-N 3.21Å
318	Q	85.7	Confident	90	Very high	105 Å²	105	53.1 Å²	53.1	49%	0.491	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.5	-4.6	-179.8	-57.5	-171.7	2.6	0	0	113.8	D315 K320	D315-Q318 HydrophobicContact CB-CB 4.13Å; D315-Q318 PolarHBondContact O-N 3.14Å; D315-Q318 PolarHBondContact OD1-N 2.8Å; Q318-K320 HydrophobicContact CB-CD 4.26Å; Q318-K320 HydrophobicContact CB-CG 3.94Å; Q318-K320 PolarHBondContact O-N 3.45Å
319	Q	83.8	Confident	90.1	Very high	81 Å²	81	49.5 Å²	49.5	38%	0.379	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.3	41.5	-177	-65.6	-73.5	-59.8	0	0	113.1	Y117 D315 H316	Y117-Q319 PolarHBondContact OH-OE1 3.38Å; D315-Q319 WeakPolarHBondContact O-CA 3.33Å; D315-Q319 PolarHBondContact O-N 3.49Å; H316-Q319 PolarHBondContact O-NE2 3.14Å
320	K	90.1	Very high	90	Very high	106 Å²	106	49.5 Å²	49.5	46%	0.461	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.5	158.1	-179.9	69.5	-177.4	-174	-162.9	0	111.9	D315 Q318	D315-K320 WeakPolarHBondContact CB-O 3.43Å; D315-K320 PolarHBondContact N-O 3.5Å; D315-K320 PolarHBondContact O-N 3.3Å; Q318-K320 HydrophobicContact CB-CD 4.26Å; Q318-K320 HydrophobicContact CB-CG 3.94Å; Q318-K320 PolarHBondContact O-N 3.45Å
321	F	90.9	Very high	89.9	Confident	26 Å²	26	50.5 Å²	50.5	11%	0.114	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	137.9	168.3	-68.2	-74.6	0	0	0	110.7	M158 V312 Y313 F314 M360 V363 N364	M158-F321 HydrophobicContact CB-CE1 4.22Å; M158-F321 HydrophobicContact CB-CZ 4.22Å; M158-F321 HydrophobicContact CE-CE1 3.88Å; M158-F321 HydrophobicContact CE-CZ 4.06Å; M158-F321 HydrophobicContact SD-CE1 4.34Å; V312-F321 HydrophobicContact CG1-CB 4.08Å; V312-F321 HydrophobicContact CG1-CD1 3.69Å; V312-F321 HydrophobicContact CG1-CG 4.23Å; Y313-F321 WeakPolarHBondContact O-CA 3.49Å; F314-F321 HydrophobicContact CB-CD1 4Å; F314-F321 HydrophobicContact CB-CE1 3.93Å; F314-F321 AromaticContact CD2-CD1 3.96Å; F314-F321 HydrophobicContact CD2-CD1 3.96Å; F314-F321 HydrophobicContact CD2-CD2 4.22Å; F314-F321 AromaticContact CD2-CE1 3.86Å; F314-F321 HydrophobicContact CD2-CE1 3.86Å; F314-F321 HydrophobicContact CD2-CE2 4.1Å; F314-F321 HydrophobicContact CD2-CG 4.15Å; F314-F321 AromaticContact CD2-CZ 3.92Å; F314-F321 HydrophobicContact CD2-CZ 3.92Å; F314-F321 HydrophobicContact CG-CE1 4.39Å; F321-M360 HydrophobicContact CB-CG 4.08Å; F321-M360 HydrophobicContact CB-SD 4.25Å; F321-V363 HydrophobicContact CD1-CG1 4.19Å; F321-V363 HydrophobicContact CD2-CG1 4.07Å; F321-V363 HydrophobicContact CE1-CG1 3.86Å; F321-V363 HydrophobicContact CE2-CG1 3.75Å; F321-V363 HydrophobicContact CG-CG1 4.28Å; F321-V363 HydrophobicContact CZ-CG1 3.63Å; F321-N364 WeakPolarHBondContact CE2-OD1 3.5Å
322	N	92.4	Very high	89.9	Confident	47 Å²	47	50.3 Å²	50.3	25%	0.251	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	172.6	177.6	-160.3	-3.3	0	0	0	109	V312 Y313 D315	V312-N322 WeakPolarHBondContact CA-O 3.45Å; Y313-N322 HydrophobicContact CD1-CB 4.44Å; Y313-N322 WeakPolarHBondContact CD1-O 3.34Å; Y313-N322 HydrophobicContact CE1-CB 3.76Å; Y313-N322 PolarHBondContact N-O 2.04Å; Y313-N322 PolarHBondContact O-N 3.05Å; Y313-N322 PolarHBondContact OH-ND2 3.36Å; D315-N322 HydrophobicContact CB-CB 4.28Å
323	Q	92.4	Very high	90	Very high	106 Å²	106	50 Å²	50	50%	0.495	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	139.5	-179.5	62.1	177	-5.6	0	0	112	I311 Y313	I311-Q323 CarbonylContact O-C 3.4Å; I311-Q323 VanDerWaalsContact O-CA 3.3Å; I311-Q323 WeakPolarHBondContact O-CA 3.49Å; Y313-Q323 VanDerWaalsContact CE1-C 3.46Å; Y313-Q323 WeakPolarHBondContact CE1-O 3.39Å
324	R	90.8	Very high	90.1	Very high	51 Å²	51	49.8 Å²	49.8	19%	0.192	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	138.5	173.5	-174.8	177	-66.3	150.8	2.7	110	H202 S310 I311 Y313 M326	H202-R324 PolarHBondContact O-NH1 2.95Å; S310-R324 WeakPolarHBondContact CA-O 3.17Å; I311-R324 HydrophobicContact CG1-CB 4.43Å; I311-R324 PolarHBondContact N-O 3.2Å; I311-R324 PolarHBondContact O-N 3.42Å; Y313-R324 HydrophobicContact CD1-CB 3.61Å; Y313-R324 HydrophobicContact CE1-CB 3.78Å; R324-M326 HydrophobicContact CG-CE 4.23Å
325	T	92.9	Very high	90.5	Very high	94 Å²	94	51.3 Å²	51.3	58%	0.577	27%	0.272	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.2	127.6	176.9	-53.4	0	0	0	0	110.3	N308 F309	N308-T325 HydrophobicContact CB-CG2 3.4Å; N308-T325 VanDerWaalsContact CB-CG2 3.4Å; F309-T325 CarbonylContact O-C 3.53Å; F309-T325 WeakPolarHBondContact O-CA 3.46Å
326	M	92	Very high	90.9	Very high	18 Å²	18	50.7 Å²	50.7	9%	0.089	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	145.2	172.5	-62.4	-60.7	-175.3	0	0	109.5	N308 F309 I311 R324 L332	N308-M326 CarbonylContact C-O 3.55Å; N308-M326 VanDerWaalsContact CA-O 3.26Å; N308-M326 WeakPolarHBondContact CA-O 3.38Å; F309-M326 PolarHBondContact N-O 3.23Å; F309-M326 PolarHBondContact O-N 3.47Å; I311-M326 HydrophobicContact CD1-CE 3.46Å; I311-M326 VanDerWaalsContact CD1-CE 3.46Å; I311-M326 HydrophobicContact CD1-CG 3.81Å; I311-M326 HydrophobicContact CG1-CE 4.21Å; I311-M326 HydrophobicContact CG1-CG 3.99Å; I311-M326 HydrophobicContact CG2-CG 4.28Å; R324-M326 HydrophobicContact CG-CE 4.23Å; M326-L332 HydrophobicContact CB-CD2 3.73Å; M326-L332 HydrophobicContact CG-CD2 4.46Å
327	G	91.2	Very high	91.6	Very high	14 Å²	14	50 Å²	50	14%	0.144	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.9	152.4	173.5	0	0	0	0	0	111.8	S264 T329	S264-G327 PolarHBondContact O-N 2.63Å; G327-T329 PolarHBondContact O-N 2.98Å
328	Y	92.7	Very high	92.3	Very high	26 Å²	26	46.4 Å²	46.4	10%	0.102	24%	0.235	C	C	.	.			trans	-60.1	125.2	176.9	-177.4	-90.2	0	0	0	112	E303 R307 F309 C333 C399 P400 P402	E303-Y328 HydrophobicContact CB-CD1 4.24Å; E303-Y328 HydrophobicContact CB-CE1 3.82Å; E303-Y328 HydrophobicContact CG-CD1 4.23Å; E303-Y328 HydrophobicContact CG-CE1 4.15Å; R307-Y328 HydrophobicContact CB-CD2 4.12Å; R307-Y328 HydrophobicContact CB-CG 4.45Å; R307-Y328 WeakPolarHBondContact O-CB 3.34Å; R307-Y328 PolarHBondContact O-N 2.96Å; F309-Y328 HydrophobicContact CD2-CD2 4.35Å; F309-Y328 AromaticContact CE2-CD2 3.26Å; F309-Y328 HydrophobicContact CE2-CD2 3.26Å; F309-Y328 AromaticContact CE2-CE2 3.79Å; F309-Y328 HydrophobicContact CE2-CE2 3.79Å; F309-Y328 HydrophobicContact CE2-CG 4.11Å; F309-Y328 AromaticContact CZ-CD2 3.42Å; F309-Y328 HydrophobicContact CZ-CD2 3.42Å; F309-Y328 VanDerWaalsContact CZ-CD2 3.42Å; F309-Y328 AromaticContact CZ-CE2 3.64Å; F309-Y328 HydrophobicContact CZ-CE2 3.64Å; Y328-C333 HydrophobicContact CE2-CB 3.79Å; Y328-C399 WeakPolarHBondContact OH-CA 3.43Å; Y328-P400 VanDerWaalsContact CE1-O 3.3Å; Y328-P400 WeakPolarHBondContact CE1-O 3.27Å; Y328-P400 PolarHBondContact OH-O 2.71Å; Y328-P402 HydrophobicContact CD1-CB 4.43Å
329	T	92.1	Very high	92.8	Very high	25 Å²	25	41.4 Å²	41.4	15%	0.153	21%	0.212	C	C	.	.			trans	-127.7	150.3	155.8	67.5	0	0	0	0	107.9	G327 T331 L332 C333	G327-T329 PolarHBondContact O-N 2.98Å; T329-T331 PolarHBondContact O-N 2.95Å; T329-T331 PolarHBondContact OG1-OG1 3.08Å; T329-T331 VanDerWaalsContact OG1-OG1 3.05Å; T329-L332 PolarHBondContact O-N 3.4Å; T329-L332 WeakPolarHBondContact OG1-CB 3.07Å; T329-L332 PolarHBondContact OG1-N 2.8Å; T329-L332 VanDerWaalsContact OG1-N 3.08Å; T329-C333 WeakPolarHBondContact O-CB 3.04Å; T329-C333 PolarHBondContact O-N 2.78Å
330	D	91.6	Very high	93.3	Very high	48 Å²	48	39.2 Å²	39.2	26%	0.257	21%	0.205	S	C	.	.	H	α-helix	trans	-59.9	-39.6	175.4	60.2	-44.5	0	0	0	111	C333 I334	D330-C333 WeakPolarHBondContact O-CB 3.38Å; D330-C333 PolarHBondContact O-N 3.35Å; D330-I334 WeakPolarHBondContact O-CD1 3.37Å; D330-I334 VanDerWaalsContact O-CG1 3.25Å; D330-I334 WeakPolarHBondContact O-CG1 3.06Å; D330-I334 PolarHBondContact O-N 2.88Å
331	T	92.7	Very high	93.6	Very high	56 Å²	56	34.9 Å²	34.9	34%	0.344	19%	0.189	S	C	.	.	H	α-helix	trans	-61.8	-48.5	176.5	56.2	0	0	0	0	112.7	T329 I334 Q335	T329-T331 PolarHBondContact O-N 2.95Å; T329-T331 PolarHBondContact OG1-OG1 3.08Å; T329-T331 VanDerWaalsContact OG1-OG1 3.05Å; T331-I334 PolarHBondContact O-N 3.39Å; T331-Q335 WeakPolarHBondContact O-CG 3.34Å; T331-Q335 PolarHBondContact O-N 3.05Å
332	L	94.4	Very high	93.9	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-65.6	-40.6	178.1	179.1	62.4	0	0	0	111	Y266 F309 I311 M326 T329 I334 Q335 L336 P354	Y266-L332 HydrophobicContact CD1-CD1 4.38Å; Y266-L332 HydrophobicContact CD2-CD1 4.42Å; Y266-L332 HydrophobicContact CG-CD1 4.07Å; F309-L332 HydrophobicContact CB-CD2 4.26Å; F309-L332 HydrophobicContact CD2-CD2 3.9Å; F309-L332 HydrophobicContact CD2-CG 4.11Å; I311-L332 HydrophobicContact CG2-CD1 4.29Å; M326-L332 HydrophobicContact CB-CD2 3.73Å; M326-L332 HydrophobicContact CG-CD2 4.46Å; T329-L332 PolarHBondContact O-N 3.4Å; T329-L332 WeakPolarHBondContact OG1-CB 3.07Å; T329-L332 PolarHBondContact OG1-N 2.8Å; T329-L332 VanDerWaalsContact OG1-N 3.08Å; L332-I334 VanDerWaalsContact C-N 3.33Å; L332-I334 PolarHBondContact O-N 3.25Å; L332-Q335 PolarHBondContact O-N 3.46Å; L332-L336 HydrophobicContact CD1-CD1 3.95Å; L332-L336 HydrophobicContact CD1-CD2 4.38Å; L332-L336 HydrophobicContact CD1-CG 3.91Å; L332-L336 HydrophobicContact CD2-CD1 4.47Å; L332-L336 HydrophobicContact CG-CD1 3.85Å; L332-L336 HydrophobicContact CG-CG 4.23Å; L332-L336 WeakPolarHBondContact O-CB 3.46Å; L332-L336 VanDerWaalsContact O-CG 3.27Å; L332-L336 WeakPolarHBondContact O-CG 3.47Å; L332-L336 PolarHBondContact O-N 2.87Å; L332-P354 HydrophobicContact CD1-CG 3.69Å
333	C	95.3	Very high	94.1	Very high	11 Å²	11	31.4 Å²	31.4	7%	0.074	17%	0.172	C	C	.	.	H	α-helix	trans	-55.6	-48.9	174.7	178.8	0	0	0	0	111.1	F309 Y328 T329 D330 L336 L337 C399	F309-C333 HydrophobicContact CE2-CB 3.77Å; F309-C333 HydrophobicContact CZ-CB 3.67Å; Y328-C333 HydrophobicContact CE2-CB 3.79Å; T329-C333 WeakPolarHBondContact O-CB 3.04Å; T329-C333 PolarHBondContact O-N 2.78Å; D330-C333 WeakPolarHBondContact O-CB 3.38Å; D330-C333 PolarHBondContact O-N 3.35Å; C333-L336 PolarHBondContact O-N 3.35Å; C333-L337 WeakPolarHBondContact O-CG 3.46Å; C333-L337 PolarHBondContact O-N 2.67Å; C333-C399 HydrophobicContact CB-CB 3.65Å; C333-C399 WeakPolarHBondContact CB-SG 3.46Å; C333-C399 WeakPolarHBondContact SG-CB 3.48Å; C333-C399 CovalentContact SG-SG 2.04Å; C333-C399 PolarHBondContact SG-SG 3.11Å
334	I	94.5	Very high	94.3	Very high	34 Å²	34	33.3 Å²	33.3	17%	0.174	18%	0.181	C	C	.	.	H	α-helix	trans	-62.6	-47.4	178.6	-68	164.5	0	0	0	110.7	D330 T331 L332 L336 L337 I338 R396 C399	D330-I334 WeakPolarHBondContact O-CD1 3.37Å; D330-I334 VanDerWaalsContact O-CG1 3.25Å; D330-I334 WeakPolarHBondContact O-CG1 3.06Å; D330-I334 PolarHBondContact O-N 2.88Å; T331-I334 PolarHBondContact O-N 3.39Å; L332-I334 VanDerWaalsContact C-N 3.33Å; L332-I334 PolarHBondContact O-N 3.25Å; I334-L336 PolarHBondContact O-N 2.98Å; I334-L337 PolarHBondContact O-N 2.79Å; I334-I338 HydrophobicContact CG2-CD1 3.65Å; I334-I338 HydrophobicContact CG2-CG1 4.34Å; I334-I338 VanDerWaalsContact O-CG1 3.26Å; I334-I338 WeakPolarHBondContact O-CG1 3.33Å; I334-I338 PolarHBondContact O-N 3.03Å; I334-R396 HydrophobicContact CD1-CG 3.94Å; I334-C399 HydrophobicContact CD1-CB 4.42Å; I334-C399 HydrophobicContact CG1-CB 3.74Å; I334-C399 PolarHBondContact N-SG 2.8Å
335	Q	94.6	Very high	94.5	Very high	37 Å²	37	36 Å²	36	17%	0.173	20%	0.196	C	C	.	.	H	α-helix	trans	-59.9	-44.4	-179.8	-72.6	174.5	-10.8	0	0	112.2	T331 L332 I338 Q339 M353 P354	T331-Q335 WeakPolarHBondContact O-CG 3.34Å; T331-Q335 PolarHBondContact O-N 3.05Å; L332-Q335 PolarHBondContact O-N 3.46Å; Q335-I338 PolarHBondContact O-N 2.8Å; Q335-Q339 WeakPolarHBondContact O-CB 3.16Å; Q335-Q339 PolarHBondContact O-N 2.81Å; Q335-M353 HydrophobicContact CB-CB 4.34Å; Q335-M353 HydrophobicContact CB-CG 4.08Å; Q335-M353 HydrophobicContact CB-SD 4.4Å; Q335-M353 HydrophobicContact CG-CG 4.12Å; Q335-P354 HydrophobicContact CB-CG 4.44Å
336	L	95.9	Very high	94.6	Very high	13 Å²	13	32.4 Å²	32.4	7%	0.068	17%	0.174	C	C	.	.	H	α-helix	trans	-68	-39.1	179.5	-68	175.7	0	0	0	112.5	F309 I311 L332 C333 I334 Q339 S340 P354 P356	F309-L336 HydrophobicContact CB-CD1 3.58Å; F309-L336 HydrophobicContact CD1-CD1 4.03Å; F309-L336 HydrophobicContact CD2-CD1 4.16Å; F309-L336 HydrophobicContact CG-CD1 3.68Å; I311-L336 HydrophobicContact CG2-CD1 4.34Å; I311-L336 HydrophobicContact CG2-CD2 4.15Å; L332-L336 HydrophobicContact CD1-CD1 3.95Å; L332-L336 HydrophobicContact CD1-CD2 4.38Å; L332-L336 HydrophobicContact CD1-CG 3.91Å; L332-L336 HydrophobicContact CD2-CD1 4.47Å; L332-L336 HydrophobicContact CG-CD1 3.85Å; L332-L336 HydrophobicContact CG-CG 4.23Å; L332-L336 WeakPolarHBondContact O-CB 3.46Å; L332-L336 VanDerWaalsContact O-CG 3.27Å; L332-L336 WeakPolarHBondContact O-CG 3.47Å; L332-L336 PolarHBondContact O-N 2.87Å; C333-L336 PolarHBondContact O-N 3.35Å; I334-L336 PolarHBondContact O-N 2.98Å; L336-Q339 PolarHBondContact O-N 2.69Å; L336-S340 VanDerWaalsContact O-CB 3.3Å; L336-S340 WeakPolarHBondContact O-CB 3.25Å; L336-S340 PolarHBondContact O-N 3.48Å; L336-P354 HydrophobicContact CD2-CB 4.27Å; L336-P354 HydrophobicContact CD2-CG 4Å; L336-P356 HydrophobicContact CB-CG 4.3Å; L336-P356 HydrophobicContact CD2-CB 4.31Å; L336-P356 HydrophobicContact CD2-CG 3.95Å
337	L	96.1	Very high	94.8	Very high	58 Å²	58	36.7 Å²	36.7	30%	0.304	19%	0.194	S	C	.	.	H	α-helix	trans	-65.6	-42.9	175.8	-72.7	-179.9	0	0	0	111.9	C333 I334 S340 A341 F395 L398 C399	C333-L337 WeakPolarHBondContact O-CG 3.46Å; C333-L337 PolarHBondContact O-N 2.67Å; I334-L337 PolarHBondContact O-N 2.79Å; L337-S340 PolarHBondContact O-N 3.27Å; L337-A341 WeakPolarHBondContact O-CB 3.31Å; L337-A341 PolarHBondContact O-N 2.83Å; L337-F395 HydrophobicContact CB-CD1 4.02Å; L337-F395 HydrophobicContact CB-CD2 4.12Å; L337-F395 HydrophobicContact CB-CE1 4.16Å; L337-F395 HydrophobicContact CB-CE2 4.23Å; L337-F395 HydrophobicContact CB-CG 4Å; L337-F395 HydrophobicContact CB-CZ 4.26Å; L337-F395 HydrophobicContact CD1-CB 4.26Å; L337-F395 HydrophobicContact CD1-CD1 3.91Å; L337-F395 HydrophobicContact CD1-CG 4.21Å; L337-L398 HydrophobicContact CD1-CB 4.24Å; L337-L398 HydrophobicContact CD1-CD1 4.43Å; L337-C399 WeakPolarHBondContact CD1-SG 3.41Å
338	I	95.6	Very high	95	Very high	19 Å²	19	36 Å²	36	10%	0.097	19%	0.187	C	C	.	.	H	α-helix	trans	-62.2	-48.9	175.7	-67.6	171.8	0	0	0	110.1	I334 Q335 S340 A341 I342 M353 R388 F395	I334-I338 HydrophobicContact CG2-CD1 3.65Å; I334-I338 HydrophobicContact CG2-CG1 4.34Å; I334-I338 VanDerWaalsContact O-CG1 3.26Å; I334-I338 WeakPolarHBondContact O-CG1 3.33Å; I334-I338 PolarHBondContact O-N 3.03Å; Q335-I338 PolarHBondContact O-N 2.8Å; I338-S340 VanDerWaalsContact C-N 3.3Å; I338-S340 PolarHBondContact O-N 3.04Å; I338-A341 PolarHBondContact O-N 2.85Å; I338-I342 HydrophobicContact CG2-CD1 3.68Å; I338-I342 HydrophobicContact CG2-CG1 4.31Å; I338-I342 WeakPolarHBondContact O-CG1 3.35Å; I338-I342 PolarHBondContact O-N 3.4Å; I338-M353 HydrophobicContact CB-CE 4.24Å; I338-M353 HydrophobicContact CB-SD 3.75Å; I338-M353 HydrophobicContact CD1-SD 4.48Å; I338-M353 HydrophobicContact CG2-CE 3.48Å; I338-M353 VanDerWaalsContact CG2-CE 3.48Å; I338-M353 HydrophobicContact CG2-SD 3.56Å; I338-M353 VanDerWaalsContact CG2-SD 3.56Å; I338-R388 HydrophobicContact CG2-CG 3.63Å; I338-F395 HydrophobicContact CB-CD2 4.5Å; I338-F395 HydrophobicContact CB-CE2 4.39Å; I338-F395 HydrophobicContact CG1-CD2 3.48Å; I338-F395 VanDerWaalsContact CG1-CD2 3.48Å; I338-F395 HydrophobicContact CG1-CE2 3.78Å
339	Q	96.3	Very high	95.2	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-60.2	-42.4	179.9	-173.6	69.5	-12.4	0	0	111.8	Q335 L336 A341 I342 M343 I349 D350 M353	Q335-Q339 WeakPolarHBondContact O-CB 3.16Å; Q335-Q339 PolarHBondContact O-N 2.81Å; L336-Q339 PolarHBondContact O-N 2.69Å; Q339-A341 VanDerWaalsContact C-N 3.34Å; Q339-A341 PolarHBondContact O-N 3.07Å; Q339-I342 PolarHBondContact O-N 2.91Å; Q339-M343 HydrophobicContact CG-CG 4.44Å; Q339-M343 HydrophobicContact CG-SD 3.98Å; Q339-M343 WeakPolarHBondContact O-CB 3.34Å; Q339-M343 VanDerWaalsContact O-CG 3.28Å; Q339-M343 WeakPolarHBondContact O-CG 3.41Å; Q339-M343 PolarHBondContact O-N 3.38Å; Q339-I349 VanDerWaalsContact NE2-CG2 3.32Å; Q339-D350 PolarHBondContact NE2-O 2.76Å; Q339-D350 PolarHBondContact OE1-O 3.18Å; Q339-M353 HydrophobicContact CB-CB 4.26Å
340	S	96.1	Very high	95.3	Very high	34 Å²	34	34 Å²	34	24%	0.238	18%	0.177	C	C	.	.	H	α-helix	trans	-60.7	-43.8	177.1	-170.2	0	0	0	0	111.9	L336 L337 I338 M343 E344 Q359	L336-S340 VanDerWaalsContact O-CB 3.3Å; L336-S340 WeakPolarHBondContact O-CB 3.25Å; L336-S340 PolarHBondContact O-N 3.48Å; L337-S340 PolarHBondContact O-N 3.27Å; I338-S340 VanDerWaalsContact C-N 3.3Å; I338-S340 PolarHBondContact O-N 3.04Å; S340-M343 PolarHBondContact O-N 3.13Å; S340-E344 WeakPolarHBondContact O-CB 3.44Å; S340-E344 PolarHBondContact O-N 3.17Å; S340-Q359 PolarHBondContact OG-NE2 3.03Å; S340-Q359 VanDerWaalsContact OG-NE2 3.1Å
341	A	96.2	Very high	95.4	Very high	15 Å²	15	32.8 Å²	32.8	12%	0.124	17%	0.169	C	C	.	.	H	α-helix	trans	-65.8	-39.7	176.7	0	0	0	0	0	112.7	L337 I338 Q339 E344 E345 V387 F395	L337-A341 WeakPolarHBondContact O-CB 3.31Å; L337-A341 PolarHBondContact O-N 2.83Å; I338-A341 PolarHBondContact O-N 2.85Å; Q339-A341 VanDerWaalsContact C-N 3.34Å; Q339-A341 PolarHBondContact O-N 3.07Å; A341-E344 PolarHBondContact O-N 2.66Å; A341-E345 VanDerWaalsContact O-CB 3.31Å; A341-E345 WeakPolarHBondContact O-CB 3.48Å; A341-E345 PolarHBondContact O-N 3.32Å; A341-V387 HydrophobicContact CB-CG1 3.73Å; A341-F395 HydrophobicContact CB-CE2 4.31Å; A341-F395 HydrophobicContact CB-CZ 3.99Å
342	I	96.8	Very high	95.3	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-65.2	-44.2	175.9	-66.8	167.5	0	0	0	110.5	I338 Q339 E344 C346 Q347 D350 M353 S384 V387 R388	I338-I342 HydrophobicContact CG2-CD1 3.68Å; I338-I342 HydrophobicContact CG2-CG1 4.31Å; I338-I342 WeakPolarHBondContact O-CG1 3.35Å; I338-I342 PolarHBondContact O-N 3.4Å; Q339-I342 PolarHBondContact O-N 2.91Å; I342-E344 VanDerWaalsContact C-N 3.28Å; I342-E344 PolarHBondContact O-N 2.92Å; I342-C346 HydrophobicContact CG2-CB 4.15Å; I342-C346 WeakPolarHBondContact O-CA 3.43Å; I342-C346 VanDerWaalsContact O-CB 3.25Å; I342-C346 WeakPolarHBondContact O-CB 3.36Å; I342-C346 PolarHBondContact O-N 2.92Å; I342-Q347 PolarHBondContact O-N 2.8Å; I342-D350 HydrophobicContact CD1-CB 3.98Å; I342-M353 HydrophobicContact CD1-CE 3.65Å; I342-S384 WeakPolarHBondContact CD1-OG 3.2Å; I342-V387 HydrophobicContact CG1-CB 4.2Å; I342-V387 HydrophobicContact CG1-CG1 3.86Å; I342-R388 HydrophobicContact CD1-CG 4.09Å
343	M	96.6	Very high	95.3	Very high	1 Å²	1	34 Å²	34	1%	0.005	17%	0.173	C	C	.	.	H	α-helix	trans	-63.1	-36.5	178.7	-71.2	176.6	71.5	0	0	111.8	Q339 S340 Q347 I349 I355 Q359 L362 L366	Q339-M343 HydrophobicContact CG-CG 4.44Å; Q339-M343 HydrophobicContact CG-SD 3.98Å; Q339-M343 WeakPolarHBondContact O-CB 3.34Å; Q339-M343 VanDerWaalsContact O-CG 3.28Å; Q339-M343 WeakPolarHBondContact O-CG 3.41Å; Q339-M343 PolarHBondContact O-N 3.38Å; S340-M343 PolarHBondContact O-N 3.13Å; M343-Q347 WeakPolarHBondContact O-CA 3.41Å; M343-Q347 PolarHBondContact O-N 3.31Å; M343-Q347 PolarHBondContact O-NE2 3.44Å; M343-I349 HydrophobicContact CE-CD1 4.5Å; M343-I349 HydrophobicContact CE-CG1 4.22Å; M343-I349 HydrophobicContact CG-CG1 4.31Å; M343-I349 HydrophobicContact SD-CG1 4.42Å; M343-I355 HydrophobicContact CE-CG2 4.17Å; M343-I355 HydrophobicContact SD-CG2 4Å; M343-Q359 HydrophobicContact CE-CB 3.84Å; M343-Q359 HydrophobicContact SD-CB 4.41Å; M343-Q359 PolarHBondContact SD-OE1 3.1Å; M343-L362 HydrophobicContact CE-CB 3.76Å; M343-L362 HydrophobicContact CE-CD1 4.19Å; M343-L366 HydrophobicContact CB-CD1 4.11Å; M343-L366 HydrophobicContact CE-CD1 3.92Å; M343-L366 HydrophobicContact CG-CD1 4.23Å
344	E	95.2	Very high	95.2	Very high	146 Å²	146	34.2 Å²	34.2	68%	0.682	17%	0.174	S	C	*	.	H	α-helix	trans	-75.4	-51.5	178.2	-171.5	175.8	-175.9	0	0	112.7	S340 A341 I342 Q347	S340-E344 WeakPolarHBondContact O-CB 3.44Å; S340-E344 PolarHBondContact O-N 3.17Å; A341-E344 PolarHBondContact O-N 2.66Å; I342-E344 VanDerWaalsContact C-N 3.28Å; I342-E344 PolarHBondContact O-N 2.92Å; E344-Q347 PolarHBondContact O-NE2 2.03Å
345	E	95.7	Very high	95.3	Very high	108 Å²	108	33 Å²	33	51%	0.505	17%	0.168	S	C	.	.	H	α-helix	trans	-83.3	-37.7	-172.4	-169.5	167.2	-177	0	0	112.8	A341 V387	A341-E345 VanDerWaalsContact O-CB 3.31Å; A341-E345 WeakPolarHBondContact O-CB 3.48Å; A341-E345 PolarHBondContact O-N 3.32Å; E345-V387 HydrophobicContact CB-CG2 4.12Å; E345-V387 HydrophobicContact CG-CG2 4.09Å; E345-V387 WeakPolarHBondContact OE2-CG2 3.22Å
346	C	95.7	Very high	95.3	Very high	18 Å²	18	31.7 Å²	31.7	12%	0.122	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.6	-8.4	-174.2	-51.8	0	0	0	0	114.4	I342 C348 C383 S384	I342-C346 HydrophobicContact CG2-CB 4.15Å; I342-C346 WeakPolarHBondContact O-CA 3.43Å; I342-C346 VanDerWaalsContact O-CB 3.25Å; I342-C346 WeakPolarHBondContact O-CB 3.36Å; I342-C346 PolarHBondContact O-N 2.92Å; C346-C348 PolarHBondContact O-N 3.12Å; C346-C383 WeakPolarHBondContact CA-SG 3.34Å; C346-C383 HydrophobicContact CB-CB 3.78Å; C346-C383 WeakPolarHBondContact CB-SG 3.46Å; C346-C383 WeakPolarHBondContact SG-CB 3.33Å; C346-C383 CovalentContact SG-SG 2.04Å; C346-C383 PolarHBondContact SG-SG 2.75Å; C346-S384 PolarHBondContact SG-N 3.08Å
347	Q	95.7	Very high	95.2	Very high	108 Å²	108	31.4 Å²	31.4	51%	0.505	16%	0.163	S	C	.	.	S	Bend	trans	51.2	41.6	-178.7	-60.6	-66.6	-48.6	0	0	112.4	I342 M343 E344 L366	I342-Q347 PolarHBondContact O-N 2.8Å; M343-Q347 WeakPolarHBondContact O-CA 3.41Å; M343-Q347 PolarHBondContact O-N 3.31Å; M343-Q347 PolarHBondContact O-NE2 3.44Å; E344-Q347 PolarHBondContact O-NE2 2.03Å; Q347-L366 HydrophobicContact CB-CD2 4.29Å
348	C	96.3	Very high	95.1	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	18%	0.183	C	C	.	.	S	Bend	trans	-147.8	161.2	176.7	67.5	0	0	0	0	110.8	C346 P367 C369	C346-C348 PolarHBondContact O-N 3.12Å; C348-P367 CarbonylContact C-O 3.55Å; C348-P367 VanDerWaalsContact CA-O 3.3Å; C348-P367 WeakPolarHBondContact CA-O 3.27Å; C348-P367 WeakPolarHBondContact CB-O 3.39Å; C348-C369 VanDerWaalsContact C-SG 3.51Å; C348-C369 HydrophobicContact CB-CB 3.88Å; C348-C369 WeakPolarHBondContact CB-SG 3.21Å; C348-C369 VanDerWaalsContact SG-CA 3.53Å; C348-C369 WeakPolarHBondContact SG-CB 3.47Å; C348-C369 CovalentContact SG-SG 2.04Å; C348-C369 PolarHBondContact SG-SG 2.9Å
349	I	96	Very high	94.9	Very high	2 Å²	2	34.8 Å²	34.8	1%	0.01	19%	0.185	C	C	.	.	B	Isolated β-bridge	trans	-102.1	127.5	178.4	-65.6	173.5	0	0	0	108.2	Q339 M343 I355 L366 P367 F368 C369	Q339-I349 VanDerWaalsContact NE2-CG2 3.32Å; M343-I349 HydrophobicContact CE-CD1 4.5Å; M343-I349 HydrophobicContact CE-CG1 4.22Å; M343-I349 HydrophobicContact CG-CG1 4.31Å; M343-I349 HydrophobicContact SD-CG1 4.42Å; I349-I355 HydrophobicContact CD1-CD1 4.18Å; I349-I355 HydrophobicContact CG2-CD1 3.8Å; I349-I355 HydrophobicContact CG2-CG1 4.09Å; I349-L366 HydrophobicContact CD1-CB 3.97Å; I349-L366 HydrophobicContact CG1-CB 3.84Å; I349-L366 HydrophobicContact CG1-CD1 4.46Å; I349-P367 PolarHBondContact N-O 2.86Å; I349-F368 HydrophobicContact CB-CD1 4.2Å; I349-F368 HydrophobicContact CB-CE1 4.36Å; I349-F368 HydrophobicContact CG2-CD1 3.98Å; I349-F368 HydrophobicContact CG2-CE1 3.74Å; I349-F368 CarbonylContact O-C 3.57Å; I349-F368 VanDerWaalsContact O-CA 3.25Å; I349-F368 WeakPolarHBondContact O-CA 3.4Å; I349-C369 PolarHBondContact O-N 2.83Å; I349-C369 PolarHBondContact O-SG 2.82Å
350	D	94.8	Very high	94.7	Very high	6 Å²	6	37.6 Å²	37.6	3%	0.032	20%	0.199	C	C	.	.			trans	-84.9	131.3	169.8	-152.3	-52.6	0	0	0	110.3	Q339 I342 L352 M353 S384 R388	Q339-D350 PolarHBondContact NE2-O 2.76Å; Q339-D350 PolarHBondContact OE1-O 3.18Å; I342-D350 HydrophobicContact CD1-CB 3.98Å; D350-L352 VanDerWaalsContact C-N 3.34Å; D350-L352 PolarHBondContact OD1-N 3.08Å; D350-M353 HydrophobicContact CB-CE 3.86Å; D350-S384 PolarHBondContact OD2-OG 3.31Å; D350-R388 IonicContact OD1-NH2 2.68Å; D350-R388 PolarHBondContact OD1-NH2 2.74Å; D350-R388 IonicContact OD2-CZ 3.89Å; D350-R388 VanDerWaalsContact OD2-CZ 3.3Å; D350-R388 IonicContact OD2-NE 3.13Å; D350-R388 PolarHBondContact OD2-NE 3.43Å; D350-R388 IonicContact OD2-NH2 2.99Å; D350-R388 PolarHBondContact OD2-NH2 3.12Å
351	F	92.4	Very high	94.5	Very high	23 Å²	23	43.8 Å²	43.8	10%	0.101	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.9	-11.9	-173.9	68.5	-97.7	0	0	0	113.2	D145 A150 Y153 Q154 Y206 M353 F368	D145-F351 HydrophobicContact CB-CZ 4.42Å; A150-F351 HydrophobicContact CB-CE2 4.31Å; A150-F351 HydrophobicContact CB-CZ 4.08Å; Y153-F351 HydrophobicContact CD1-CB 4.24Å; Y153-F351 HydrophobicContact CE1-CB 4.05Å; Q154-F351 HydrophobicContact CG-CD1 3.62Å; Q154-F351 HydrophobicContact CG-CE1 4.12Å; Q154-F351 HydrophobicContact CG-CG 4.2Å; Q154-F351 VanDerWaalsContact NE2-CE1 3.29Å; Y206-F351 AromaticContact CD1-CD2 3.41Å; Y206-F351 HydrophobicContact CD1-CD2 3.41Å; Y206-F351 VanDerWaalsContact CD1-CD2 3.41Å; Y206-F351 AromaticContact CD1-CE2 3.67Å; Y206-F351 HydrophobicContact CD1-CE2 3.67Å; Y206-F351 AromaticContact CD2-CD2 3.74Å; Y206-F351 HydrophobicContact CD2-CD2 3.74Å; Y206-F351 AromaticContact CD2-CE2 3.43Å; Y206-F351 HydrophobicContact CD2-CE2 3.43Å; Y206-F351 VanDerWaalsContact CD2-CE2 3.43Å; Y206-F351 HydrophobicContact CE1-CD2 4.01Å; Y206-F351 AromaticContact CE1-CE2 3.85Å; Y206-F351 HydrophobicContact CE1-CE2 3.85Å; Y206-F351 HydrophobicContact CE2-CD2 4.3Å; Y206-F351 AromaticContact CE2-CE2 3.62Å; Y206-F351 HydrophobicContact CE2-CE2 3.62Å; Y206-F351 AromaticContact CG-CD2 3.24Å; Y206-F351 HydrophobicContact CG-CD2 3.24Å; Y206-F351 AromaticContact CG-CE2 3.45Å; Y206-F351 HydrophobicContact CG-CE2 3.45Å; Y206-F351 VanDerWaalsContact CG-CE2 3.45Å; Y206-F351 HydrophobicContact CG-CG 4.42Å; Y206-F351 AromaticContact CZ-CE2 3.81Å; F351-M353 VanDerWaalsContact C-N 3.33Å; F351-F368 HydrophobicContact CB-CD1 3.86Å; F351-F368 HydrophobicContact CB-CE1 4.02Å
352	L	92.1	Very high	94.4	Very high	63 Å²	63	45.7 Å²	45.7	33%	0.33	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.4	-15.9	179.5	-67.8	-164	0	0	0	113.9	E144 Y206 D350	E144-L352 HydrophobicContact CB-CD1 4.13Å; E144-L352 WeakPolarHBondContact OE2-CD1 3.47Å; E144-L352 WeakPolarHBondContact OE2-CG 3.36Å; Y206-L352 HydrophobicContact CD1-CD2 3.95Å; Y206-L352 HydrophobicContact CE1-CD2 3.26Å; D350-L352 VanDerWaalsContact C-N 3.34Å; D350-L352 PolarHBondContact OD1-N 3.08Å
353	M	92.7	Very high	94.1	Very high	19 Å²	19	46.2 Å²	46.2	9%	0.094	24%	0.235	C	C	.	.	S	Bend	trans	-125.8	147.8	-171.4	-68.2	172.3	-65.6	0	0	111.8	Q335 I338 Q339 I342 D350 F351	Q335-M353 HydrophobicContact CB-CB 4.34Å; Q335-M353 HydrophobicContact CB-CG 4.08Å; Q335-M353 HydrophobicContact CB-SD 4.4Å; Q335-M353 HydrophobicContact CG-CG 4.12Å; I338-M353 HydrophobicContact CB-CE 4.24Å; I338-M353 HydrophobicContact CB-SD 3.75Å; I338-M353 HydrophobicContact CD1-SD 4.48Å; I338-M353 HydrophobicContact CG2-CE 3.48Å; I338-M353 VanDerWaalsContact CG2-CE 3.48Å; I338-M353 HydrophobicContact CG2-SD 3.56Å; I338-M353 VanDerWaalsContact CG2-SD 3.56Å; Q339-M353 HydrophobicContact CB-CB 4.26Å; I342-M353 HydrophobicContact CD1-CE 3.65Å; D350-M353 HydrophobicContact CB-CE 3.86Å; F351-M353 VanDerWaalsContact C-N 3.33Å
354	P	94.4	Very high	93.6	Very high	14 Å²	14	52.2 Å²	52.2	9%	0.091	27%	0.267	C	S	.	.	P	Polyproline II helix	trans	-63.8	148.3	173.7	27	-34.3	0	0	0	111.3	Y266 I311 L332 Q335 L336	Y266-P354 HydrophobicContact CE1-CG 4.48Å; Y266-P354 HydrophobicContact CE2-CB 4.17Å; Y266-P354 HydrophobicContact CE2-CG 4.36Å; I311-P354 HydrophobicContact CG2-CB 4.41Å; L332-P354 HydrophobicContact CD1-CG 3.69Å; Q335-P354 HydrophobicContact CB-CG 4.44Å; L336-P354 HydrophobicContact CD2-CB 4.27Å; L336-P354 HydrophobicContact CD2-CG 4Å
355	I	95.2	Very high	93.5	Very high	9 Å²	9	51.7 Å²	51.7	5%	0.046	27%	0.265	C	S	.	.	P	Polyproline II helix	trans	-87	129.9	178.7	-58.7	166.8	0	0	0	109.3	M158 I311 V312 M343 I349 G357 V363	M158-I355 HydrophobicContact CE-CD1 3.43Å; M158-I355 VanDerWaalsContact CE-CD1 3.43Å; M158-I355 HydrophobicContact SD-CD1 3.97Å; I311-I355 WeakPolarHBondContact CA-O 3.33Å; V312-I355 HydrophobicContact CB-CB 4.14Å; V312-I355 HydrophobicContact CB-CG2 4.39Å; V312-I355 HydrophobicContact CG2-CB 4.13Å; V312-I355 HydrophobicContact CG2-CG2 3.86Å; V312-I355 PolarHBondContact N-O 3.41Å; M343-I355 HydrophobicContact CE-CG2 4.17Å; M343-I355 HydrophobicContact SD-CG2 4Å; I349-I355 HydrophobicContact CD1-CD1 4.18Å; I349-I355 HydrophobicContact CG2-CD1 3.8Å; I349-I355 HydrophobicContact CG2-CG1 4.09Å; I355-G357 PolarHBondContact O-N 3.23Å; I355-V363 HydrophobicContact CD1-CG1 4.47Å; I355-V363 HydrophobicContact CD1-CG2 4.02Å; I355-V363 HydrophobicContact CG2-CG2 3.97Å
356	P	95.9	Very high	93.4	Very high	9 Å²	9	47.6 Å²	47.6	6%	0.058	25%	0.246	C	C	.	.	B	Isolated β-bridge	trans	-58.9	134.1	174.4	-21.9	31.8	0	0	0	112.1	L336 T358 Q359	L336-P356 HydrophobicContact CB-CG 4.3Å; L336-P356 HydrophobicContact CD2-CB 4.31Å; L336-P356 HydrophobicContact CD2-CG 3.95Å; P356-T358 PolarHBondContact O-N 2.96Å; P356-T358 VanDerWaalsContact O-N 3.16Å; P356-Q359 PolarHBondContact O-N 3.04Å
357	G	93.8	Very high	93.4	Very high	7 Å²	7	48.6 Å²	48.6	7%	0.072	25%	0.252	C	S	.	.	G	3₁₀ helix	trans	-60	-27	179.1	0	0	0	0	0	113.4	S310 I355 Q359 M360	S310-G357 PolarHBondContact O-N 3.3Å; I355-G357 PolarHBondContact O-N 3.23Å; G357-Q359 PolarHBondContact O-N 3.29Å; G357-M360 WeakPolarHBondContact O-CB 3.02Å; G357-M360 PolarHBondContact O-N 2.85Å
358	T	92.7	Very high	93.4	Very high	120 Å²	120	44.3 Å²	44.3	74%	0.736	23%	0.232	S	C	*	.	G	3₁₀ helix	trans	-64	-20.8	174	52	0	0	0	0	113.7	P356	P356-T358 PolarHBondContact O-N 2.96Å; P356-T358 VanDerWaalsContact O-N 3.16Å
359	Q	92.6	Very high	93.3	Very high	28 Å²	28	44.5 Å²	44.5	13%	0.131	23%	0.233	C	C	.	.	G	3₁₀ helix	trans	-111.6	18.6	-177.1	-67.4	177.5	-34.9	0	0	112.3	S340 M343 P356 G357 E361 L362	S340-Q359 PolarHBondContact OG-NE2 3.03Å; S340-Q359 VanDerWaalsContact OG-NE2 3.1Å; M343-Q359 HydrophobicContact CE-CB 3.84Å; M343-Q359 HydrophobicContact SD-CB 4.41Å; M343-Q359 PolarHBondContact SD-OE1 3.1Å; P356-Q359 PolarHBondContact O-N 3.04Å; G357-Q359 PolarHBondContact O-N 3.29Å; Q359-E361 PolarHBondContact O-N 2.86Å; Q359-E361 VanDerWaalsContact O-N 3.15Å; Q359-L362 HydrophobicContact CB-CD1 4.25Å; Q359-L362 HydrophobicContact CG-CD1 4.35Å; Q359-L362 WeakPolarHBondContact O-CB 3.46Å; Q359-L362 PolarHBondContact O-N 3.02Å
360	M	92.6	Very high	93.2	Very high	60 Å²	60	44.5 Å²	44.5	30%	0.296	23%	0.234	S	C	.	.	G	3₁₀ helix	trans	-54.2	-35.3	-178.2	-173.6	177.2	68.2	0	0	113.6	V312 F321 G357 L362 V363	V312-M360 HydrophobicContact CG1-CG 4.12Å; V312-M360 HydrophobicContact CG2-CB 3.8Å; V312-M360 HydrophobicContact CG2-CG 4.03Å; F321-M360 HydrophobicContact CB-CG 4.08Å; F321-M360 HydrophobicContact CB-SD 4.25Å; G357-M360 WeakPolarHBondContact O-CB 3.02Å; G357-M360 PolarHBondContact O-N 2.85Å; M360-L362 PolarHBondContact O-N 2.8Å; M360-V363 WeakPolarHBondContact O-CB 3.1Å; M360-V363 VanDerWaalsContact O-CG2 3.24Å; M360-V363 WeakPolarHBondContact O-CG2 3.3Å; M360-V363 PolarHBondContact O-N 3.42Å
361	E	91.6	Very high	93.2	Very high	163 Å²	163	45.2 Å²	45.2	76%	0.762	24%	0.238	S	C	*	.	G	3₁₀ helix	trans	-65.3	-27.3	-179.5	-61.8	-177	174.4	0	0	113.1	Q359 V363	Q359-E361 PolarHBondContact O-N 2.86Å; Q359-E361 VanDerWaalsContact O-N 3.15Å; E361-V363 VanDerWaalsContact C-N 3.31Å
362	L	92.9	Very high	93.2	Very high	55 Å²	55	44.3 Å²	44.3	29%	0.288	23%	0.234	S	C	.	.	G	3₁₀ helix	trans	-80	-13.7	-179.1	-61.8	176.5	0	0	0	112.9	M343 Q359 M360 N364 Q365 L366	M343-L362 HydrophobicContact CE-CB 3.76Å; M343-L362 HydrophobicContact CE-CD1 4.19Å; Q359-L362 HydrophobicContact CB-CD1 4.25Å; Q359-L362 HydrophobicContact CG-CD1 4.35Å; Q359-L362 WeakPolarHBondContact O-CB 3.46Å; Q359-L362 PolarHBondContact O-N 3.02Å; M360-L362 PolarHBondContact O-N 2.8Å; L362-N364 VanDerWaalsContact C-N 3.29Å; L362-N364 PolarHBondContact O-N 3.01Å; L362-Q365 PolarHBondContact O-N 3.09Å; L362-L366 HydrophobicContact CB-CD1 4.03Å; L362-L366 HydrophobicContact CB-CG 4.26Å; L362-L366 HydrophobicContact CD1-CD1 4.47Å; L362-L366 PolarHBondContact O-N 3.05Å
363	V	90.7	Very high	93.2	Very high	11 Å²	11	44.5 Å²	44.5	7%	0.067	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-39.5	-174.6	174.2	0	0	0	0	112.7	M158 V312 F321 I355 M360 E361	M158-V363 HydrophobicContact CE-CG1 3.34Å; V312-V363 HydrophobicContact CG1-CG2 4.25Å; V312-V363 HydrophobicContact CG2-CG2 4.37Å; F321-V363 HydrophobicContact CD1-CG1 4.19Å; F321-V363 HydrophobicContact CD2-CG1 4.07Å; F321-V363 HydrophobicContact CE1-CG1 3.86Å; F321-V363 HydrophobicContact CE2-CG1 3.75Å; F321-V363 HydrophobicContact CG-CG1 4.28Å; F321-V363 HydrophobicContact CZ-CG1 3.63Å; I355-V363 HydrophobicContact CD1-CG1 4.47Å; I355-V363 HydrophobicContact CD1-CG2 4.02Å; I355-V363 HydrophobicContact CG2-CG2 3.97Å; M360-V363 WeakPolarHBondContact O-CB 3.1Å; M360-V363 VanDerWaalsContact O-CG2 3.24Å; M360-V363 WeakPolarHBondContact O-CG2 3.3Å; M360-V363 PolarHBondContact O-N 3.42Å; E361-V363 VanDerWaalsContact C-N 3.31Å
364	N	87.6	Confident	93.2	Very high	127 Å²	127	47.2 Å²	47.2	68%	0.679	25%	0.25	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.9	-12.2	179	-69.7	-33	0	0	0	113.2	F321 L362	F321-N364 WeakPolarHBondContact CE2-OD1 3.5Å; L362-N364 VanDerWaalsContact C-N 3.29Å; L362-N364 PolarHBondContact O-N 3.01Å
365	Q	91.6	Very high	93.1	Very high	136 Å²	136	52.4 Å²	52.4	64%	0.636	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.1	-35	-175.1	-60	178.8	8.3	0	0	111.6	L362	L362-Q365 PolarHBondContact O-N 3.09Å
366	L	94.3	Very high	93	Very high	21 Å²	21	54.4 Å²	54.4	11%	0.11	30%	0.299	C	S	.	.	S	Bend	trans	-96.2	131.5	-176.2	-61.1	-177.6	0	0	0	111.3	M343 Q347 I349 L362	M343-L366 HydrophobicContact CB-CD1 4.11Å; M343-L366 HydrophobicContact CE-CD1 3.92Å; M343-L366 HydrophobicContact CG-CD1 4.23Å; Q347-L366 HydrophobicContact CB-CD2 4.29Å; I349-L366 HydrophobicContact CD1-CB 3.97Å; I349-L366 HydrophobicContact CG1-CB 3.84Å; I349-L366 HydrophobicContact CG1-CD1 4.46Å; L362-L366 HydrophobicContact CB-CD1 4.03Å; L362-L366 HydrophobicContact CB-CG 4.26Å; L362-L366 HydrophobicContact CD1-CD1 4.47Å; L362-L366 PolarHBondContact O-N 3.05Å
367	P	94.8	Very high	92.8	Very high	39 Å²	39	54.1 Å²	54.1	25%	0.253	30%	0.297	S	S	.	.	P	Polyproline II helix	trans	-78.5	164.2	172	33.5	-37.1	0	0	0	111.6	C348 I349	C348-P367 CarbonylContact C-O 3.55Å; C348-P367 VanDerWaalsContact CA-O 3.3Å; C348-P367 WeakPolarHBondContact CA-O 3.27Å; C348-P367 WeakPolarHBondContact CB-O 3.39Å; I349-P367 PolarHBondContact N-O 2.86Å
368	F	95.5	Very high	92.8	Very high	18 Å²	18	56.9 Å²	56.9	8%	0.079	31%	0.31	C	S	.	.	B	Isolated β-bridge	trans	-64.9	143.1	169.7	-68.8	-76.8	0	0	0	112.2	Y153 Q154 M158 I349 F351 G370 N371	Y153-F368 HydrophobicContact CE1-CE1 4.21Å; Y153-F368 HydrophobicContact CE1-CZ 4.14Å; Q154-F368 HydrophobicContact CB-CB 3.95Å; Q154-F368 HydrophobicContact CB-CD2 4.44Å; Q154-F368 HydrophobicContact CB-CG 4.27Å; Q154-F368 HydrophobicContact CG-CB 3.85Å; Q154-F368 HydrophobicContact CG-CG 4.09Å; M158-F368 HydrophobicContact CE-CZ 4.47Å; M158-F368 HydrophobicContact CG-CZ 4.14Å; I349-F368 HydrophobicContact CB-CD1 4.2Å; I349-F368 HydrophobicContact CB-CE1 4.36Å; I349-F368 HydrophobicContact CG2-CD1 3.98Å; I349-F368 HydrophobicContact CG2-CE1 3.74Å; I349-F368 CarbonylContact O-C 3.57Å; I349-F368 VanDerWaalsContact O-CA 3.25Å; I349-F368 WeakPolarHBondContact O-CA 3.4Å; F351-F368 HydrophobicContact CB-CD1 3.86Å; F351-F368 HydrophobicContact CB-CE1 4.02Å; F368-G370 VanDerWaalsContact C-N 3.27Å; F368-G370 PolarHBondContact O-N 2.81Å; F368-N371 HydrophobicContact CB-CB 4.4Å; F368-N371 WeakPolarHBondContact O-CB 3.26Å; F368-N371 PolarHBondContact O-N 3.33Å; F368-N371 VanDerWaalsContact O-N 3.15Å
369	C	95.6	Very high	92.9	Very high	4 Å²	4	57.9 Å²	57.9	3%	0.027	31%	0.307	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-32.7	-176.4	-62	0	0	0	0	113.3	C348 I349 S380	C348-C369 VanDerWaalsContact C-SG 3.51Å; C348-C369 HydrophobicContact CB-CB 3.88Å; C348-C369 WeakPolarHBondContact CB-SG 3.21Å; C348-C369 VanDerWaalsContact SG-CA 3.53Å; C348-C369 WeakPolarHBondContact SG-CB 3.47Å; C348-C369 CovalentContact SG-SG 2.04Å; C348-C369 PolarHBondContact SG-SG 2.9Å; I349-C369 PolarHBondContact O-N 2.83Å; I349-C369 PolarHBondContact O-SG 2.82Å; C369-S380 PolarHBondContact O-OG 2.81Å
370	G	93.4	Very high	93	Very high	2 Å²	2	57 Å²	57	2%	0.021	30%	0.304	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.8	22.7	177.1	0	0	0	0	0	114.2	Q154 F368 L372	Q154-G370 PolarHBondContact OE1-O 2.82Å; F368-G370 VanDerWaalsContact C-N 3.27Å; F368-G370 PolarHBondContact O-N 2.81Å; G370-L372 PolarHBondContact O-N 2.88Å
371	N	94.3	Very high	93.1	Very high	21 Å²	21	54.8 Å²	54.8	11%	0.112	29%	0.293	C	S	.	.			trans	-67.9	101.8	175.5	-174.2	-26.6	0	0	0	110.8	Q154 L155 F368 S373 R374	Q154-N371 PolarHBondContact O-ND2 2.9Å; L155-N371 WeakPolarHBondContact CD2-OD1 3.5Å; F368-N371 HydrophobicContact CB-CB 4.4Å; F368-N371 WeakPolarHBondContact O-CB 3.26Å; F368-N371 PolarHBondContact O-N 3.33Å; F368-N371 VanDerWaalsContact O-N 3.15Å; N371-S373 PolarHBondContact O-N 3.2Å; N371-S373 VanDerWaalsContact O-N 3.11Å; N371-S373 WeakPolarHBondContact OD1-CB 3.14Å; N371-S373 PolarHBondContact OD1-N 3.35Å; N371-S373 PolarHBondContact OD1-OG 3.44Å; N371-R374 HydrophobicContact CB-CG 4.47Å; N371-R374 WeakPolarHBondContact O-CB 3.46Å; N371-R374 PolarHBondContact O-N 3.49Å; N371-R374 VanDerWaalsContact O-N 3.08Å
372	L	93.6	Very high	93.3	Very high	5 Å²	5	49.7 Å²	49.7	3%	0.026	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-9.3	-175.1	-63.5	176.7	0	0	0	114.9	Y130 Y134 I139 I151 G370 V377	Y130-L372 HydrophobicContact CD1-CB 4.36Å; Y130-L372 HydrophobicContact CD2-CB 4.27Å; Y130-L372 HydrophobicContact CG-CB 4.12Å; Y130-L372 HydrophobicContact CG-CD1 4.43Å; Y134-L372 HydrophobicContact CD2-CB 4.5Å; Y134-L372 HydrophobicContact CD2-CD1 3.87Å; Y134-L372 HydrophobicContact CD2-CD2 4.23Å; Y134-L372 HydrophobicContact CD2-CG 4.44Å; Y134-L372 HydrophobicContact CE2-CB 4.05Å; Y134-L372 HydrophobicContact CE2-CD1 4.26Å; Y134-L372 HydrophobicContact CE2-CD2 4.16Å; Y134-L372 HydrophobicContact CE2-CG 4.4Å; Y134-L372 HydrophobicContact CG-CD1 4.49Å; I139-L372 HydrophobicContact CG2-CD2 3.8Å; I151-L372 HydrophobicContact CD1-CD1 3.91Å; I151-L372 HydrophobicContact CG1-CD1 3.95Å; I151-L372 HydrophobicContact CG2-CD1 3.93Å; G370-L372 PolarHBondContact O-N 2.88Å; L372-V377 HydrophobicContact CD2-CG1 4.49Å; L372-V377 HydrophobicContact CD2-CG2 4.12Å
373	S	92.3	Very high	93.4	Very high	67 Å²	67	48.5 Å²	48.5	47%	0.469	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74	-16.1	171.6	70	0	0	0	0	113	N371	N371-S373 PolarHBondContact O-N 3.2Å; N371-S373 VanDerWaalsContact O-N 3.11Å; N371-S373 WeakPolarHBondContact OD1-CB 3.14Å; N371-S373 PolarHBondContact OD1-N 3.35Å; N371-S373 PolarHBondContact OD1-OG 3.44Å
374	R	92.7	Very high	93.6	Very high	75 Å²	75	48.1 Å²	48.1	28%	0.283	26%	0.264	S	S	.	.	S	Bend	trans	-89.5	137.9	-178.2	-63.1	178.5	67	-157.7	7.1	111.6	N371 T376 V377	N371-R374 HydrophobicContact CB-CG 4.47Å; N371-R374 WeakPolarHBondContact O-CB 3.46Å; N371-R374 PolarHBondContact O-N 3.49Å; N371-R374 VanDerWaalsContact O-N 3.08Å; R374-T376 VanDerWaalsContact C-N 3.28Å; R374-T376 PolarHBondContact NH2-OG1 3.15Å; R374-T376 PolarHBondContact O-N 2.97Å; R374-V377 WeakPolarHBondContact O-CB 3.15Å; R374-V377 WeakPolarHBondContact O-CG1 3.21Å; R374-V377 PolarHBondContact O-N 2.96Å
375	S	91.1	Very high	94	Very high	124 Å²	124	44.7 Å²	44.7	87%	0.867	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-30.4	173.2	52.4	0	0	0	0	113.3	V377	S375-V377 VanDerWaalsContact C-N 3.28Å; S375-V377 PolarHBondContact O-N 3.31Å
376	T	92.7	Very high	94.1	Very high	50 Å²	50	43.5 Å²	43.5	31%	0.307	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.1	10.9	-177.9	63.1	0	0	0	0	113.7	R374 N378 E379 S380	R374-T376 VanDerWaalsContact C-N 3.28Å; R374-T376 PolarHBondContact NH2-OG1 3.15Å; R374-T376 PolarHBondContact O-N 2.97Å; T376-N378 VanDerWaalsContact C-N 3.27Å; T376-N378 PolarHBondContact O-N 3.29Å; T376-E379 PolarHBondContact O-N 2.97Å; T376-E379 VanDerWaalsContact O-N 3.1Å; T376-S380 PolarHBondContact O-N 3.27Å; T376-S380 VanDerWaalsContact O-N 3.08Å; T376-S380 PolarHBondContact O-OG 3.4Å
377	V	93.4	Very high	94.2	Very high	4 Å²	4	42.6 Å²	42.6	2%	0.024	23%	0.234	C	C	.	.	H	α-helix	trans	-59.7	-34.8	-172.1	67.2	0	0	0	0	113.4	I139 L372 R374 S375 S380 L381	I139-V377 HydrophobicContact CD1-CG1 4.11Å; L372-V377 HydrophobicContact CD2-CG1 4.49Å; L372-V377 HydrophobicContact CD2-CG2 4.12Å; R374-V377 WeakPolarHBondContact O-CB 3.15Å; R374-V377 WeakPolarHBondContact O-CG1 3.21Å; R374-V377 PolarHBondContact O-N 2.96Å; S375-V377 VanDerWaalsContact C-N 3.28Å; S375-V377 PolarHBondContact O-N 3.31Å; V377-S380 WeakPolarHBondContact CA-OG 3.36Å; V377-S380 PolarHBondContact O-OG 3.2Å; V377-L381 HydrophobicContact CG2-CD1 4.05Å; V377-L381 HydrophobicContact CG2-CG 4.34Å; V377-L381 WeakPolarHBondContact O-CB 3.44Å; V377-L381 VanDerWaalsContact O-CG 3.25Å; V377-L381 WeakPolarHBondContact O-CG 3.45Å; V377-L381 PolarHBondContact O-N 3.38Å
378	N	93.2	Very high	94.1	Very high	65 Å²	65	43 Å²	43	35%	0.348	23%	0.231	S	C	.	.	H	α-helix	trans	-66.9	-37.9	178.4	-175	32.6	0	0	0	111.9	I139 K142 T376 D382	I139-N378 HydrophobicContact CD1-CB 4.44Å; I139-N378 HydrophobicContact CG1-CB 4.24Å; K142-N378 WeakPolarHBondContact CD-OD1 3.48Å; K142-N378 WeakPolarHBondContact CE-OD1 3.32Å; K142-N378 PolarHBondContact NZ-OD1 3.43Å; T376-N378 VanDerWaalsContact C-N 3.27Å; T376-N378 PolarHBondContact O-N 3.29Å; N378-D382 WeakPolarHBondContact O-CB 3.18Å; N378-D382 PolarHBondContact O-N 3Å; N378-D382 VanDerWaalsContact O-N 3.15Å
379	E	94.6	Very high	94	Very high	141 Å²	141	49.3 Å²	49.3	66%	0.659	26%	0.26	S	S	*	.	H	α-helix	trans	-71.6	-41.1	178.3	-64	171.8	177.5	0	0	111.1	T376 D382 C383	T376-E379 PolarHBondContact O-N 2.97Å; T376-E379 VanDerWaalsContact O-N 3.1Å; E379-D382 PolarHBondContact O-N 2.9Å; E379-C383 WeakPolarHBondContact O-CB 3.23Å; E379-C383 PolarHBondContact O-N 3.41Å
380	S	94.5	Very high	93.9	Very high	9 Å²	9	56.2 Å²	56.2	6%	0.063	29%	0.29	C	S	.	.	H	α-helix	trans	-67.8	-38.1	178.5	51.6	0	0	0	0	112.9	C369 T376 V377 S384	C369-S380 PolarHBondContact O-OG 2.81Å; T376-S380 PolarHBondContact O-N 3.27Å; T376-S380 VanDerWaalsContact O-N 3.08Å; T376-S380 PolarHBondContact O-OG 3.4Å; V377-S380 WeakPolarHBondContact CA-OG 3.36Å; V377-S380 PolarHBondContact O-OG 3.2Å; S380-S384 PolarHBondContact O-N 2.81Å
381	L	95	Very high	93.8	Very high	13 Å²	13	57.4 Å²	57.4	7%	0.068	30%	0.296	C	S	.	.	H	α-helix	trans	-65.3	-43.7	173.7	-72.1	172.2	0	0	0	111.7	I139 K142 L143 V377 C383 S384 Q385	I139-L381 HydrophobicContact CG2-CD1 4.05Å; K142-L381 HydrophobicContact CB-CB 4.31Å; K142-L381 HydrophobicContact CB-CD1 4.17Å; L143-L381 HydrophobicContact CD2-CD1 3.86Å; L143-L381 HydrophobicContact CD2-CD2 4.14Å; L143-L381 HydrophobicContact CG-CD1 4.36Å; V377-L381 HydrophobicContact CG2-CD1 4.05Å; V377-L381 HydrophobicContact CG2-CG 4.34Å; V377-L381 WeakPolarHBondContact O-CB 3.44Å; V377-L381 VanDerWaalsContact O-CG 3.25Å; V377-L381 WeakPolarHBondContact O-CG 3.45Å; V377-L381 PolarHBondContact O-N 3.38Å; L381-C383 VanDerWaalsContact C-N 3.35Å; L381-C383 PolarHBondContact O-N 3.37Å; L381-S384 PolarHBondContact O-N 3.34Å; L381-Q385 WeakPolarHBondContact O-CG 3.16Å; L381-Q385 PolarHBondContact O-N 3.33Å; L381-Q385 VanDerWaalsContact O-N 3.11Å
382	D	95	Very high	93.6	Very high	57 Å²	57	58.3 Å²	58.3	31%	0.305	30%	0.304	S	S	.	.	H	α-helix	trans	-61.7	-45.1	177.5	-149.9	73.8	0	0	0	111.2	K142 N378 E379 Q385 Q386	K142-D382 IonicContact NZ-OD1 2.8Å; K142-D382 PolarHBondContact NZ-OD1 3.12Å; N378-D382 WeakPolarHBondContact O-CB 3.18Å; N378-D382 PolarHBondContact O-N 3Å; N378-D382 VanDerWaalsContact O-N 3.15Å; E379-D382 PolarHBondContact O-N 2.9Å; D382-Q385 PolarHBondContact O-N 3.41Å; D382-Q386 WeakPolarHBondContact O-CB 3Å; D382-Q386 VanDerWaalsContact O-CG 3.26Å; D382-Q386 WeakPolarHBondContact O-CG 3.35Å; D382-Q386 PolarHBondContact O-N 2.59Å; D382-Q386 PolarHBondContact OD2-NE2 3.45Å
383	C	96.3	Very high	93.4	Very high	29 Å²	29	66.3 Å²	66.3	20%	0.196	34%	0.338	C	S	.	.	H	α-helix	trans	-60.4	-50.6	176.4	-175.9	0	0	0	0	111.8	C346 E379 L381 Q385 Q386 V387	C346-C383 WeakPolarHBondContact CA-SG 3.34Å; C346-C383 HydrophobicContact CB-CB 3.78Å; C346-C383 WeakPolarHBondContact CB-SG 3.46Å; C346-C383 WeakPolarHBondContact SG-CB 3.33Å; C346-C383 CovalentContact SG-SG 2.04Å; C346-C383 PolarHBondContact SG-SG 2.75Å; E379-C383 WeakPolarHBondContact O-CB 3.23Å; E379-C383 PolarHBondContact O-N 3.41Å; L381-C383 VanDerWaalsContact C-N 3.35Å; L381-C383 PolarHBondContact O-N 3.37Å; C383-Q385 VanDerWaalsContact C-N 3.31Å; C383-Q385 PolarHBondContact O-N 2.9Å; C383-Q386 PolarHBondContact O-N 2.94Å; C383-Q386 VanDerWaalsContact O-N 3.15Å; C383-V387 VanDerWaalsContact O-CG2 3.31Å; C383-V387 WeakPolarHBondContact O-CG2 3.43Å; C383-V387 PolarHBondContact O-N 3.44Å
384	S	95.1	Very high	93.5	Very high	3 Å²	3	68 Å²	68	2%	0.021	34%	0.339	C	S	.	.	H	α-helix	trans	-56.6	-45.4	-179.8	176.1	0	0	0	0	111.7	I342 C346 D350 S380 L381 V387 R388	I342-S384 WeakPolarHBondContact CD1-OG 3.2Å; C346-S384 PolarHBondContact SG-N 3.08Å; D350-S384 PolarHBondContact OD2-OG 3.31Å; S380-S384 PolarHBondContact O-N 2.81Å; L381-S384 PolarHBondContact O-N 3.34Å; S384-V387 PolarHBondContact O-N 2.86Å; S384-R388 VanDerWaalsContact O-CG 3.29Å; S384-R388 WeakPolarHBondContact O-CG 3.28Å; S384-R388 PolarHBondContact O-N 2.71Å
385	Q	94.1	Very high	93.5	Very high	55 Å²	55	65.3 Å²	65.3	26%	0.257	33%	0.329	S	S	.	.	H	α-helix	trans	-63.1	-44.1	177.8	-70.8	-177.4	-16.3	0	0	112.4	K142 L381 D382 C383 R388 Q389	K142-Q385 PolarHBondContact O-NE2 3.26Å; L381-Q385 WeakPolarHBondContact O-CG 3.16Å; L381-Q385 PolarHBondContact O-N 3.33Å; L381-Q385 VanDerWaalsContact O-N 3.11Å; D382-Q385 PolarHBondContact O-N 3.41Å; C383-Q385 VanDerWaalsContact C-N 3.31Å; C383-Q385 PolarHBondContact O-N 2.9Å; Q385-R388 PolarHBondContact O-N 3.26Å; Q385-Q389 WeakPolarHBondContact O-CB 3.36Å; Q385-Q389 VanDerWaalsContact O-CG 3.28Å; Q385-Q389 WeakPolarHBondContact O-CG 3.39Å; Q385-Q389 PolarHBondContact O-N 3.42Å
386	Q	95.3	Very high	93.5	Very high	112 Å²	112	67.3 Å²	67.3	52%	0.523	32%	0.317	S	S	.	.	H	α-helix	trans	-63.3	-44.4	178	-72.6	-178.2	21.7	0	0	112	D382 C383 R388 Q389 K390	D382-Q386 WeakPolarHBondContact O-CB 3Å; D382-Q386 VanDerWaalsContact O-CG 3.26Å; D382-Q386 WeakPolarHBondContact O-CG 3.35Å; D382-Q386 PolarHBondContact O-N 2.59Å; D382-Q386 PolarHBondContact OD2-NE2 3.45Å; C383-Q386 PolarHBondContact O-N 2.94Å; C383-Q386 VanDerWaalsContact O-N 3.15Å; Q386-R388 PolarHBondContact O-N 2.89Å; Q386-Q389 PolarHBondContact O-N 2.85Å; Q386-K390 WeakPolarHBondContact O-CB 3.34Å; Q386-K390 PolarHBondContact O-N 2.89Å
387	V	95.4	Very high	93.4	Very high	2 Å²	2	71.7 Å²	71.7	1%	0.012	34%	0.338	C	S	.	.	H	α-helix	trans	-60.2	-46.2	178.4	172.6	0	0	0	0	111	A341 I342 E345 C383 S384 Q389 N391	A341-V387 HydrophobicContact CB-CG1 3.73Å; I342-V387 HydrophobicContact CG1-CB 4.2Å; I342-V387 HydrophobicContact CG1-CG1 3.86Å; E345-V387 HydrophobicContact CB-CG2 4.12Å; E345-V387 HydrophobicContact CG-CG2 4.09Å; E345-V387 WeakPolarHBondContact OE2-CG2 3.22Å; C383-V387 VanDerWaalsContact O-CG2 3.31Å; C383-V387 WeakPolarHBondContact O-CG2 3.43Å; C383-V387 PolarHBondContact O-N 3.44Å; S384-V387 PolarHBondContact O-N 2.86Å; V387-Q389 PolarHBondContact O-N 2.85Å; V387-N391 WeakPolarHBondContact O-CB 3.45Å; V387-N391 PolarHBondContact O-N 3.26Å; V387-N391 VanDerWaalsContact O-N 3.09Å; V387-N391 PolarHBondContact O-ND2 2.78Å
388	R	93.3	Very high	93.4	Very high	48 Å²	48	75.9 Å²	75.9	18%	0.181	36%	0.36	C	S	.	.	H	α-helix	trans	-59.3	-47.6	176.5	-73.4	168.9	172.7	-134	6.5	112	E144 I338 I342 D350 S384 Q385 Q386 S392	E144-R388 IonicContact OE1-CZ 2.97Å; E144-R388 IonicContact OE1-NE 3.1Å; E144-R388 IonicContact OE1-NH1 2.84Å; E144-R388 PolarHBondContact OE1-NH1 3.43Å; E144-R388 IonicContact OE1-NH2 3.64Å; E144-R388 IonicContact OE2-CZ 2.86Å; E144-R388 IonicContact OE2-NH1 2.9Å; E144-R388 PolarHBondContact OE2-NH1 3.41Å; E144-R388 IonicContact OE2-NH2 3.03Å; E144-R388 PolarHBondContact OE2-NH2 3.44Å; I338-R388 HydrophobicContact CG2-CG 3.63Å; I342-R388 HydrophobicContact CD1-CG 4.09Å; D350-R388 IonicContact OD1-NH2 2.68Å; D350-R388 PolarHBondContact OD1-NH2 2.74Å; D350-R388 IonicContact OD2-CZ 3.89Å; D350-R388 VanDerWaalsContact OD2-CZ 3.3Å; D350-R388 IonicContact OD2-NE 3.13Å; D350-R388 PolarHBondContact OD2-NE 3.43Å; D350-R388 IonicContact OD2-NH2 2.99Å; D350-R388 PolarHBondContact OD2-NH2 3.12Å; S384-R388 VanDerWaalsContact O-CG 3.29Å; S384-R388 WeakPolarHBondContact O-CG 3.28Å; S384-R388 PolarHBondContact O-N 2.71Å; Q385-R388 PolarHBondContact O-N 3.26Å; Q386-R388 PolarHBondContact O-N 2.89Å; R388-S392 WeakPolarHBondContact O-CB 3.16Å; R388-S392 PolarHBondContact O-N 2.77Å; R388-S392 VanDerWaalsContact O-N 3.09Å
389	Q	93.1	Very high	93.4	Very high	150 Å²	150	73 Å²	73	70%	0.701	35%	0.345	S	S	*	.	H	α-helix	trans	-66.9	-47.4	-178.1	-72.2	176.2	10.2	0	0	112.3	Q385 Q386 V387 N391	Q385-Q389 WeakPolarHBondContact O-CB 3.36Å; Q385-Q389 VanDerWaalsContact O-CG 3.28Å; Q385-Q389 WeakPolarHBondContact O-CG 3.39Å; Q385-Q389 PolarHBondContact O-N 3.42Å; Q386-Q389 PolarHBondContact O-N 2.85Å; V387-Q389 PolarHBondContact O-N 2.85Å; Q389-N391 VanDerWaalsContact C-N 3.33Å; Q389-N391 PolarHBondContact O-N 2.88Å
390	K	93.1	Very high	93.3	Very high	148 Å²	148	67.4 Å²	67.4	64%	0.643	32%	0.321	S	S	*	.	H	α-helix	trans	-61.1	-42	-178.8	-178.3	-178.1	172.5	-169.4	0	111.7	Q386	Q386-K390 WeakPolarHBondContact O-CB 3.34Å; Q386-K390 PolarHBondContact O-N 2.89Å
391	N	92.1	Very high	93.2	Very high	27 Å²	27	70.1 Å²	70.1	14%	0.144	33%	0.334	C	S	.	.	H	α-helix	trans	-96.1	-9	-171.4	-62.5	-31.8	0	0	0	114.7	V387 Q389 K393 H394 F395	V387-N391 WeakPolarHBondContact O-CB 3.45Å; V387-N391 PolarHBondContact O-N 3.26Å; V387-N391 VanDerWaalsContact O-N 3.09Å; V387-N391 PolarHBondContact O-ND2 2.78Å; Q389-N391 VanDerWaalsContact C-N 3.33Å; Q389-N391 PolarHBondContact O-N 2.88Å; N391-K393 VanDerWaalsContact C-N 3.35Å; N391-K393 PolarHBondContact O-N 3.42Å; N391-H394 PolarHBondContact O-N 2.98Å; N391-H394 VanDerWaalsContact O-N 3.07Å; N391-F395 HydrophobicContact CB-CD1 4.46Å; N391-F395 HydrophobicContact CB-CD2 3.58Å; N391-F395 HydrophobicContact CB-CE1 4.14Å; N391-F395 HydrophobicContact CB-CE2 3.21Å; N391-F395 HydrophobicContact CB-CG 4.22Å; N391-F395 HydrophobicContact CB-CZ 3.53Å; N391-F395 WeakPolarHBondContact O-CG 3.39Å; N391-F395 PolarHBondContact O-N 3.02Å
392	S	88.7	Confident	93.1	Very high	40 Å²	40	70.5 Å²	70.5	28%	0.28	34%	0.337	S	S	.	.	H	α-helix	trans	-51.2	-46.7	-175.6	-175.3	0	0	0	0	114.1	R388 R396	R388-S392 WeakPolarHBondContact O-CB 3.16Å; R388-S392 PolarHBondContact O-N 2.77Å; R388-S392 VanDerWaalsContact O-N 3.09Å; S392-R396 WeakPolarHBondContact O-CG 3.28Å; S392-R396 PolarHBondContact O-N 3.47Å
393	K	90.5	Very high	93	Very high	174 Å²	174	68 Å²	68	76%	0.757	32%	0.324	S	S	*	.	H	α-helix	trans	-70.6	-40.8	178.9	-68.5	-175.9	-178.2	178.3	0	112.3	N391 R396 L397	N391-K393 VanDerWaalsContact C-N 3.35Å; N391-K393 PolarHBondContact O-N 3.42Å; K393-R396 PolarHBondContact O-N 3.24Å; K393-L397 PolarHBondContact O-N 3.2Å
394	H	93.2	Very high	92.8	Very high	102 Å²	102	70.5 Å²	70.5	47%	0.472	34%	0.338	S	S	.	.	H	α-helix	trans	-65.8	-45.1	-178.2	-178.4	63.2	0	0	0	111.3	N391 R396 L397 L398	N391-H394 PolarHBondContact O-N 2.98Å; N391-H394 VanDerWaalsContact O-N 3.07Å; H394-R396 PolarHBondContact O-N 3.4Å; H394-L397 WeakPolarHBondContact O-CB 3.37Å; H394-L397 PolarHBondContact O-N 2.96Å; H394-L397 VanDerWaalsContact O-N 3.14Å; H394-L398 WeakPolarHBondContact NE2-CD1 3.01Å; H394-L398 PolarHBondContact O-N 2.89Å; H394-L398 VanDerWaalsContact O-N 3.17Å
395	F	93.3	Very high	92.5	Very high	18 Å²	18	73.1 Å²	73.1	8%	0.079	35%	0.35	C	S	.	.	H	α-helix	trans	-68.1	-32.5	179.1	-63.6	-27.2	0	0	0	113.3	L337 I338 A341 N391 L397 L398 C399	L337-F395 HydrophobicContact CB-CD1 4.02Å; L337-F395 HydrophobicContact CB-CD2 4.12Å; L337-F395 HydrophobicContact CB-CE1 4.16Å; L337-F395 HydrophobicContact CB-CE2 4.23Å; L337-F395 HydrophobicContact CB-CG 4Å; L337-F395 HydrophobicContact CB-CZ 4.26Å; L337-F395 HydrophobicContact CD1-CB 4.26Å; L337-F395 HydrophobicContact CD1-CD1 3.91Å; L337-F395 HydrophobicContact CD1-CG 4.21Å; I338-F395 HydrophobicContact CB-CD2 4.5Å; I338-F395 HydrophobicContact CB-CE2 4.39Å; I338-F395 HydrophobicContact CG1-CD2 3.48Å; I338-F395 VanDerWaalsContact CG1-CD2 3.48Å; I338-F395 HydrophobicContact CG1-CE2 3.78Å; A341-F395 HydrophobicContact CB-CE2 4.31Å; A341-F395 HydrophobicContact CB-CZ 3.99Å; N391-F395 HydrophobicContact CB-CD1 4.46Å; N391-F395 HydrophobicContact CB-CD2 3.58Å; N391-F395 HydrophobicContact CB-CE1 4.14Å; N391-F395 HydrophobicContact CB-CE2 3.21Å; N391-F395 HydrophobicContact CB-CG 4.22Å; N391-F395 HydrophobicContact CB-CZ 3.53Å; N391-F395 WeakPolarHBondContact O-CG 3.39Å; N391-F395 PolarHBondContact O-N 3.02Å; F395-L397 VanDerWaalsContact C-N 3.27Å; F395-L397 PolarHBondContact O-N 2.82Å; F395-L398 HydrophobicContact CD1-CD1 4.21Å; F395-L398 PolarHBondContact O-N 3.47Å; F395-C399 WeakPolarHBondContact O-CB 3.34Å; F395-C399 PolarHBondContact O-N 2.87Å; F395-C399 PolarHBondContact O-SG 3.48Å
396	R	91.2	Very high	92.3	Very high	166 Å²	166	73.1 Å²	73.1	63%	0.626	35%	0.352	S	S	*	.	H	α-helix	trans	-62.8	-32	171.1	-75.2	176.6	-177	179.3	2.7	113.3	I334 S392 K393 H394	I334-R396 HydrophobicContact CD1-CG 3.94Å; S392-R396 WeakPolarHBondContact O-CG 3.28Å; S392-R396 PolarHBondContact O-N 3.47Å; K393-R396 PolarHBondContact O-N 3.24Å; H394-R396 PolarHBondContact O-N 3.4Å
397	L	91.1	Very high	92	Very high	143 Å²	143	72.1 Å²	72.1	75%	0.749	35%	0.347	S	S	*	.	H	α-helix	trans	-74.8	-32.8	175.4	-68.6	166.3	0	0	0	112	K393 H394 F395	K393-L397 PolarHBondContact O-N 3.2Å; H394-L397 WeakPolarHBondContact O-CB 3.37Å; H394-L397 PolarHBondContact O-N 2.96Å; H394-L397 VanDerWaalsContact O-N 3.14Å; F395-L397 VanDerWaalsContact C-N 3.27Å; F395-L397 PolarHBondContact O-N 2.82Å
398	L	92.4	Very high	91.7	Very high	92 Å²	92	72.6 Å²	72.6	48%	0.482	35%	0.349	S	S	.	.	H	α-helix	trans	-77.9	-23.1	177.2	-69.7	176.4	0	0	0	113.7	L337 H394 F395 P400	L337-L398 HydrophobicContact CD1-CB 4.24Å; L337-L398 HydrophobicContact CD1-CD1 4.43Å; H394-L398 WeakPolarHBondContact NE2-CD1 3.01Å; H394-L398 PolarHBondContact O-N 2.89Å; H394-L398 VanDerWaalsContact O-N 3.17Å; F395-L398 HydrophobicContact CD1-CD1 4.21Å; F395-L398 PolarHBondContact O-N 3.47Å; L398-P400 VanDerWaalsContact C-CD 3.4Å; L398-P400 WeakPolarHBondContact O-CD 3.35Å
399	C	94	Very high	91.7	Very high	5 Å²	5	73.2 Å²	73.2	3%	0.034	36%	0.356	C	S	.	.	S	Bend	trans	-111.4	76.3	-178.8	-63.1	0	0	0	0	111.2	Y328 C333 I334 L337 F395	Y328-C399 WeakPolarHBondContact OH-CA 3.43Å; C333-C399 HydrophobicContact CB-CB 3.65Å; C333-C399 WeakPolarHBondContact CB-SG 3.46Å; C333-C399 WeakPolarHBondContact SG-CB 3.48Å; C333-C399 CovalentContact SG-SG 2.04Å; C333-C399 PolarHBondContact SG-SG 3.11Å; I334-C399 HydrophobicContact CD1-CB 4.42Å; I334-C399 HydrophobicContact CG1-CB 3.74Å; I334-C399 PolarHBondContact N-SG 2.8Å; L337-C399 WeakPolarHBondContact CD1-SG 3.41Å; F395-C399 WeakPolarHBondContact O-CB 3.34Å; F395-C399 PolarHBondContact O-N 2.87Å; F395-C399 PolarHBondContact O-SG 3.48Å
400	P	93.3	Very high	91.6	Very high	23 Å²	23	68.9 Å²	68.9	15%	0.149	33%	0.333	C	S	.	.	P	Polyproline II helix	trans	-68.2	151.8	176.6	29.8	-35.1	0	0	0	111.7	P301 E303 Y328 L398	P301-P400 HydrophobicContact CB-CB 4.46Å; P301-P400 HydrophobicContact CG-CB 4.43Å; P301-P400 VanDerWaalsContact O-CB 3.27Å; P301-P400 WeakPolarHBondContact O-CB 3.29Å; E303-P400 HydrophobicContact CB-CG 4.29Å; Y328-P400 VanDerWaalsContact CE1-O 3.3Å; Y328-P400 WeakPolarHBondContact CE1-O 3.27Å; Y328-P400 PolarHBondContact OH-O 2.71Å; L398-P400 VanDerWaalsContact C-CD 3.4Å; L398-P400 WeakPolarHBondContact O-CD 3.35Å
401	I	92	Very high	91.7	Very high	66 Å²	66	67.9 Å²	67.9	34%	0.338	33%	0.331	S	S	.	.	P	Polyproline II helix	trans	-61.4	143.8	176.7	-57.6	170.8	0	0	0	109.5	C302 E303	C302-I401 CarbonylContact C-O 3.59Å; C302-I401 WeakPolarHBondContact CA-O 3.41Å; C302-I401 WeakPolarHBondContact CB-O 3.43Å; E303-I401 PolarHBondContact N-O 3.34Å
402	P	92.3	Very high	91.9	Very high	21 Å²	21	69 Å²	69	14%	0.136	34%	0.337	C	S	.	.	B	Isolated β-bridge	trans	-58.5	140.9	174.2	23.4	-35.4	0	0	0	112.3	Y328 V404 Q405	Y328-P402 HydrophobicContact CD1-CB 4.43Å; P402-V404 VanDerWaalsContact C-N 3.3Å; P402-V404 PolarHBondContact O-N 3.03Å; P402-Q405 HydrophobicContact CG-CB 4.29Å
403	C	93.2	Very high	92.2	Very high	3 Å²	3	70.9 Å²	70.9	2%	0.02	35%	0.346	C	S	.	.	S	Bend	trans	-68.5	-32.3	177	-61.3	0	0	0	0	112	E293 K294 C302 E303 N304	E293-C403 CarbonylContact C-O 3.58Å; E293-C403 VanDerWaalsContact CA-O 3.32Å; E293-C403 WeakPolarHBondContact CA-O 3.32Å; K294-C403 PolarHBondContact N-O 3.44Å; C302-C403 HydrophobicContact CB-CB 3.95Å; C302-C403 WeakPolarHBondContact CB-SG 3.48Å; C302-C403 PolarHBondContact O-SG 2.92Å; C302-C403 VanDerWaalsContact SG-CA 3.51Å; C302-C403 WeakPolarHBondContact SG-CB 3.5Å; C302-C403 CovalentContact SG-SG 2.02Å; C302-C403 PolarHBondContact SG-SG 3.32Å; E303-C403 PolarHBondContact O-N 2.02Å; E303-C403 PolarHBondContact O-SG 2.95Å; N304-C403 WeakPolarHBondContact OD1-CB 3.24Å; N304-C403 PolarHBondContact OD1-SG 3.17Å
404	V	91.4	Very high	92.5	Very high	82 Å²	82	67 Å²	67	50%	0.497	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	117.7	175.4	-176.8	0	0	0	0	108.3	R291 I292 E293 P402	R291-V404 HydrophobicContact CG-CG1 4.38Å; I292-V404 WeakPolarHBondContact O-CA 3.4Å; E293-V404 HydrophobicContact CG-CG2 4.39Å; P402-V404 VanDerWaalsContact C-N 3.3Å; P402-V404 PolarHBondContact O-N 3.03Å
405	Q	90.1	Very high	92.7	Very high	58 Å²	58	67.3 Å²	67.3	27%	0.271	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	143.4	175.7	63.2	-179.5	-9.3	0	0	110.6	R291 I292 P402	R291-Q405 WeakPolarHBondContact CA-O 3.3Å; I292-Q405 HydrophobicContact CB-CG 3.63Å; I292-Q405 HydrophobicContact CD1-CG 4.19Å; I292-Q405 VanDerWaalsContact CD1-NE2 3.29Å; I292-Q405 HydrophobicContact CG1-CG 4.37Å; I292-Q405 HydrophobicContact CG2-CG 4.3Å; I292-Q405 PolarHBondContact N-O 3.49Å; I292-Q405 PolarHBondContact O-N 2.75Å; P402-Q405 HydrophobicContact CG-CB 4.29Å
406	L	88.6	Confident	92.8	Very high	56 Å²	56	75.6 Å²	75.6	29%	0.293	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	116.8	172.9	-169.5	67.9	0	0	0	108.3	V82 H290 R291 Y408 L484	V82-L406 HydrophobicContact CG1-CD1 4.35Å; V82-L406 HydrophobicContact CG1-CD2 3.74Å; H290-L406 CarbonylContact O-C 3.56Å; H290-L406 WeakPolarHBondContact O-CA 3.32Å; R291-L406 HydrophobicContact CB-CD1 4.35Å; L406-Y408 HydrophobicContact CD2-CE2 3.88Å; L406-Y408 WeakPolarHBondContact CD2-OH 3.29Å; L406-Y408 HydrophobicContact CG-CE2 4.04Å; L406-L484 HydrophobicContact CD1-CD1 4.05Å
407	Q	89.6	Confident	93	Very high	90 Å²	90	69.1 Å²	69.1	42%	0.421	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	137.1	179.2	179.3	177.1	-4	0	0	109.5	H290	H290-Q407 HydrophobicContact CB-CB 4.28Å; H290-Q407 PolarHBondContact N-O 3.05Å; H290-Q407 PolarHBondContact O-N 3.49Å
408	Y	90.4	Very high	93.2	Very high	13 Å²	13	62.4 Å²	62.4	5%	0.051	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	122.8	175.2	-61.9	-93.2	0	0	0	108	A83 P85 I286 M289 L406 Y410	A83-Y408 PolarHBondContact O-OH 3.05Å; P85-Y408 HydrophobicContact CB-CD1 4Å; P85-Y408 HydrophobicContact CB-CD2 4.12Å; P85-Y408 HydrophobicContact CB-CE1 3.78Å; P85-Y408 HydrophobicContact CB-CE2 3.94Å; P85-Y408 HydrophobicContact CB-CG 4.15Å; P85-Y408 HydrophobicContact CG-CD1 4.01Å; P85-Y408 HydrophobicContact CG-CE1 3.95Å; P85-Y408 HydrophobicContact CG-CG 4.49Å; I286-Y408 HydrophobicContact CG2-CD1 4.2Å; M289-Y408 HydrophobicContact CG-CD1 3.81Å; M289-Y408 HydrophobicContact CG-CE1 3.94Å; M289-Y408 HydrophobicContact SD-CD1 4.37Å; M289-Y408 HydrophobicContact SD-CE1 3.96Å; L406-Y408 HydrophobicContact CD2-CE2 3.88Å; L406-Y408 WeakPolarHBondContact CD2-OH 3.29Å; L406-Y408 HydrophobicContact CG-CE2 4.04Å; Y408-Y410 VanDerWaalsContact O-CD1 3.22Å; Y408-Y410 WeakPolarHBondContact O-CD1 3.44Å; Y408-Y410 WeakPolarHBondContact O-CE1 3.38Å
409	N	91.2	Very high	93.2	Very high	61 Å²	61	63.4 Å²	63.4	33%	0.326	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	122	171.3	-73.3	0.8	0	0	0	108	I286 D287 G288 H290	I286-N409 WeakPolarHBondContact CA-O 3.39Å; D287-N409 PolarHBondContact N-O 2.88Å; D287-N409 VanDerWaalsContact N-O 3.09Å; G288-N409 PolarHBondContact O-N 3.03Å; H290-N409 PolarHBondContact CE1-ND2 3.19Å
410	Y	93.1	Very high	93.1	Very high	58 Å²	58	65 Å²	65	23%	0.227	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	150.9	-176.6	56.4	-90.1	0	0	0	112.1	V260 S272 L274 I284 L285 Y408	V260-Y410 HydrophobicContact CB-CD1 3.91Å; V260-Y410 HydrophobicContact CB-CE1 3.72Å; V260-Y410 HydrophobicContact CB-CE2 4.38Å; V260-Y410 HydrophobicContact CB-CG 4.34Å; V260-Y410 HydrophobicContact CG1-CD1 4.11Å; V260-Y410 HydrophobicContact CG1-CE1 4.27Å; V260-Y410 HydrophobicContact CG2-CD1 4.45Å; V260-Y410 HydrophobicContact CG2-CD2 4.36Å; V260-Y410 HydrophobicContact CG2-CE2 4.39Å; V260-Y410 HydrophobicContact CG2-CG 4.39Å; S272-Y410 PolarHBondContact O-OH 2.96Å; L274-Y410 HydrophobicContact CD1-CD2 3.81Å; L274-Y410 HydrophobicContact CD1-CE2 3.58Å; L274-Y410 HydrophobicContact CG-CE2 4.08Å; I284-Y410 HydrophobicContact CG2-CD2 4.3Å; I284-Y410 HydrophobicContact CG2-CG 4.46Å; L285-Y410 CarbonylContact O-C 3.58Å; L285-Y410 WeakPolarHBondContact O-CA 3.27Å; Y408-Y410 VanDerWaalsContact O-CD1 3.22Å; Y408-Y410 WeakPolarHBondContact O-CD1 3.44Å; Y408-Y410 WeakPolarHBondContact O-CE1 3.38Å
411	E	93.9	Very high	92.9	Very high	127 Å²	127	67.8 Å²	67.8	59%	0.593	33%	0.334	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-128.4	144.6	179.1	-62.9	-177.5	171.9	0	0	109.9	I284 L285	I284-E411 CarbonylContact C-O 3.54Å; I284-E411 WeakPolarHBondContact CA-O 3.08Å; L285-E411 PolarHBondContact N-O 2.82Å; L285-E411 PolarHBondContact O-N 3.31Å
412	L	95.7	Very high	92.9	Very high	52 Å²	52	71.2 Å²	71.2	27%	0.272	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	128	176.1	171.8	67.9	0	0	0	110.1	L274 N275 L276 N282 Q283 I284 Q414	L274-L412 HydrophobicContact CB-CD2 4.24Å; L274-L412 HydrophobicContact CD1-CB 3.82Å; N275-L412 VanDerWaalsContact O-CD2 3.27Å; N275-L412 WeakPolarHBondContact O-CD2 3.33Å; L276-L412 HydrophobicContact CD2-CD1 4.32Å; N282-L412 HydrophobicContact CB-CD1 3.96Å; Q283-L412 WeakPolarHBondContact O-CA 3.46Å; I284-L412 HydrophobicContact CD1-CD1 4.08Å; I284-L412 HydrophobicContact CG1-CD1 4.07Å; L412-Q414 HydrophobicContact CD1-CG 4.37Å; L412-Q414 HydrophobicContact CG-CG 4.34Å
413	T	96.5	Very high	93	Very high	78 Å²	78	70.2 Å²	70.2	48%	0.479	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	150.3	169.7	57.2	0	0	0	0	109.5	Q283	Q283-T413 WeakPolarHBondContact CB-O 3.48Å; Q283-T413 VanDerWaalsContact CB-OG1 3.31Å; Q283-T413 WeakPolarHBondContact CB-OG1 3.45Å; Q283-T413 PolarHBondContact N-O 2.92Å; Q283-T413 PolarHBondContact O-N 2.86Å; Q283-T413 PolarHBondContact O-OG1 2.82Å
414	Q	96.8	Very high	92.9	Very high	92 Å²	92	71.3 Å²	71.3	43%	0.43	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	135.2	-172.6	-67.4	174.6	-27.4	0	0	110.4	S281 N282 L412	S281-Q414 WeakPolarHBondContact O-CA 3.27Å; N282-Q414 PolarHBondContact OD1-NE2 2.79Å; L412-Q414 HydrophobicContact CD1-CG 4.37Å; L412-Q414 HydrophobicContact CG-CG 4.34Å
415	L	96.4	Very high	92.9	Very high	110 Å²	110	72.5 Å²	72.5	58%	0.576	35%	0.345	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-126.5	144.2	177.8	-63.2	169	0	0	0	109.4	A280 S281 Q283 W417	A280-L415 CarbonylContact C-O 3.46Å; A280-L415 VanDerWaalsContact CA-O 3.24Å; A280-L415 WeakPolarHBondContact CA-O 3.06Å; A280-L415 WeakPolarHBondContact CB-O 3.33Å; S281-L415 PolarHBondContact N-O 3.21Å; S281-L415 PolarHBondContact O-N 2.82Å; Q283-L415 HydrophobicContact CG-CD1 4.32Å; L415-W417 PolarHBondContact O-N 3.11Å
416	R	95.4	Very high	92.9	Very high	191 Å²	191	71.7 Å²	71.7	72%	0.721	34%	0.34	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-59.3	128.6	174.1	-174	-179.7	68.6	96.2	-4.1	110.7
417	W	95.5	Very high	92.9	Very high	31 Å²	31	70.1 Å²	70.1	12%	0.117	33%	0.33	C	S	.	.			trans	-152.6	142.9	179.4	173.1	93.9	0	0	0	111.3	I231 G279 L415 Y426 F467 F471 H473	I231-W417 HydrophobicContact CD1-CH2 3.74Å; I231-W417 HydrophobicContact CD1-CZ2 3.57Å; I231-W417 HydrophobicContact CG1-CH2 4.09Å; I231-W417 HydrophobicContact CG1-CZ2 4.16Å; I231-W417 HydrophobicContact CG2-CH2 4.02Å; G279-W417 CarbonylContact C-O 3.53Å; G279-W417 WeakPolarHBondContact CA-O 3.25Å; G279-W417 PolarHBondContact O-N 3.19Å; G279-W417 VanDerWaalsContact O-N 3.14Å; L415-W417 PolarHBondContact O-N 3.11Å; W417-Y426 HydrophobicContact CZ2-CD2 4.48Å; W417-Y426 HydrophobicContact CZ2-CE1 4.1Å; W417-Y426 AromaticContact CZ2-CE2 3.87Å; W417-Y426 HydrophobicContact CZ2-CE2 3.87Å; W417-Y426 AromaticContact CZ2-CZ 3.65Å; W417-Y426 PolarHBondContact NE1-OH 3.37Å; W417-F467 AromaticContact CH2-CE1 3.73Å; W417-F467 HydrophobicContact CH2-CE1 3.73Å; W417-F467 HydrophobicContact CH2-CZ 4.08Å; W417-F467 HydrophobicContact CZ2-CE1 4.44Å; W417-F467 AromaticContact CZ3-CE1 3.93Å; W417-F467 HydrophobicContact CZ3-CE1 3.93Å; W417-F471 HydrophobicContact CH2-CB 4.31Å; W417-F471 HydrophobicContact CZ3-CB 4.01Å; W417-H473 HydrophobicContact CD2-CB 3.76Å; W417-H473 HydrophobicContact CE3-CB 3.88Å; W417-H473 HydrophobicContact CG-CB 4.31Å; W417-H473 HydrophobicContact CH2-CB 4.26Å; W417-H473 HydrophobicContact CZ2-CB 4.14Å; W417-H473 HydrophobicContact CZ3-CB 4.13Å
418	P	95.1	Very high	92.9	Very high	2 Å²	2	67.7 Å²	67.7	1%	0.013	33%	0.325	C	S	.	.			cis	-84	178.5	-4.7	34.9	-37	0	0	0	112.5	I423 Y426 F467	P418-I423 HydrophobicContact CG-CD1 4.19Å; P418-I423 HydrophobicContact CG-CG1 3.47Å; P418-I423 VanDerWaalsContact CG-CG1 3.47Å; P418-Y426 HydrophobicContact CB-CD2 4.35Å; P418-Y426 HydrophobicContact CB-CE2 3.91Å; P418-F467 HydrophobicContact CG-CD1 3.74Å; P418-F467 HydrophobicContact CG-CE1 3.64Å
419	Q	92.8	Very high	92.8	Very high	113 Å²	113	71.7 Å²	71.7	53%	0.528	35%	0.345	S	S	.	.			trans	-71	133.7	160.5	-68.1	177.3	-19.3	0	0	108.5	R422	Q419-R422 HydrophobicContact CB-CG 4.38Å; Q419-R422 WeakPolarHBondContact O-CB 3.45Å; Q419-R422 PolarHBondContact O-N 3.43Å
420	K	91.2	Very high	92.6	Very high	37 Å²	37	69.1 Å²	69.1	16%	0.161	33%	0.331	C	S	.	.	G	3₁₀ helix	trans	-43.1	-54.2	-174.5	-72.9	-64.6	-164.3	176.4	0	113.7	R422 I423 L461 T464 E468	K420-R422 PolarHBondContact O-N 3.37Å; K420-I423 HydrophobicContact CD-CD1 3.86Å; K420-I423 VanDerWaalsContact O-CB 3.32Å; K420-I423 WeakPolarHBondContact O-CB 3.45Å; K420-I423 VanDerWaalsContact O-CG1 3.29Å; K420-I423 WeakPolarHBondContact O-CG1 3.31Å; K420-I423 PolarHBondContact O-N 3.25Å; K420-L461 HydrophobicContact CB-CD2 4.31Å; K420-L461 HydrophobicContact CB-CG 4.25Å; K420-L461 WeakPolarHBondContact CD-O 3.42Å; K420-L461 WeakPolarHBondContact CE-O 3.29Å; K420-L461 PolarHBondContact NZ-O 3.29Å; K420-L461 WeakPolarHBondContact O-CD2 3.42Å; K420-T464 PolarHBondContact NZ-O 3.29Å; K420-E468 VanDerWaalsContact CD-OE1 3.25Å; K420-E468 WeakPolarHBondContact CD-OE1 3.23Å; K420-E468 WeakPolarHBondContact CE-OE1 3.28Å; K420-E468 IonicContact NZ-OE1 3.3Å; K420-E468 PolarHBondContact NZ-OE1 3.45Å; K420-E468 IonicContact NZ-OE2 3.61Å
421	P	89.8	Confident	92	Very high	82 Å²	82	71.5 Å²	71.5	53%	0.532	34%	0.342	S	S	.	.	G	3₁₀ helix	trans	-61.3	-23.9	-177.9	-23.4	35.3	0	0	0	114.9	I423 L458	P421-I423 VanDerWaalsContact C-N 3.27Å; P421-I423 PolarHBondContact O-N 2.91Å; P421-L458 HydrophobicContact CG-CD1 4.27Å
422	R	92.9	Very high	91.3	Very high	139 Å²	139	72.5 Å²	72.5	53%	0.525	35%	0.351	S	S	.	.	G	3₁₀ helix	trans	-75.6	-15.4	179.4	-67.2	-170.9	174.2	-164.6	-2.9	113.1	Q419 K420 L424 N425 Y426	Q419-R422 HydrophobicContact CB-CG 4.38Å; Q419-R422 WeakPolarHBondContact O-CB 3.45Å; Q419-R422 PolarHBondContact O-N 3.43Å; K420-R422 PolarHBondContact O-N 3.37Å; R422-L424 PolarHBondContact O-N 3.12Å; R422-N425 WeakPolarHBondContact O-CB 3.01Å; R422-N425 PolarHBondContact O-N 3.14Å; R422-N425 VanDerWaalsContact O-N 3.13Å; R422-Y426 HydrophobicContact CB-CE2 4.22Å; R422-Y426 VanDerWaalsContact O-CD2 3.22Å; R422-Y426 WeakPolarHBondContact O-CD2 3.34Å; R422-Y426 PolarHBondContact O-N 3.28Å
423	I	93	Very high	90.4	Very high	0 Å²	0	73.7 Å²	73.7	0%	0	35%	0.352	C	S	.	.	H	α-helix	trans	-57	-41.1	178.9	-66.5	170.3	0	0	0	110.6	P418 K420 P421 N425 Y426 Y427 Y443 L461 F467	P418-I423 HydrophobicContact CG-CD1 4.19Å; P418-I423 HydrophobicContact CG-CG1 3.47Å; P418-I423 VanDerWaalsContact CG-CG1 3.47Å; K420-I423 HydrophobicContact CD-CD1 3.86Å; K420-I423 VanDerWaalsContact O-CB 3.32Å; K420-I423 WeakPolarHBondContact O-CB 3.45Å; K420-I423 VanDerWaalsContact O-CG1 3.29Å; K420-I423 WeakPolarHBondContact O-CG1 3.31Å; K420-I423 PolarHBondContact O-N 3.25Å; P421-I423 VanDerWaalsContact C-N 3.27Å; P421-I423 PolarHBondContact O-N 2.91Å; I423-N425 VanDerWaalsContact C-N 3.28Å; I423-N425 PolarHBondContact O-N 3.45Å; I423-Y426 PolarHBondContact O-N 2.89Å; I423-Y426 VanDerWaalsContact O-N 3.08Å; I423-Y427 WeakPolarHBondContact O-CB 3.49Å; I423-Y427 PolarHBondContact O-N 3.23Å; I423-Y443 HydrophobicContact CG2-CD1 3.83Å; I423-Y443 HydrophobicContact CG2-CE1 3.48Å; I423-Y443 VanDerWaalsContact CG2-CE1 3.48Å; I423-L461 HydrophobicContact CB-CD1 4.22Å; I423-L461 HydrophobicContact CD1-CD1 4.23Å; I423-L461 HydrophobicContact CG2-CD1 4.36Å; I423-F467 HydrophobicContact CD1-CB 4.3Å; I423-F467 HydrophobicContact CG1-CB 4.42Å; I423-F467 HydrophobicContact CG1-CD1 4.14Å; I423-F467 HydrophobicContact CG1-CG 4.23Å; I423-F467 HydrophobicContact CG2-CB 3.8Å; I423-F467 HydrophobicContact CG2-CD1 4.47Å; I423-F467 HydrophobicContact CG2-CD2 3.82Å; I423-F467 HydrophobicContact CG2-CG 3.77Å
424	L	90.7	Very high	89.2	Confident	25 Å²	25	71.1 Å²	71.1	13%	0.131	34%	0.335	C	S	.	.	H	α-helix	trans	-59.9	-37.5	179	-61.2	179.3	0	0	0	112.4	R422 Y427 A428 Y443 I446 E447	R422-L424 PolarHBondContact O-N 3.12Å; L424-Y427 PolarHBondContact O-N 2.84Å; L424-A428 WeakPolarHBondContact O-CB 3.37Å; L424-A428 PolarHBondContact O-N 3.35Å; L424-Y443 HydrophobicContact CD2-CD1 4.44Å; L424-I446 HydrophobicContact CD1-CG2 4.43Å; L424-I446 HydrophobicContact CD2-CB 4.4Å; L424-I446 HydrophobicContact CD2-CG2 4Å; L424-E447 HydrophobicContact CD2-CB 4.43Å
425	N	91.6	Very high	87.6	Confident	108 Å²	108	72.2 Å²	72.2	58%	0.578	34%	0.344	S	S	*	.	H	α-helix	trans	-69.2	-34.5	176.6	-68.8	-8.1	0	0	0	112.8	R422 I423 Q429	R422-N425 WeakPolarHBondContact O-CB 3.01Å; R422-N425 PolarHBondContact O-N 3.14Å; R422-N425 VanDerWaalsContact O-N 3.13Å; I423-N425 VanDerWaalsContact C-N 3.28Å; I423-N425 PolarHBondContact O-N 3.45Å; N425-Q429 PolarHBondContact O-NE2 3.31Å
426	Y	91.6	Very high	85.7	Confident	41 Å²	41	69.1 Å²	69.1	16%	0.161	33%	0.325	C	S	.	.	H	α-helix	trans	-71.3	-44.9	174.1	-71.1	-66.7	0	0	0	110.5	F176 I231 W417 P418 R422 I423 A428 Q429 L430 F467	F176-Y426 HydrophobicContact CE1-CD1 4.09Å; F176-Y426 HydrophobicContact CE1-CE1 4.26Å; F176-Y426 HydrophobicContact CE2-CD1 4.24Å; F176-Y426 AromaticContact CZ-CD1 3.76Å; F176-Y426 HydrophobicContact CZ-CD1 3.76Å; F176-Y426 HydrophobicContact CZ-CE1 4.36Å; I231-Y426 HydrophobicContact CD1-CD1 4.12Å; I231-Y426 HydrophobicContact CD1-CE1 3.7Å; W417-Y426 HydrophobicContact CZ2-CD2 4.48Å; W417-Y426 HydrophobicContact CZ2-CE1 4.1Å; W417-Y426 AromaticContact CZ2-CE2 3.87Å; W417-Y426 HydrophobicContact CZ2-CE2 3.87Å; W417-Y426 AromaticContact CZ2-CZ 3.65Å; W417-Y426 PolarHBondContact NE1-OH 3.37Å; P418-Y426 HydrophobicContact CB-CD2 4.35Å; P418-Y426 HydrophobicContact CB-CE2 3.91Å; R422-Y426 HydrophobicContact CB-CE2 4.22Å; R422-Y426 VanDerWaalsContact O-CD2 3.22Å; R422-Y426 WeakPolarHBondContact O-CD2 3.34Å; R422-Y426 PolarHBondContact O-N 3.28Å; I423-Y426 PolarHBondContact O-N 2.89Å; I423-Y426 VanDerWaalsContact O-N 3.08Å; Y426-A428 PolarHBondContact O-N 3.32Å; Y426-Q429 PolarHBondContact O-N 2.94Å; Y426-Q429 VanDerWaalsContact O-N 3.16Å; Y426-L430 WeakPolarHBondContact O-CB 3.2Å; Y426-L430 VanDerWaalsContact O-CG 3.28Å; Y426-L430 WeakPolarHBondContact O-CG 3.39Å; Y426-L430 PolarHBondContact O-N 3.01Å; Y426-L430 VanDerWaalsContact O-N 3.14Å; Y426-F467 HydrophobicContact CD2-CE1 4.42Å; Y426-F467 AromaticContact CD2-CZ 3.99Å; Y426-F467 HydrophobicContact CD2-CZ 3.99Å; Y426-F467 HydrophobicContact CG-CE2 4.4Å; Y426-F467 AromaticContact CG-CZ 3.84Å; Y426-F467 HydrophobicContact CG-CZ 3.84Å
427	Y	88.8	Confident	83.9	Confident	23 Å²	23	62.6 Å²	62.6	9%	0.09	30%	0.304	C	S	.	.	H	α-helix	trans	-56.9	-47.4	176	175.4	-107.2	0	0	0	111.8	I423 L424 Q429 L430 K431 F440 Y443 E444	I423-Y427 WeakPolarHBondContact O-CB 3.49Å; I423-Y427 PolarHBondContact O-N 3.23Å; L424-Y427 PolarHBondContact O-N 2.84Å; Y427-Q429 PolarHBondContact O-N 2.9Å; Y427-Q429 VanDerWaalsContact O-N 3.13Å; Y427-L430 CarbonylContact O-C 3.59Å; Y427-L430 WeakPolarHBondContact O-CA 3.44Å; Y427-L430 PolarHBondContact O-N 2.92Å; Y427-K431 HydrophobicContact CE1-CB 4.34Å; Y427-K431 HydrophobicContact CE2-CB 4.29Å; Y427-K431 PolarHBondContact O-N 2.78Å; Y427-F440 HydrophobicContact CD2-CB 4.03Å; Y427-F440 HydrophobicContact CE2-CB 3.61Å; Y427-F440 WeakPolarHBondContact CE2-O 3.33Å; Y427-Y443 HydrophobicContact CD2-CD2 4.3Å; Y427-Y443 HydrophobicContact CD2-CG 4.39Å; Y427-Y443 HydrophobicContact CG-CG 4.37Å; Y427-E444 HydrophobicContact CE1-CB 4.27Å
428	A	88	Confident	82.7	Confident	39 Å²	39	70.6 Å²	70.6	32%	0.322	33%	0.334	S	S	.	.	H	α-helix	trans	-57.8	-30.7	178.8	0	0	0	0	0	113.6	L424 Y426	L424-A428 WeakPolarHBondContact O-CB 3.37Å; L424-A428 PolarHBondContact O-N 3.35Å; Y426-A428 PolarHBondContact O-N 3.32Å
429	Q	88.2	Confident	82	Confident	97 Å²	97	72 Å²	72	45%	0.453	34%	0.34	S	S	.	.	H	α-helix	trans	-83.1	-16.5	175.5	-71.2	173	76.4	0	0	113.4	F176 N425 Y426 Y427	F176-Q429 VanDerWaalsContact CE1-OE1 3.3Å; F176-Q429 HydrophobicContact CZ-CB 4.01Å; N425-Q429 PolarHBondContact O-NE2 3.31Å; Y426-Q429 PolarHBondContact O-N 2.94Å; Y426-Q429 VanDerWaalsContact O-N 3.16Å; Y427-Q429 PolarHBondContact O-N 2.9Å; Y427-Q429 VanDerWaalsContact O-N 3.13Å
430	L	87.3	Confident	81.7	Confident	6 Å²	6	67.1 Å²	67.1	3%	0.031	32%	0.317	C	S	.	.	H	α-helix	trans	-111.3	-11.8	-174	-70.5	176	0	0	0	113.9	I173 F176 Y426 Y427 D432 R433 F434 F467 F471	I173-L430 HydrophobicContact CD1-CD1 4.21Å; I173-L430 HydrophobicContact CD1-CD2 4.04Å; I173-L430 HydrophobicContact CG2-CD2 3.78Å; F176-L430 HydrophobicContact CE2-CD1 4.12Å; F176-L430 HydrophobicContact CE2-CD2 3.92Å; F176-L430 HydrophobicContact CE2-CG 4.01Å; Y426-L430 WeakPolarHBondContact O-CB 3.2Å; Y426-L430 VanDerWaalsContact O-CG 3.28Å; Y426-L430 WeakPolarHBondContact O-CG 3.39Å; Y426-L430 PolarHBondContact O-N 3.01Å; Y426-L430 VanDerWaalsContact O-N 3.14Å; Y427-L430 CarbonylContact O-C 3.59Å; Y427-L430 WeakPolarHBondContact O-CA 3.44Å; Y427-L430 PolarHBondContact O-N 2.92Å; L430-D432 PolarHBondContact O-N 2.78Å; L430-D432 VanDerWaalsContact O-N 3.17Å; L430-R433 WeakPolarHBondContact O-CB 3.27Å; L430-R433 PolarHBondContact O-N 2.83Å; L430-F434 HydrophobicContact CB-CD2 4.24Å; L430-F434 HydrophobicContact CB-CE2 3.97Å; L430-F434 HydrophobicContact CD1-CE2 4.28Å; L430-F434 HydrophobicContact CD2-CE2 4.22Å; L430-F434 HydrophobicContact CG-CE2 4.39Å; L430-F467 HydrophobicContact CD1-CE2 4.4Å; L430-F471 HydrophobicContact CD1-CE1 3.9Å; L430-F471 HydrophobicContact CD1-CZ 3.86Å
431	K	81.7	Confident	81.4	Confident	109 Å²	109	68 Å²	68	47%	0.474	32%	0.324	S	S	.	.	G	3₁₀ helix	trans	-54	-39.1	-172.7	66.6	-179.7	-174	173	0	113.2	Y427 R433	Y427-K431 HydrophobicContact CE1-CB 4.34Å; Y427-K431 HydrophobicContact CE2-CB 4.29Å; Y427-K431 PolarHBondContact O-N 2.78Å; K431-R433 PolarHBondContact O-N 2.54Å
432	D	78.5	Confident	81.3	Confident	147 Å²	147	66.8 Å²	66.8	79%	0.786	31%	0.312	S	S	*	.	G	3₁₀ helix	trans	-74.7	-6.7	-177.8	-58	-32.9	0	0	0	112.7	L430	L430-D432 PolarHBondContact O-N 2.78Å; L430-D432 VanDerWaalsContact O-N 3.17Å
433	R	76.6	Confident	81.2	Confident	77 Å²	77	60.1 Å²	60.1	29%	0.291	29%	0.287	S	S	.	.	G	3₁₀ helix	trans	-91.4	-33.2	-176.7	-169.9	175.4	-136.5	-152.5	4.9	113.7	D169 D170 P174 L430 K431	D169-R433 PolarHBondContact O-NH1 3.47Å; D169-R433 PolarHBondContact O-NH2 3.23Å; D170-R433 PolarHBondContact O-NH1 3.24Å; P174-R433 VanDerWaalsContact CD-NH2 3.33Å; L430-R433 WeakPolarHBondContact O-CB 3.27Å; L430-R433 PolarHBondContact O-N 2.83Å; K431-R433 PolarHBondContact O-N 2.54Å
434	F	72.2	Confident	80.9	Confident	25 Å²	25	64.9 Å²	64.9	11%	0.11	31%	0.309	C	S	.	.			trans	-113.3	39	-163.9	-60.1	-65.3	0	0	0	113.9	Y233 L430 Y436 F440 F471	Y233-F434 AromaticContact CD1-CE1 3.61Å; Y233-F434 HydrophobicContact CD1-CE1 3.61Å; Y233-F434 HydrophobicContact CD1-CZ 4.01Å; Y233-F434 HydrophobicContact CD2-CE1 4.11Å; Y233-F434 AromaticContact CD2-CZ 3.91Å; Y233-F434 HydrophobicContact CD2-CZ 3.91Å; Y233-F434 HydrophobicContact CE1-CD1 4.18Å; Y233-F434 AromaticContact CE1-CE1 3.46Å; Y233-F434 HydrophobicContact CE1-CE1 3.46Å; Y233-F434 VanDerWaalsContact CE1-CE1 3.46Å; Y233-F434 HydrophobicContact CE1-CZ 4.22Å; Y233-F434 AromaticContact CE2-CE1 3.96Å; Y233-F434 HydrophobicContact CE2-CE1 3.96Å; Y233-F434 HydrophobicContact CE2-CZ 4.09Å; Y233-F434 AromaticContact CG-CE1 3.94Å; Y233-F434 HydrophobicContact CG-CE1 3.94Å; Y233-F434 AromaticContact CG-CZ 3.86Å; Y233-F434 HydrophobicContact CG-CZ 3.86Å; Y233-F434 AromaticContact CZ-CE1 3.65Å; L430-F434 HydrophobicContact CB-CD2 4.24Å; L430-F434 HydrophobicContact CB-CE2 3.97Å; L430-F434 HydrophobicContact CD1-CE2 4.28Å; L430-F434 HydrophobicContact CD2-CE2 4.22Å; L430-F434 HydrophobicContact CG-CE2 4.39Å; F434-Y436 PolarHBondContact O-N 2.81Å; F434-Y436 VanDerWaalsContact O-N 3.15Å; F434-F440 HydrophobicContact CB-CD2 3.8Å; F434-F440 HydrophobicContact CB-CE2 4.19Å; F434-F440 HydrophobicContact CD1-CE2 4.37Å; F434-F440 HydrophobicContact CD2-CD2 4.06Å; F434-F440 HydrophobicContact CD2-CE2 4.04Å; F434-F440 AromaticContact CG-CD2 4Å; F434-F440 HydrophobicContact CG-CD2 4Å; F434-F440 AromaticContact CG-CE2 3.96Å; F434-F440 HydrophobicContact CG-CE2 3.96Å; F434-F471 HydrophobicContact CE2-CE1 4.21Å; F434-F471 AromaticContact CE2-CZ 3.69Å; F434-F471 HydrophobicContact CE2-CZ 3.69Å; F434-F471 HydrophobicContact CZ-CE1 4.09Å; F434-F471 AromaticContact CZ-CZ 3.87Å; F434-F471 HydrophobicContact CZ-CZ 3.87Å
435	D	61.7	Low	80.9	Confident	115 Å²	115	69.7 Å²	69.7	62%	0.615	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.1	-20.3	-173.4	-157.1	24.6	0	0	0	113.9
436	Y	56.3	Low	80.9	Confident	45 Å²	45	64.6 Å²	64.6	18%	0.176	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.7	-27.1	-168.3	88.6	-89.7	0	0	0	115.3	S97 Y98 Y101 D235 F434	S97-Y436 PolarHBondContact OG-OH 3.03Å; Y98-Y436 VanDerWaalsContact CA-CZ 3.5Å; Y98-Y436 WeakPolarHBondContact CA-OH 3.27Å; Y98-Y436 WeakPolarHBondContact CB-OH 3.4Å; Y98-Y436 AromaticContact CD2-CD1 3.43Å; Y98-Y436 HydrophobicContact CD2-CD1 3.43Å; Y98-Y436 VanDerWaalsContact CD2-CD1 3.43Å; Y98-Y436 AromaticContact CD2-CD2 3.43Å; Y98-Y436 HydrophobicContact CD2-CD2 3.43Å; Y98-Y436 VanDerWaalsContact CD2-CD2 3.43Å; Y98-Y436 AromaticContact CD2-CE1 3.64Å; Y98-Y436 HydrophobicContact CD2-CE1 3.64Å; Y98-Y436 AromaticContact CD2-CE2 3.56Å; Y98-Y436 HydrophobicContact CD2-CE2 3.56Å; Y98-Y436 AromaticContact CD2-CG 3.33Å; Y98-Y436 HydrophobicContact CD2-CG 3.33Å; Y98-Y436 AromaticContact CD2-CZ 3.7Å; Y98-Y436 AromaticContact CE2-CD1 3.95Å; Y98-Y436 HydrophobicContact CE2-CD1 3.95Å; Y98-Y436 HydrophobicContact CE2-CD2 4.06Å; Y98-Y436 AromaticContact CE2-CG 3.67Å; Y98-Y436 HydrophobicContact CE2-CG 3.67Å; Y98-Y436 HydrophobicContact CG-CD1 4.12Å; Y98-Y436 HydrophobicContact CG-CD2 4.47Å; Y98-Y436 AromaticContact CG-CE1 3.92Å; Y98-Y436 HydrophobicContact CG-CE1 3.92Å; Y98-Y436 HydrophobicContact CG-CE2 4.21Å; Y98-Y436 HydrophobicContact CG-CG 4.39Å; Y98-Y436 AromaticContact CG-CZ 3.97Å; Y98-Y436 PolarHBondContact N-OH 3.44Å; Y101-Y436 HydrophobicContact CD1-CD2 4.25Å; D235-Y436 PolarHBondContact OD1-OH 3.28Å; F434-Y436 PolarHBondContact O-N 2.81Å; F434-Y436 VanDerWaalsContact O-N 3.15Å
437	N	58.6	Low	80.8	Confident	54 Å²	54	65.6 Å²	65.6	29%	0.289	31%	0.308	S	S	.	.	S	Bend	trans	-114.2	-4.2	-160.6	-114	7.8	0	0	0	115.3	K439	N437-K439 HydrophobicContact CB-CB 4.12Å; N437-K439 PolarHBondContact O-N 2.74Å
438	R	70.4	Confident	80.9	Confident	198 Å²	198	70.1 Å²	70.1	75%	0.747	33%	0.33	S	S	*	.			trans	51.3	7.2	-173.4	-65.9	-168.9	179.9	166.5	-0.8	115.2	F440 D441	R438-F440 PolarHBondContact O-N 2.73Å; R438-D441 VanDerWaalsContact CA-CG 3.48Å; R438-D441 VanDerWaalsContact CA-OD1 3.22Å; R438-D441 WeakPolarHBondContact CA-OD1 3.48Å; R438-D441 WeakPolarHBondContact CB-OD2 3.47Å; R438-D441 WeakPolarHBondContact CD-OD2 3.34Å; R438-D441 WeakPolarHBondContact CG-OD2 3.43Å; R438-D441 WeakPolarHBondContact O-CB 3.45Å; R438-D441 VanDerWaalsContact O-CG 3.24Å; R438-D441 PolarHBondContact O-N 2.74Å; R438-D441 VanDerWaalsContact O-N 3.14Å
439	K	80.2	Confident	81	Confident	31 Å²	31	70.3 Å²	70.3	14%	0.135	33%	0.325	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-31.7	-170.3	-175.4	176.8	-165.7	174.5	0	111	E236 N437 I466 N470	E236-K439 PolarHBondContact O-NZ 3.39Å; N437-K439 HydrophobicContact CB-CB 4.12Å; N437-K439 PolarHBondContact O-N 2.74Å; K439-I466 HydrophobicContact CD-CG2 4.48Å; K439-I466 HydrophobicContact CG-CG2 3.83Å; K439-I466 WeakPolarHBondContact O-CD1 3.25Å; K439-N470 WeakPolarHBondContact CE-ND2 3.44Å; K439-N470 WeakPolarHBondContact CE-OD1 3.4Å; K439-N470 VanDerWaalsContact NZ-CG 3.33Å; K439-N470 PolarHBondContact NZ-ND2 3.34Å; K439-N470 PolarHBondContact NZ-OD1 3.5Å
440	F	86.2	Confident	81.2	Confident	11 Å²	11	67.6 Å²	67.6	5%	0.048	32%	0.317	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.3	2.1	-178.3	-59.9	-71.8	0	0	0	113.7	Y233 Y427 F434 R438 I442 Y443 I466 N470 F471	Y233-F440 HydrophobicContact CE2-CE2 4.06Å; Y233-F440 AromaticContact CE2-CZ 3.87Å; Y233-F440 HydrophobicContact CE2-CZ 3.87Å; Y427-F440 HydrophobicContact CD2-CB 4.03Å; Y427-F440 HydrophobicContact CE2-CB 3.61Å; Y427-F440 WeakPolarHBondContact CE2-O 3.33Å; F434-F440 HydrophobicContact CB-CD2 3.8Å; F434-F440 HydrophobicContact CB-CE2 4.19Å; F434-F440 HydrophobicContact CD1-CE2 4.37Å; F434-F440 HydrophobicContact CD2-CD2 4.06Å; F434-F440 HydrophobicContact CD2-CE2 4.04Å; F434-F440 AromaticContact CG-CD2 4Å; F434-F440 HydrophobicContact CG-CD2 4Å; F434-F440 AromaticContact CG-CE2 3.96Å; F434-F440 HydrophobicContact CG-CE2 3.96Å; R438-F440 PolarHBondContact O-N 2.73Å; F440-I442 PolarHBondContact O-N 3.42Å; F440-I442 VanDerWaalsContact O-N 3.07Å; F440-Y443 HydrophobicContact CB-CD2 4.15Å; F440-Y443 AromaticContact CD1-CD2 3.91Å; F440-Y443 HydrophobicContact CD1-CD2 3.91Å; F440-Y443 AromaticContact CD1-CE2 3.8Å; F440-Y443 HydrophobicContact CD1-CE2 3.8Å; F440-Y443 HydrophobicContact CE1-CE2 4.49Å; F440-Y443 WeakPolarHBondContact O-CB 3.34Å; F440-Y443 PolarHBondContact O-N 3.3Å; F440-I466 HydrophobicContact CD1-CG2 4.07Å; F440-I466 HydrophobicContact CE1-CG2 3.76Å; F440-N470 HydrophobicContact CZ-CB 4.14Å; F440-F471 AromaticContact CE1-CE2 3.67Å; F440-F471 HydrophobicContact CE1-CE2 3.67Å; F440-F471 HydrophobicContact CE1-CZ 4.44Å; F440-F471 AromaticContact CZ-CE2 3.61Å; F440-F471 HydrophobicContact CZ-CE2 3.61Å; F440-F471 HydrophobicContact CZ-CZ 4.02Å
441	D	84.4	Confident	81.3	Confident	57 Å²	57	74.6 Å²	74.6	31%	0.305	35%	0.351	S	S	.	.	H	α-helix	trans	-58.6	-26.3	-179.5	-68.5	8.5	0	0	0	112.6	R438 Y443 E444 K445	R438-D441 VanDerWaalsContact CA-CG 3.48Å; R438-D441 VanDerWaalsContact CA-OD1 3.22Å; R438-D441 WeakPolarHBondContact CA-OD1 3.48Å; R438-D441 WeakPolarHBondContact CB-OD2 3.47Å; R438-D441 WeakPolarHBondContact CD-OD2 3.34Å; R438-D441 WeakPolarHBondContact CG-OD2 3.43Å; R438-D441 WeakPolarHBondContact O-CB 3.45Å; R438-D441 VanDerWaalsContact O-CG 3.24Å; R438-D441 PolarHBondContact O-N 2.74Å; R438-D441 VanDerWaalsContact O-N 3.14Å; D441-Y443 PolarHBondContact O-N 3.21Å; D441-E444 WeakPolarHBondContact O-CB 3.32Å; D441-E444 PolarHBondContact O-N 3.29Å; D441-K445 PolarHBondContact O-N 3.25Å
442	I	88.5	Confident	81.8	Confident	55 Å²	55	76.9 Å²	76.9	28%	0.282	37%	0.367	S	S	.	.	H	α-helix	trans	-60.6	-31.4	175.4	-167.1	155.1	0	0	0	111.9	F440 K445 I446 T464 I466	F440-I442 PolarHBondContact O-N 3.42Å; F440-I442 VanDerWaalsContact O-N 3.07Å; I442-K445 PolarHBondContact O-N 3.08Å; I442-I446 HydrophobicContact CG1-CD1 4.08Å; I442-I446 WeakPolarHBondContact O-CG1 3.43Å; I442-I446 PolarHBondContact O-N 3.31Å; I442-T464 HydrophobicContact CD1-CG2 3.43Å; I442-T464 VanDerWaalsContact CD1-CG2 3.43Å; I442-T464 HydrophobicContact CG1-CG2 4.04Å; I442-I466 HydrophobicContact CG2-CD1 3.8Å
443	Y	90.7	Very high	82.6	Confident	0 Å²	0	72.8 Å²	72.8	0%	0	35%	0.345	C	S	.	.	H	α-helix	trans	-73.7	-30.2	178.8	-65.5	-64.4	0	0	0	112.5	I423 L424 Y427 F440 D441 I446 E447 L461 I466 F467	I423-Y443 HydrophobicContact CG2-CD1 3.83Å; I423-Y443 HydrophobicContact CG2-CE1 3.48Å; I423-Y443 VanDerWaalsContact CG2-CE1 3.48Å; L424-Y443 HydrophobicContact CD2-CD1 4.44Å; Y427-Y443 HydrophobicContact CD2-CD2 4.3Å; Y427-Y443 HydrophobicContact CD2-CG 4.39Å; Y427-Y443 HydrophobicContact CG-CG 4.37Å; F440-Y443 HydrophobicContact CB-CD2 4.15Å; F440-Y443 AromaticContact CD1-CD2 3.91Å; F440-Y443 HydrophobicContact CD1-CD2 3.91Å; F440-Y443 AromaticContact CD1-CE2 3.8Å; F440-Y443 HydrophobicContact CD1-CE2 3.8Å; F440-Y443 HydrophobicContact CE1-CE2 4.49Å; F440-Y443 WeakPolarHBondContact O-CB 3.34Å; F440-Y443 PolarHBondContact O-N 3.3Å; D441-Y443 PolarHBondContact O-N 3.21Å; Y443-I446 HydrophobicContact CD1-CD1 4.17Å; Y443-I446 HydrophobicContact CE1-CD1 4.49Å; Y443-I446 PolarHBondContact O-N 3.35Å; Y443-E447 WeakPolarHBondContact O-CB 3.28Å; Y443-E447 PolarHBondContact O-N 3.36Å; Y443-L461 HydrophobicContact CD1-CD1 4.08Å; Y443-L461 HydrophobicContact CE1-CD1 3.76Å; Y443-I466 HydrophobicContact CE2-CB 4.21Å; Y443-F467 HydrophobicContact CE2-CB 4.19Å; Y443-F467 VanDerWaalsContact OH-CB 3.3Å; Y443-F467 WeakPolarHBondContact OH-CB 3.34Å; Y443-F467 PolarHBondContact OH-N 3.42Å
444	E	87.4	Confident	83.3	Confident	99 Å²	99	72.3 Å²	72.3	46%	0.463	36%	0.358	S	S	.	.	H	α-helix	trans	-62.9	-46.9	170.1	-173.2	174	-153.7	0	0	110.5	Y427 D441 I446 E447 E448	Y427-E444 HydrophobicContact CE1-CB 4.27Å; D441-E444 WeakPolarHBondContact O-CB 3.32Å; D441-E444 PolarHBondContact O-N 3.29Å; E444-I446 VanDerWaalsContact C-N 3.33Å; E444-I446 PolarHBondContact O-N 2.86Å; E444-E447 WeakPolarHBondContact O-CB 3.3Å; E444-E447 PolarHBondContact O-N 3.44Å; E444-E448 WeakPolarHBondContact O-CG 3.25Å; E444-E448 PolarHBondContact O-N 3.38Å
445	K	90	Very high	84.2	Confident	127 Å²	127	76.1 Å²	76.1	55%	0.552	38%	0.383	S	S	*	.	H	α-helix	trans	-60.6	-41.2	175.3	-65.4	176.3	-177.6	171.9	0	112.3	D441 I442 I449	D441-K445 PolarHBondContact O-N 3.25Å; I442-K445 PolarHBondContact O-N 3.08Å; K445-I449 WeakPolarHBondContact O-CD1 3.4Å; K445-I449 VanDerWaalsContact O-CG1 3.26Å; K445-I449 WeakPolarHBondContact O-CG1 3.27Å; K445-I449 PolarHBondContact O-N 3.45Å; K445-I449 VanDerWaalsContact O-N 3.09Å
446	I	91.4	Very high	85.8	Confident	0 Å²	0	75 Å²	75	0%	0	37%	0.374	C	S	.	.	H	α-helix	trans	-66.6	-39.6	177.5	-68	165.7	0	0	0	110.5	L424 I442 Y443 E444 I449 S450 A457 M460 L461 T464	L424-I446 HydrophobicContact CD1-CG2 4.43Å; L424-I446 HydrophobicContact CD2-CB 4.4Å; L424-I446 HydrophobicContact CD2-CG2 4Å; I442-I446 HydrophobicContact CG1-CD1 4.08Å; I442-I446 WeakPolarHBondContact O-CG1 3.43Å; I442-I446 PolarHBondContact O-N 3.31Å; Y443-I446 HydrophobicContact CD1-CD1 4.17Å; Y443-I446 HydrophobicContact CE1-CD1 4.49Å; Y443-I446 PolarHBondContact O-N 3.35Å; E444-I446 VanDerWaalsContact C-N 3.33Å; E444-I446 PolarHBondContact O-N 2.86Å; I446-I449 PolarHBondContact O-N 3.42Å; I446-S450 WeakPolarHBondContact O-CB 3.27Å; I446-S450 PolarHBondContact O-N 2.94Å; I446-A457 HydrophobicContact CG2-CB 4.2Å; I446-M460 HydrophobicContact CD1-CB 4.18Å; I446-M460 HydrophobicContact CG1-CB 3.91Å; I446-M460 HydrophobicContact CG1-CE 4.13Å; I446-L461 HydrophobicContact CD1-CD1 4.35Å; I446-L461 HydrophobicContact CG2-CB 4.35Å; I446-T464 HydrophobicContact CD1-CG2 4.33Å
447	E	89.4	Confident	87.5	Confident	62 Å²	62	73.1 Å²	73.1	29%	0.29	37%	0.367	S	S	.	.	H	α-helix	trans	-62.2	-46.6	177	-172.8	172.3	-154	0	0	111.3	L424 Y443 E444 I449 S450 M451	L424-E447 HydrophobicContact CD2-CB 4.43Å; Y443-E447 WeakPolarHBondContact O-CB 3.28Å; Y443-E447 PolarHBondContact O-N 3.36Å; E444-E447 WeakPolarHBondContact O-CB 3.3Å; E444-E447 PolarHBondContact O-N 3.44Å; E447-I449 PolarHBondContact O-N 2.94Å; E447-S450 WeakPolarHBondContact O-CB 3.39Å; E447-S450 PolarHBondContact O-N 3.34Å; E447-S450 PolarHBondContact O-OG 2.88Å; E447-M451 HydrophobicContact CG-CE 4.37Å
448	E	90.5	Very high	89.1	Confident	119 Å²	119	74 Å²	74	56%	0.556	37%	0.372	S	S	*	.	H	α-helix	trans	-58.7	-47.5	174.9	-70.3	-178.7	167.6	0	0	112.2	E444 S450 M451	E444-E448 WeakPolarHBondContact O-CG 3.25Å; E444-E448 PolarHBondContact O-N 3.38Å; E448-S450 VanDerWaalsContact C-N 3.27Å; E448-S450 PolarHBondContact O-N 2.66Å; E448-M451 PolarHBondContact O-N 2.94Å
449	I	91.8	Very high	90.2	Very high	42 Å²	42	67.9 Å²	67.9	22%	0.215	36%	0.356	C	S	.	.	H	α-helix	trans	-65.1	-33.7	178.6	-66.8	167.8	0	0	0	110.8	K445 I446 E447 M451 I452 N453 Q456 A457 M460	K445-I449 WeakPolarHBondContact O-CD1 3.4Å; K445-I449 VanDerWaalsContact O-CG1 3.26Å; K445-I449 WeakPolarHBondContact O-CG1 3.27Å; K445-I449 PolarHBondContact O-N 3.45Å; K445-I449 VanDerWaalsContact O-N 3.09Å; I446-I449 PolarHBondContact O-N 3.42Å; E447-I449 PolarHBondContact O-N 2.94Å; I449-M451 PolarHBondContact O-N 3.35Å; I449-I452 PolarHBondContact O-N 3.42Å; I449-N453 CarbonylContact O-C 3.58Å; I449-N453 PolarHBondContact O-N 3.31Å; I449-Q456 HydrophobicContact CG2-CB 4.21Å; I449-Q456 HydrophobicContact CG2-CG 4.09Å; I449-A457 HydrophobicContact CB-CB 4.47Å; I449-A457 HydrophobicContact CG2-CB 4.1Å; I449-M460 HydrophobicContact CD1-CE 3.91Å; I449-M460 HydrophobicContact CD1-SD 3.48Å; I449-M460 WeakPolarHBondContact CD1-SD 3.46Å
450	S	90.8	Very high	90.8	Very high	41 Å²	41	69 Å²	69	29%	0.287	36%	0.363	S	S	.	.	H	α-helix	trans	-60.8	-28.5	-179.3	81.1	0	0	0	0	113.1	I446 E447 E448 I452 A457	I446-S450 WeakPolarHBondContact O-CB 3.27Å; I446-S450 PolarHBondContact O-N 2.94Å; E447-S450 WeakPolarHBondContact O-CB 3.39Å; E447-S450 PolarHBondContact O-N 3.34Å; E447-S450 PolarHBondContact O-OG 2.88Å; E448-S450 VanDerWaalsContact C-N 3.27Å; E448-S450 PolarHBondContact O-N 2.66Å; S450-I452 VanDerWaalsContact C-N 3.33Å; S450-A457 VanDerWaalsContact CA-CB 3.49Å
451	M	89.4	Confident	91.1	Very high	153 Å²	153	68.7 Å²	68.7	75%	0.754	36%	0.362	S	S	*	.	H	α-helix	trans	-73.8	-24.5	176.9	-56.6	-168.6	-158.7	0	0	112.9	E447 E448 I449	E447-M451 HydrophobicContact CG-CE 4.37Å; E448-M451 PolarHBondContact O-N 2.94Å; I449-M451 PolarHBondContact O-N 3.35Å
452	I	93.8	Very high	91.4	Very high	157 Å²	157	71.4 Å²	71.4	81%	0.805	37%	0.373	S	S	*	.	H	α-helix	trans	-100	-48.6	-177.5	-56	172.9	0	0	0	110.7	I449 S450	I449-I452 PolarHBondContact O-N 3.42Å; S450-I452 VanDerWaalsContact C-N 3.33Å
453	N	93.5	Very high	91.6	Very high	60 Å²	60	75.4 Å²	75.4	32%	0.321	39%	0.394	S	S	.	.			trans	-143.1	93.4	-175.4	-173.7	-5.9	0	0	0	111.5	I449 T455 Q456 A457	I449-N453 CarbonylContact O-C 3.58Å; I449-N453 PolarHBondContact O-N 3.31Å; N453-T455 VanDerWaalsContact C-N 3.27Å; N453-T455 PolarHBondContact O-N 3.42Å; N453-T455 PolarHBondContact OD1-N 3.46Å; N453-T455 PolarHBondContact OD1-OG1 2.82Å; N453-Q456 HydrophobicContact CB-CB 4.12Å; N453-Q456 WeakPolarHBondContact ND2-CB 3.31Å; N453-Q456 PolarHBondContact ND2-OE1 2.89Å; N453-Q456 PolarHBondContact O-N 2.83Å; N453-Q456 PolarHBondContact OD1-N 2.87Å; N453-A457 PolarHBondContact O-N 3.5Å
454	A	91.5	Very high	91.7	Very high	68 Å²	68	76.1 Å²	76.1	56%	0.562	40%	0.399	S	S	*	.	H	α-helix	trans	-60	-32.9	-179.9	0	0	0	0	0	113.7	L458	A454-L458 WeakPolarHBondContact O-CB 3.36Å; A454-L458 PolarHBondContact O-N 3Å
455	T	92.7	Very high	91.9	Very high	104 Å²	104	74.9 Å²	74.9	64%	0.638	40%	0.395	S	S	*	.	H	α-helix	trans	-69	-43.4	-179.5	59.9	0	0	0	0	111.8	N453 L458 T459	N453-T455 VanDerWaalsContact C-N 3.27Å; N453-T455 PolarHBondContact O-N 3.42Å; N453-T455 PolarHBondContact OD1-N 3.46Å; N453-T455 PolarHBondContact OD1-OG1 2.82Å; T455-L458 PolarHBondContact O-N 3.46Å; T455-T459 PolarHBondContact O-N 2.86Å; T455-T459 VanDerWaalsContact O-N 3.07Å; T455-T459 PolarHBondContact O-OG1 2.87Å
456	Q	93.5	Very high	92	Very high	93 Å²	93	70.2 Å²	70.2	44%	0.435	38%	0.376	S	S	.	.	H	α-helix	trans	-66.4	-42.7	176.2	-177.4	178.8	-2.2	0	0	111.6	I449 N453 L458 T459 M460	I449-Q456 HydrophobicContact CG2-CB 4.21Å; I449-Q456 HydrophobicContact CG2-CG 4.09Å; N453-Q456 HydrophobicContact CB-CB 4.12Å; N453-Q456 WeakPolarHBondContact ND2-CB 3.31Å; N453-Q456 PolarHBondContact ND2-OE1 2.89Å; N453-Q456 PolarHBondContact O-N 2.83Å; N453-Q456 PolarHBondContact OD1-N 2.87Å; Q456-L458 VanDerWaalsContact C-N 3.3Å; Q456-L458 PolarHBondContact O-N 2.89Å; Q456-T459 WeakPolarHBondContact CA-OG1 3.41Å; Q456-T459 PolarHBondContact O-N 2.89Å; Q456-T459 PolarHBondContact O-OG1 3.33Å; Q456-M460 HydrophobicContact CG-SD 4.47Å; Q456-M460 WeakPolarHBondContact O-CG 3.37Å; Q456-M460 PolarHBondContact O-N 3.44Å
457	A	92.4	Very high	92	Very high	4 Å²	4	70.4 Å²	70.4	3%	0.033	38%	0.377	C	S	.	.	H	α-helix	trans	-59.9	-41.5	174.8	0	0	0	0	0	111.7	I446 I449 S450 N453 M460 L461	I446-A457 HydrophobicContact CG2-CB 4.2Å; I449-A457 HydrophobicContact CB-CB 4.47Å; I449-A457 HydrophobicContact CG2-CB 4.1Å; S450-A457 VanDerWaalsContact CA-CB 3.49Å; N453-A457 PolarHBondContact O-N 3.5Å; A457-M460 PolarHBondContact O-N 2.93Å; A457-L461 VanDerWaalsContact O-CB 3.29Å; A457-L461 WeakPolarHBondContact O-CB 3.5Å; A457-L461 PolarHBondContact O-N 3.33Å
458	L	91.9	Very high	92.3	Very high	73 Å²	73	68.9 Å²	68.9	38%	0.382	37%	0.37	S	S	.	.	H	α-helix	trans	-64.1	-40.4	177.2	-176.4	62.4	0	0	0	112.2	P421 A454 T455 Q456 L461 Q462	P421-L458 HydrophobicContact CG-CD1 4.27Å; A454-L458 WeakPolarHBondContact O-CB 3.36Å; A454-L458 PolarHBondContact O-N 3Å; T455-L458 PolarHBondContact O-N 3.46Å; Q456-L458 VanDerWaalsContact C-N 3.3Å; Q456-L458 PolarHBondContact O-N 2.89Å; L458-L461 PolarHBondContact O-N 3.28Å; L458-Q462 WeakPolarHBondContact O-CG 3.42Å; L458-Q462 PolarHBondContact O-N 2.94Å
459	T	93.5	Very high	92.4	Very high	69 Å²	69	66 Å²	66	42%	0.423	36%	0.355	S	S	.	.	H	α-helix	trans	-63.2	-45.1	175.3	48.6	0	0	0	0	111.8	T455 Q456 L461 Q462 D463	T455-T459 PolarHBondContact O-N 2.86Å; T455-T459 VanDerWaalsContact O-N 3.07Å; T455-T459 PolarHBondContact O-OG1 2.87Å; Q456-T459 WeakPolarHBondContact CA-OG1 3.41Å; Q456-T459 PolarHBondContact O-N 2.89Å; Q456-T459 PolarHBondContact O-OG1 3.33Å; T459-L461 VanDerWaalsContact C-N 3.27Å; T459-L461 PolarHBondContact O-N 3.46Å; T459-Q462 WeakPolarHBondContact O-CB 3.48Å; T459-Q462 PolarHBondContact O-N 3.38Å; T459-Q462 VanDerWaalsContact O-N 3.12Å; T459-D463 PolarHBondContact O-N 2.9Å; T459-D463 VanDerWaalsContact O-N 3.09Å
460	M	92.8	Very high	92.4	Very high	55 Å²	55	64 Å²	64	27%	0.271	35%	0.345	S	S	.	.	H	α-helix	trans	-62.6	-36	176	-67.8	178	68.1	0	0	112.2	I446 I449 Q456 A457 Q462 D463 T464	I446-M460 HydrophobicContact CD1-CB 4.18Å; I446-M460 HydrophobicContact CG1-CB 3.91Å; I446-M460 HydrophobicContact CG1-CE 4.13Å; I449-M460 HydrophobicContact CD1-CE 3.91Å; I449-M460 HydrophobicContact CD1-SD 3.48Å; I449-M460 WeakPolarHBondContact CD1-SD 3.46Å; Q456-M460 HydrophobicContact CG-SD 4.47Å; Q456-M460 WeakPolarHBondContact O-CG 3.37Å; Q456-M460 PolarHBondContact O-N 3.44Å; A457-M460 PolarHBondContact O-N 2.93Å; M460-Q462 VanDerWaalsContact C-N 3.33Å; M460-D463 PolarHBondContact O-N 3.24Å; M460-T464 VanDerWaalsContact O-CG2 3.31Å; M460-T464 WeakPolarHBondContact O-CG2 3.32Å; M460-T464 PolarHBondContact O-N 3.4Å; M460-T464 PolarHBondContact O-OG1 2.98Å
461	L	93	Very high	92.7	Very high	5 Å²	5	62.1 Å²	62.1	3%	0.026	33%	0.332	C	S	.	.	H	α-helix	trans	-70.8	-30	177.1	-168	59.4	0	0	0	112.6	K420 I423 Y443 I446 A457 L458 T459 T464	K420-L461 HydrophobicContact CB-CD2 4.31Å; K420-L461 HydrophobicContact CB-CG 4.25Å; K420-L461 WeakPolarHBondContact CD-O 3.42Å; K420-L461 WeakPolarHBondContact CE-O 3.29Å; K420-L461 PolarHBondContact NZ-O 3.29Å; K420-L461 WeakPolarHBondContact O-CD2 3.42Å; I423-L461 HydrophobicContact CB-CD1 4.22Å; I423-L461 HydrophobicContact CD1-CD1 4.23Å; I423-L461 HydrophobicContact CG2-CD1 4.36Å; Y443-L461 HydrophobicContact CD1-CD1 4.08Å; Y443-L461 HydrophobicContact CE1-CD1 3.76Å; I446-L461 HydrophobicContact CD1-CD1 4.35Å; I446-L461 HydrophobicContact CG2-CB 4.35Å; A457-L461 VanDerWaalsContact O-CB 3.29Å; A457-L461 WeakPolarHBondContact O-CB 3.5Å; A457-L461 PolarHBondContact O-N 3.33Å; L458-L461 PolarHBondContact O-N 3.28Å; T459-L461 VanDerWaalsContact C-N 3.27Å; T459-L461 PolarHBondContact O-N 3.46Å; L461-T464 WeakPolarHBondContact CA-OG1 3.49Å; L461-T464 PolarHBondContact O-OG1 3.05Å
462	Q	91.2	Very high	93	Very high	114 Å²	114	54.8 Å²	54.8	53%	0.533	30%	0.296	S	S	.	.	H	α-helix	trans	-71.9	-38.3	174.7	-76.3	175.1	-22.2	0	0	112	L458 T459 M460 T464	L458-Q462 WeakPolarHBondContact O-CG 3.42Å; L458-Q462 PolarHBondContact O-N 2.94Å; T459-Q462 WeakPolarHBondContact O-CB 3.48Å; T459-Q462 PolarHBondContact O-N 3.38Å; T459-Q462 VanDerWaalsContact O-N 3.12Å; M460-Q462 VanDerWaalsContact C-N 3.33Å; Q462-T464 VanDerWaalsContact C-N 3.29Å; Q462-T464 PolarHBondContact O-N 2.93Å
463	D	92.7	Very high	93.2	Very high	138 Å²	138	48.5 Å²	48.5	74%	0.738	26%	0.263	S	S	*	.	H	α-helix	trans	-76.5	-13.4	-179.6	-65.6	-21.2	0	0	0	113.8	T459 M460	T459-D463 PolarHBondContact O-N 2.9Å; T459-D463 VanDerWaalsContact O-N 3.09Å; M460-D463 PolarHBondContact O-N 3.24Å
464	T	92.3	Very high	93.5	Very high	16 Å²	16	45.6 Å²	45.6	10%	0.098	25%	0.248	C	C	.	.			trans	-101.7	131	-179.7	47	0	0	0	0	111.7	K420 I442 I446 M460 L461 Q462	K420-T464 PolarHBondContact NZ-O 3.29Å; I442-T464 HydrophobicContact CD1-CG2 3.43Å; I442-T464 VanDerWaalsContact CD1-CG2 3.43Å; I442-T464 HydrophobicContact CG1-CG2 4.04Å; I446-T464 HydrophobicContact CD1-CG2 4.33Å; M460-T464 VanDerWaalsContact O-CG2 3.31Å; M460-T464 WeakPolarHBondContact O-CG2 3.32Å; M460-T464 PolarHBondContact O-N 3.4Å; M460-T464 PolarHBondContact O-OG1 2.98Å; L461-T464 WeakPolarHBondContact CA-OG1 3.49Å; L461-T464 PolarHBondContact O-OG1 3.05Å; Q462-T464 VanDerWaalsContact C-N 3.29Å; Q462-T464 PolarHBondContact O-N 2.93Å
465	D	92.3	Very high	93.7	Very high	72 Å²	72	42.6 Å²	42.6	39%	0.385	22%	0.222	S	C	.	.			trans	-122.7	9.2	-178.1	64.1	-3.4	0	0	0	114.1	F467 E468 K469	D465-F467 VanDerWaalsContact C-N 3.33Å; D465-F467 PolarHBondContact O-N 3.47Å; D465-E468 WeakPolarHBondContact CA-OE2 3.42Å; D465-E468 PolarHBondContact O-N 2.83Å; D465-K469 WeakPolarHBondContact O-CG 3.33Å; D465-K469 PolarHBondContact O-N 2.68Å; D465-K469 WeakPolarHBondContact OD1-CE 3.44Å; D465-K469 IonicContact OD1-NZ 3.38Å; D465-K469 PolarHBondContact OD1-NZ 3.32Å; D465-K469 WeakPolarHBondContact OD2-CE 3.3Å; D465-K469 IonicContact OD2-NZ 2.69Å; D465-K469 PolarHBondContact OD2-NZ 3.15Å
466	I	91.5	Very high	94	Very high	30 Å²	30	37.6 Å²	37.6	15%	0.154	19%	0.192	C	C	.	.	H	α-helix	trans	-57.5	-44.2	-175.3	-56.3	-179.2	0	0	0	111.4	K439 F440 I442 Y443 N470	K439-I466 HydrophobicContact CD-CG2 4.48Å; K439-I466 HydrophobicContact CG-CG2 3.83Å; K439-I466 WeakPolarHBondContact O-CD1 3.25Å; F440-I466 HydrophobicContact CD1-CG2 4.07Å; F440-I466 HydrophobicContact CE1-CG2 3.76Å; I442-I466 HydrophobicContact CG2-CD1 3.8Å; Y443-I466 HydrophobicContact CE2-CB 4.21Å; I466-N470 WeakPolarHBondContact O-CB 3.48Å; I466-N470 PolarHBondContact O-N 3.43Å; I466-N470 VanDerWaalsContact O-N 3.17Å; I466-N470 PolarHBondContact O-ND2 2.99Å
467	F	92.5	Very high	94	Very high	3 Å²	3	35 Å²	35	1%	0.013	18%	0.181	C	C	.	.	H	α-helix	trans	-64.4	-47.1	179.1	-171.1	-83.1	0	0	0	111.3	W417 P418 I423 Y426 L430 Y443 D465 K469 N470 F471	W417-F467 AromaticContact CH2-CE1 3.73Å; W417-F467 HydrophobicContact CH2-CE1 3.73Å; W417-F467 HydrophobicContact CH2-CZ 4.08Å; W417-F467 HydrophobicContact CZ2-CE1 4.44Å; W417-F467 AromaticContact CZ3-CE1 3.93Å; W417-F467 HydrophobicContact CZ3-CE1 3.93Å; P418-F467 HydrophobicContact CG-CD1 3.74Å; P418-F467 HydrophobicContact CG-CE1 3.64Å; I423-F467 HydrophobicContact CD1-CB 4.3Å; I423-F467 HydrophobicContact CG1-CB 4.42Å; I423-F467 HydrophobicContact CG1-CD1 4.14Å; I423-F467 HydrophobicContact CG1-CG 4.23Å; I423-F467 HydrophobicContact CG2-CB 3.8Å; I423-F467 HydrophobicContact CG2-CD1 4.47Å; I423-F467 HydrophobicContact CG2-CD2 3.82Å; I423-F467 HydrophobicContact CG2-CG 3.77Å; Y426-F467 HydrophobicContact CD2-CE1 4.42Å; Y426-F467 AromaticContact CD2-CZ 3.99Å; Y426-F467 HydrophobicContact CD2-CZ 3.99Å; Y426-F467 HydrophobicContact CG-CE2 4.4Å; Y426-F467 AromaticContact CG-CZ 3.84Å; Y426-F467 HydrophobicContact CG-CZ 3.84Å; L430-F467 HydrophobicContact CD1-CE2 4.4Å; Y443-F467 HydrophobicContact CE2-CB 4.19Å; Y443-F467 VanDerWaalsContact OH-CB 3.3Å; Y443-F467 WeakPolarHBondContact OH-CB 3.34Å; Y443-F467 PolarHBondContact OH-N 3.42Å; D465-F467 VanDerWaalsContact C-N 3.33Å; D465-F467 PolarHBondContact O-N 3.47Å; F467-K469 VanDerWaalsContact C-N 3.32Å; F467-K469 PolarHBondContact O-N 3.25Å; F467-N470 PolarHBondContact O-N 2.9Å; F467-F471 HydrophobicContact CD1-CB 4.32Å; F467-F471 HydrophobicContact CD1-CD2 4.09Å; F467-F471 AromaticContact CD2-CD2 3.53Å; F467-F471 HydrophobicContact CD2-CD2 3.53Å; F467-F471 AromaticContact CD2-CE2 3.72Å; F467-F471 HydrophobicContact CD2-CE2 3.72Å; F467-F471 HydrophobicContact CD2-CG 4.47Å; F467-F471 HydrophobicContact CE1-CB 3.94Å; F467-F471 HydrophobicContact CE1-CD2 4.11Å; F467-F471 HydrophobicContact CE1-CG 4.23Å; F467-F471 AromaticContact CE2-CD2 3.57Å; F467-F471 HydrophobicContact CE2-CD2 3.57Å; F467-F471 AromaticContact CE2-CE2 3.79Å; F467-F471 HydrophobicContact CE2-CE2 3.79Å; F467-F471 HydrophobicContact CE2-CG 4.14Å; F467-F471 AromaticContact CG-CD2 3.8Å; F467-F471 HydrophobicContact CG-CD2 3.8Å; F467-F471 HydrophobicContact CG-CE2 4.37Å; F467-F471 HydrophobicContact CZ-CB 4.16Å; F467-F471 AromaticContact CZ-CD2 3.86Å; F467-F471 HydrophobicContact CZ-CD2 3.86Å; F467-F471 HydrophobicContact CZ-CE2 4.48Å; F467-F471 HydrophobicContact CZ-CG 4.01Å; F467-F471 WeakPolarHBondContact O-CD2 3.36Å; F467-F471 PolarHBondContact O-N 2.93Å
468	E	93.9	Very high	94.1	Very high	30 Å²	30	35 Å²	35	14%	0.14	18%	0.18	C	C	.	.	H	α-helix	trans	-62	-39.3	179.8	-68.5	92.4	150	0	0	112.4	P278 G279 K420 D465 N470	P278-E468 CarbonylContact C-O 3.59Å; P278-E468 WeakPolarHBondContact CB-O 3.47Å; G279-E468 WeakPolarHBondContact CA-O 3.28Å; G279-E468 PolarHBondContact N-O 3.33Å; K420-E468 VanDerWaalsContact CD-OE1 3.25Å; K420-E468 WeakPolarHBondContact CD-OE1 3.23Å; K420-E468 WeakPolarHBondContact CE-OE1 3.28Å; K420-E468 IonicContact NZ-OE1 3.3Å; K420-E468 PolarHBondContact NZ-OE1 3.45Å; K420-E468 IonicContact NZ-OE2 3.61Å; D465-E468 WeakPolarHBondContact CA-OE2 3.42Å; D465-E468 PolarHBondContact O-N 2.83Å; E468-N470 VanDerWaalsContact C-N 3.34Å; E468-N470 PolarHBondContact O-N 2.94Å
469	K	93.1	Very high	93.7	Very high	58 Å²	58	34.7 Å²	34.7	25%	0.252	18%	0.183	S	C	.	.	H	α-helix	trans	-65.9	-36.9	176.4	-73.2	175.4	175.4	158.5	0	113	E236 E238 P278 D465 F467	E236-K469 WeakPolarHBondContact OE2-CB 3.17Å; E238-K469 WeakPolarHBondContact OE1-CD 3.26Å; E238-K469 VanDerWaalsContact OE1-CE 3.29Å; E238-K469 WeakPolarHBondContact OE1-CE 3.47Å; E238-K469 IonicContact OE1-NZ 2.75Å; E238-K469 PolarHBondContact OE1-NZ 2.93Å; P278-K469 WeakPolarHBondContact CB-O 3.47Å; D465-K469 WeakPolarHBondContact O-CG 3.33Å; D465-K469 PolarHBondContact O-N 2.68Å; D465-K469 WeakPolarHBondContact OD1-CE 3.44Å; D465-K469 IonicContact OD1-NZ 3.38Å; D465-K469 PolarHBondContact OD1-NZ 3.32Å; D465-K469 WeakPolarHBondContact OD2-CE 3.3Å; D465-K469 IonicContact OD2-NZ 2.69Å; D465-K469 PolarHBondContact OD2-NZ 3.15Å; F467-K469 VanDerWaalsContact C-N 3.32Å; F467-K469 PolarHBondContact O-N 3.25Å
470	N	93.2	Very high	93.3	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-94	-16.8	-171.3	-77.1	-85.3	0	0	0	115.4	Y233 L234 E236 K439 F440 I466 F467 E468	Y233-N470 WeakPolarHBondContact CA-O 3.42Å; Y233-N470 HydrophobicContact CD2-CB 4.2Å; Y233-N470 HydrophobicContact CE2-CB 3.88Å; L234-N470 PolarHBondContact N-O 3.48Å; E236-N470 PolarHBondContact N-OD1 2.86Å; K439-N470 WeakPolarHBondContact CE-ND2 3.44Å; K439-N470 WeakPolarHBondContact CE-OD1 3.4Å; K439-N470 VanDerWaalsContact NZ-CG 3.33Å; K439-N470 PolarHBondContact NZ-ND2 3.34Å; K439-N470 PolarHBondContact NZ-OD1 3.5Å; F440-N470 HydrophobicContact CZ-CB 4.14Å; I466-N470 WeakPolarHBondContact O-CB 3.48Å; I466-N470 PolarHBondContact O-N 3.43Å; I466-N470 VanDerWaalsContact O-N 3.17Å; I466-N470 PolarHBondContact O-ND2 2.99Å; F467-N470 PolarHBondContact O-N 2.9Å; E468-N470 VanDerWaalsContact C-N 3.34Å; E468-N470 PolarHBondContact O-N 2.94Å
471	F	95.6	Very high	92.8	Very high	2 Å²	2	32.4 Å²	32.4	1%	0.009	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	143.6	-176.4	-63.3	-82.5	0	0	0	112	I173 I231 L232 Y233 G279 W417 L430 F434 F440 F467	I173-F471 HydrophobicContact CD1-CD1 3.73Å; I173-F471 HydrophobicContact CD1-CE1 3.47Å; I173-F471 VanDerWaalsContact CD1-CE1 3.47Å; I231-F471 HydrophobicContact CG2-CB 4.36Å; I231-F471 HydrophobicContact CG2-CD1 3.95Å; L232-F471 WeakPolarHBondContact O-CA 3.45Å; Y233-F471 AromaticContact CD2-CD1 3.99Å; Y233-F471 HydrophobicContact CD2-CD1 3.99Å; Y233-F471 AromaticContact CD2-CE1 3.4Å; Y233-F471 HydrophobicContact CD2-CE1 3.4Å; Y233-F471 VanDerWaalsContact CD2-CE1 3.4Å; Y233-F471 HydrophobicContact CD2-CE2 4.13Å; Y233-F471 AromaticContact CD2-CZ 3.48Å; Y233-F471 HydrophobicContact CD2-CZ 3.48Å; Y233-F471 VanDerWaalsContact CD2-CZ 3.48Å; Y233-F471 HydrophobicContact CE2-CE1 4.34Å; Y233-F471 HydrophobicContact CE2-CE2 4.41Å; Y233-F471 AromaticContact CE2-CZ 3.98Å; Y233-F471 HydrophobicContact CE2-CZ 3.98Å; Y233-F471 AromaticContact CG-CE1 3.97Å; Y233-F471 HydrophobicContact CG-CE1 3.97Å; Y233-F471 HydrophobicContact CG-CZ 4.38Å; G279-F471 PolarHBondContact N-O 2.93Å; W417-F471 HydrophobicContact CH2-CB 4.31Å; W417-F471 HydrophobicContact CZ3-CB 4.01Å; L430-F471 HydrophobicContact CD1-CE1 3.9Å; L430-F471 HydrophobicContact CD1-CZ 3.86Å; F434-F471 HydrophobicContact CE2-CE1 4.21Å; F434-F471 AromaticContact CE2-CZ 3.69Å; F434-F471 HydrophobicContact CE2-CZ 3.69Å; F434-F471 HydrophobicContact CZ-CE1 4.09Å; F434-F471 AromaticContact CZ-CZ 3.87Å; F434-F471 HydrophobicContact CZ-CZ 3.87Å; F440-F471 AromaticContact CE1-CE2 3.67Å; F440-F471 HydrophobicContact CE1-CE2 3.67Å; F440-F471 HydrophobicContact CE1-CZ 4.44Å; F440-F471 AromaticContact CZ-CE2 3.61Å; F440-F471 HydrophobicContact CZ-CE2 3.61Å; F440-F471 HydrophobicContact CZ-CZ 4.02Å; F467-F471 HydrophobicContact CD1-CB 4.32Å; F467-F471 HydrophobicContact CD1-CD2 4.09Å; F467-F471 AromaticContact CD2-CD2 3.53Å; F467-F471 HydrophobicContact CD2-CD2 3.53Å; F467-F471 AromaticContact CD2-CE2 3.72Å; F467-F471 HydrophobicContact CD2-CE2 3.72Å; F467-F471 HydrophobicContact CD2-CG 4.47Å; F467-F471 HydrophobicContact CE1-CB 3.94Å; F467-F471 HydrophobicContact CE1-CD2 4.11Å; F467-F471 HydrophobicContact CE1-CG 4.23Å; F467-F471 AromaticContact CE2-CD2 3.57Å; F467-F471 HydrophobicContact CE2-CD2 3.57Å; F467-F471 AromaticContact CE2-CE2 3.79Å; F467-F471 HydrophobicContact CE2-CE2 3.79Å; F467-F471 HydrophobicContact CE2-CG 4.14Å; F467-F471 AromaticContact CG-CD2 3.8Å; F467-F471 HydrophobicContact CG-CD2 3.8Å; F467-F471 HydrophobicContact CG-CE2 4.37Å; F467-F471 HydrophobicContact CZ-CB 4.16Å; F467-F471 AromaticContact CZ-CD2 3.86Å; F467-F471 HydrophobicContact CZ-CD2 3.86Å; F467-F471 HydrophobicContact CZ-CE2 4.48Å; F467-F471 HydrophobicContact CZ-CG 4.01Å; F467-F471 WeakPolarHBondContact O-CD2 3.36Å; F467-F471 PolarHBondContact O-N 2.93Å
472	L	97.3	Very high	92.2	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	151.7	166	64.7	80.5	0	0	0	110.8	I231 L232 L234 L276 L277 V474	I231-L472 WeakPolarHBondContact CA-O 3.47Å; L232-L472 HydrophobicContact CB-CD1 3.89Å; L232-L472 HydrophobicContact CB-CG 4.12Å; L232-L472 HydrophobicContact CD1-CD1 3.72Å; L232-L472 HydrophobicContact CG-CD1 3.78Å; L232-L472 PolarHBondContact N-O 3.29Å; L232-L472 PolarHBondContact O-N 3.46Å; L232-L472 VanDerWaalsContact O-N 3.16Å; L234-L472 HydrophobicContact CD1-CD2 4.11Å; L234-L472 HydrophobicContact CD2-CD2 4Å; L234-L472 HydrophobicContact CD2-CG 4.48Å; L234-L472 HydrophobicContact CG-CD2 4.41Å; L276-L472 HydrophobicContact CB-CD1 4.35Å; L276-L472 HydrophobicContact CB-CD2 3.81Å; L276-L472 HydrophobicContact CD1-CD1 4.21Å; L277-L472 WeakPolarHBondContact O-CB 3Å; L472-V474 HydrophobicContact CD1-CG2 3.37Å
473	H	97.8	Very high	92	Very high	24 Å²	24	31.3 Å²	31.3	11%	0.111	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	135.7	175.2	176	-102.4	0	0	0	109.1	S229 M230 I231 A280 S281 N282 W417	S229-H473 PolarHBondContact OG-CE1 3.16Å; S229-H473 PolarHBondContact OG-NE2 3.39Å; M230-H473 PolarHBondContact O-CD2 2.93Å; I231-H473 HydrophobicContact CG1-CB 4.48Å; A280-H473 PolarHBondContact O-N 3.44Å; S281-H473 PolarHBondContact OG-ND1 3.09Å; N282-H473 PolarHBondContact N-O 3.31Å; N282-H473 PolarHBondContact ND2-O 3.04Å; W417-H473 HydrophobicContact CD2-CB 3.76Å; W417-H473 HydrophobicContact CE3-CB 3.88Å; W417-H473 HydrophobicContact CG-CB 4.31Å; W417-H473 HydrophobicContact CH2-CB 4.26Å; W417-H473 HydrophobicContact CZ2-CB 4.14Å; W417-H473 HydrophobicContact CZ3-CB 4.13Å
474	V	98	Very high	91.9	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	131.4	175.6	-174.7	0	0	0	0	108.7	S229 M230 L232 I258 L276 N282 I284 L472 V476	S229-V474 CarbonylContact C-O 3.52Å; S229-V474 WeakPolarHBondContact CA-O 3.29Å; M230-V474 HydrophobicContact CE-CB 3.95Å; M230-V474 HydrophobicContact CE-CG1 3.73Å; M230-V474 HydrophobicContact CG-CB 3.91Å; M230-V474 PolarHBondContact N-O 3.5Å; M230-V474 PolarHBondContact O-N 3.47Å; L232-V474 HydrophobicContact CD1-CG2 3.94Å; L232-V474 HydrophobicContact CG-CG2 4.11Å; I258-V474 HydrophobicContact CD1-CG1 3.87Å; L276-V474 HydrophobicContact CD1-CG2 3.64Å; N282-V474 WeakPolarHBondContact O-CA 3.07Å; I284-V474 HydrophobicContact CD1-CG1 3.79Å; L472-V474 HydrophobicContact CD1-CG2 3.37Å; V474-V476 HydrophobicContact CG1-CG2 4.19Å
475	D	97.4	Very high	91.8	Very high	4 Å²	4	28.1 Å²	28.1	2%	0.021	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	105.9	-179.3	-164.1	5.6	0	0	0	109.9	R227 N282 Q283 I284 N477	R227-D475 WeakPolarHBondContact CG-OD1 3.48Å; R227-D475 IonicContact CZ-OD1 3.8Å; R227-D475 IonicContact CZ-OD2 3.65Å; R227-D475 IonicContact NE-OD1 3.94Å; R227-D475 PolarHBondContact NE-OD1 2.87Å; R227-D475 IonicContact NE-OD2 2.87Å; R227-D475 PolarHBondContact NE-OD2 2.98Å; R227-D475 VanDerWaalsContact NH2-CG 3.3Å; R227-D475 IonicContact NH2-OD1 3.5Å; R227-D475 PolarHBondContact NH2-OD1 3.33Å; R227-D475 IonicContact NH2-OD2 3.48Å; R227-D475 PolarHBondContact NH2-OD2 3.31Å; N282-D475 PolarHBondContact O-N 2.85Å; Q283-D475 CarbonylContact C-O 3.5Å; Q283-D475 WeakPolarHBondContact CA-O 3.44Å; Q283-D475 PolarHBondContact NE2-OD2 3.16Å; Q283-D475 PolarHBondContact OE1-OD2 3.44Å; I284-D475 PolarHBondContact N-O 2.8Å; D475-N477 PolarHBondContact OD2-ND2 3.33Å
476	V	97.2	Very high	91.9	Very high	0 Å²	0	25 Å²	25	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	110.8	178.3	-173.6	0	0	0	0	108.8	F84 I87 R227 L228 I258 I284 I286 V474	F84-V476 HydrophobicContact CZ-CB 4.34Å; F84-V476 HydrophobicContact CZ-CG1 3.99Å; I87-V476 HydrophobicContact CD1-CB 3.97Å; I87-V476 HydrophobicContact CD1-CG1 4.04Å; I87-V476 HydrophobicContact CD1-CG2 3.63Å; R227-V476 CarbonylContact C-O 3.51Å; R227-V476 VanDerWaalsContact CA-O 3.23Å; R227-V476 WeakPolarHBondContact CA-O 3.45Å; L228-V476 HydrophobicContact CB-CB 4.43Å; L228-V476 PolarHBondContact N-O 3.4Å; L228-V476 PolarHBondContact O-N 2.89Å; I258-V476 HydrophobicContact CD1-CG2 4.2Å; I284-V476 HydrophobicContact CB-CG1 4.37Å; I284-V476 HydrophobicContact CB-CG2 4.15Å; I284-V476 HydrophobicContact CD1-CG2 4.24Å; I284-V476 HydrophobicContact CG2-CG1 4.32Å; I284-V476 CarbonylContact O-C 3.52Å; I284-V476 WeakPolarHBondContact O-CA 3.41Å; I286-V476 HydrophobicContact CD1-CG1 3.61Å; I286-V476 HydrophobicContact CG1-CG1 4.25Å; V474-V476 HydrophobicContact CG1-CG2 4.19Å
477	N	95	Very high	92	Very high	39 Å²	39	26.5 Å²	26.5	21%	0.209	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	130	-176.7	-73.9	-50.6	0	0	0	110.8	R227 Q283 I284 L285 I286 D475	R227-N477 WeakPolarHBondContact CD-OD1 3.24Å; R227-N477 WeakPolarHBondContact CG-OD1 3.18Å; Q283-N477 PolarHBondContact OE1-ND2 2.87Å; I284-N477 PolarHBondContact O-N 3.46Å; L285-N477 HydrophobicContact CD1-CB 4.4Å; I286-N477 PolarHBondContact N-O 3.16Å; D475-N477 PolarHBondContact OD2-ND2 3.33Å
478	R	93.1	Very high	92	Very high	2 Å²	2	30.9 Å²	30.9	1%	0.008	15%	0.153	C	C	.	.			trans	-124	82.9	175.4	-175.3	179.8	69.9	161	1.1	109	V82 A83 F84 S222 H223 A225 V226 I286 F481	V82-R478 PolarHBondContact O-NH1 3.38Å; V82-R478 PolarHBondContact O-NH2 2.95Å; A83-R478 PolarHBondContact O-NH1 2.94Å; F84-R478 HydrophobicContact CE2-CB 4.37Å; S222-R478 PolarHBondContact O-NH2 3.47Å; H223-R478 PolarHBondContact O-NH2 2.83Å; A225-R478 VanDerWaalsContact O-CZ 3.27Å; A225-R478 PolarHBondContact O-NE 2.98Å; A225-R478 VanDerWaalsContact O-NE 3.12Å; A225-R478 PolarHBondContact O-NH2 3.16Å; V226-R478 PolarHBondContact O-N 2.9Å; I286-R478 HydrophobicContact CB-CB 4.33Å; I286-R478 HydrophobicContact CB-CG 4.35Å; I286-R478 HydrophobicContact CD1-CB 4.4Å; I286-R478 HydrophobicContact CG2-CG 4.38Å; R478-F481 HydrophobicContact CG-CB 4.22Å
479	P	84.4	Confident	91.9	Very high	68 Å²	68	31.1 Å²	31.1	44%	0.442	15%	0.154	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-40.1	-177.2	26.4	-34.9	0	0	0	112.4	L285 F481	L285-P479 HydrophobicContact CD1-CG 3.77Å; P479-F481 VanDerWaalsContact C-N 3.33Å; P479-F481 PolarHBondContact O-N 2.97Å
480	N	84.1	Confident	91.7	Very high	65 Å²	65	30.8 Å²	30.8	35%	0.348	16%	0.155	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.5	47.2	-173.8	-61.4	-32.5	0	0	0	112.5	D287 D482 T483	D287-N480 PolarHBondContact O-ND2 3.3Å; N480-D482 PolarHBondContact O-N 3.03Å; N480-D482 VanDerWaalsContact O-N 3.11Å; N480-T483 HydrophobicContact CB-CG2 4.44Å; N480-T483 WeakPolarHBondContact CB-OG1 3.47Å; N480-T483 PolarHBondContact O-N 3.42Å; N480-T483 PolarHBondContact O-OG1 3.11Å
481	F	82.3	Confident	91.4	Very high	11 Å²	11	34.8 Å²	34.8	5%	0.048	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-15.9	-173.3	77.5	-72.2	0	0	0	115.3	H81 R182 V226 R478 P479	H81-F481 AromaticContact CE1-CE2 3.75Å; H81-F481 AromaticContact ND1-CD2 3.93Å; H81-F481 AromaticContact ND1-CE2 3.61Å; R182-F481 HydrophobicContact CB-CE1 4.49Å; R182-F481 HydrophobicContact CB-CZ 4.2Å; R182-F481 HydrophobicContact CG-CZ 4.23Å; V226-F481 HydrophobicContact CG1-CB 4.24Å; V226-F481 HydrophobicContact CG1-CD1 3.76Å; V226-F481 HydrophobicContact CG1-CD2 4.48Å; V226-F481 HydrophobicContact CG1-CE1 4.33Å; V226-F481 HydrophobicContact CG1-CG 3.88Å; R478-F481 HydrophobicContact CG-CB 4.22Å; P479-F481 VanDerWaalsContact C-N 3.33Å; P479-F481 PolarHBondContact O-N 2.97Å
482	D	82.1	Confident	91.1	Very high	56 Å²	56	38.9 Å²	38.9	30%	0.299	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	-108.5	10.1	-179.1	68.4	-26.5	0	0	0	113.5	R78 G79 I80 N480	R78-D482 CarbonylContact C-O 3.56Å; R78-D482 WeakPolarHBondContact CA-O 3.22Å; G79-D482 PolarHBondContact N-O 3.33Å; I80-D482 PolarHBondContact N-O 2.64Å; I80-D482 CarbonylContact O-C 3.58Å; N480-D482 PolarHBondContact O-N 3.03Å; N480-D482 VanDerWaalsContact O-N 3.11Å
483	T	85.3	Confident	90.6	Very high	40 Å²	40	41.5 Å²	41.5	25%	0.245	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	129.3	176.8	73.2	0	0	0	0	111.3	L77 R78 M289 N480	L77-T483 WeakPolarHBondContact O-CA 3.49Å; R78-T483 HydrophobicContact CG-CG2 4.39Å; M289-T483 VanDerWaalsContact CE-O 3.31Å; M289-T483 WeakPolarHBondContact CE-O 3.38Å; N480-T483 HydrophobicContact CB-CG2 4.44Å; N480-T483 WeakPolarHBondContact CB-OG1 3.47Å; N480-T483 PolarHBondContact O-N 3.42Å; N480-T483 PolarHBondContact O-OG1 3.11Å
484	L	90.4	Very high	90.2	Very high	8 Å²	8	42.7 Å²	42.7	4%	0.042	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	120	177.9	178.6	62.6	0	0	0	108.8	L77 I80 V82 M289 R291 L406	L77-L484 HydrophobicContact CB-CB 4.47Å; L77-L484 WeakPolarHBondContact CB-O 3.23Å; L77-L484 PolarHBondContact N-O 3.37Å; L77-L484 PolarHBondContact O-N 3.01Å; I80-L484 HydrophobicContact CB-CB 4.48Å; I80-L484 HydrophobicContact CG2-CD2 4.09Å; V82-L484 HydrophobicContact CG2-CB 4.29Å; V82-L484 HydrophobicContact CG2-CD1 4.08Å; V82-L484 HydrophobicContact CG2-CD2 4.22Å; V82-L484 HydrophobicContact CG2-CG 4.43Å; M289-L484 HydrophobicContact CB-CD1 4.08Å; M289-L484 WeakPolarHBondContact O-CD1 3.32Å; R291-L484 HydrophobicContact CB-CD1 3.87Å; R291-L484 HydrophobicContact CB-CD2 4.16Å; R291-L484 HydrophobicContact CB-CG 4.2Å; L406-L484 HydrophobicContact CD1-CD1 4.05Å
485	M	91.9	Very high	89.8	Confident	78 Å²	78	46.9 Å²	46.9	38%	0.384	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	117.9	170.5	-62.8	-169.3	170.8	0	0	108.9	T76 M289 H290 R291 Y487	T76-M485 HydrophobicContact CG2-CE 4.44Å; T76-M485 HydrophobicContact CG2-CG 4.4Å; M289-M485 PolarHBondContact O-N 2.85Å; H290-M485 CarbonylContact C-O 3.49Å; H290-M485 VanDerWaalsContact CA-O 3.29Å; H290-M485 WeakPolarHBondContact CA-O 3.44Å; H290-M485 PolarHBondContact NE2-SD 2.91Å; H290-M485 VanDerWaalsContact NE2-SD 3.41Å; R291-M485 PolarHBondContact N-O 2.86Å; M485-Y487 HydrophobicContact CB-CE2 3.81Å
486	S	92.9	Very high	89.6	Confident	8 Å²	8	51.1 Å²	51.1	6%	0.056	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	121.1	177.1	-177.5	0	0	0	0	109.6	M74 R75 R291	M74-S486 CarbonylContact C-O 3.47Å; M74-S486 WeakPolarHBondContact CA-O 3.12Å; R75-S486 PolarHBondContact N-O 2.96Å; R75-S486 PolarHBondContact O-N 3.1Å; R291-S486 CarbonylContact O-C 3.53Å; R291-S486 WeakPolarHBondContact O-CA 3.48Å
487	Y	93.5	Very high	89.4	Confident	61 Å²	61	53.7 Å²	53.7	24%	0.239	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	113.8	172.2	-60	-95.8	0	0	0	106.9	M74 H290 R291 I292 E293 M485	M74-Y487 HydrophobicContact CB-CD1 4.21Å; M74-Y487 HydrophobicContact CB-CE1 4.19Å; H290-Y487 HydrophobicContact CB-CD2 4.24Å; H290-Y487 HydrophobicContact CB-CE2 3.89Å; H290-Y487 AromaticContact CD2-CE2 3.94Å; H290-Y487 AromaticContact CE1-CE2 3.92Å; H290-Y487 PolarHBondContact CE1-OH 3.03Å; H290-Y487 AromaticContact CG-CE2 3.55Å; H290-Y487 AromaticContact ND1-CE2 3.56Å; R291-Y487 PolarHBondContact O-N 2.88Å; I292-Y487 WeakPolarHBondContact CA-O 3.47Å; I292-Y487 HydrophobicContact CG1-CD2 4.14Å; I292-Y487 HydrophobicContact CG1-CG 4.49Å; E293-Y487 PolarHBondContact N-O 3.33Å; M485-Y487 HydrophobicContact CB-CE2 3.81Å
488	R	93.5	Very high	89.3	Confident	94 Å²	94	52.3 Å²	52.3	36%	0.355	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	121	179.2	-177	-179.8	-68.6	150.1	3.5	110.2	N73 E293 N490	N73-R488 PolarHBondContact N-O 3.19Å; N73-R488 PolarHBondContact O-N 3.1Å; E293-R488 HydrophobicContact CB-CB 4.44Å; E293-R488 HydrophobicContact CB-CG 4.33Å; E293-R488 IonicContact OE1-NH2 3.93Å; E293-R488 IonicContact OE2-CZ 3.12Å; E293-R488 IonicContact OE2-NE 2.74Å; E293-R488 PolarHBondContact OE2-NE 2.77Å; E293-R488 IonicContact OE2-NH2 2.74Å; E293-R488 PolarHBondContact OE2-NH2 2.99Å; R488-N490 WeakPolarHBondContact CD-OD1 3.44Å; R488-N490 PolarHBondContact O-ND2 3.36Å
489	E	91.9	Very high	89.2	Confident	36 Å²	36	57.3 Å²	57.3	17%	0.168	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76	120.7	170.7	-170.4	176.6	-164.8	0	0	109.5	T70 E293 K294 K295	T70-E489 VanDerWaalsContact CB-CG 3.46Å; T70-E489 VanDerWaalsContact CB-OE1 3.28Å; T70-E489 WeakPolarHBondContact CB-OE1 3.25Å; T70-E489 HydrophobicContact CG2-CG 3.9Å; T70-E489 PolarHBondContact OG1-OE1 3.45Å; E293-E489 PolarHBondContact O-N 3Å; K294-E489 WeakPolarHBondContact CA-OE2 3.38Å; K295-E489 HydrophobicContact CB-CB 4.35Å; K295-E489 HydrophobicContact CB-CG 4.21Å; K295-E489 PolarHBondContact N-OE2 2.93Å
490	N	89.7	Confident	89.7	Confident	51 Å²	51	58.3 Å²	58.3	27%	0.273	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	159.4	177.5	-58.4	-80.7	0	0	0	109.6	T70 I71 N73 R488 E492	T70-N490 CarbonylContact C-O 3.55Å; T70-N490 WeakPolarHBondContact CA-O 3.48Å; T70-N490 WeakPolarHBondContact CB-O 3.16Å; I71-N490 HydrophobicContact CG2-CB 4.5Å; I71-N490 PolarHBondContact N-O 3.13Å; I71-N490 PolarHBondContact O-N 3.34Å; N73-N490 PolarHBondContact ND2-ND2 3.13Å; R488-N490 WeakPolarHBondContact CD-OD1 3.44Å; R488-N490 PolarHBondContact O-ND2 3.36Å; N490-E492 PolarHBondContact O-N 3.16Å
491	E	86.5	Confident	90.1	Very high	83 Å²	83	58.7 Å²	58.7	39%	0.388	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.4	131.1	170.8	-76.9	164.8	-167.6	0	0	109.7	K295 Y493 T494	K295-E491 HydrophobicContact CD-CG 4.34Å; K295-E491 VanDerWaalsContact NZ-CG 3.26Å; K295-E491 IonicContact NZ-OE1 2.73Å; K295-E491 PolarHBondContact NZ-OE1 3.48Å; K295-E491 IonicContact NZ-OE2 2.66Å; E491-Y493 VanDerWaalsContact C-N 3.34Å; E491-T494 HydrophobicContact CB-CG2 4.23Å
492	E	87.9	Confident	90.7	Very high	89 Å²	89	60.1 Å²	60.1	42%	0.416	31%	0.312	S	S	.	.	S	Bend	trans	-65.9	-43.3	170.6	-171.8	-173.4	167.3	0	0	110	H64 N69 N490	H64-E492 IonicContact CE1-OE1 3.57Å; H64-E492 IonicContact CE1-OE2 2.61Å; H64-E492 IonicContact NE2-OE1 3.25Å; N69-E492 HydrophobicContact CB-CB 4.3Å; N69-E492 WeakPolarHBondContact CB-OE2 3.3Å; N69-E492 WeakPolarHBondContact O-CB 3.49Å; N69-E492 PolarHBondContact O-N 2.77Å; N490-E492 PolarHBondContact O-N 3.16Å
493	Y	86.5	Confident	91.1	Very high	55 Å²	55	59.1 Å²	59.1	22%	0.216	32%	0.316	C	S	.	.	S	Bend	trans	-118.4	109.9	175.4	-102.6	-94.3	0	0	0	112	L61 H64 E491 Q501	L61-Y493 HydrophobicContact CD1-CE1 3.74Å; H64-Y493 AromaticContact CE1-CD2 3.48Å; H64-Y493 VanDerWaalsContact CE1-CD2 3.48Å; H64-Y493 WeakPolarHBondContact CE1-CD2 3.32Å; H64-Y493 AromaticContact CE1-CE2 3.62Å; H64-Y493 AromaticContact ND1-CD2 3.27Å; H64-Y493 VanDerWaalsContact ND1-CD2 3.27Å; H64-Y493 WeakPolarHBondContact ND1-CD2 3.44Å; H64-Y493 AromaticContact ND1-CE2 3.45Å; H64-Y493 WeakPolarHBondContact ND1-CE2 3.37Å; E491-Y493 VanDerWaalsContact C-N 3.34Å; Y493-Q501 VanDerWaalsContact CE1-OE1 3.22Å; Y493-Q501 VanDerWaalsContact OH-CD 3.23Å; Y493-Q501 PolarHBondContact OH-NE2 3.36Å; Y493-Q501 PolarHBondContact OH-OE1 3.25Å
494	T	89.4	Confident	91.5	Very high	48 Å²	48	58.7 Å²	58.7	29%	0.294	32%	0.319	S	S	.	.			trans	-81.2	157.4	172.4	70.2	0	0	0	0	111.5	E491 P496 T497 L498	E491-T494 HydrophobicContact CB-CG2 4.23Å; T494-P496 WeakPolarHBondContact OG1-CD 3.01Å; T494-T497 WeakPolarHBondContact CA-OG1 3.48Å; T494-T497 PolarHBondContact N-OG1 3.16Å; T494-T497 PolarHBondContact O-N 3.36Å; T494-T497 VanDerWaalsContact O-N 3.15Å; T494-T497 PolarHBondContact O-OG1 3.02Å; T494-T497 WeakPolarHBondContact OG1-CG2 3.49Å; T494-T497 PolarHBondContact OG1-N 3.18Å; T494-T497 PolarHBondContact OG1-OG1 3.25Å; T494-L498 PolarHBondContact O-N 3.47Å
495	L	91.2	Very high	91.7	Very high	88 Å²	88	59.8 Å²	59.8	46%	0.461	33%	0.325	S	S	.	.	H	α-helix	trans	-56.3	-42.7	173.8	178.5	68	0	0	0	113	T497 L498 L499	L495-T497 VanDerWaalsContact C-N 3.35Å; L495-T497 PolarHBondContact O-N 3.48Å; L495-L498 HydrophobicContact CD1-CD2 4.34Å; L495-L498 WeakPolarHBondContact O-CB 3.28Å; L495-L498 PolarHBondContact O-N 3.2Å; L495-L499 HydrophobicContact CD1-CD1 4.34Å; L495-L499 HydrophobicContact CD1-CG 4.25Å; L495-L499 HydrophobicContact CG-CD1 4.18Å; L495-L499 HydrophobicContact CG-CG 4.48Å; L495-L499 WeakPolarHBondContact O-CG 3.45Å; L495-L499 PolarHBondContact O-N 2.75Å
496	P	93.4	Very high	91.7	Very high	93 Å²	93	57.1 Å²	57.1	60%	0.604	31%	0.313	S	S	*	.	H	α-helix	trans	-59.1	-41.3	173.8	-26.5	35.6	0	0	0	113.6	T494 L499 S500	T494-P496 WeakPolarHBondContact OG1-CD 3.01Å; P496-L499 PolarHBondContact O-N 3.09Å; P496-S500 VanDerWaalsContact O-CB 3.28Å; P496-S500 WeakPolarHBondContact O-CB 3.48Å; P496-S500 PolarHBondContact O-N 3.17Å
497	T	92.1	Very high	91.6	Very high	55 Å²	55	59.1 Å²	59.1	34%	0.337	33%	0.327	S	S	.	.	H	α-helix	trans	-66.4	-39.4	177.5	43.5	0	0	0	0	111.7	T494 L495 S500 Q501	T494-T497 WeakPolarHBondContact CA-OG1 3.48Å; T494-T497 PolarHBondContact N-OG1 3.16Å; T494-T497 PolarHBondContact O-N 3.36Å; T494-T497 VanDerWaalsContact O-N 3.15Å; T494-T497 PolarHBondContact O-OG1 3.02Å; T494-T497 WeakPolarHBondContact OG1-CG2 3.49Å; T494-T497 PolarHBondContact OG1-N 3.18Å; T494-T497 PolarHBondContact OG1-OG1 3.25Å; L495-T497 VanDerWaalsContact C-N 3.35Å; L495-T497 PolarHBondContact O-N 3.48Å; T497-S500 PolarHBondContact O-N 3.28Å; T497-Q501 WeakPolarHBondContact O-CG 3.48Å; T497-Q501 PolarHBondContact O-N 2.83Å
498	L	92.9	Very high	91.5	Very high	9 Å²	9	61.5 Å²	61.5	5%	0.047	34%	0.343	C	S	.	.	H	α-helix	trans	-59.6	-52.8	174	177.3	68.5	0	0	0	111.3	L61 L62 Y65 T494 L495 S500 Q501 I502	L61-L498 HydrophobicContact CD2-CD1 3.85Å; L61-L498 HydrophobicContact CG-CD1 3.72Å; L62-L498 HydrophobicContact CD2-CD2 4.49Å; Y65-L498 HydrophobicContact CD1-CD2 3.67Å; Y65-L498 HydrophobicContact CD2-CB 4.22Å; Y65-L498 HydrophobicContact CD2-CD2 3.85Å; Y65-L498 HydrophobicContact CD2-CG 4.42Å; Y65-L498 HydrophobicContact CE1-CD2 3.87Å; Y65-L498 HydrophobicContact CE2-CB 4.5Å; Y65-L498 HydrophobicContact CE2-CD2 4.07Å; Y65-L498 HydrophobicContact CG-CD1 4.25Å; Y65-L498 HydrophobicContact CG-CD2 3.65Å; Y65-L498 HydrophobicContact CG-CG 4.4Å; T494-L498 PolarHBondContact O-N 3.47Å; L495-L498 HydrophobicContact CD1-CD2 4.34Å; L495-L498 WeakPolarHBondContact O-CB 3.28Å; L495-L498 PolarHBondContact O-N 3.2Å; L498-S500 VanDerWaalsContact C-N 3.31Å; L498-S500 PolarHBondContact O-N 3.32Å; L498-Q501 PolarHBondContact O-N 2.9Å; L498-I502 HydrophobicContact CD1-CD1 3.85Å; L498-I502 HydrophobicContact CD1-CG1 4.21Å; L498-I502 HydrophobicContact CD2-CD1 4.44Å; L498-I502 HydrophobicContact CG-CD1 3.84Å; L498-I502 HydrophobicContact CG-CG1 4.45Å; L498-I502 WeakPolarHBondContact O-CG1 3.28Å; L498-I502 PolarHBondContact O-N 3.01Å
499	L	91.9	Very high	91.3	Very high	108 Å²	108	59.2 Å²	59.2	57%	0.565	34%	0.336	S	S	*	.	H	α-helix	trans	-62.5	-39.5	-178.5	-69.7	175.5	0	0	0	112.1	L495 P496 G503	L495-L499 HydrophobicContact CD1-CD1 4.34Å; L495-L499 HydrophobicContact CD1-CG 4.25Å; L495-L499 HydrophobicContact CG-CD1 4.18Å; L495-L499 HydrophobicContact CG-CG 4.48Å; L495-L499 WeakPolarHBondContact O-CG 3.45Å; L495-L499 PolarHBondContact O-N 2.75Å; P496-L499 PolarHBondContact O-N 3.09Å; L499-G503 PolarHBondContact O-N 3.39Å
500	S	93.2	Very high	91	Very high	88 Å²	88	58.2 Å²	58.2	62%	0.615	33%	0.332	S	S	*	.	H	α-helix	trans	-59.7	-46.8	175.6	-175.8	0	0	0	0	111.5	P496 T497 L498 G503 G504	P496-S500 VanDerWaalsContact O-CB 3.28Å; P496-S500 WeakPolarHBondContact O-CB 3.48Å; P496-S500 PolarHBondContact O-N 3.17Å; T497-S500 PolarHBondContact O-N 3.28Å; L498-S500 VanDerWaalsContact C-N 3.31Å; L498-S500 PolarHBondContact O-N 3.32Å; S500-G503 PolarHBondContact O-N 3.47Å; S500-G504 PolarHBondContact O-N 2.93Å
501	Q	94.5	Very high	90.9	Very high	73 Å²	73	56.7 Å²	56.7	34%	0.341	33%	0.325	S	S	.	.	H	α-helix	trans	-74.5	-38.8	-178.1	-71.3	-176.9	6	0	0	113.6	L61 Y493 T497 L498 G503 G504 I505	L61-Q501 HydrophobicContact CD2-CB 3.68Å; Y493-Q501 VanDerWaalsContact CE1-OE1 3.22Å; Y493-Q501 VanDerWaalsContact OH-CD 3.23Å; Y493-Q501 PolarHBondContact OH-NE2 3.36Å; Y493-Q501 PolarHBondContact OH-OE1 3.25Å; T497-Q501 WeakPolarHBondContact O-CG 3.48Å; T497-Q501 PolarHBondContact O-N 2.83Å; L498-Q501 PolarHBondContact O-N 2.9Å; Q501-G503 VanDerWaalsContact C-N 3.27Å; Q501-G503 PolarHBondContact O-N 3.11Å; Q501-G504 PolarHBondContact O-N 2.97Å; Q501-G504 VanDerWaalsContact O-N 3.16Å; Q501-I505 VanDerWaalsContact O-CG1 3.31Å; Q501-I505 WeakPolarHBondContact O-CG1 3.44Å; Q501-I505 PolarHBondContact O-N 3.3Å
502	I	93.3	Very high	90.8	Very high	41 Å²	41	56 Å²	56	21%	0.21	32%	0.321	C	S	.	.	H	α-helix	trans	-57.9	-46.2	170.1	-68.3	175.6	0	0	0	109.3	L61 L62 L498 G504 I505 C506	L61-I502 HydrophobicContact CD2-CG1 3.78Å; L62-I502 HydrophobicContact CD2-CD1 4.36Å; L498-I502 HydrophobicContact CD1-CD1 3.85Å; L498-I502 HydrophobicContact CD1-CG1 4.21Å; L498-I502 HydrophobicContact CD2-CD1 4.44Å; L498-I502 HydrophobicContact CG-CD1 3.84Å; L498-I502 HydrophobicContact CG-CG1 4.45Å; L498-I502 WeakPolarHBondContact O-CG1 3.28Å; L498-I502 PolarHBondContact O-N 3.01Å; I502-G504 VanDerWaalsContact C-N 3.31Å; I502-G504 PolarHBondContact O-N 3.46Å; I502-I505 PolarHBondContact O-N 3.28Å; I502-C506 VanDerWaalsContact O-CB 3.23Å; I502-C506 WeakPolarHBondContact O-CB 3.32Å; I502-C506 PolarHBondContact O-N 2.84Å; I502-C506 PolarHBondContact O-SG 2.88Å; I502-C506 VanDerWaalsContact O-SG 3.33Å
503	G	92.1	Very high	90.8	Very high	36 Å²	36	54.7 Å²	54.7	37%	0.371	32%	0.319	S	S	.	.	H	α-helix	trans	-57.2	-43.3	175.1	0	0	0	0	0	112.6	L499 S500 Q501 S507	L499-G503 PolarHBondContact O-N 3.39Å; S500-G503 PolarHBondContact O-N 3.47Å; Q501-G503 VanDerWaalsContact C-N 3.27Å; Q501-G503 PolarHBondContact O-N 3.11Å; G503-S507 VanDerWaalsContact O-CB 3.24Å; G503-S507 WeakPolarHBondContact O-CB 3.38Å; G503-S507 PolarHBondContact O-N 3.31Å
504	G	93.3	Very high	90.7	Very high	31 Å²	31	56.3 Å²	56.3	32%	0.32	34%	0.338	S	S	.	.	H	α-helix	trans	-60.9	-51.1	174.9	0	0	0	0	0	113.2	S500 Q501 I502 S507 I508	S500-G504 PolarHBondContact O-N 2.93Å; Q501-G504 PolarHBondContact O-N 2.97Å; Q501-G504 VanDerWaalsContact O-N 3.16Å; I502-G504 VanDerWaalsContact C-N 3.31Å; I502-G504 PolarHBondContact O-N 3.46Å; G504-S507 PolarHBondContact O-N 2.87Å; G504-I508 VanDerWaalsContact O-CG1 3.28Å; G504-I508 WeakPolarHBondContact O-CG1 3.39Å; G504-I508 PolarHBondContact O-N 2.9Å
505	I	93.9	Very high	90.6	Very high	30 Å²	30	58.1 Å²	58.1	15%	0.154	35%	0.348	C	S	.	.	H	α-helix	trans	-63	-45.2	-179.7	-65.1	163.5	0	0	0	110.5	N54 L57 V58 L61 Q501 I502 S507 I508 F509	N54-I505 PolarHBondContact ND2-O 3.43Å; N54-I505 VanDerWaalsContact ND2-O 3.16Å; L57-I505 HydrophobicContact CB-CD1 4.27Å; L57-I505 HydrophobicContact CB-CG2 4.1Å; L57-I505 HydrophobicContact CD1-CG2 4.47Å; V58-I505 HydrophobicContact CG2-CB 4.44Å; V58-I505 HydrophobicContact CG2-CG2 3.93Å; L61-I505 HydrophobicContact CD2-CD1 4.16Å; Q501-I505 VanDerWaalsContact O-CG1 3.31Å; Q501-I505 WeakPolarHBondContact O-CG1 3.44Å; Q501-I505 PolarHBondContact O-N 3.3Å; I502-I505 PolarHBondContact O-N 3.28Å; I505-S507 PolarHBondContact O-N 3.23Å; I505-I508 PolarHBondContact O-N 3.31Å; I505-F509 HydrophobicContact CG2-CD2 3.89Å; I505-F509 HydrophobicContact CG2-CE2 4.2Å; I505-F509 WeakPolarHBondContact O-CD2 3.43Å; I505-F509 PolarHBondContact O-N 2.9Å; I505-F509 VanDerWaalsContact O-N 3.09Å
506	C	91.8	Very high	90.3	Very high	22 Å²	22	54 Å²	54	15%	0.149	33%	0.326	C	S	.	.	H	α-helix	trans	-60	-43.1	175.7	-76.8	0	0	0	0	113	N54 I502 L510 S511 F512	N54-C506 WeakPolarHBondContact ND2-CA 3.34Å; N54-C506 PolarHBondContact ND2-N 2.9Å; I502-C506 VanDerWaalsContact O-CB 3.23Å; I502-C506 WeakPolarHBondContact O-CB 3.32Å; I502-C506 PolarHBondContact O-N 2.84Å; I502-C506 PolarHBondContact O-SG 2.88Å; I502-C506 VanDerWaalsContact O-SG 3.33Å; C506-L510 PolarHBondContact O-N 3.42Å; C506-L510 VanDerWaalsContact O-N 3.16Å; C506-S511 PolarHBondContact O-N 3.24Å; C506-S511 VanDerWaalsContact O-N 3.09Å; C506-F512 HydrophobicContact CB-CB 3.81Å; C506-F512 PolarHBondContact O-N 3.45Å
507	S	91.3	Very high	90	Very high	50 Å²	50	52.7 Å²	52.7	35%	0.35	32%	0.317	S	S	.	.	H	α-helix	trans	-67.2	-40.2	178.3	-176.9	0	0	0	0	112.6	G503 G504 I505 S511	G503-S507 VanDerWaalsContact O-CB 3.24Å; G503-S507 WeakPolarHBondContact O-CB 3.38Å; G503-S507 PolarHBondContact O-N 3.31Å; G504-S507 PolarHBondContact O-N 2.87Å; I505-S507 PolarHBondContact O-N 3.23Å; S507-S511 WeakPolarHBondContact O-CA 3.49Å; S507-S511 PolarHBondContact O-N 3.25Å; S507-S511 VanDerWaalsContact O-N 3.16Å; S507-S511 PolarHBondContact O-OG 3.23Å
508	I	90.4	Very high	89.9	Confident	112 Å²	112	55.2 Å²	55.2	57%	0.574	33%	0.328	S	S	*	.	H	α-helix	trans	-70.1	-52.2	-178.1	-69.8	166.7	0	0	0	111.7	R26 G504 I505	R26-I508 PolarHBondContact NH1-O 3.24Å; G504-I508 VanDerWaalsContact O-CG1 3.28Å; G504-I508 WeakPolarHBondContact O-CG1 3.39Å; G504-I508 PolarHBondContact O-N 2.9Å; I505-I508 PolarHBondContact O-N 3.31Å
509	F	90.2	Very high	89.7	Confident	45 Å²	45	56.7 Å²	56.7	20%	0.197	33%	0.334	C	S	.	.	H	α-helix	trans	-81.9	-43.3	-171.3	-74.4	-87.6	0	0	0	113.4	M50 A53 N54 L57 I505	M50-F509 HydrophobicContact CB-CD1 4.48Å; M50-F509 HydrophobicContact SD-CD1 3.53Å; M50-F509 VanDerWaalsContact SD-CD1 3.53Å; M50-F509 HydrophobicContact SD-CE1 4.12Å; M50-F509 HydrophobicContact SD-CG 4.48Å; A53-F509 HydrophobicContact CB-CD1 3.85Å; A53-F509 HydrophobicContact CB-CE1 3.52Å; A53-F509 HydrophobicContact CB-CZ 4.24Å; N54-F509 HydrophobicContact CB-CB 3.82Å; N54-F509 HydrophobicContact CB-CG 4.22Å; L57-F509 HydrophobicContact CD1-CD2 4.43Å; L57-F509 HydrophobicContact CD1-CE2 3.42Å; L57-F509 VanDerWaalsContact CD1-CE2 3.42Å; L57-F509 HydrophobicContact CD1-CZ 3.49Å; L57-F509 VanDerWaalsContact CD1-CZ 3.49Å; I505-F509 HydrophobicContact CG2-CD2 3.89Å; I505-F509 HydrophobicContact CG2-CE2 4.2Å; I505-F509 WeakPolarHBondContact O-CD2 3.43Å; I505-F509 PolarHBondContact O-N 2.9Å; I505-F509 VanDerWaalsContact O-N 3.09Å
510	L	86.3	Confident	89.5	Confident	16 Å²	16	54.2 Å²	54.2	8%	0.084	32%	0.321	C	S	.	.	T	Hydrogen-bonded Turn	trans	-112.6	-12.2	-174.2	-64	174.9	0	0	0	113.5	V25 R26 C51 N54 C506 F512	V25-L510 WeakPolarHBondContact CA-O 3.23Å; R26-L510 PolarHBondContact N-O 2.8Å; C51-L510 HydrophobicContact CB-CD2 4.27Å; N54-L510 HydrophobicContact CB-CD1 4.29Å; N54-L510 HydrophobicContact CB-CG 4.39Å; C506-L510 PolarHBondContact O-N 3.42Å; C506-L510 VanDerWaalsContact O-N 3.16Å; L510-F512 HydrophobicContact CB-CB 4.46Å; L510-F512 HydrophobicContact CB-CD1 3.51Å; L510-F512 HydrophobicContact CB-CE1 3.9Å; L510-F512 HydrophobicContact CB-CG 4.1Å; L510-F512 HydrophobicContact CD1-CD1 4.28Å; L510-F512 HydrophobicContact CD1-CE1 4.12Å; L510-F512 HydrophobicContact CD1-CE2 4.48Å; L510-F512 HydrophobicContact CD1-CZ 4.24Å; L510-F512 PolarHBondContact O-N 3.22Å
511	S	85.8	Confident	89.3	Confident	19 Å²	19	53.7 Å²	53.7	13%	0.133	31%	0.311	C	S	.	.			trans	59.4	31	-164.5	-66	0	0	0	0	113.8	R26 C506 S507 T513 T516	R26-S511 VanDerWaalsContact CD-OG 3.28Å; R26-S511 WeakPolarHBondContact CD-OG 3.46Å; R26-S511 WeakPolarHBondContact CG-OG 3.42Å; R26-S511 PolarHBondContact NE-OG 2.82Å; R26-S511 PolarHBondContact NH2-OG 2.94Å; C506-S511 PolarHBondContact O-N 3.24Å; C506-S511 VanDerWaalsContact O-N 3.09Å; S507-S511 WeakPolarHBondContact O-CA 3.49Å; S507-S511 PolarHBondContact O-N 3.25Å; S507-S511 VanDerWaalsContact O-N 3.16Å; S507-S511 PolarHBondContact O-OG 3.23Å; S511-T513 PolarHBondContact O-N 3.48Å; S511-T516 VanDerWaalsContact O-CG2 3.25Å; S511-T516 WeakPolarHBondContact O-CG2 3.47Å
512	F	85.2	Confident	89.1	Confident	67 Å²	67	54.7 Å²	54.7	29%	0.294	32%	0.316	S	S	.	.			trans	-68.7	119.8	171.8	-89.1	34.3	0	0	0	109.7	V25 C506 L510 T516 L520	V25-F512 HydrophobicContact CB-CE1 4.45Å; V25-F512 HydrophobicContact CG1-CE1 4.17Å; V25-F512 HydrophobicContact CG2-CD1 3.99Å; V25-F512 HydrophobicContact CG2-CE1 3.45Å; V25-F512 VanDerWaalsContact CG2-CE1 3.45Å; V25-F512 HydrophobicContact CG2-CZ 4.46Å; C506-F512 HydrophobicContact CB-CB 3.81Å; C506-F512 PolarHBondContact O-N 3.45Å; L510-F512 HydrophobicContact CB-CB 4.46Å; L510-F512 HydrophobicContact CB-CD1 3.51Å; L510-F512 HydrophobicContact CB-CE1 3.9Å; L510-F512 HydrophobicContact CB-CG 4.1Å; L510-F512 HydrophobicContact CD1-CD1 4.28Å; L510-F512 HydrophobicContact CD1-CE1 4.12Å; L510-F512 HydrophobicContact CD1-CE2 4.48Å; L510-F512 HydrophobicContact CD1-CZ 4.24Å; L510-F512 PolarHBondContact O-N 3.22Å; F512-T516 VanDerWaalsContact CA-OG1 3.23Å; F512-T516 WeakPolarHBondContact CA-OG1 3.18Å; F512-T516 HydrophobicContact CD1-CG2 4.36Å; F512-L520 HydrophobicContact CE2-CD1 4.05Å; F512-L520 HydrophobicContact CZ-CD1 4.06Å
513	T	87.3	Confident	88.9	Confident	63 Å²	63	53.7 Å²	53.7	39%	0.387	31%	0.311	S	S	.	.			trans	-131.9	177.2	177.2	62.3	0	0	0	0	109.2	S511 V515 T516 V517	S511-T513 PolarHBondContact O-N 3.48Å; T513-V515 PolarHBondContact O-N 3.42Å; T513-V515 VanDerWaalsContact O-N 3.11Å; T513-V515 PolarHBondContact OG1-N 3.34Å; T513-T516 PolarHBondContact N-OG1 2.86Å; T513-T516 PolarHBondContact O-N 3.27Å; T513-T516 VanDerWaalsContact O-N 3.17Å; T513-T516 PolarHBondContact O-OG1 2.88Å; T513-V517 PolarHBondContact O-N 3.46Å
514	C	84.8	Confident	88.8	Confident	89 Å²	89	56.8 Å²	56.8	60%	0.601	32%	0.318	S	S	*	.	H	α-helix	trans	-56.5	-28.4	172.3	-61.9	0	0	0	0	112.5	V517 L518	C514-V517 PolarHBondContact O-N 3.42Å; C514-L518 PolarHBondContact O-N 2.99Å
515	V	86.8	Confident	88.6	Confident	85 Å²	85	58.4 Å²	58.4	52%	0.515	32%	0.324	S	S	.	.	H	α-helix	trans	-71.2	-44.6	177.6	-177.6	0	0	0	0	111.3	T513 V517 L518 E519	T513-V515 PolarHBondContact O-N 3.42Å; T513-V515 VanDerWaalsContact O-N 3.11Å; T513-V515 PolarHBondContact OG1-N 3.34Å; V515-V517 PolarHBondContact O-N 3.4Å; V515-L518 WeakPolarHBondContact O-CB 3.43Å; V515-L518 PolarHBondContact O-N 3.25Å; V515-E519 WeakPolarHBondContact O-CG 3.28Å; V515-E519 PolarHBondContact O-N 3.34Å
516	T	86.8	Confident	88.4	Confident	1 Å²	1	62.6 Å²	62.6	1%	0.006	34%	0.337	C	S	.	.	H	α-helix	trans	-60.8	-33.3	175.3	55.4	0	0	0	0	111.8	S24 V25 S511 F512 T513 E519 L520	S24-T516 WeakPolarHBondContact OG-CG2 3.27Å; V25-T516 HydrophobicContact CG2-CG2 4.37Å; S511-T516 VanDerWaalsContact O-CG2 3.25Å; S511-T516 WeakPolarHBondContact O-CG2 3.47Å; F512-T516 VanDerWaalsContact CA-OG1 3.23Å; F512-T516 WeakPolarHBondContact CA-OG1 3.18Å; F512-T516 HydrophobicContact CD1-CG2 4.36Å; T513-T516 PolarHBondContact N-OG1 2.86Å; T513-T516 PolarHBondContact O-N 3.27Å; T513-T516 VanDerWaalsContact O-N 3.17Å; T513-T516 PolarHBondContact O-OG1 2.88Å; T516-E519 WeakPolarHBondContact O-CB 3.48Å; T516-E519 PolarHBondContact O-N 2.94Å; T516-L520 WeakPolarHBondContact O-CB 3.34Å; T516-L520 VanDerWaalsContact O-CG 3.3Å; T516-L520 WeakPolarHBondContact O-CG 3.41Å; T516-L520 PolarHBondContact O-N 2.91Å
517	V	86.1	Confident	88.2	Confident	67 Å²	67	63.6 Å²	63.6	41%	0.406	34%	0.341	S	S	.	.	H	α-helix	trans	-64.1	-42.5	175.7	175.8	0	0	0	0	110.5	T513 C514 V515 L520 I521	T513-V517 PolarHBondContact O-N 3.46Å; C514-V517 PolarHBondContact O-N 3.42Å; V515-V517 PolarHBondContact O-N 3.4Å; V517-L520 PolarHBondContact O-N 3.3Å; V517-I521 HydrophobicContact CG1-CD1 3.95Å; V517-I521 VanDerWaalsContact O-CG1 3.28Å; V517-I521 WeakPolarHBondContact O-CG1 3.37Å; V517-I521 PolarHBondContact O-N 3.33Å
518	L	89.4	Confident	87.9	Confident	108 Å²	108	65.9 Å²	65.9	57%	0.565	35%	0.349	S	S	*	.	H	α-helix	trans	-63.5	-41.5	173.6	-67.5	173.2	0	0	0	112.1	C514 V515 L520 I521 E522	C514-L518 PolarHBondContact O-N 2.99Å; V515-L518 WeakPolarHBondContact O-CB 3.43Å; V515-L518 PolarHBondContact O-N 3.25Å; L518-L520 VanDerWaalsContact C-N 3.31Å; L518-L520 PolarHBondContact O-N 3.02Å; L518-I521 PolarHBondContact O-N 3.49Å; L518-E522 WeakPolarHBondContact O-CB 3.49Å; L518-E522 PolarHBondContact O-N 3.07Å
519	E	89.9	Confident	87.7	Confident	39 Å²	39	64.9 Å²	64.9	18%	0.182	34%	0.344	C	S	.	.	H	α-helix	trans	-59.4	-41.5	174.2	-66.2	173.6	-166	0	0	111.6	F19 T23 S24 V515 T516 E522 L523	F19-E519 HydrophobicContact CE2-CB 3.96Å; F19-E519 WeakPolarHBondContact CE2-O 3.22Å; T23-E519 WeakPolarHBondContact CA-OE2 3.47Å; T23-E519 WeakPolarHBondContact CB-OE2 3.47Å; T23-E519 PolarHBondContact OG1-OE2 3.26Å; S24-E519 WeakPolarHBondContact CB-OE1 3Å; S24-E519 PolarHBondContact N-OE1 3.02Å; S24-E519 PolarHBondContact N-OE2 2.82Å; S24-E519 VanDerWaalsContact OG-CD 3.23Å; S24-E519 PolarHBondContact OG-OE1 3.39Å; S24-E519 PolarHBondContact OG-OE2 2.96Å; V515-E519 WeakPolarHBondContact O-CG 3.28Å; V515-E519 PolarHBondContact O-N 3.34Å; T516-E519 WeakPolarHBondContact O-CB 3.48Å; T516-E519 PolarHBondContact O-N 2.94Å; E519-E522 PolarHBondContact O-N 3.25Å; E519-L523 WeakPolarHBondContact O-CB 3.43Å; E519-L523 PolarHBondContact O-N 3Å
520	L	87.4	Confident	87.3	Confident	56 Å²	56	65.3 Å²	65.3	29%	0.293	35%	0.347	S	S	.	.	H	α-helix	trans	-68.7	-39.8	177.3	-73.9	170.4	0	0	0	112.2	F19 F512 T516 V517 L518 E522 L523 L524	F19-L520 HydrophobicContact CE1-CD2 4.4Å; F19-L520 HydrophobicContact CE2-CD2 4.41Å; F19-L520 HydrophobicContact CZ-CD2 3.71Å; F19-L520 HydrophobicContact CZ-CG 4.36Å; F512-L520 HydrophobicContact CE2-CD1 4.05Å; F512-L520 HydrophobicContact CZ-CD1 4.06Å; T516-L520 WeakPolarHBondContact O-CB 3.34Å; T516-L520 VanDerWaalsContact O-CG 3.3Å; T516-L520 WeakPolarHBondContact O-CG 3.41Å; T516-L520 PolarHBondContact O-N 2.91Å; V517-L520 PolarHBondContact O-N 3.3Å; L518-L520 VanDerWaalsContact C-N 3.31Å; L518-L520 PolarHBondContact O-N 3.02Å; L520-E522 VanDerWaalsContact C-N 3.33Å; L520-L523 WeakPolarHBondContact O-CB 3.46Å; L520-L523 PolarHBondContact O-N 3.46Å; L520-L524 WeakPolarHBondContact O-CB 3.38Å; L520-L524 WeakPolarHBondContact O-CG 3.48Å; L520-L524 PolarHBondContact O-N 3.31Å
521	I	89.5	Confident	87	Confident	77 Å²	77	67.6 Å²	67.6	40%	0.395	37%	0.368	S	S	.	.	H	α-helix	trans	-63	-43.6	173.7	-69.2	165.4	0	0	0	109.9	V517 L518 L523 L524 C525	V517-I521 HydrophobicContact CG1-CD1 3.95Å; V517-I521 VanDerWaalsContact O-CG1 3.28Å; V517-I521 WeakPolarHBondContact O-CG1 3.37Å; V517-I521 PolarHBondContact O-N 3.33Å; L518-I521 PolarHBondContact O-N 3.49Å; I521-L523 VanDerWaalsContact C-N 3.33Å; I521-L523 PolarHBondContact O-N 3.14Å; I521-L524 PolarHBondContact O-N 2.84Å; I521-C525 WeakPolarHBondContact O-CB 3.49Å; I521-C525 PolarHBondContact O-N 3.34Å; I521-C525 PolarHBondContact O-SG 3.34Å; I521-C525 VanDerWaalsContact O-SG 3.34Å
522	E	90.1	Very high	86.7	Confident	95 Å²	95	72.4 Å²	72.4	44%	0.444	39%	0.387	S	S	.	.	H	α-helix	trans	-60	-44.1	175.2	-176.5	180	175.9	0	0	111.4	L518 E519 L520 C525 R526	L518-E522 WeakPolarHBondContact O-CB 3.49Å; L518-E522 PolarHBondContact O-N 3.07Å; E519-E522 PolarHBondContact O-N 3.25Å; L520-E522 VanDerWaalsContact C-N 3.33Å; E522-C525 PolarHBondContact O-N 3.12Å; E522-R526 WeakPolarHBondContact O-CB 3.48Å; E522-R526 VanDerWaalsContact O-CG 3.3Å; E522-R526 WeakPolarHBondContact O-CG 3.44Å; E522-R526 PolarHBondContact O-N 3.07Å; E522-R526 IonicContact OE1-CZ 3.35Å; E522-R526 IonicContact OE1-NE 3.18Å; E522-R526 PolarHBondContact OE1-NE 3.38Å; E522-R526 IonicContact OE1-NH2 2.67Å; E522-R526 PolarHBondContact OE1-NH2 2.92Å
523	L	89	Confident	86	Confident	20 Å²	20	73.5 Å²	73.5	11%	0.105	40%	0.401	C	S	.	.	H	α-helix	trans	-58.7	-49.4	174.4	175	63.3	0	0	0	111.4	V15 L16 F19 E519 L520 I521 C525 R526 L527	V15-L523 HydrophobicContact CG1-CD1 3.78Å; L16-L523 HydrophobicContact CD2-CD1 4.25Å; L16-L523 HydrophobicContact CD2-CD2 4.39Å; F19-L523 HydrophobicContact CB-CD1 3.95Å; F19-L523 HydrophobicContact CB-CD2 4.48Å; F19-L523 HydrophobicContact CD1-CD2 3.83Å; F19-L523 HydrophobicContact CD2-CB 3.78Å; F19-L523 HydrophobicContact CD2-CD1 4.26Å; F19-L523 HydrophobicContact CD2-CD2 3.9Å; F19-L523 HydrophobicContact CD2-CG 4.19Å; F19-L523 HydrophobicContact CE1-CD2 3.98Å; F19-L523 HydrophobicContact CE2-CB 3.97Å; F19-L523 HydrophobicContact CE2-CD2 4.02Å; F19-L523 HydrophobicContact CG-CB 4.4Å; F19-L523 HydrophobicContact CG-CD1 4.09Å; F19-L523 HydrophobicContact CG-CD2 3.79Å; F19-L523 HydrophobicContact CG-CG 4.31Å; F19-L523 HydrophobicContact CZ-CD2 4.07Å; E519-L523 WeakPolarHBondContact O-CB 3.43Å; E519-L523 PolarHBondContact O-N 3Å; L520-L523 WeakPolarHBondContact O-CB 3.46Å; L520-L523 PolarHBondContact O-N 3.46Å; I521-L523 VanDerWaalsContact C-N 3.33Å; I521-L523 PolarHBondContact O-N 3.14Å; L523-C525 PolarHBondContact O-N 3.44Å; L523-R526 PolarHBondContact O-N 3.3Å; L523-L527 HydrophobicContact CD1-CD1 4Å; L523-L527 HydrophobicContact CD1-CG 4.11Å; L523-L527 HydrophobicContact CG-CD1 3.95Å; L523-L527 HydrophobicContact CG-CG 4.44Å; L523-L527 WeakPolarHBondContact O-CB 3.33Å; L523-L527 VanDerWaalsContact O-CG 3.28Å; L523-L527 WeakPolarHBondContact O-CG 3.48Å; L523-L527 PolarHBondContact O-N 3.4Å
524	L	89.5	Confident	84.6	Confident	101 Å²	101	81 Å²	81	53%	0.529	42%	0.422	S	S	.	.	H	α-helix	trans	-59.9	-46.2	178.9	-75	170	0	0	0	111.3	L520 I521 R526 L527 I528	L520-L524 WeakPolarHBondContact O-CB 3.38Å; L520-L524 WeakPolarHBondContact O-CG 3.48Å; L520-L524 PolarHBondContact O-N 3.31Å; I521-L524 PolarHBondContact O-N 2.84Å; L524-R526 PolarHBondContact O-N 2.72Å; L524-L527 PolarHBondContact O-N 2.85Å; L524-I528 WeakPolarHBondContact O-CB 3.28Å; L524-I528 VanDerWaalsContact O-CG1 3.23Å; L524-I528 WeakPolarHBondContact O-CG1 3.31Å; L524-I528 PolarHBondContact O-N 3.36Å
525	C	89.8	Confident	83.3	Confident	64 Å²	64	85 Å²	85	43%	0.432	43%	0.43	S	S	.	.	H	α-helix	trans	-58.3	-46.9	175.3	-74.4	0	0	0	0	111.7	I521 E522 L523 L527 I528 I529	I521-C525 WeakPolarHBondContact O-CB 3.49Å; I521-C525 PolarHBondContact O-N 3.34Å; I521-C525 PolarHBondContact O-SG 3.34Å; I521-C525 VanDerWaalsContact O-SG 3.34Å; E522-C525 PolarHBondContact O-N 3.12Å; L523-C525 PolarHBondContact O-N 3.44Å; C525-L527 VanDerWaalsContact C-N 3.32Å; C525-L527 PolarHBondContact O-N 3.25Å; C525-I528 PolarHBondContact O-N 3.49Å; C525-I529 WeakPolarHBondContact O-CD1 3.17Å; C525-I529 WeakPolarHBondContact O-CG1 3.44Å; C525-I529 PolarHBondContact O-N 3.41Å
526	R	88.6	Confident	81.7	Confident	118 Å²	118	87 Å²	87	45%	0.445	44%	0.437	S	S	.	.	H	α-helix	trans	-62	-39.1	177.2	-71.6	174.8	-179.6	-139.1	4.4	111.9	V15 E522 L523 L524 I530	V15-R526 HydrophobicContact CG1-CB 3.99Å; E522-R526 WeakPolarHBondContact O-CB 3.48Å; E522-R526 VanDerWaalsContact O-CG 3.3Å; E522-R526 WeakPolarHBondContact O-CG 3.44Å; E522-R526 PolarHBondContact O-N 3.07Å; E522-R526 IonicContact OE1-CZ 3.35Å; E522-R526 IonicContact OE1-NE 3.18Å; E522-R526 PolarHBondContact OE1-NE 3.38Å; E522-R526 IonicContact OE1-NH2 2.67Å; E522-R526 PolarHBondContact OE1-NH2 2.92Å; L523-R526 PolarHBondContact O-N 3.3Å; L524-R526 PolarHBondContact O-N 2.72Å; R526-I530 WeakPolarHBondContact O-CD1 3.3Å; R526-I530 VanDerWaalsContact O-CG1 3.32Å; R526-I530 WeakPolarHBondContact O-CG1 3.33Å; R526-I530 PolarHBondContact O-N 3.35Å
527	L	87.8	Confident	79.7	Confident	44 Å²	44	92.4 Å²	92.4	23%	0.23	47%	0.47	C	S	.	.	H	α-helix	trans	-68.3	-41.6	176.3	-70.1	173.5	0	0	0	112.2	C12 V15 L523 L524 C525 I530 A531	C12-L527 HydrophobicContact CB-CD2 4.32Å; V15-L527 HydrophobicContact CG1-CD2 4.38Å; L523-L527 HydrophobicContact CD1-CD1 4Å; L523-L527 HydrophobicContact CD1-CG 4.11Å; L523-L527 HydrophobicContact CG-CD1 3.95Å; L523-L527 HydrophobicContact CG-CG 4.44Å; L523-L527 WeakPolarHBondContact O-CB 3.33Å; L523-L527 VanDerWaalsContact O-CG 3.28Å; L523-L527 WeakPolarHBondContact O-CG 3.48Å; L523-L527 PolarHBondContact O-N 3.4Å; L524-L527 PolarHBondContact O-N 2.85Å; C525-L527 VanDerWaalsContact C-N 3.32Å; C525-L527 PolarHBondContact O-N 3.25Å; L527-I530 PolarHBondContact O-N 3.46Å; L527-A531 WeakPolarHBondContact O-CB 3.47Å; L527-A531 PolarHBondContact O-N 2.98Å
528	I	86.4	Confident	77.7	Confident	98 Å²	98	95.4 Å²	95.4	50%	0.503	49%	0.488	S	S	.	.	H	α-helix	trans	-63.1	-42.4	176.3	-69.5	164.5	0	0	0	110.7	L524 C525 I530 A531 F532	L524-I528 WeakPolarHBondContact O-CB 3.28Å; L524-I528 VanDerWaalsContact O-CG1 3.23Å; L524-I528 WeakPolarHBondContact O-CG1 3.31Å; L524-I528 PolarHBondContact O-N 3.36Å; C525-I528 PolarHBondContact O-N 3.49Å; I528-I530 PolarHBondContact O-N 2.93Å; I528-A531 PolarHBondContact O-N 3.05Å; I528-F532 HydrophobicContact CG2-CD2 4.38Å; I528-F532 PolarHBondContact O-N 2.82Å
529	I	85.2	Confident	75.3	Confident	91 Å²	91	92.3 Å²	92.3	47%	0.467	48%	0.475	S	S	.	.	H	α-helix	trans	-59.1	-38.6	176.5	-69.7	164.6	0	0	0	111	C525 L536	C525-I529 WeakPolarHBondContact O-CD1 3.17Å; C525-I529 WeakPolarHBondContact O-CG1 3.44Å; C525-I529 PolarHBondContact O-N 3.41Å; I529-L536 HydrophobicContact CD1-CD1 4.47Å; I529-L536 HydrophobicContact CG1-CD1 3.76Å; I529-L536 HydrophobicContact CG2-CD1 4.47Å
530	I	82.2	Confident	73.1	Confident	53 Å²	53	99.5 Å²	99.5	27%	0.272	51%	0.506	S	S	.	.	H	α-helix	trans	-74.5	-40.7	178.2	-67.4	165.5	0	0	0	111.4	S10 V15 R526 L527 I528	S10-I530 WeakPolarHBondContact O-CD1 3.35Å; V15-I530 HydrophobicContact CB-CD1 4.37Å; V15-I530 HydrophobicContact CG2-CD1 3.38Å; R526-I530 WeakPolarHBondContact O-CD1 3.3Å; R526-I530 VanDerWaalsContact O-CG1 3.32Å; R526-I530 WeakPolarHBondContact O-CG1 3.33Å; R526-I530 PolarHBondContact O-N 3.35Å; L527-I530 PolarHBondContact O-N 3.46Å; I528-I530 PolarHBondContact O-N 2.93Å
531	A	80.7	Confident	71.2	Confident	64 Å²	64	103.5 Å²	103.5	53%	0.529	53%	0.528	S	S	.	.	H	α-helix	trans	-73.6	-35.8	-177.8	0	0	0	0	0	113	L527 I528 P533	L527-A531 WeakPolarHBondContact O-CB 3.47Å; L527-A531 PolarHBondContact O-N 2.98Å; I528-A531 PolarHBondContact O-N 3.05Å; A531-P533 VanDerWaalsContact C-CD 3.46Å; A531-P533 WeakPolarHBondContact O-CD 3.49Å
532	F	78.9	Confident	69.2	Low	121 Å²	121	103.7 Å²	103.7	53%	0.531	53%	0.533	S	S	.	.			trans	-126.4	66.3	-175	-61.7	-76.9	0	0	0	112.3	I528 R534 F535	I528-F532 HydrophobicContact CG2-CD2 4.38Å; I528-F532 PolarHBondContact O-N 2.82Å; F532-R534 PolarHBondContact O-N 3.34Å; F532-F535 HydrophobicContact CB-CD2 4.25Å; F532-F535 PolarHBondContact O-N 3.3Å; F532-F535 VanDerWaalsContact O-N 3.16Å
533	P	69.4	Low	67.3	Low	89 Å²	89	104.7 Å²	104.7	58%	0.578	54%	0.54	S	S	*	.	G	3₁₀ helix	trans	-60.9	-19.2	179.7	24.2	-33.3	0	0	0	113.1	A531	A531-P533 VanDerWaalsContact C-CD 3.46Å; A531-P533 WeakPolarHBondContact O-CD 3.49Å
534	R	59.4	Low	65.3	Low	222 Å²	222	110.5 Å²	110.5	84%	0.838	57%	0.566	S	S	*	*	G	3₁₀ helix	trans	-78.4	-15.1	-179.3	-67.3	-175.7	176.9	167.9	-0.5	114.7	F532 T537	F532-R534 PolarHBondContact O-N 3.34Å; R534-T537 PolarHBondContact O-OG1 2.85Å
535	F	56.1	Low	63.1	Low	173 Å²	173	113.5 Å²	113.5	76%	0.759	57%	0.571	S	S	*	*	G	3₁₀ helix	trans	-82.5	-14.5	179.7	-100.5	-84	0	0	0	113.8	F532	F532-F535 HydrophobicContact CB-CD2 4.25Å; F532-F535 PolarHBondContact O-N 3.3Å; F532-F535 VanDerWaalsContact O-N 3.16Å
536	L	53.1	Low	61.1	Low	126 Å²	126	116 Å²	116	66%	0.66	58%	0.58	S	S	*	*	G	3₁₀ helix	trans	-105.2	8.2	178.5	-78.8	162.1	0	0	0	113.9	I529 V538	I529-L536 HydrophobicContact CD1-CD1 4.47Å; I529-L536 HydrophobicContact CG1-CD1 3.76Å; I529-L536 HydrophobicContact CG2-CD1 4.47Å; L536-V538 PolarHBondContact O-N 2.84Å
537	T	45.4	Very low	59.2	Low	115 Å²	115	115.3 Å²	115.3	71%	0.706	59%	0.585	S	S	*	*			trans	-83.1	49.3	168.1	51.1	0	0	0	0	111.4	R534	R534-T537 PolarHBondContact O-OG1 2.85Å
538	V	43.5	Very low	57.1	Low	129 Å²	129	122.5 Å²	122.5	78%	0.782	61%	0.609	S	S	*	*	S	Bend	trans	-103.4	95.3	163.4	179	0	0	0	0	107.6	L536	L536-V538 PolarHBondContact O-N 2.84Å
539	S	39.7	Very low	55.1	Low	43 Å²	43	125 Å²	125	30%	0.301	62%	0.616	S	S	.	*			trans	50.9	82	161.8	-160.9	0	0	0	0	119.2	N541 T542	S539-N541 PolarHBondContact O-N 3.21Å; S539-N541 VanDerWaalsContact O-N 3.16Å; S539-N541 PolarHBondContact OG-N 2.94Å; S539-T542 VanDerWaalsContact CB-OG1 3.24Å; S539-T542 WeakPolarHBondContact CB-OG1 3.38Å; S539-T542 PolarHBondContact O-N 2.66Å; S539-T542 WeakPolarHBondContact OG-CB 3.35Å; S539-T542 PolarHBondContact OG-N 3.05Å; S539-T542 PolarHBondContact OG-OG1 3.34Å
540	K	43.8	Very low	53.2	Low	191 Å²	191	125.7 Å²	125.7	83%	0.83	63%	0.625	S	S	*	*	H	α-helix	trans	-59	-12.1	150.5	-80	-179	174.7	176	0	113.1
541	N	46.6	Very low	51.1	Low	140 Å²	140	130.4 Å²	130.4	75%	0.749	65%	0.65	S	S	*	*	H	α-helix	trans	-90.5	-17.1	-179	-72.8	-8.3	0	0	0	114.3	S539	S539-N541 PolarHBondContact O-N 3.21Å; S539-N541 VanDerWaalsContact O-N 3.16Å; S539-N541 PolarHBondContact OG-N 2.94Å
542	T	47.5	Very low	49	Very low	81 Å²	81	136.2 Å²	136.2	50%	0.497	66%	0.663	S	S	.	*	H	α-helix	trans	-87.8	-32.2	-179.8	-50.4	0	0	0	0	111.5	S539 H544 Y545 L546	S539-T542 VanDerWaalsContact CB-OG1 3.24Å; S539-T542 WeakPolarHBondContact CB-OG1 3.38Å; S539-T542 PolarHBondContact O-N 2.66Å; S539-T542 WeakPolarHBondContact OG-CB 3.35Å; S539-T542 PolarHBondContact OG-N 3.05Å; S539-T542 PolarHBondContact OG-OG1 3.34Å; T542-H544 VanDerWaalsContact C-N 3.35Å; T542-Y545 PolarHBondContact O-N 3.25Å; T542-L546 HydrophobicContact CG2-CD1 4.37Å; T542-L546 PolarHBondContact O-N 2.85Å
543	I	50.5	Low	46.9	Very low	115 Å²	115	137.4 Å²	137.4	59%	0.59	67%	0.674	S	S	*	*	H	α-helix	trans	-73.4	-28	178.5	-64	173.8	0	0	0	111.6	Y545 N547	I543-Y545 VanDerWaalsContact C-N 3.34Å; I543-Y545 PolarHBondContact O-N 3.43Å; I543-N547 PolarHBondContact O-N 2.87Å
544	H	47.1	Very low	45.2	Very low	142 Å²	142	139.9 Å²	139.9	66%	0.657	68%	0.683	S	S	*	*	H	α-helix	trans	-77.7	-17.4	177.6	-146.5	-56.3	0	0	0	113.7	T542	T542-H544 VanDerWaalsContact C-N 3.35Å
545	Y	43.4	Very low	43.8	Very low	164 Å²	164	138.6 Å²	138.6	64%	0.643	69%	0.686	S	S	*	*	H	α-helix	trans	-89.6	-30.7	176.5	-159.2	-94.8	0	0	0	112.4	T542 I543	T542-Y545 PolarHBondContact O-N 3.25Å; I543-Y545 VanDerWaalsContact C-N 3.34Å; I543-Y545 PolarHBondContact O-N 3.43Å
546	L	47.2	Very low	42.7	Very low	116 Å²	116	135.3 Å²	135.3	61%	0.607	68%	0.682	S	S	*	*	H	α-helix	trans	-74.9	-36.5	176.1	-85	153.6	0	0	0	113	T542 R548 T550	T542-L546 HydrophobicContact CG2-CD1 4.37Å; T542-L546 PolarHBondContact O-N 2.85Å; L546-R548 VanDerWaalsContact C-N 3.33Å; L546-R548 PolarHBondContact O-N 3.13Å; L546-T550 PolarHBondContact O-OG1 3.07Å
547	N	48.7	Very low	41.8	Very low	104 Å²	104	135.6 Å²	135.6	56%	0.556	69%	0.689	S	S	*	*	H	α-helix	trans	-76.7	-12.6	177.2	-78.9	-19.9	0	0	0	114.7	I543	I543-N547 PolarHBondContact O-N 2.87Å
548	R	45.2	Very low	40.9	Very low	196 Å²	196	139.5 Å²	139.5	74%	0.74	70%	0.696	S	S	*	*	H	α-helix	trans	-91.9	-15.8	-179.9	-146.9	177.8	-171.6	-169.8	2.5	113.6	L546	L546-R548 VanDerWaalsContact C-N 3.33Å; L546-R548 PolarHBondContact O-N 3.13Å
549	K	44.5	Very low	40.4	Very low	151 Å²	151	139.7 Å²	139.7	66%	0.657	70%	0.698	S	S	*	*	H	α-helix	trans	-95.1	-21.6	175.4	-93.4	-175.6	173.7	-178.3	0	113.5
550	T	44.7	Very low	39.8	Very low	104 Å²	104	145.2 Å²	145.2	64%	0.638	72%	0.724	S	S	*	*	S	Bend	trans	-88.9	-8	179.5	47	0	0	0	0	114.2	L546	L546-T550 PolarHBondContact O-OG1 3.07Å
551	L	37.6	Very low	39.3	Very low	153 Å²	153	141.2 Å²	141.2	80%	0.801	72%	0.72	S	S	*	*	S	Bend	trans	-109.4	18.7	-177.1	-127	101.9	0	0	0	115
552	K	37.6	Very low	38.4	Very low	185 Å²	185	140.1 Å²	140.1	80%	0.804	72%	0.719	S	S	*	*			trans	-111.9	13.8	-179.9	-92.3	-168.7	177.1	-172.5	0	115.3
553	L	33	Very low	37.7	Very low	147 Å²	147	145 Å²	145	77%	0.77	73%	0.733	S	S	*	*	S	Bend	trans	-113	120.6	169.3	-93.1	96.3	0	0	0	111.3
554	N	34.4	Very low	36.7	Very low	141 Å²	141	145.7 Å²	145.7	75%	0.754	74%	0.738	S	S	*	*			trans	80.7	79.2	157.3	-53.9	-14.9	0	0	0	117.3	P556	N554-P556 WeakPolarHBondContact O-CD 3.24Å
555	H	30.9	Very low	35.9	Very low	194 Å²	194	148 Å²	148	90%	0.898	75%	0.746	S	S	*	*			trans	-84	119	140.5	-99.1	-70.7	0	0	0	108.6
556	P	33.1	Very low	35.2	Very low	105 Å²	105	144.5 Å²	144.5	68%	0.682	75%	0.746	S	S	*	*			trans	-101.2	115.4	151.9	15.1	3.7	0	0	0	108.3	N554 F558	N554-P556 WeakPolarHBondContact O-CD 3.24Å; P556-F558 PolarHBondContact O-N 3.4Å
557	T	33.3	Very low	34.3	Very low	131 Å²	131	146.3 Å²	146.3	80%	0.804	76%	0.756	S	S	*	*			trans	-61.9	120.4	168.9	38.7	0	0	0	0	110.4
558	F	27.5	Very low	33.2	Very low	197 Å²	197	152.5 Å²	152.5	86%	0.864	77%	0.772	S	S	*	*			trans	-78.1	122.2	168.1	-104.1	-94.4	0	0	0	109.8	P556	P556-F558 PolarHBondContact O-N 3.4Å
559	T	32.6	Very low	32.4	Very low	133 Å²	133	150 Å²	150	82%	0.816	78%	0.778	S	S	*	*			trans	-121.9	123.3	158.9	45.9	0	0	0	0	109.1
560	N	27.2	Very low	31.4	Very low	160 Å²	160	149.8 Å²	149.8	86%	0.856	78%	0.783	S	S	*	*			trans	-56.4	137	-179.2	-73.6	-31.6	0	0	0	113.5
561	S	32.1	Very low	30.6	Very low	106 Å²	106	151.5 Å²	151.5	74%	0.741	79%	0.793	S	S	*	*			trans	-174.3	101.4	142.2	177.3	0	0	0	0	110.8
562	T	29.4	Very low	30	Very low	117 Å²	117	152 Å²	152	72%	0.718	79%	0.791	S	S	*	*			trans	16	118.4	138.5	50.6	0	0	0	0	119.7
563	K	31.6	Very low	29.4	Very low	184 Å²	184	148.6 Å²	148.6	80%	0.8	79%	0.786	S	S	*	*				146.6	126.1	109.6	-98	166.4	-179.5	177.4	0	113
564	N	30.5	Very low	29	Very low	130 Å²	130	147.2 Å²	147.2	70%	0.695	78%	0.784	S	S	*	*			trans	74.9	122	138.3	-75.9	-14.3	0	0	0	121.7
565	K	30.4	Very low	28.7	Very low	190 Å²	190	149.4 Å²	149.4	83%	0.826	79%	0.787	S	S	*	*			trans	61.5	137.3	133.3	-74.9	-180	173.3	179.7	0	116.3
566	S	28.2	Very low	28.5	Very low	90 Å²	90	147.3 Å²	147.3	63%	0.629	78%	0.782	S	S	*	*			cis	179.6	160.3	7.1	41.4	0	0	0	0	106.9
567	N	28.8	Very low	28.2	Very low	155 Å²	155	149.3 Å²	149.3	83%	0.829	79%	0.786	S	S	*	*			trans	96.2	109.4	154.1	-64	-9.9	0	0	0	119.9
568	R	24.2	Very low	27.9	Very low	234 Å²	234	147.6 Å²	147.6	88%	0.883	78%	0.78	S	S	*	*			trans	-49.6	144.1	150.5	-74.5	168.8	159.4	166.1	-6.6	112
569	T	28.4	Very low	27.8	Very low	143 Å²	143	143.6 Å²	143.6	88%	0.877	77%	0.771	S	S	*	*				-158.1	129.4	126	1.8	0	0	0	0	111.7
570	I	23.9	Very low	27.6	Very low	147 Å²	147	144.6 Å²	144.6	75%	0.754	77%	0.771	S	S	*	*			trans	-79.6	133.3	168.7	-67	155.6	0	0	0	107.6
571	V	28.4	Very low	27.6	Very low	140 Å²	140	141.6 Å²	141.6	85%	0.848	76%	0.763	S	S	*	*			trans	-153	133.4	147.5	-178.2	0	0	0	0	109.8
572	E	23.7	Very low	27.3	Very low	163 Å²	163	146.7 Å²	146.7	76%	0.762	77%	0.767	S	S	*	*			trans	-77	173	-179	-67.4	172	125.3	0	0	115.2
573	T	25.1	Very low	27.2	Very low	113 Å²	113	150.3 Å²	150.3	69%	0.693	77%	0.773	S	S	*	*			trans	86.8	115.4	143.9	38.5	0	0	0	0	121.5
574	T	25.6	Very low	27	Very low	119 Å²	119	149.7 Å²	149.7	73%	0.73	77%	0.77	S	S	*	*				94.2	123	129.7	54.5	0	0	0	0	121.6
575	K	27	Very low	26.9	Very low	187 Å²	187	148.9 Å²	148.9	81%	0.813	77%	0.766	S	S	*	*			trans	75.7	102.8	140.2	-74.5	178.6	177.6	177.1	0	119.3
576	N	27.3	Very low	26.8	Very low	149 Å²	149	147.1 Å²	147.1	80%	0.797	76%	0.761	S	S	*	*				55.8	134.5	118	-80.7	1.9	0	0	0	122
577	L	26.8	Very low	26.8	Very low	147 Å²	147	149.5 Å²	149.5	77%	0.77	77%	0.766	S	S	*	*			trans	107.3	119.1	136.7	-118.5	82	0	0	0	118.7
578	S	26.8	Very low	26.9	Very low	96 Å²	96	149.5 Å²	149.5	67%	0.671	76%	0.761	S	S	*	*			trans	83.9	133.8	135.7	81	0	0	0	0	115.3
579	T	26.9	Very low	27.2	Very low	112 Å²	112	147.5 Å²	147.5	69%	0.687	76%	0.759	S	S	*	*				-177.8	168.7	50.2	26.5	0	0	0	0	111
580	L	27.4	Very low	27.5	Very low	154 Å²	154	145.9 Å²	145.9	81%	0.806	75%	0.751	S	S	*	*			trans	86.7	140.3	154.2	-65.4	125.3	0	0	0	118.8
581	S	28.2	Very low	27.7	Very low	98 Å²	98	144 Å²	144	69%	0.685	75%	0.749	S	S	*	*			cis	179.7	131.1	-11.2	48.5	0	0	0	0	110.2
582	Y	24.3	Very low	27.6	Very low	213 Å²	213	144 Å²	144	84%	0.835	75%	0.745	S	S	*	*			trans	31.2	125.7	138.4	-108.5	-91.6	0	0	0	123.6
583	K	28.9	Very low	27.8	Very low	192 Å²	192	144 Å²	144	84%	0.835	75%	0.75	S	S	*	*				164.4	127.1	105	-97.8	-178.1	178.7	176.8	0	115.6
584	K	26.5	Very low	27.9	Very low	171 Å²	171	144.8 Å²	144.8	74%	0.743	76%	0.759	S	S	*	*			trans	9	148	132.4	-93	-179.4	172.6	-176.1	0	119.3
585	D	28.5	Very low	28.1	Very low	114 Å²	114	150 Å²	150	61%	0.61	77%	0.765	S	S	*	*			cis	-170.5	151.7	45.6	-105.4	-38.6	0	0	0	112.5
586	Q	27.3	Very low	28.1	Very low	153 Å²	153	148.4 Å²	148.4	72%	0.715	77%	0.765	S	S	*	*			trans	36.9	130	138.6	-58.7	178.5	25.4	0	0	123.6
587	N	29.9	Very low	28.1	Very low	140 Å²	140	150.7 Å²	150.7	75%	0.749	76%	0.764	S	S	*	*				-174.9	130	119.2	-94.9	-25.7	0	0	0	115.8
588	H	30.5	Very low	28.4	Very low	154 Å²	154	148.9 Å²	148.9	71%	0.713	76%	0.759	S	S	*	*			trans	80.3	102.1	141.5	-71	-20.8	0	0	0	125.5
589	K	29.8	Very low	28.5	Very low	193 Å²	193	154.2 Å²	154.2	84%	0.839	77%	0.77	S	S	*	*				74.6	150.3	108.7	-83.4	-162.1	174.2	178.9	0	122.7
590	P	34.5	Very low	28.7	Very low	109 Å²	109	153.6 Å²	153.6	71%	0.708	77%	0.77	S	S	*	*			trans	-130.9	178.7	-133	42.6	-24.7	0	0	0	115.5
591	C	27.6	Very low	29	Very low	108 Å²	108	150.6 Å²	150.6	73%	0.73	76%	0.759	S	S	*	*			trans	157.9	151.6	152.9	-88.5	0	0	0	0	108.4
592	D	26.3	Very low	29.2	Very low	140 Å²	140	152.2 Å²	152.2	75%	0.749	76%	0.758	S	S	*	*			cis	-170.4	157.2	-9.9	-98.9	-18	0	0	0	105.7
593	N	29	Very low	29.5	Very low	162 Å²	162	151 Å²	151	87%	0.866	76%	0.757	S	S	*	*			trans	87.8	75.4	178.3	-68.7	-21.5	0	0	0	119
594	C	26.7	Very low	29.7	Very low	130 Å²	130	149.1 Å²	149.1	88%	0.878	76%	0.756	S	S	*	*			trans	-130.6	105.4	142.7	-84.2	0	0	0	0	108.8
595	R	30.1	Very low	29.9	Very low	228 Å²	228	147.9 Å²	147.9	86%	0.86	76%	0.756	S	S	*	*			trans	-93.8	119.3	175.6	-146.1	177.9	-167.6	-177.2	3.3	108.6
596	N	26.5	Very low	30	Very low	153 Å²	153	150.6 Å²	150.6	82%	0.818	77%	0.767	S	S	*	*			trans	-66.1	132.2	178.9	-73.3	-31.5	0	0	0	112.2
597	Y	28.7	Very low	30.2	Very low	198 Å²	198	149 Å²	149	78%	0.776	77%	0.768	S	S	*	*			trans	-118	132.6	158.7	-85.6	-81	0	0	0	110.9
598	T	31.7	Very low	30.3	Very low	109 Å²	109	149 Å²	149	67%	0.669	77%	0.768	S	S	*	*			trans	-86.5	158.1	-170.3	32.9	0	0	0	0	113	S600	T598-S600 PolarHBondContact O-N 3.19Å
599	K	29.9	Very low	30.3	Very low	208 Å²	208	148.4 Å²	148.4	90%	0.904	77%	0.77	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55.2	5.8	-169.3	-142.7	171.8	-177	178.3	0	117.6
600	S	30.9	Very low	30.4	Very low	98 Å²	98	146.4 Å²	146.4	69%	0.685	77%	0.768	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.6	-8.3	-172.4	53.2	0	0	0	0	115.1	T598	T598-S600 PolarHBondContact O-N 3.19Å
601	T	32.7	Very low	30.2	Very low	92 Å²	92	148.1 Å²	148.1	56%	0.564	77%	0.772	S	S	*	*	S	Bend	trans	-100	-4.2	-174.5	-33.4	0	0	0	0	113.7
602	I	32.6	Very low	30.4	Very low	131 Å²	131	150.8 Å²	150.8	67%	0.672	78%	0.779	S	S	*	*	G	3₁₀ helix	trans	-87.7	-5.3	-174.5	-66.1	172.7	0	0	0	112.7
603	K	31.8	Very low	30.7	Very low	188 Å²	188	152.3 Å²	152.3	82%	0.817	78%	0.781	S	S	*	*	G	3₁₀ helix	trans	-89.2	-6.6	-173.3	-141.5	177.3	-178.2	-175.5	0	115.5
604	N	32.3	Very low	30.9	Very low	153 Å²	153	150.2 Å²	150.2	82%	0.818	77%	0.769	S	S	*	*	G	3₁₀ helix	trans	-118.1	13.8	-171.8	-72.4	-4.5	0	0	0	115
605	I	31.1	Very low	31.2	Very low	144 Å²	144	149 Å²	149	74%	0.738	75%	0.754	S	S	*	*			trans	-131.1	46.5	-179.6	-45.6	176	0	0	0	109.7
606	M	30	Very low	31.2	Very low	171 Å²	171	147.6 Å²	147.6	84%	0.842	75%	0.75	S	S	*	*			trans	-124.8	33	174.4	-78.3	-169.7	168.9	0	0	111.5
607	V	30.7	Very low	31.4	Very low	121 Å²	121	146 Å²	146	73%	0.733	74%	0.74	S	S	*	*	S	Bend	trans	-127.6	128.4	167.7	-176.6	0	0	0	0	105.1
608	D	32.6	Very low	31.5	Very low	138 Å²	138	144.2 Å²	144.2	74%	0.738	74%	0.737	S	S	*	*	S	Bend	trans	90.4	98.5	178	-58.2	-23	0	0	0	118.7
609	N	31.3	Very low	31.4	Very low	142 Å²	142	147.8 Å²	147.8	76%	0.759	75%	0.746	S	S	*	*			trans	79.1	126.4	132	-65.6	-29.5	0	0	0	121.4
610	N	32.4	Very low	31.4	Very low	151 Å²	151	142.8 Å²	142.8	81%	0.807	73%	0.733	S	S	*	*			trans	84.9	84.5	156.8	-68.5	-11.6	0	0	0	118.1	N612	N610-N612 PolarHBondContact O-N 2.89Å; N610-N612 VanDerWaalsContact O-N 3.08Å
611	D	30.2	Very low	31.2	Very low	146 Å²	146	144.8 Å²	144.8	78%	0.781	74%	0.735	S	S	*	*	T	Hydrogen-bonded Turn	trans	-52.2	99.4	152	-65.5	-47.5	0	0	0	110.6
612	N	30.9	Very low	31	Very low	164 Å²	164	148 Å²	148	88%	0.877	75%	0.748	S	S	*	*	T	Hydrogen-bonded Turn	trans	-167.8	1.1	152.4	-93.2	-29.4	0	0	0	115.1	N610	N610-N612 PolarHBondContact O-N 2.89Å; N610-N612 VanDerWaalsContact O-N 3.08Å
613	E	32	Very low	30.7	Very low	171 Å²	171	148 Å²	148	80%	0.799	75%	0.754	S	S	*	*	S	Bend	trans	-125.8	11.7	-179.5	-78.9	-171.9	143.7	0	0	115.3
614	I	33.8	Very low	30.4	Very low	119 Å²	119	145 Å²	145	61%	0.61	75%	0.751	S	S	*	*	S	Bend	trans	-102.3	-6.6	-174.4	-69.1	176.8	0	0	0	114.1
615	N	33.6	Very low	30.2	Very low	105 Å²	105	145.5 Å²	145.5	56%	0.561	75%	0.754	S	S	*	*	S	Bend	trans	-88.8	-10.9	174.3	-80.1	-18.6	0	0	0	114.4
616	Y	30.6	Very low	29.9	Very low	198 Å²	198	144.4 Å²	144.4	78%	0.776	76%	0.755	S	S	*	*	S	Bend	trans	-91.5	-15.7	-179	-163	-103.9	0	0	0	113.7
617	L	29.9	Very low	29.6	Very low	118 Å²	118	143 Å²	143	62%	0.618	75%	0.751	S	S	*	*	S	Bend	trans	-105.3	-3.2	-177.9	-82	160.8	0	0	0	114.4
618	K	31	Very low	29.5	Very low	162 Å²	162	146.5 Å²	146.5	70%	0.704	76%	0.758	S	S	*	*	S	Bend	trans	-89	-15.5	174	-94.1	178.2	176	173.8	0	114.4
619	E	29.9	Very low	29.2	Very low	183 Å²	183	145.4 Å²	145.4	86%	0.855	76%	0.761	S	S	*	*	S	Bend	trans	-93.5	-6.7	174.9	-80.7	-160.9	142.2	0	0	114.4
620	V	28.7	Very low	29.2	Very low	103 Å²	103	143.4 Å²	143.4	62%	0.624	76%	0.759	S	S	*	*	S	Bend	trans	-103.9	-0.4	-172.3	179.7	0	0	0	0	113.4
621	L	27.3	Very low	29	Very low	140 Å²	140	141.2 Å²	141.2	73%	0.733	76%	0.755	S	S	*	*	S	Bend	trans	-129.4	21.7	-171.6	-88.1	165.3	0	0	0	117.1
622	L	28.7	Very low	29	Very low	161 Å²	161	139.1 Å²	139.1	84%	0.843	75%	0.752	S	S	*	*	S	Bend	trans	-136.7	52.1	172.5	-80.1	168.4	0	0	0	113.4
623	T	26.5	Very low	28.9	Very low	131 Å²	131	137.9 Å²	137.9	80%	0.804	75%	0.746	S	S	*	*			trans	-140.9	67.3	161.6	56.7	0	0	0	0	111.1
624	T	25.8	Very low	28.9	Very low	123 Å²	123	135.7 Å²	135.7	76%	0.755	74%	0.739	S	S	*	*			trans	-140.3	102.1	161.4	51.8	0	0	0	0	109.3
625	N	26.4	Very low	28.7	Very low	164 Å²	164	136.3 Å²	136.3	88%	0.877	74%	0.742	S	S	*	*			trans	145.9	72	147.9	-74.3	-14.8	0	0	0	111.5
626	T	24.7	Very low	28.6	Very low	122 Å²	122	137.8 Å²	137.8	75%	0.748	75%	0.75	S	S	*	*			trans	-87.8	138.5	152.7	45.8	0	0	0	0	109.5
627	N	25.2	Very low	28.5	Very low	142 Å²	142	134.6 Å²	134.6	76%	0.759	75%	0.747	S	S	*	*			trans	105.1	102.5	159.8	-54.2	-21.9	0	0	0	116.3
628	H	29.1	Very low	28.5	Very low	193 Å²	193	136 Å²	136	89%	0.894	76%	0.755	S	S	*	*				-163.1	113.9	115.9	-102.7	-62.6	0	0	0	110.8
629	S	25.2	Very low	28.3	Very low	115 Å²	115	135.1 Å²	135.1	80%	0.804	76%	0.758	S	S	*	*			trans	-102.7	129	159	55.2	0	0	0	0	108.8
630	S	30.8	Very low	28.3	Very low	100 Å²	100	134.3 Å²	134.3	70%	0.699	76%	0.758	S	S	*	*			trans	-163.8	103	155.6	52.7	0	0	0	0	112.6
631	S	28.8	Very low	28.1	Very low	106 Å²	106	138.3 Å²	138.3	74%	0.741	77%	0.766	S	S	*	*				61.4	143.1	124.1	68.1	0	0	0	0	124.3
632	S	29.4	Very low	28	Very low	101 Å²	101	138.3 Å²	138.3	71%	0.706	77%	0.767	S	S	*	*			trans	94.1	135.1	148.9	84.9	0	0	0	0	115.2
633	N	29.7	Very low	27.8	Very low	139 Å²	139	142.1 Å²	142.1	74%	0.743	77%	0.77	S	S	*	*			cis	-169.1	165.8	16.2	-115.5	-8.8	0	0	0	111.3
634	N	31.7	Very low	27.7	Very low	125 Å²	125	139.3 Å²	139.3	67%	0.668	77%	0.767	S	S	*	*			trans	87.4	104.8	154.4	-62.1	-9.9	0	0	0	119.2
635	I	29.5	Very low	27.7	Very low	132 Å²	132	143.5 Å²	143.5	68%	0.677	78%	0.778	S	S	*	*				82.9	102.1	71.1	-71	169	0	0	0	111.9
636	N	32.1	Very low	27.7	Very low	136 Å²	136	140.7 Å²	140.7	73%	0.727	77%	0.771	S	S	*	*				160	117.6	107.1	-104.4	-22	0	0	0	114.1
637	N	27.3	Very low	27.8	Very low	131 Å²	131	146.1 Å²	146.1	70%	0.701	78%	0.78	S	S	*	*			trans	23.6	121.3	130.5	-70.7	-11.1	0	0	0	120.1
638	N	31.1	Very low	28.1	Very low	147 Å²	147	145.7 Å²	145.7	79%	0.786	78%	0.782	S	S	*	*				177.8	147.7	91.9	-96	-31.9	0	0	0	113.7
639	N	25.3	Very low	27.9	Very low	144 Å²	144	139.7 Å²	139.7	77%	0.77	77%	0.772	S	S	*	*			trans	-53.3	148.7	178.9	-62.3	-58.2	0	0	0	114.8
640	I	31	Very low	28.3	Very low	166 Å²	166	139.9 Å²	139.9	85%	0.851	76%	0.763	S	S	*	*				-176.4	112.5	115.3	-84.8	149.6	0	0	0	110.6
641	K	24.8	Very low	28.6	Very low	186 Å²	186	138.8 Å²	138.8	81%	0.809	75%	0.753	S	S	*	*			trans	-13.5	124.6	147.1	-95.8	173.7	176.8	174.2	0	116.9
642	L	25.1	Very low	28.8	Very low	141 Å²	141	140.4 Å²	140.4	74%	0.738	75%	0.753	S	S	*	*				164.8	133.3	90.2	-97.8	143.6	0	0	0	114.1
643	R	23.8	Very low	29	Very low	240 Å²	240	144.5 Å²	144.5	91%	0.906	75%	0.754	S	S	*	*			trans	70	83.6	148.3	-79.1	176.1	-175.9	-170.9	1.1	119.7
644	G	24.9	Very low	29.5	Very low	73 Å²	73	142.6 Å²	142.6	75%	0.753	74%	0.741	S	S	*	*			trans	-120.5	121	143.2	0	0	0	0	0	109.4	S646	G644-S646 PolarHBondContact O-N 3.25Å
645	Q	24.9	Very low	29.7	Very low	210 Å²	210	140.1 Å²	140.1	98%	0.981	73%	0.727	S	S	*	*			trans	-77.6	108.7	167.8	-79.4	176.8	-29.6	0	0	107.9
646	S	26.9	Very low	29.9	Very low	105 Å²	105	141.9 Å²	141.9	73%	0.734	73%	0.73	S	S	*	*			trans	-133.2	135.3	167.5	54.7	0	0	0	0	108.6	G644 V648	G644-S646 PolarHBondContact O-N 3.25Å; S646-V648 PolarHBondContact O-N 2.8Å
647	Y	27.5	Very low	29.9	Very low	237 Å²	237	142 Å²	142	93%	0.929	73%	0.726	S	S	*	*	P	Polyproline II helix	trans	-62.4	126.5	-176.7	-84.2	-100.5	0	0	0	110.5	G649	Y647-G649 PolarHBondContact O-N 2.59Å
648	V	30.6	Very low	30	Very low	133 Å²	133	145.8 Å²	145.8	81%	0.806	73%	0.732	S	S	*	*	P	Polyproline II helix	trans	-67.4	124.3	179	173.5	0	0	0	0	109.7	S646	S646-V648 PolarHBondContact O-N 2.8Å
649	G	26.2	Very low	30.1	Very low	66 Å²	66	145.1 Å²	145.1	68%	0.68	73%	0.727	S	S	*	*	P	Polyproline II helix	trans	-67.5	124.4	170.5	0	0	0	0	0	111.4	Y647	Y647-G649 PolarHBondContact O-N 2.59Å
650	L	32.8	Very low	30.3	Very low	119 Å²	119	143.2 Å²	143.2	62%	0.623	72%	0.72	S	S	*	*	P	Polyproline II helix	trans	-82.3	128.4	167	-84.5	145.9	0	0	0	109	Q654 I655	L650-Q654 HydrophobicContact CD2-CB 4.05Å; L650-I655 HydrophobicContact CB-CD1 4.11Å; L650-I655 HydrophobicContact CB-CG1 4.01Å
651	T	37.2	Very low	30.1	Very low	77 Å²	77	141.5 Å²	141.5	47%	0.472	71%	0.713	S	S	.	*	P	Polyproline II helix	trans	-71.5	145.5	174.3	58.1	0	0	0	0	110.4	Y653 Q654 I655	T651-Y653 PolarHBondContact O-N 3.43Å; T651-Q654 PolarHBondContact O-N 3.16Å; T651-Q654 WeakPolarHBondContact OG1-CG 3.37Å; T651-Q654 PolarHBondContact OG1-OE1 3.37Å; T651-I655 PolarHBondContact O-N 3.46Å
652	N	33.3	Very low	30.3	Very low	140 Å²	140	140.1 Å²	140.1	75%	0.749	72%	0.715	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.2	-13.4	176.3	-83.4	-19.9	0	0	0	114.2
653	Y	34.1	Very low	30.4	Very low	188 Å²	188	143.5 Å²	143.5	74%	0.737	72%	0.724	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.2	-35.4	173.7	-156.8	-93.4	0	0	0	112.2	T651 K656	T651-Y653 PolarHBondContact O-N 3.43Å; Y653-K656 PolarHBondContact O-N 3.31Å
654	Q	38.8	Very low	30.6	Very low	99 Å²	99	139.2 Å²	139.2	46%	0.463	72%	0.717	S	S	.	*	T	Hydrogen-bonded Turn	trans	-80.2	-22.3	177.1	-70.6	169.1	-40.9	0	0	113	L650 T651 K656	L650-Q654 HydrophobicContact CD2-CB 4.05Å; T651-Q654 PolarHBondContact O-N 3.16Å; T651-Q654 WeakPolarHBondContact OG1-CG 3.37Å; T651-Q654 PolarHBondContact OG1-OE1 3.37Å; Q654-K656 VanDerWaalsContact C-N 3.31Å
655	I	37.5	Very low	30.6	Very low	72 Å²	72	143.1 Å²	143.1	37%	0.369	72%	0.716	S	S	.	*	T	Hydrogen-bonded Turn	trans	-74.3	-25	170.7	-63.4	172.7	0	0	0	111.1	L650 T651 I659	L650-I655 HydrophobicContact CB-CD1 4.11Å; L650-I655 HydrophobicContact CB-CG1 4.01Å; T651-I655 PolarHBondContact O-N 3.46Å; I655-I659 HydrophobicContact CG2-CD1 3.93Å; I655-I659 WeakPolarHBondContact O-CD1 3.04Å; I655-I659 WeakPolarHBondContact O-CG1 3.4Å
656	K	32.7	Very low	30.7	Very low	170 Å²	170	140.5 Å²	140.5	74%	0.739	71%	0.707	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.7	-17.9	176.5	-112	176.5	176.6	179.2	0	114	Y653 Q654	Y653-K656 PolarHBondContact O-N 3.31Å; Q654-K656 VanDerWaalsContact C-N 3.31Å
657	E	31.4	Very low	30.7	Very low	139 Å²	139	143 Å²	143	65%	0.65	71%	0.707	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.1	-17.3	178.8	-130.8	176.2	-179.7	0	0	112.8	T660	E657-T660 PolarHBondContact O-OG1 2.62Å
658	Y	29.9	Very low	30.7	Very low	209 Å²	209	140.8 Å²	140.8	82%	0.82	71%	0.705	S	S	*	*	S	Bend	trans	-96.6	-6.8	-178.9	-132.1	-91.6	0	0	0	114.3
659	I	32.6	Very low	30.9	Very low	133 Å²	133	140.2 Å²	140.2	68%	0.682	70%	0.704	S	S	*	*	S	Bend	trans	-97.2	-0.1	-179.1	-66.8	174	0	0	0	111.5	I655	I655-I659 HydrophobicContact CG2-CD1 3.93Å; I655-I659 WeakPolarHBondContact O-CD1 3.04Å; I655-I659 WeakPolarHBondContact O-CG1 3.4Å
660	T	29.8	Very low	31	Very low	104 Å²	104	144.1 Å²	144.1	64%	0.638	71%	0.709	S	S	*	*	S	Bend	trans	-102.4	-2.4	-175.4	33.2	0	0	0	0	116.3	E657	E657-T660 PolarHBondContact O-OG1 2.62Å
661	D	27.6	Very low	30.8	Very low	131 Å²	131	145.2 Å²	145.2	70%	0.701	72%	0.716	S	S	*	*	S	Bend	trans	-129.5	127.7	176	-71.9	-39.7	0	0	0	110.6
662	N	29.8	Very low	30.2	Very low	157 Å²	157	147.9 Å²	147.9	84%	0.84	73%	0.727	S	S	*	*			trans	95.9	76.1	175.6	-47.5	-46.3	0	0	0	117.1
663	F	26.4	Very low	29.9	Very low	212 Å²	212	152.7 Å²	152.7	93%	0.93	74%	0.737	S	S	*	*			trans	-86.2	115.8	150.3	-94.5	-91	0	0	0	109.1
664	I	28.2	Very low	29.3	Very low	150 Å²	150	151 Å²	151	77%	0.769	74%	0.739	S	S	*	*			trans	-114.7	123.8	159.2	-65.4	176.6	0	0	0	107.2	I666	I664-I666 HydrophobicContact CG2-CG1 4.45Å
665	Q	24	Very low	28.5	Very low	155 Å²	155	153.4 Å²	153.4	72%	0.724	75%	0.754	S	S	*	*			trans	-83.5	125.6	-177.9	-173.2	-179.1	-0.7	0	0	109.3
666	I	27	Very low	27.8	Very low	155 Å²	155	157.7 Å²	157.7	80%	0.795	77%	0.772	S	S	*	*			trans	-134.7	127.7	166.9	-56.9	-179.1	0	0	0	108.4	I664	I664-I666 HydrophobicContact CG2-CG1 4.45Å
667	H	28.4	Very low	27.4	Very low	157 Å²	157	158.3 Å²	158.3	73%	0.727	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-69.8	142.4	179.8	-84.6	-101.4	0	0	0	112.6
668	E	27.3	Very low	27	Very low	190 Å²	190	157.1 Å²	157.1	89%	0.888	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-81.3	137.9	157.3	-91.1	173.9	156.4	0	0	109.9
669	P	33.6	Very low	26.7	Very low	121 Å²	121	157.2 Å²	157.2	79%	0.786	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-102.6	139.2	152.8	33	-22.2	0	0	0	110.9
670	D	28.7	Very low	26.4	Very low	149 Å²	149	157.9 Å²	157.9	80%	0.797	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-59.3	162.4	171.8	-67.3	-51.5	0	0	0	113.8
671	D	27.9	Very low	26.1	Very low	141 Å²	141	160.8 Å²	160.8	75%	0.754	79%	0.785	S	S	*	*	S	Bend	trans	70.1	120.6	156.7	-64.4	-25	0	0	0	119.6
672	N	25.6	Very low	26.1	Very low	134 Å²	134	163.8 Å²	163.8	72%	0.717	79%	0.792	S	S	*	*			trans	43.8	114.6	149.6	-65.8	-35	0	0	0	116.8
673	Y	26.8	Very low	26	Very low	241 Å²	241	165.2 Å²	165.2	95%	0.945	79%	0.791	S	S	*	*				179.6	138.2	129.1	-88.5	-63.9	0	0	0	111.3
674	I	22.3	Very low	26	Very low	152 Å²	152	162.4 Å²	162.4	78%	0.779	79%	0.786	S	S	*	*			trans	-73.5	129.4	171.2	-61.8	163.7	0	0	0	108.7
675	L	21.6	Very low	25.9	Very low	149 Å²	149	159.8 Å²	159.8	78%	0.78	78%	0.779	S	S	*	*			trans	160.8	130.6	135.1	-104.1	107.5	0	0	0	114.6
676	H	22.1	Very low	26.1	Very low	162 Å²	162	159.3 Å²	159.3	75%	0.75	78%	0.781	S	S	*	*			trans	35.9	122.4	142.2	-80.6	-73.9	0	0	0	125.1
677	K	24.2	Very low	26.1	Very low	183 Å²	183	160.1 Å²	160.1	80%	0.796	78%	0.782	S	S	*	*			trans	51.4	145.5	139.4	-99.6	-178.4	179.9	171.5	0	119.4
678	P	24.3	Very low	26.1	Very low	115 Å²	115	159 Å²	159	75%	0.747	79%	0.786	S	S	*	*				-152.1	167.7	57.8	35.7	-12.3	0	0	0	117.9
679	R	22.7	Very low	25.9	Very low	211 Å²	211	156.5 Å²	156.5	80%	0.796	78%	0.777	S	S	*	*			trans	-57.6	132.5	166.4	-74.9	171.2	166.5	165.2	-5.3	110.9
680	I	25.6	Very low	25.6	Very low	146 Å²	146	161.9 Å²	161.9	75%	0.749	78%	0.783	S	S	*	*			trans	-111.4	109.6	158.3	-63.2	175.3	0	0	0	107.9	F682	I680-F682 HydrophobicContact CG2-CD2 4.46Å; I680-F682 HydrophobicContact CG2-CE2 4.22Å
681	K	24.6	Very low	25.3	Very low	165 Å²	165	159.9 Å²	159.9	72%	0.717	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-90	127.9	165.9	-78.1	-179.8	172.2	-176.6	0	107.5
682	F	27.4	Very low	25.2	Very low	195 Å²	195	160.9 Å²	160.9	86%	0.855	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-83.3	120.1	158.2	-82.8	-81.8	0	0	0	108.9	I680	I680-F682 HydrophobicContact CG2-CD2 4.46Å; I680-F682 HydrophobicContact CG2-CE2 4.22Å
683	F	26.6	Very low	25	Very low	186 Å²	186	160.9 Å²	160.9	82%	0.816	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-65.9	137.7	173.4	-91.1	-98	0	0	0	110.6
684	N	26.4	Very low	25	Very low	154 Å²	154	156.2 Å²	156.2	82%	0.824	77%	0.773	S	S	*	*			trans	-118.5	122.9	148	-148.3	2.9	0	0	0	106.1	N686	N684-N686 PolarHBondContact O-N 3.39Å
685	P	26.7	Very low	25.1	Very low	94 Å²	94	153.1 Å²	153.1	61%	0.61	77%	0.765	S	S	*	*			trans	-84.4	116.2	-177.2	32.3	-27.5	0	0	0	108.5
686	N	28.1	Very low	25.2	Very low	146 Å²	146	154.6 Å²	154.6	78%	0.781	77%	0.765	S	S	*	*				178	129.8	126.1	-89.9	-20.8	0	0	0	111.3	N684	N684-N686 PolarHBondContact O-N 3.39Å
687	Q	28	Very low	25.5	Very low	172 Å²	172	153.5 Å²	153.5	80%	0.804	77%	0.765	S	S	*	*			trans	89.7	85.8	154.1	-67.7	173.2	-19.2	0	0	118.8
688	T	28.6	Very low	25.6	Very low	133 Å²	133	153.5 Å²	153.5	82%	0.816	77%	0.767	S	S	*	*				68.6	105.5	123.7	47.7	0	0	0	0	119.8
689	I	22.5	Very low	25.9	Very low	137 Å²	137	152.6 Å²	152.6	70%	0.703	76%	0.762	S	S	*	*			trans	-74.8	134.8	165.8	-65.3	162	0	0	0	109.8	T691	I689-T691 HydrophobicContact CG2-CG2 4.3Å
690	Y	27.3	Very low	26.1	Very low	234 Å²	234	150.3 Å²	150.3	92%	0.918	76%	0.76	S	S	*	*			trans	-136.5	112.1	135.4	-83.1	-76.2	0	0	0	108.4
691	T	22.2	Very low	26.1	Very low	107 Å²	107	149.6 Å²	149.6	66%	0.656	76%	0.757	S	S	*	*			trans	-87.7	140.8	162.9	42.8	0	0	0	0	108.7	I689	I689-T691 HydrophobicContact CG2-CG2 4.3Å
692	L	24.6	Very low	26.2	Very low	162 Å²	162	148.9 Å²	148.9	85%	0.848	76%	0.76	S	S	*	*				-171.2	148.2	120.1	-121.1	103	0	0	0	111.5
693	D	22.1	Very low	26.2	Very low	134 Å²	134	146.4 Å²	146.4	72%	0.717	76%	0.755	S	S	*	*			trans	-52.7	150.1	179.8	-60.4	-59.5	0	0	0	115.4
694	N	26.9	Very low	26	Very low	143 Å²	143	144.4 Å²	144.4	77%	0.765	75%	0.753	S	S	*	*				158.2	116.4	119	-86.4	-28.6	0	0	0	112
695	S	23.5	Very low	26	Very low	88 Å²	88	146.1 Å²	146.1	62%	0.615	76%	0.756	S	S	*	*				58	137.9	128.1	75.5	0	0	0	0	122.5
696	F	24.3	Very low	26	Very low	180 Å²	180	146.5 Å²	146.5	79%	0.789	76%	0.758	S	S	*	*			trans	92.5	121.2	148.6	-72.2	-72.5	0	0	0	120.7
697	N	28.4	Very low	25.8	Very low	139 Å²	139	147.2 Å²	147.2	74%	0.743	76%	0.762	S	S	*	*			trans	85	104.4	139.9	-62.6	-18	0	0	0	120.7
698	H	27.1	Very low	25.7	Very low	182 Å²	182	145.4 Å²	145.4	84%	0.843	76%	0.758	S	S	*	*				1.6	163.1	124.6	-87.4	-54.9	0	0	0	119.1
699	P	30.9	Very low	25.6	Very low	97 Å²	97	147.9 Å²	147.9	63%	0.63	76%	0.76	S	S	*	*			cis	-143.9	-167.3	-6.4	36.7	-13.6	0	0	0	115
700	E	26.7	Very low	25.7	Very low	162 Å²	162	150 Å²	150	76%	0.757	77%	0.765	S	S	*	*			trans	90	115.7	146	-81.3	177.2	-162.5	0	0	122.1
701	N	25.3	Very low	25.6	Very low	131 Å²	131	145.4 Å²	145.4	70%	0.701	76%	0.755	S	S	*	*				52.2	124.9	128.6	-64	-22.1	0	0	0	119.2
702	I	26.7	Very low	25.7	Very low	150 Å²	150	146 Å²	146	77%	0.769	75%	0.754	S	S	*	*				172.6	126	111.9	-90.6	158.9	0	0	0	112
703	L	26.4	Very low	25.8	Very low	144 Å²	144	146.9 Å²	146.9	75%	0.754	75%	0.747	S	S	*	*			trans	62.2	114.2	151.7	-87.4	71.4	0	0	0	119.6
704	N	24.1	Very low	26	Very low	144 Å²	144	146.6 Å²	146.6	77%	0.77	75%	0.745	S	S	*	*				57.8	104.6	81.1	-76.5	-12.2	0	0	0	113.6
705	Q	26.6	Very low	26.1	Very low	189 Å²	189	145.7 Å²	145.7	88%	0.883	74%	0.741	S	S	*	*				171.7	159.4	85.6	-110.9	-177.4	-20.2	0	0	110.3
706	P	26.6	Very low	26.2	Very low	102 Å²	102	146.7 Å²	146.7	66%	0.662	74%	0.739	S	S	*	*			trans	-93	156.2	-154.5	38	-36.6	0	0	0	112.6
707	N	24	Very low	26.5	Very low	161 Å²	161	144.4 Å²	144.4	86%	0.861	73%	0.734	S	S	*	*			trans	-171.9	99.1	149	-90.4	-21.8	0	0	0	108
708	N	25.9	Very low	26.5	Very low	135 Å²	135	143.4 Å²	143.4	72%	0.722	73%	0.729	S	S	*	*			trans	-131.2	96.6	161.4	-96.3	-14.3	0	0	0	108.1	F710	N708-F710 VanDerWaalsContact C-N 3.35Å; N708-F710 HydrophobicContact CB-CD2 3.92Å; N708-F710 HydrophobicContact CB-CE2 3.88Å; N708-F710 PolarHBondContact O-N 3.41Å; N708-F710 VanDerWaalsContact O-N 3.08Å
709	E	24.5	Very low	26.6	Very low	185 Å²	185	140.9 Å²	140.9	86%	0.864	72%	0.721	S	S	*	*			trans	-57.3	99.3	151.1	-70.4	178.9	148.3	0	0	107.8	I711	E709-I711 PolarHBondContact O-N 3.36Å
710	F	25.4	Very low	26.5	Very low	182 Å²	182	142.3 Å²	142.3	80%	0.798	72%	0.723	S	S	*	*			trans	-83.8	97.4	165.9	-93.3	-80.9	0	0	0	108.9	N708 N712	N708-F710 VanDerWaalsContact C-N 3.35Å; N708-F710 HydrophobicContact CB-CD2 3.92Å; N708-F710 HydrophobicContact CB-CE2 3.88Å; N708-F710 PolarHBondContact O-N 3.41Å; N708-F710 VanDerWaalsContact O-N 3.08Å; F710-N712 PolarHBondContact O-N 3.49Å
711	I	25.7	Very low	26.7	Very low	137 Å²	137	140.7 Å²	140.7	70%	0.703	72%	0.719	S	S	*	*			trans	-59.8	122.4	165.3	-67.9	172.6	0	0	0	108.6	E709 Y713	E709-I711 PolarHBondContact O-N 3.36Å; I711-Y713 PolarHBondContact O-N 3.42Å
712	N	24.7	Very low	26.8	Very low	118 Å²	118	143.8 Å²	143.8	63%	0.631	72%	0.723	S	S	*	*			trans	-59.5	105.1	-175.3	-166.8	-3.3	0	0	0	112.5	F710 N714	F710-N712 PolarHBondContact O-N 3.49Å; N712-N714 WeakPolarHBondContact OD1-CB 3.47Å; N712-N714 PolarHBondContact OD1-N 3.48Å
713	Y	25.8	Very low	26.8	Very low	182 Å²	182	146.7 Å²	146.7	71%	0.714	73%	0.726	S	S	*	*			trans	-93.9	25	174.3	-105.7	-83	0	0	0	113.7	I711 N715 L716	I711-Y713 PolarHBondContact O-N 3.42Å; Y713-N715 VanDerWaalsContact C-N 3.29Å; Y713-N715 PolarHBondContact O-N 3.17Å; Y713-L716 HydrophobicContact CD1-CB 4.35Å; Y713-L716 HydrophobicContact CE1-CD2 4.47Å
714	N	27.6	Very low	26.9	Very low	127 Å²	127	148.9 Å²	148.9	68%	0.679	73%	0.729	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.9	4.7	173.6	-78.2	-18	0	0	0	114.7	N712	N712-N714 WeakPolarHBondContact OD1-CB 3.47Å; N712-N714 PolarHBondContact OD1-N 3.48Å
715	N	27.8	Very low	27.1	Very low	124 Å²	124	146.8 Å²	146.8	66%	0.663	73%	0.726	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.7	6.1	179.7	-85.6	-17.5	0	0	0	115.5	Y713	Y713-N715 VanDerWaalsContact C-N 3.29Å; Y713-N715 PolarHBondContact O-N 3.17Å
716	L	26.7	Very low	27.1	Very low	110 Å²	110	146.2 Å²	146.2	58%	0.576	73%	0.725	S	S	*	*	S	Bend	trans	-106.1	-13.1	177.6	-133.1	89.5	0	0	0	114.8	Y713	Y713-L716 HydrophobicContact CD1-CB 4.35Å; Y713-L716 HydrophobicContact CE1-CD2 4.47Å
717	L	29.3	Very low	27.2	Very low	132 Å²	132	147.2 Å²	147.2	69%	0.691	73%	0.729	S	S	*	*	S	Bend	trans	-92.5	-15.4	177.9	-122.9	81.5	0	0	0	114.2
718	N	29.7	Very low	27.3	Very low	118 Å²	118	147 Å²	147	63%	0.631	73%	0.728	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.2	-11	176.7	-77.6	-22.8	0	0	0	114.2
719	N	27.7	Very low	27.4	Very low	128 Å²	128	148.2 Å²	148.2	68%	0.684	73%	0.729	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.4	-3	178.6	-78.4	-30.1	0	0	0	114.4
720	L	29.7	Very low	27.6	Very low	128 Å²	128	144.7 Å²	144.7	67%	0.67	72%	0.716	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.8	-12.8	177.6	-83.6	157	0	0	0	113.7
721	N	30.9	Very low	27.6	Very low	127 Å²	127	143.5 Å²	143.5	68%	0.679	72%	0.718	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.2	2.1	172.8	-76	-19.5	0	0	0	114
722	Y	27.5	Very low	27.6	Very low	196 Å²	196	142.4 Å²	142.4	77%	0.769	72%	0.717	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.7	-0.1	175.3	-141.2	-93.3	0	0	0	114
723	Y	26.4	Very low	27.5	Very low	212 Å²	212	142.9 Å²	142.9	83%	0.831	73%	0.725	S	S	*	*	S	Bend	trans	-110	13	179.7	-99.1	-82.9	0	0	0	114.4
724	K	28.4	Very low	27.5	Very low	190 Å²	190	143.4 Å²	143.4	83%	0.826	74%	0.736	S	S	*	*	S	Bend	trans	-120.5	12.8	-176.8	-130.1	177.6	-177.6	-177.6	0	115.1
725	S	28.1	Very low	27.5	Very low	100 Å²	100	142.4 Å²	142.4	70%	0.699	73%	0.734	S	S	*	*	S	Bend	trans	-120.3	14.4	177.5	64.2	0	0	0	0	114.5
726	M	26.1	Very low	27.5	Very low	177 Å²	177	140.6 Å²	140.6	87%	0.872	73%	0.728	S	S	*	*	S	Bend	trans	-112.6	15.2	-175.1	-120.9	-173.8	179.1	0	0	115.8
727	T	28.9	Very low	27.6	Very low	122 Å²	122	141.1 Å²	141.1	75%	0.748	74%	0.736	S	S	*	*	S	Bend	trans	-137	72.9	176.1	54.5	0	0	0	0	110.2
728	N	26.9	Very low	27.7	Very low	156 Å²	156	141.6 Å²	141.6	83%	0.834	74%	0.739	S	S	*	*	S	Bend	trans	-173.6	81.4	157.3	-96.6	-9.9	0	0	0	107.9
729	Q	27.8	Very low	27.7	Very low	161 Å²	161	143.3 Å²	143.3	75%	0.752	75%	0.747	S	S	*	*			trans	-179.2	133.2	152.2	-101.4	163.2	9.2	0	0	108.5
730	N	29.3	Very low	27.8	Very low	111 Å²	111	144.1 Å²	144.1	59%	0.594	75%	0.749	S	S	*	*			trans	83.7	97.5	167.8	-49.6	-26.9	0	0	0	116.3
731	L	25.7	Very low	27.7	Very low	158 Å²	158	148.1 Å²	148.1	83%	0.827	76%	0.762	S	S	*	*				80.8	97.7	83	-149.7	88.3	0	0	0	112.8
732	V	24.4	Very low	27.6	Very low	113 Å²	113	146.9 Å²	146.9	69%	0.685	76%	0.763	S	S	*	*			trans	68.3	133.4	133.7	178.8	0	0	0	0	119.4
733	T	22.6	Very low	27.8	Very low	129 Å²	129	146.9 Å²	146.9	79%	0.791	77%	0.767	S	S	*	*			trans	75.6	97.3	164	53.7	0	0	0	0	118.7
734	M	26.9	Very low	28	Very low	192 Å²	192	141.2 Å²	141.2	95%	0.946	76%	0.758	S	S	*	*				-164.6	143.9	119.5	-109.8	-168.9	172.1	0	0	113.5
735	T	26.8	Very low	28.3	Very low	106 Å²	106	141.5 Å²	141.5	65%	0.65	76%	0.76	S	S	*	*			trans	-78.4	135.1	-171.3	40.3	0	0	0	0	114.6
736	T	28.4	Very low	28.6	Very low	86 Å²	86	140.7 Å²	140.7	53%	0.528	75%	0.752	S	S	.	*			trans	57.2	123.3	138.1	60.6	0	0	0	0	121.8
737	T	28.6	Very low	29.1	Very low	121 Å²	121	140.1 Å²	140.1	74%	0.742	75%	0.753	S	S	*	*				141.4	119.6	129.9	51	0	0	0	0	107.6
738	N	30.8	Very low	29.2	Very low	142 Å²	142	141.2 Å²	141.2	76%	0.759	75%	0.753	S	S	*	*				-179.6	153.4	51.7	-109.5	-20.6	0	0	0	112.1
739	I	30.7	Very low	29.3	Very low	154 Å²	154	142.3 Å²	142.3	79%	0.79	75%	0.751	S	S	*	*			trans	90.5	93.3	149.8	-57.3	154.3	0	0	0	119.9
740	I	28	Very low	29.4	Very low	145 Å²	145	140.3 Å²	140.3	74%	0.744	76%	0.755	S	S	*	*			trans	-32.4	137.1	149	-63.2	152.9	0	0	0	115.7
741	K	29.4	Very low	29.5	Very low	213 Å²	213	142.4 Å²	142.4	93%	0.926	77%	0.765	S	S	*	*				-148.2	107.1	127.3	-107	180	-174.8	177.7	0	110.5
742	S	27.5	Very low	29.6	Very low	101 Å²	101	147 Å²	147	71%	0.706	78%	0.782	S	S	*	*			trans	-76.5	145.5	170.9	53.2	0	0	0	0	111.9
743	K	32	Very low	29.9	Very low	195 Å²	195	148.7 Å²	148.7	85%	0.848	79%	0.787	S	S	*	*			trans	-148.8	105.9	136.6	-103	-178.1	-177.3	-176.7	0	109.8
744	S	31.4	Very low	30.3	Very low	94 Å²	94	149.7 Å²	149.7	66%	0.657	79%	0.786	S	S	*	*			trans	-23.1	158.9	147.1	57	0	0	0	0	117
745	F	34	Very low	30.5	Very low	195 Å²	195	147.4 Å²	147.4	86%	0.855	78%	0.777	S	S	*	*			cis	-173.7	-169.9	31.2	-128.4	-49.7	0	0	0	107.9
746	P	34.7	Very low	30.7	Very low	84 Å²	84	149.8 Å²	149.8	55%	0.545	79%	0.785	S	S	.	*				-93.6	174.1	-117.8	35.5	-13.8	0	0	0	116.1
747	D	35.3	Very low	30.8	Very low	165 Å²	165	153.8 Å²	153.8	88%	0.882	80%	0.801	S	S	*	*				-156.5	135.1	122.6	-97.2	-23.6	0	0	0	112.4
748	L	31.3	Very low	31	Very low	144 Å²	144	156 Å²	156	75%	0.754	81%	0.805	S	S	*	*			trans	-78.9	143.4	-177.6	-97.3	89.3	0	0	0	111.1
749	F	28.9	Very low	31	Very low	180 Å²	180	157 Å²	157	79%	0.789	81%	0.808	S	S	*	*			trans	23.4	115.8	134.4	-76	-89.8	0	0	0	118.3	L751	F749-L751 HydrophobicContact CD1-CD1 4.2Å
750	S	30.7	Very low	31	Very low	118 Å²	118	157.2 Å²	157.2	83%	0.825	81%	0.81	S	S	*	*				-137.7	121.1	120.8	77.9	0	0	0	0	109.8	H752	S750-H752 PolarHBondContact O-N 3.39Å
751	L	30.9	Very low	31.2	Very low	156 Å²	156	158.3 Å²	158.3	82%	0.817	82%	0.815	S	S	*	*			trans	-56.2	122.1	163.3	-79.2	104.8	0	0	0	109.6	F749	F749-L751 HydrophobicContact CD1-CD1 4.2Å
752	H	28.9	Very low	31.4	Very low	254 Å²	254	153.3 Å²	153.3	100%	1.176	81%	0.805	S	S	*	*				-153.7	0	125.8	-140.3	-42.9	0	0	0	111.2	S750	S750-H752 PolarHBondContact O-N 3.39Å

Retrieved 752 of 752 residues in 717.7 ms (Link to these results)

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