A0A5K4FC70_SCHMA Loading...

Spindle pole body component

AlphaFold DB , UniProt , Accession A0A5K4FC70, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 495 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	42.7	Very low	39.5	Very low	210 Å²	210	123.3 Å²	123.3	100%	1.034	65%	0.645	S	S	*	*				0	-48.5	0	-146	163.4	164.2	0	0	111.6	E3 M4	M1-E3 PolarHBondContact O-N 3.49Å; M1-M4 PolarHBondContact O-N 2.72Å
2	G	40.6	Very low	39.5	Very low	51 Å²	51	120.9 Å²	120.9	53%	0.526	64%	0.64	S	S	.	*	H	α-helix	trans	-66.8	-25	178.4	0	0	0	0	0	117.4	M4 K6	G2-M4 VanDerWaalsContact C-N 3.34Å; G2-K6 PolarHBondContact O-N 3.06Å
3	E	34.6	Very low	39.3	Very low	173 Å²	173	117.7 Å²	117.7	81%	0.808	62%	0.623	S	S	*	*	H	α-helix	trans	-73	-27.8	174.6	-71.1	-171.6	156.5	0	0	112.9	M1 A7	M1-E3 PolarHBondContact O-N 3.49Å; E3-A7 PolarHBondContact O-N 2.74Å; E3-A7 VanDerWaalsContact O-N 3.08Å
4	M	38.6	Very low	39.6	Very low	149 Å²	149	113.5 Å²	113.5	73%	0.734	61%	0.606	S	S	*	*	H	α-helix	trans	-74.1	-33.9	179.7	-150.1	172.2	-177.7	0	0	111.2	M1 G2 A7 V8	M1-M4 PolarHBondContact O-N 2.72Å; G2-M4 VanDerWaalsContact C-N 3.34Å; M4-A7 PolarHBondContact O-N 2.76Å; M4-V8 WeakPolarHBondContact O-CG2 3.32Å; M4-V8 PolarHBondContact O-N 2.92Å
5	E	41.3	Very low	39.5	Very low	141 Å²	141	112.3 Å²	112.3	66%	0.659	60%	0.599	S	S	*	*	H	α-helix	trans	-68.7	-37.5	173.7	-75.3	179.4	157	0	0	112.8	V8 S9	E5-V8 PolarHBondContact O-N 3.27Å; E5-S9 PolarHBondContact O-N 3.43Å
6	K	39.2	Very low	39.6	Very low	157 Å²	157	111.1 Å²	111.1	68%	0.683	59%	0.588	S	S	*	*	H	α-helix	trans	-66.6	-36.1	172.7	-85.5	-174.1	175.6	-178.8	0	112.7	G2 S9 L10	G2-K6 PolarHBondContact O-N 3.06Å; K6-S9 PolarHBondContact O-OG 3.09Å; K6-L10 PolarHBondContact O-N 2.91Å
7	A	39.4	Very low	40	Very low	34 Å²	34	109.1 Å²	109.1	28%	0.281	58%	0.584	S	S	.	*	H	α-helix	trans	-64.7	-47.7	172.6	0	0	0	0	0	110.4	E3 M4 S9 L10 F11	E3-A7 PolarHBondContact O-N 2.74Å; E3-A7 VanDerWaalsContact O-N 3.08Å; M4-A7 PolarHBondContact O-N 2.76Å; A7-S9 VanDerWaalsContact C-N 3.3Å; A7-S9 PolarHBondContact O-N 2.84Å; A7-L10 WeakPolarHBondContact O-CB 3.12Å; A7-L10 PolarHBondContact O-N 3.05Å; A7-L10 VanDerWaalsContact O-N 3.1Å; A7-F11 HydrophobicContact CB-CD2 4.29Å; A7-F11 HydrophobicContact CB-CE2 3.94Å; A7-F11 WeakPolarHBondContact O-CD2 3.28Å; A7-F11 WeakPolarHBondContact O-CG 3.49Å; A7-F11 PolarHBondContact O-N 3.5Å; A7-F11 VanDerWaalsContact O-N 3.09Å
8	V	39.8	Very low	40.1	Very low	82 Å²	82	108 Å²	108	50%	0.497	58%	0.578	S	S	.	*	H	α-helix	trans	-62	-33.6	179.7	172.2	0	0	0	0	112.9	M4 E5 F11 T12	M4-V8 WeakPolarHBondContact O-CG2 3.32Å; M4-V8 PolarHBondContact O-N 2.92Å; E5-V8 PolarHBondContact O-N 3.27Å; V8-F11 PolarHBondContact O-N 3.31Å; V8-T12 HydrophobicContact CG1-CG2 4.5Å; V8-T12 PolarHBondContact O-N 2.9Å; V8-T12 PolarHBondContact O-OG1 3.05Å
9	S	41.2	Very low	40.4	Very low	77 Å²	77	109 Å²	109	54%	0.538	58%	0.576	S	S	.	*	H	α-helix	trans	-68.4	-33.7	174.6	67.3	0	0	0	0	113.2	E5 K6 A7 F11 T12	E5-S9 PolarHBondContact O-N 3.43Å; K6-S9 PolarHBondContact O-OG 3.09Å; A7-S9 VanDerWaalsContact C-N 3.3Å; A7-S9 PolarHBondContact O-N 2.84Å; S9-F11 VanDerWaalsContact C-N 3.32Å; S9-T12 PolarHBondContact O-OG1 3.49Å
10	L	35.5	Very low	40.7	Very low	113 Å²	113	109.1 Å²	109.1	59%	0.592	57%	0.573	S	S	*	*	H	α-helix	trans	-67.5	-30.9	169.7	-86.2	151.8	0	0	0	112.3	K6 A7 F16	K6-L10 PolarHBondContact O-N 2.91Å; A7-L10 WeakPolarHBondContact O-CB 3.12Å; A7-L10 PolarHBondContact O-N 3.05Å; A7-L10 VanDerWaalsContact O-N 3.1Å; L10-F16 HydrophobicContact CD2-CD1 4.46Å; L10-F16 HydrophobicContact CD2-CE1 4.25Å
11	F	41.2	Very low	40.9	Very low	169 Å²	169	109.4 Å²	109.4	74%	0.741	58%	0.575	S	S	*	*	H	α-helix	trans	-85.5	-15.4	-175	-72.1	-60.2	0	0	0	115.6	A7 V8 S9	A7-F11 HydrophobicContact CB-CD2 4.29Å; A7-F11 HydrophobicContact CB-CE2 3.94Å; A7-F11 WeakPolarHBondContact O-CD2 3.28Å; A7-F11 WeakPolarHBondContact O-CG 3.49Å; A7-F11 PolarHBondContact O-N 3.5Å; A7-F11 VanDerWaalsContact O-N 3.09Å; V8-F11 PolarHBondContact O-N 3.31Å; S9-F11 VanDerWaalsContact C-N 3.32Å
12	T	39.6	Very low	41	Very low	95 Å²	95	104 Å²	104	58%	0.583	55%	0.549	S	S	*	.	S	Bend	trans	-86.1	-10.1	-175.6	40.2	0	0	0	0	114.5	V8 S9	V8-T12 HydrophobicContact CG1-CG2 4.5Å; V8-T12 PolarHBondContact O-N 2.9Å; V8-T12 PolarHBondContact O-OG1 3.05Å; S9-T12 PolarHBondContact O-OG1 3.49Å
13	N	37.3	Very low	41.4	Very low	79 Å²	79	105.2 Å²	105.2	42%	0.422	54%	0.544	S	S	.	.			trans	-131.2	89.9	-172.5	-149.8	-4.8	0	0	0	113.6	D15 F16	N13-D15 PolarHBondContact O-N 2.75Å; N13-D15 WeakPolarHBondContact OD1-CB 3.31Å; N13-F16 HydrophobicContact CB-CB 4.21Å; N13-F16 WeakPolarHBondContact O-CA 3.32Å; N13-F16 WeakPolarHBondContact O-CB 3.38Å; N13-F16 PolarHBondContact O-N 2.87Å
14	P	43.1	Very low	42	Very low	59 Å²	59	99.9 Å²	99.9	38%	0.383	53%	0.525	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-19.3	174.2	26.3	-33	0	0	0	113.2	F16 S17 K452	P14-F16 PolarHBondContact O-N 2.64Å; P14-S17 PolarHBondContact O-OG 3.37Å; P14-K452 HydrophobicContact CG-CD 4.01Å; P14-K452 HydrophobicContact CG-CG 4.31Å
15	D	38.8	Very low	42.3	Very low	95 Å²	95	97.5 Å²	97.5	51%	0.508	52%	0.515	S	S	.	.	H	α-helix	trans	-60.5	-21.4	166.4	-70.9	-18.9	0	0	0	111.4	N13 K19	N13-D15 PolarHBondContact O-N 2.75Å; N13-D15 WeakPolarHBondContact OD1-CB 3.31Å; D15-K19 WeakPolarHBondContact O-CA 3.37Å; D15-K19 WeakPolarHBondContact O-CB 3.45Å; D15-K19 VanDerWaalsContact O-CG 3.31Å; D15-K19 WeakPolarHBondContact O-CG 3.38Å; D15-K19 PolarHBondContact O-N 3.28Å
16	F	40.2	Very low	42.5	Very low	94 Å²	94	96.4 Å²	96.4	41%	0.412	51%	0.506	S	S	.	.	H	α-helix	trans	-70.5	-41	-177.2	-161.3	-94.8	0	0	0	112.6	L10 N13 P14 E20	L10-F16 HydrophobicContact CD2-CD1 4.46Å; L10-F16 HydrophobicContact CD2-CE1 4.25Å; N13-F16 HydrophobicContact CB-CB 4.21Å; N13-F16 WeakPolarHBondContact O-CA 3.32Å; N13-F16 WeakPolarHBondContact O-CB 3.38Å; N13-F16 PolarHBondContact O-N 2.87Å; P14-F16 PolarHBondContact O-N 2.64Å; F16-E20 HydrophobicContact CD1-CG 4.28Å; F16-E20 VanDerWaalsContact CE1-CD 3.44Å; F16-E20 HydrophobicContact CE1-CG 4.09Å; F16-E20 VanDerWaalsContact CE1-OE1 3.25Å; F16-E20 WeakPolarHBondContact CE1-OE1 3.21Å; F16-E20 VanDerWaalsContact O-CB 3.27Å; F16-E20 WeakPolarHBondContact O-CB 3.46Å; F16-E20 WeakPolarHBondContact O-CG 3.44Å; F16-E20 PolarHBondContact O-N 2.86Å
17	S	46.9	Very low	42.9	Very low	76 Å²	76	94 Å²	94	53%	0.531	50%	0.499	S	S	.	.	H	α-helix	trans	-79.4	-37.8	-178.4	64	0	0	0	0	112.8	P14 E20 L21	P14-S17 PolarHBondContact O-OG 3.37Å; S17-E20 PolarHBondContact O-N 3.1Å; S17-L21 WeakPolarHBondContact O-CB 3.44Å; S17-L21 PolarHBondContact O-N 3.16Å
18	I	41.6	Very low	43.1	Very low	90 Å²	90	96 Å²	96	46%	0.462	51%	0.506	S	S	.	.	H	α-helix	trans	-70.8	-40	172.3	-64.8	175.6	0	0	0	109.9	L21 I22	I18-L21 PolarHBondContact O-N 2.7Å; I18-I22 HydrophobicContact CG2-CD1 3.51Å; I18-I22 HydrophobicContact CG2-CG1 4.1Å; I18-I22 WeakPolarHBondContact O-CB 3.43Å; I18-I22 WeakPolarHBondContact O-CG1 3.31Å; I18-I22 PolarHBondContact O-N 3.14Å
19	K	45.2	Very low	43.1	Very low	127 Å²	127	95 Å²	95	55%	0.552	50%	0.5	S	S	*	.	H	α-helix	trans	-63.9	-37.1	169.1	-88.5	179.4	165	168.8	0	112.1	D15 N23	D15-K19 WeakPolarHBondContact O-CA 3.37Å; D15-K19 WeakPolarHBondContact O-CB 3.45Å; D15-K19 VanDerWaalsContact O-CG 3.31Å; D15-K19 WeakPolarHBondContact O-CG 3.38Å; D15-K19 PolarHBondContact O-N 3.28Å; K19-N23 VanDerWaalsContact O-CA 3.25Å; K19-N23 WeakPolarHBondContact O-CA 3.33Å; K19-N23 WeakPolarHBondContact O-CB 3.28Å; K19-N23 PolarHBondContact O-N 3Å; K19-N23 PolarHBondContact O-ND2 3.03Å
20	E	47.4	Very low	43.1	Very low	110 Å²	110	93.5 Å²	93.5	51%	0.514	49%	0.485	S	S	.	.	H	α-helix	trans	-68.5	-40.6	177.9	-90	-172.1	156.1	0	0	111.2	F16 S17 N23 S24	F16-E20 HydrophobicContact CD1-CG 4.28Å; F16-E20 VanDerWaalsContact CE1-CD 3.44Å; F16-E20 HydrophobicContact CE1-CG 4.09Å; F16-E20 VanDerWaalsContact CE1-OE1 3.25Å; F16-E20 WeakPolarHBondContact CE1-OE1 3.21Å; F16-E20 VanDerWaalsContact O-CB 3.27Å; F16-E20 WeakPolarHBondContact O-CB 3.46Å; F16-E20 WeakPolarHBondContact O-CG 3.44Å; F16-E20 PolarHBondContact O-N 2.86Å; S17-E20 PolarHBondContact O-N 3.1Å; E20-N23 PolarHBondContact O-N 2.73Å; E20-S24 WeakPolarHBondContact O-CA 3.44Å; E20-S24 WeakPolarHBondContact O-CB 3.28Å; E20-S24 PolarHBondContact O-N 3.13Å
21	L	45.1	Very low	43.4	Very low	116 Å²	116	92.6 Å²	92.6	61%	0.607	48%	0.479	S	S	*	.	H	α-helix	trans	-68.1	-47.2	175.5	-167.6	84.4	0	0	0	111.2	S17 I18 N23 S24 L25	S17-L21 WeakPolarHBondContact O-CB 3.44Å; S17-L21 PolarHBondContact O-N 3.16Å; I18-L21 PolarHBondContact O-N 2.7Å; L21-N23 VanDerWaalsContact C-N 3.33Å; L21-S24 PolarHBondContact O-N 3.34Å; L21-L25 HydrophobicContact CD2-CD1 4.45Å; L21-L25 HydrophobicContact CG-CD1 4.2Å; L21-L25 VanDerWaalsContact O-CB 3.3Å; L21-L25 WeakPolarHBondContact O-CB 3.4Å; L21-L25 VanDerWaalsContact O-CG 3.32Å; L21-L25 WeakPolarHBondContact O-CG 3.49Å; L21-L25 PolarHBondContact O-N 3.35Å
22	I	45.4	Very low	43.2	Very low	98 Å²	98	88.6 Å²	88.6	50%	0.503	47%	0.465	S	S	.	.	H	α-helix	trans	-64.4	-38.9	175	-68	175.9	0	0	0	110	I18 L25 Y26	I18-I22 HydrophobicContact CG2-CD1 3.51Å; I18-I22 HydrophobicContact CG2-CG1 4.1Å; I18-I22 WeakPolarHBondContact O-CB 3.43Å; I18-I22 WeakPolarHBondContact O-CG1 3.31Å; I18-I22 PolarHBondContact O-N 3.14Å; I22-L25 CarbonylContact O-C 3.54Å; I22-Y26 VanDerWaalsContact O-CA 3.31Å; I22-Y26 WeakPolarHBondContact O-CA 3.4Å; I22-Y26 WeakPolarHBondContact O-CB 3.34Å; I22-Y26 PolarHBondContact O-N 3.42Å
23	N	48.2	Very low	42.9	Very low	76 Å²	76	89.7 Å²	89.7	41%	0.406	46%	0.458	S	S	.	.	H	α-helix	trans	-71.4	-35.3	176.7	-77	-20.2	0	0	0	110.9	K19 E20 L21 Y26 L27	K19-N23 VanDerWaalsContact O-CA 3.25Å; K19-N23 WeakPolarHBondContact O-CA 3.33Å; K19-N23 WeakPolarHBondContact O-CB 3.28Å; K19-N23 PolarHBondContact O-N 3Å; K19-N23 PolarHBondContact O-ND2 3.03Å; E20-N23 PolarHBondContact O-N 2.73Å; L21-N23 VanDerWaalsContact C-N 3.33Å; N23-Y26 CarbonylContact O-C 3.59Å; N23-Y26 PolarHBondContact O-N 2.85Å; N23-L27 WeakPolarHBondContact O-CA 3.38Å; N23-L27 WeakPolarHBondContact O-CB 3.47Å; N23-L27 WeakPolarHBondContact O-CD1 3.25Å; N23-L27 WeakPolarHBondContact O-CG 3.39Å; N23-L27 PolarHBondContact O-N 3.48Å
24	S	46.3	Very low	43.1	Very low	60 Å²	60	93 Å²	93	42%	0.42	47%	0.471	S	S	.	.	H	α-helix	trans	-67.5	-49.6	174.6	-172.7	0	0	0	0	109	E20 L21 Y26 L27 D28	E20-S24 WeakPolarHBondContact O-CA 3.44Å; E20-S24 WeakPolarHBondContact O-CB 3.28Å; E20-S24 PolarHBondContact O-N 3.13Å; L21-S24 PolarHBondContact O-N 3.34Å; S24-Y26 VanDerWaalsContact C-N 3.28Å; S24-Y26 PolarHBondContact O-N 2.79Å; S24-L27 PolarHBondContact O-N 2.77Å; S24-D28 VanDerWaalsContact O-CB 3.31Å; S24-D28 WeakPolarHBondContact O-CB 2.97Å; S24-D28 PolarHBondContact O-N 3.31Å
25	L	44.5	Very low	42.8	Very low	100 Å²	100	92.7 Å²	92.7	52%	0.524	47%	0.47	S	S	.	.	H	α-helix	trans	-62.6	-35.8	174.3	-72.8	169.7	0	0	0	111.7	L21 I22 T29	L21-L25 HydrophobicContact CD2-CD1 4.45Å; L21-L25 HydrophobicContact CG-CD1 4.2Å; L21-L25 VanDerWaalsContact O-CB 3.3Å; L21-L25 WeakPolarHBondContact O-CB 3.4Å; L21-L25 VanDerWaalsContact O-CG 3.32Å; L21-L25 WeakPolarHBondContact O-CG 3.49Å; L21-L25 PolarHBondContact O-N 3.35Å; I22-L25 CarbonylContact O-C 3.54Å; L25-T29 WeakPolarHBondContact O-CA 3.45Å; L25-T29 WeakPolarHBondContact O-CB 3.44Å; L25-T29 PolarHBondContact O-N 3.41Å; L25-T29 PolarHBondContact O-OG1 3Å
26	Y	47.5	Very low	42.5	Very low	118 Å²	118	93.6 Å²	93.6	46%	0.463	47%	0.469	S	S	.	.	H	α-helix	trans	-78.2	-28.8	177.6	179.6	-103.3	0	0	0	111.9	I22 N23 S24 T29 L30	I22-Y26 VanDerWaalsContact O-CA 3.31Å; I22-Y26 WeakPolarHBondContact O-CA 3.4Å; I22-Y26 WeakPolarHBondContact O-CB 3.34Å; I22-Y26 PolarHBondContact O-N 3.42Å; N23-Y26 CarbonylContact O-C 3.59Å; N23-Y26 PolarHBondContact O-N 2.85Å; S24-Y26 VanDerWaalsContact C-N 3.28Å; S24-Y26 PolarHBondContact O-N 2.79Å; Y26-T29 CarbonylContact O-C 3.53Å; Y26-L30 HydrophobicContact CD1-CD1 3.6Å; Y26-L30 HydrophobicContact CD1-CG 3.97Å; Y26-L30 HydrophobicContact CE1-CD1 3.12Å; Y26-L30 HydrophobicContact CE1-CD2 4.33Å; Y26-L30 HydrophobicContact CE1-CG 3.6Å; Y26-L30 HydrophobicContact CE2-CG 4.16Å; Y26-L30 HydrophobicContact CG-CD1 4.49Å; Y26-L30 HydrophobicContact CG-CG 4.41Å; Y26-L30 WeakPolarHBondContact O-CA 3.46Å; Y26-L30 WeakPolarHBondContact O-CB 3.13Å; Y26-L30 VanDerWaalsContact O-CG 3.22Å; Y26-L30 WeakPolarHBondContact O-CG 3.05Å; Y26-L30 PolarHBondContact O-N 3.16Å
27	L	46.8	Very low	41.9	Very low	105 Å²	105	94.9 Å²	94.9	55%	0.55	48%	0.477	S	S	.	.	H	α-helix	trans	-74.4	-43.7	171.4	-79.7	167.4	0	0	0	109.3	N23 S24 T29 L30 M31	N23-L27 WeakPolarHBondContact O-CA 3.38Å; N23-L27 WeakPolarHBondContact O-CB 3.47Å; N23-L27 WeakPolarHBondContact O-CD1 3.25Å; N23-L27 WeakPolarHBondContact O-CG 3.39Å; N23-L27 PolarHBondContact O-N 3.48Å; S24-L27 PolarHBondContact O-N 2.77Å; L27-T29 VanDerWaalsContact C-N 3.3Å; L27-T29 PolarHBondContact O-N 3.31Å; L27-L30 CarbonylContact O-C 3.59Å; L27-L30 PolarHBondContact O-N 2.72Å; L27-M31 WeakPolarHBondContact O-CA 3.25Å; L27-M31 WeakPolarHBondContact O-CB 3.49Å; L27-M31 PolarHBondContact O-N 2.74Å
28	D	42.9	Very low	41	Very low	77 Å²	77	93.1 Å²	93.1	41%	0.412	47%	0.471	S	S	.	.	H	α-helix	trans	-61.4	-43.7	171.3	-69.4	-24.2	0	0	0	109.5	S24 M31 I32	S24-D28 VanDerWaalsContact O-CB 3.31Å; S24-D28 WeakPolarHBondContact O-CB 2.97Å; S24-D28 PolarHBondContact O-N 3.31Å; D28-M31 PolarHBondContact O-N 3.18Å; D28-I32 VanDerWaalsContact O-CB 3.23Å; D28-I32 WeakPolarHBondContact O-CB 3.34Å; D28-I32 WeakPolarHBondContact O-CD1 3.22Å; D28-I32 WeakPolarHBondContact O-CG1 3.29Å; D28-I32 PolarHBondContact O-N 3.35Å
29	T	40	Very low	40.1	Very low	60 Å²	60	95.4 Å²	95.4	37%	0.368	49%	0.489	S	S	.	.	H	α-helix	trans	-70.5	-35.3	175.5	-57.1	0	0	0	0	112	L25 Y26 L27 I32 R33	L25-T29 WeakPolarHBondContact O-CA 3.45Å; L25-T29 WeakPolarHBondContact O-CB 3.44Å; L25-T29 PolarHBondContact O-N 3.41Å; L25-T29 PolarHBondContact O-OG1 3Å; Y26-T29 CarbonylContact O-C 3.53Å; L27-T29 VanDerWaalsContact C-N 3.3Å; L27-T29 PolarHBondContact O-N 3.31Å; T29-I32 CarbonylContact O-C 3.54Å; T29-R33 HydrophobicContact CG2-CG 4.1Å; T29-R33 WeakPolarHBondContact O-CA 2.94Å; T29-R33 WeakPolarHBondContact O-CB 3.07Å; T29-R33 WeakPolarHBondContact O-CG 3.43Å; T29-R33 PolarHBondContact O-N 2.74Å
30	L	42.2	Very low	39.3	Very low	46 Å²	46	95.1 Å²	95.1	24%	0.241	49%	0.488	C	S	.	.	H	α-helix	trans	-70.7	-36.2	174.6	-91.5	177.3	0	0	0	110.1	Y26 L27 R33 Q34	Y26-L30 HydrophobicContact CD1-CD1 3.6Å; Y26-L30 HydrophobicContact CD1-CG 3.97Å; Y26-L30 HydrophobicContact CE1-CD1 3.12Å; Y26-L30 HydrophobicContact CE1-CD2 4.33Å; Y26-L30 HydrophobicContact CE1-CG 3.6Å; Y26-L30 HydrophobicContact CE2-CG 4.16Å; Y26-L30 HydrophobicContact CG-CD1 4.49Å; Y26-L30 HydrophobicContact CG-CG 4.41Å; Y26-L30 WeakPolarHBondContact O-CA 3.46Å; Y26-L30 WeakPolarHBondContact O-CB 3.13Å; Y26-L30 VanDerWaalsContact O-CG 3.22Å; Y26-L30 WeakPolarHBondContact O-CG 3.05Å; Y26-L30 PolarHBondContact O-N 3.16Å; L27-L30 CarbonylContact O-C 3.59Å; L27-L30 PolarHBondContact O-N 2.72Å; L30-R33 CarbonylContact O-C 3.6Å; L30-R33 PolarHBondContact O-N 3.32Å; L30-Q34 WeakPolarHBondContact O-CA 2.98Å; L30-Q34 WeakPolarHBondContact O-CB 3.17Å; L30-Q34 WeakPolarHBondContact O-CG 3.27Å; L30-Q34 PolarHBondContact O-N 2.89Å
31	M	41.3	Very low	38.2	Very low	94 Å²	94	95.6 Å²	95.6	46%	0.463	49%	0.493	S	S	.	.	H	α-helix	trans	-72.4	-43.4	177.9	-157.9	-98.9	-72.1	0	0	108.6	L27 D28 Q34 C35	L27-M31 WeakPolarHBondContact O-CA 3.25Å; L27-M31 WeakPolarHBondContact O-CB 3.49Å; L27-M31 PolarHBondContact O-N 2.74Å; D28-M31 PolarHBondContact O-N 3.18Å; M31-Q34 PolarHBondContact O-N 3.17Å; M31-C35 WeakPolarHBondContact O-CB 3.43Å; M31-C35 PolarHBondContact O-N 3.37Å; M31-C35 PolarHBondContact O-SG 2.78Å
32	I	36.6	Very low	37.2	Very low	86 Å²	86	97.5 Å²	97.5	44%	0.441	50%	0.503	S	S	.	.	H	α-helix	trans	-58.6	-49.6	167.4	-68.7	164.8	0	0	0	110.1	D28 T29 Q34 C35 F36	D28-I32 VanDerWaalsContact O-CB 3.23Å; D28-I32 WeakPolarHBondContact O-CB 3.34Å; D28-I32 WeakPolarHBondContact O-CD1 3.22Å; D28-I32 WeakPolarHBondContact O-CG1 3.29Å; D28-I32 PolarHBondContact O-N 3.35Å; T29-I32 CarbonylContact O-C 3.54Å; I32-Q34 PolarHBondContact O-N 3.18Å; I32-C35 CarbonylContact O-C 3.57Å; I32-C35 PolarHBondContact O-N 2.82Å; I32-F36 HydrophobicContact CB-CD2 4.29Å; I32-F36 HydrophobicContact CG2-CD2 3.72Å; I32-F36 HydrophobicContact CG2-CE2 4.34Å; I32-F36 WeakPolarHBondContact O-CA 3.18Å; I32-F36 WeakPolarHBondContact O-CB 3.45Å; I32-F36 WeakPolarHBondContact O-CD2 3.18Å; I32-F36 PolarHBondContact O-N 2.88Å
33	R	34.4	Very low	36.3	Very low	118 Å²	118	99.1 Å²	99.1	45%	0.445	51%	0.512	S	S	.	.	H	α-helix	trans	-67.3	-31.5	178.1	-76.2	-177.4	160.4	-174.5	-6.3	112.9	T29 L30 Q37 G38	T29-R33 HydrophobicContact CG2-CG 4.1Å; T29-R33 WeakPolarHBondContact O-CA 2.94Å; T29-R33 WeakPolarHBondContact O-CB 3.07Å; T29-R33 WeakPolarHBondContact O-CG 3.43Å; T29-R33 PolarHBondContact O-N 2.74Å; L30-R33 CarbonylContact O-C 3.6Å; L30-R33 PolarHBondContact O-N 3.32Å; R33-Q37 HydrophobicContact CB-CB 4.11Å; R33-Q37 HydrophobicContact CB-CG 4.15Å; R33-Q37 HydrophobicContact CG-CB 4.43Å; R33-Q37 HydrophobicContact CG-CG 3.94Å; R33-Q37 VanDerWaalsContact NE-OE1 3.16Å; R33-Q37 CarbonylContact O-C 3.49Å; R33-Q37 VanDerWaalsContact O-C 3.24Å; R33-Q37 WeakPolarHBondContact O-CA 3.45Å; R33-Q37 WeakPolarHBondContact O-CB 3.29Å; R33-Q37 PolarHBondContact O-N 2.79Å; R33-G38 PolarHBondContact O-N 2.82Å
34	Q	40.1	Very low	35.1	Very low	149 Å²	149	102.2 Å²	102.2	70%	0.696	53%	0.528	S	S	*	.	H	α-helix	trans	-76.2	-34.2	174.6	-77.4	175	-4.6	0	0	110.3	L30 M31 I32	L30-Q34 WeakPolarHBondContact O-CA 2.98Å; L30-Q34 WeakPolarHBondContact O-CB 3.17Å; L30-Q34 WeakPolarHBondContact O-CG 3.27Å; L30-Q34 PolarHBondContact O-N 2.89Å; M31-Q34 PolarHBondContact O-N 3.17Å; I32-Q34 PolarHBondContact O-N 3.18Å
35	C	36.6	Very low	34.1	Very low	51 Å²	51	105.7 Å²	105.7	35%	0.345	54%	0.542	S	S	.	.	H	α-helix	trans	-74.9	-29	173.2	-69.1	0	0	0	0	113.4	M31 I32	M31-C35 WeakPolarHBondContact O-CB 3.43Å; M31-C35 PolarHBondContact O-N 3.37Å; M31-C35 PolarHBondContact O-SG 2.78Å; I32-C35 CarbonylContact O-C 3.57Å; I32-C35 PolarHBondContact O-N 2.82Å
36	F	32.8	Very low	33.1	Very low	115 Å²	115	107.9 Å²	107.9	50%	0.504	55%	0.554	S	S	.	*	H	α-helix	trans	-129.6	-13.8	-168	-62.7	-77.3	0	0	0	115.7	I32 F40	I32-F36 HydrophobicContact CB-CD2 4.29Å; I32-F36 HydrophobicContact CG2-CD2 3.72Å; I32-F36 HydrophobicContact CG2-CE2 4.34Å; I32-F36 WeakPolarHBondContact O-CA 3.18Å; I32-F36 WeakPolarHBondContact O-CB 3.45Å; I32-F36 WeakPolarHBondContact O-CD2 3.18Å; I32-F36 PolarHBondContact O-N 2.88Å; F36-F40 WeakPolarHBondContact O-CE2 3.15Å
37	Q	28.7	Very low	32	Very low	120 Å²	120	111.4 Å²	111.4	56%	0.561	57%	0.568	S	S	*	*			trans	-112.6	19	170.4	-64.4	-170.5	-26.4	0	0	112.9	R33 T39	R33-Q37 HydrophobicContact CB-CB 4.11Å; R33-Q37 HydrophobicContact CB-CG 4.15Å; R33-Q37 HydrophobicContact CG-CB 4.43Å; R33-Q37 HydrophobicContact CG-CG 3.94Å; R33-Q37 VanDerWaalsContact NE-OE1 3.16Å; R33-Q37 CarbonylContact O-C 3.49Å; R33-Q37 VanDerWaalsContact O-C 3.24Å; R33-Q37 WeakPolarHBondContact O-CA 3.45Å; R33-Q37 WeakPolarHBondContact O-CB 3.29Å; R33-Q37 PolarHBondContact O-N 2.79Å; Q37-T39 PolarHBondContact O-N 2.8Å
38	G	28.3	Very low	31	Very low	40 Å²	40	113.5 Å²	113.5	41%	0.412	58%	0.58	S	S	.	*	S	Bend	trans	-49.8	120	141.7	0	0	0	0	0	105.9	R33 F40	R33-G38 PolarHBondContact O-N 2.82Å; G38-F40 VanDerWaalsContact C-N 3.28Å; G38-F40 VanDerWaalsContact O-CD2 3.27Å; G38-F40 WeakPolarHBondContact O-CD2 3.34Å; G38-F40 PolarHBondContact O-N 2.8Å
39	T	22.6	Very low	30.3	Very low	137 Å²	137	116.4 Å²	116.4	84%	0.84	60%	0.595	S	S	*	*			trans	-55.5	97.3	179.6	20.8	0	0	0	0	107.7	Q37 I41	Q37-T39 PolarHBondContact O-N 2.8Å; T39-I41 PolarHBondContact O-N 3.06Å
40	F	27.8	Very low	29.9	Very low	122 Å²	122	122 Å²	122	54%	0.535	62%	0.618	S	S	.	*			trans	-70.4	88.4	171.8	-67.6	-74.8	0	0	0	106.1	F36 G38 L42	F36-F40 WeakPolarHBondContact O-CE2 3.15Å; G38-F40 VanDerWaalsContact C-N 3.28Å; G38-F40 VanDerWaalsContact O-CD2 3.27Å; G38-F40 WeakPolarHBondContact O-CD2 3.34Å; G38-F40 PolarHBondContact O-N 2.8Å; F40-L42 PolarHBondContact O-N 2.69Å
41	I	24.3	Very low	29.3	Very low	120 Å²	120	124.6 Å²	124.6	62%	0.615	64%	0.639	S	S	*	*			trans	-68.1	99.8	149.9	-56.2	177.9	0	0	0	103.7	T39 L43	T39-I41 PolarHBondContact O-N 3.06Å; I41-L43 HydrophobicContact CG2-CD2 3.83Å; I41-L43 HydrophobicContact CG2-CG 3.88Å; I41-L43 PolarHBondContact O-N 3.41Å
42	L	23.1	Very low	28.6	Very low	155 Å²	155	127.3 Å²	127.3	81%	0.812	66%	0.656	S	S	*	*			trans	-65.6	84.9	166.2	-160.9	122.8	0	0	0	105.9	F40 N44	F40-L42 PolarHBondContact O-N 2.69Å; L42-N44 PolarHBondContact O-N 3.04Å
43	L	26.5	Very low	28.4	Very low	132 Å²	132	131.8 Å²	131.8	69%	0.691	67%	0.674	S	S	*	*			trans	-66.4	119.3	170.2	-75.3	173.5	0	0	0	106.4	I41 N45	I41-L43 HydrophobicContact CG2-CD2 3.83Å; I41-L43 HydrophobicContact CG2-CG 3.88Å; I41-L43 PolarHBondContact O-N 3.41Å; L43-N45 PolarHBondContact O-N 2.85Å
44	N	24.7	Very low	28	Very low	141 Å²	141	132.3 Å²	132.3	75%	0.754	69%	0.691	S	S	*	*			trans	-47	129.2	-175.2	-155.7	2.9	0	0	0	110.6	L42 N46	L42-N44 PolarHBondContact O-N 3.04Å; N44-N46 VanDerWaalsContact C-N 3.32Å; N44-N46 PolarHBondContact O-N 3.47Å
45	N	23.6	Very low	27.3	Very low	134 Å²	134	128.5 Å²	128.5	72%	0.717	68%	0.681	S	S	*	*			trans	-62.8	90.2	175.6	-86.7	-22.4	0	0	0	109.7	L43	L43-N45 PolarHBondContact O-N 2.85Å
46	N	24.6	Very low	26.7	Very low	145 Å²	145	129.6 Å²	129.6	78%	0.775	69%	0.686	S	S	*	*			trans	-119	64.3	147.3	-79.7	-11.4	0	0	0	107.3	N44 N48	N44-N46 VanDerWaalsContact C-N 3.32Å; N44-N46 PolarHBondContact O-N 3.47Å; N46-N48 PolarHBondContact O-N 2.8Å
47	Y	25.1	Very low	26.3	Very low	192 Å²	192	129.2 Å²	129.2	75%	0.753	69%	0.693	S	S	*	*			trans	-72.5	81.1	160.1	-113.2	-85.9	0	0	0	107.2	N49	Y47-N49 PolarHBondContact O-N 2.8Å
48	N	24.7	Very low	26.4	Very low	150 Å²	150	126.4 Å²	126.4	80%	0.802	68%	0.678	S	S	*	*			trans	-78.7	101.4	154.4	-88.8	0.1	0	0	0	106.4	N46 E50	N46-N48 PolarHBondContact O-N 2.8Å; N48-E50 PolarHBondContact O-N 2.56Å; N48-E50 VanDerWaalsContact O-N 3.14Å
49	N	29	Very low	26.2	Very low	137 Å²	137	128 Å²	128	73%	0.733	68%	0.681	S	S	*	*			trans	-59.1	105.6	150.3	-84.8	-17	0	0	0	106.7	Y47	Y47-N49 PolarHBondContact O-N 2.8Å
50	E	30.4	Very low	26.5	Very low	178 Å²	178	121.8 Å²	121.8	83%	0.832	64%	0.643	S	S	*	*			trans	-179.5	134.9	146.3	-98.8	161	-153.5	0	0	107.4	N48	N48-E50 PolarHBondContact O-N 2.56Å; N48-E50 VanDerWaalsContact O-N 3.14Å
51	S	30.5	Very low	26.4	Very low	100 Å²	100	119 Å²	119	70%	0.699	63%	0.634	S	S	*	*			trans	66.5	98.9	-178.6	68.7	0	0	0	0	117.5
52	D	27.2	Very low	26.6	Very low	152 Å²	152	114.5 Å²	114.5	81%	0.813	61%	0.611	S	S	*	*				-160.4	90.6	111.5	-92.4	-18.6	0	0	0	111	T54	D52-T54 PolarHBondContact O-N 2.77Å
53	H	30.9	Very low	26.6	Very low	179 Å²	179	110.9 Å²	110.9	83%	0.829	59%	0.588	S	S	*	*			trans	-65.1	115.1	155.6	-67.8	-79.2	0	0	0	108.2
54	T	25.7	Very low	26.5	Very low	129 Å²	129	108.8 Å²	108.8	79%	0.791	58%	0.577	S	S	*	*			trans	142.6	37.5	154.7	61.8	0	0	0	0	113.2	D52 T56	D52-T54 PolarHBondContact O-N 2.77Å; T54-T56 VanDerWaalsContact C-N 3.27Å; T54-T56 PolarHBondContact O-N 3.46Å
55	S	25.9	Very low	26.5	Very low	70 Å²	70	107.1 Å²	107.1	49%	0.49	57%	0.568	S	S	.	*			trans	-66.7	93.4	161	63.5	0	0	0	0	108.3	T57	S55-T57 PolarHBondContact O-N 2.85Å
56	T	24.6	Very low	26.7	Very low	74 Å²	74	111.2 Å²	111.2	45%	0.454	57%	0.573	S	S	.	*			trans	-63.4	103.6	164.9	37.3	0	0	0	0	107.1	T54 Y58	T54-T56 VanDerWaalsContact C-N 3.27Å; T54-T56 PolarHBondContact O-N 3.46Å; T56-Y58 WeakPolarHBondContact O-CD2 3.14Å; T56-Y58 WeakPolarHBondContact O-CE2 3.28Å; T56-Y58 PolarHBondContact O-N 2.78Å; T56-Y58 VanDerWaalsContact O-N 3.16Å; T56-Y58 WeakPolarHBondContact OG1-CE2 3.22Å; T56-Y58 VanDerWaalsContact OG1-CZ 3.31Å; T56-Y58 PolarHBondContact OG1-OH 2.78Å; T56-Y58 VanDerWaalsContact OG1-OH 3.1Å
57	T	24.9	Very low	26.7	Very low	106 Å²	106	110.7 Å²	110.7	65%	0.65	57%	0.57	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-70.8	106.1	173	37.9	0	0	0	0	107.9	S55	S55-T57 PolarHBondContact O-N 2.85Å
58	Y	30.5	Very low	26.7	Very low	62 Å²	62	109.7 Å²	109.7	24%	0.243	58%	0.578	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-90.8	122.4	173.7	-62.4	-76.2	0	0	0	108.8	T56 T60 I94 Y229	T56-Y58 WeakPolarHBondContact O-CD2 3.14Å; T56-Y58 WeakPolarHBondContact O-CE2 3.28Å; T56-Y58 PolarHBondContact O-N 2.78Å; T56-Y58 VanDerWaalsContact O-N 3.16Å; T56-Y58 WeakPolarHBondContact OG1-CE2 3.22Å; T56-Y58 VanDerWaalsContact OG1-CZ 3.31Å; T56-Y58 PolarHBondContact OG1-OH 2.78Å; T56-Y58 VanDerWaalsContact OG1-OH 3.1Å; Y58-T60 PolarHBondContact O-N 2.73Å; Y58-I94 HydrophobicContact CD1-CD1 3.69Å; Y58-I94 HydrophobicContact CE1-CD1 3.37Å; Y58-I94 HydrophobicContact CE1-CG1 4.36Å; Y58-Y229 AromaticContact CD2-CD1 3.93Å; Y58-Y229 HydrophobicContact CD2-CD1 3.93Å; Y58-Y229 HydrophobicContact CD2-CE1 4.42Å; Y58-Y229 AromaticContact CE2-CD1 3.72Å; Y58-Y229 HydrophobicContact CE2-CD1 3.72Å; Y58-Y229 AromaticContact CE2-CE1 3.79Å; Y58-Y229 HydrophobicContact CE2-CE1 3.79Å
59	P	24.2	Very low	26.7	Very low	74 Å²	74	110.9 Å²	110.9	48%	0.481	58%	0.578	S	S	.	*			trans	-66.8	107.8	171.8	24.5	-29.6	0	0	0	109.2	F92 F234	P59-F92 WeakPolarHBondContact O-CE2 3.45Å; P59-F234 HydrophobicContact CB-CE2 4.2Å; P59-F234 HydrophobicContact CB-CZ 3.82Å
60	T	29.2	Very low	26.5	Very low	5 Å²	5	116.2 Å²	116.2	3%	0.031	59%	0.588	C	S	.	*			trans	-96.3	107.2	174.9	38.6	0	0	0	0	111.3	Y58 L62 Y89 L231 H232 F234	Y58-T60 PolarHBondContact O-N 2.73Å; T60-L62 PolarHBondContact O-N 2.75Å; T60-Y89 HydrophobicContact CG2-CE2 4.44Å; T60-L231 HydrophobicContact CG2-CB 3.92Å; T60-L231 HydrophobicContact CG2-CD1 4.42Å; T60-L231 HydrophobicContact CG2-CD2 3.54Å; T60-L231 HydrophobicContact CG2-CG 4.13Å; T60-L231 VanDerWaalsContact OG1-C 3.23Å; T60-L231 WeakPolarHBondContact OG1-CA 3.27Å; T60-L231 WeakPolarHBondContact OG1-CB 3.34Å; T60-H232 PolarHBondContact OG1-N 3.21Å; T60-H232 PolarHBondContact OG1-O 2.55Å; T60-F234 WeakPolarHBondContact O-CD2 3.47Å; T60-F234 VanDerWaalsContact O-CE2 3.22Å; T60-F234 WeakPolarHBondContact O-CE2 3.45Å
61	N	25.7	Very low	26.3	Very low	64 Å²	64	114.1 Å²	114.1	34%	0.342	58%	0.581	S	S	.	*			trans	-63.8	80.9	173.4	-79.9	-26.3	0	0	0	110.4	F63 F234	N61-F63 HydrophobicContact CB-CD2 3.97Å; N61-F63 HydrophobicContact CB-CE2 3.72Å; N61-F63 PolarHBondContact O-N 2.66Å; N61-F234 VanDerWaalsContact CA-CD2 3.49Å; N61-F234 VanDerWaalsContact CA-CE2 3.48Å; N61-F234 HydrophobicContact CB-CD2 4.45Å; N61-F234 HydrophobicContact CB-CE2 4.21Å; N61-F234 VanDerWaalsContact N-CE2 3.32Å; N61-F234 WeakPolarHBondContact OD1-CD2 3.47Å; N61-F234 WeakPolarHBondContact OD1-CE2 3.41Å; N61-F234 WeakPolarHBondContact OD1-CZ 3.34Å
62	L	26.8	Very low	26.2	Very low	25 Å²	25	116.9 Å²	116.9	13%	0.131	59%	0.588	C	S	.	*			trans	-89.3	93.3	171.9	-95.2	152.6	0	0	0	108.7	T60 F104 I106 I220 L233	T60-L62 PolarHBondContact O-N 2.75Å; L62-F104 HydrophobicContact CD2-CB 4.09Å; L62-I106 HydrophobicContact CB-CD1 4.01Å; L62-I106 HydrophobicContact CD2-CD1 3.57Å; L62-I106 HydrophobicContact CD2-CG1 3.93Å; L62-I106 HydrophobicContact CG-CD1 4.28Å; L62-I220 HydrophobicContact CD1-CD1 4.41Å; L62-L233 HydrophobicContact CB-CD2 3.59Å; L62-L233 HydrophobicContact CD1-CD2 3.37Å; L62-L233 HydrophobicContact CG-CD2 3.99Å
63	F	24.7	Very low	26.1	Very low	79 Å²	79	114.6 Å²	114.6	35%	0.346	58%	0.575	S	S	.	*			trans	-99.8	140.7	172.7	-70.4	-81.7	0	0	0	110.7	N61 L65 W87 H235	N61-F63 HydrophobicContact CB-CD2 3.97Å; N61-F63 HydrophobicContact CB-CE2 3.72Å; N61-F63 PolarHBondContact O-N 2.66Å; F63-L65 PolarHBondContact O-N 3.46Å; F63-W87 HydrophobicContact CD2-CB 4.17Å; F63-W87 HydrophobicContact CD2-CG 4.22Å; F63-W87 HydrophobicContact CE2-CG 4.44Å; F63-H235 AromaticContact CD1-CE1 3.83Å; F63-H235 AromaticContact CE1-CE1 3.93Å
64	I	24.2	Very low	25.8	Very low	89 Å²	89	112.3 Å²	112.3	46%	0.456	58%	0.579	S	S	.	*			trans	-75.5	114	172.4	-61.1	171.2	0	0	0	107.6	R66 I106 T109	I64-R66 PolarHBondContact O-N 2.83Å; I64-I106 HydrophobicContact CG1-CG2 4.33Å; I64-T109 HydrophobicContact CD1-CG2 3.42Å; I64-T109 VanDerWaalsContact CD1-CG2 3.42Å
65	L	24.8	Very low	25.8	Very low	105 Å²	105	110.6 Å²	110.6	55%	0.55	57%	0.573	S	S	.	*			trans	-77.7	117	173.7	-72.8	163.9	0	0	0	109.2	F63	F63-L65 PolarHBondContact O-N 3.46Å
66	R	26.1	Very low	25.8	Very low	221 Å²	221	112 Å²	112	83%	0.834	57%	0.574	S	S	*	*			trans	-87.7	118.4	155.8	-95.8	-174.8	174.9	175.4	-1.7	107.4	I64	I64-R66 PolarHBondContact O-N 2.83Å
67	D	24.9	Very low	25.8	Very low	134 Å²	134	116.8 Å²	116.8	72%	0.717	60%	0.596	S	S	*	*	S	Bend	trans	87.6	127.5	160.2	-47.7	-35.4	0	0	0	118.4	H69	D67-H69 PolarHBondContact O-N 3.01Å
68	N	26.3	Very low	25.7	Very low	171 Å²	171	117.4 Å²	117.4	91%	0.914	60%	0.6	S	S	*	*			trans	-68.4	72	-169.5	-73	-34.7	0	0	0	115.1
69	H	23.6	Very low	25.3	Very low	175 Å²	175	119.4 Å²	119.4	81%	0.81	62%	0.623	S	S	*	*			trans	-120.2	130	169.3	-74.8	-59.1	0	0	0	114.1	D67	D67-H69 PolarHBondContact O-N 3.01Å
70	R	25	Very low	25.4	Very low	248 Å²	248	123.2 Å²	123.2	94%	0.936	64%	0.639	S	S	*	*			trans	-85.8	115.3	177.2	-73.3	177.2	172.1	175.7	-3	110.5
71	I	26.6	Very low	25.1	Very low	134 Å²	134	129 Å²	129	69%	0.687	68%	0.68	S	S	*	*			trans	-144.2	146.1	164.5	-58	-176.9	0	0	0	111.7	I73	I71-I73 HydrophobicContact CG2-CG1 4.29Å
72	N	28.5	Very low	25.1	Very low	159 Å²	159	128.7 Å²	128.7	85%	0.85	69%	0.691	S	S	*	*			trans	-100.7	122.5	-169.4	-159.2	11.4	0	0	0	109.7
73	I	25.9	Very low	25.1	Very low	103 Å²	103	133.1 Å²	133.1	53%	0.528	72%	0.724	S	S	.	*			trans	-145.1	116.5	-177	-57	178.8	0	0	0	112	I71 L76	I71-I73 HydrophobicContact CG2-CG1 4.29Å; I73-L76 HydrophobicContact CG2-CD1 4.27Å
74	S	24.3	Very low	25.2	Very low	132 Å²	132	133.8 Å²	133.8	92%	0.923	73%	0.731	S	S	*	*	S	Bend	trans	-106.7	29.5	168.4	58.4	0	0	0	0	112.6
75	S	25.3	Very low	25.5	Very low	93 Å²	93	136 Å²	136	65%	0.65	75%	0.748	S	S	*	*			trans	-149.4	81.7	-177.1	61.2	0	0	0	0	112.2
76	L	25	Very low	25.6	Very low	99 Å²	99	135.1 Å²	135.1	52%	0.518	75%	0.751	S	S	.	*			trans	-153.6	62.3	166.2	-119.8	123.9	0	0	0	111.6	I73 I84 W87	I73-L76 HydrophobicContact CG2-CD1 4.27Å; L76-I84 HydrophobicContact CD2-CD1 4.24Å; L76-W87 HydrophobicContact CD2-CH2 3.98Å; L76-W87 HydrophobicContact CD2-CZ3 4.28Å
77	L	25.1	Very low	25.9	Very low	174 Å²	174	129.7 Å²	129.7	91%	0.911	73%	0.731	S	S	*	*			trans	-124.6	51.2	163.5	-91.7	171.1	0	0	0	109.1
78	T	23.7	Very low	26	Very low	120 Å²	120	128.1 Å²	128.1	74%	0.736	73%	0.726	S	S	*	*			trans	-152	117.5	168.8	48.2	0	0	0	0	111.2
79	S	22.2	Very low	26.2	Very low	103 Å²	103	124.5 Å²	124.5	72%	0.72	70%	0.7	S	S	*	*			trans	51.7	122.2	142.6	63.7	0	0	0	0	120
80	N	24.6	Very low	26.4	Very low	154 Å²	154	120.5 Å²	120.5	82%	0.824	69%	0.692	S	S	*	*			trans	46.7	136.2	134.3	-69.9	-7.4	0	0	0	120.7
81	S	23.4	Very low	26.6	Very low	127 Å²	127	113.1 Å²	113.1	89%	0.888	68%	0.676	S	S	*	*			trans	63.4	95	159.5	61.9	0	0	0	0	116.4
82	G	26.1	Very low	26.7	Very low	57 Å²	57	112.2 Å²	112.2	59%	0.588	67%	0.668	S	S	*	*			trans	168	132	164.1	0	0	0	0	0	110.7	I84	G82-I84 WeakPolarHBondContact O-CG1 3.28Å; G82-I84 PolarHBondContact O-N 2.78Å
83	S	26.3	Very low	26.6	Very low	118 Å²	118	114.1 Å²	114.1	83%	0.825	67%	0.671	S	S	*	*			trans	-65.8	92.1	175.3	53	0	0	0	0	109.9
84	I	26.9	Very low	27	Very low	94 Å²	94	111.9 Å²	111.9	48%	0.482	66%	0.659	S	S	.	*			trans	-89	116.9	-177.7	-65.4	157.7	0	0	0	108.8	L76 G82 W87	L76-I84 HydrophobicContact CD2-CD1 4.24Å; G82-I84 WeakPolarHBondContact O-CG1 3.28Å; G82-I84 PolarHBondContact O-N 2.78Å; I84-W87 HydrophobicContact CD1-CZ2 4.32Å; I84-W87 HydrophobicContact CG2-CZ2 4.01Å
85	T	32	Very low	27.5	Very low	134 Å²	134	113.5 Å²	113.5	82%	0.822	66%	0.658	S	S	*	*			trans	-111.9	23.1	-171.2	48.6	0	0	0	0	115.2
86	S	26.2	Very low	28.2	Very low	87 Å²	87	114.6 Å²	114.6	61%	0.608	66%	0.656	S	S	*	*			trans	-166	141.7	161.7	50	0	0	0	0	112.5
87	W	32.7	Very low	28.9	Very low	107 Å²	107	116.9 Å²	116.9	41%	0.405	67%	0.669	S	S	.	*			trans	-131.8	125.6	176.5	-64.1	82.4	0	0	0	109.6	F63 L76 I84	F63-W87 HydrophobicContact CD2-CB 4.17Å; F63-W87 HydrophobicContact CD2-CG 4.22Å; F63-W87 HydrophobicContact CE2-CG 4.44Å; L76-W87 HydrophobicContact CD2-CH2 3.98Å; L76-W87 HydrophobicContact CD2-CZ3 4.28Å; I84-W87 HydrophobicContact CD1-CZ2 4.32Å; I84-W87 HydrophobicContact CG2-CZ2 4.01Å
88	T	26	Very low	30.1	Very low	101 Å²	101	110 Å²	110	62%	0.62	63%	0.633	S	S	*	*			trans	-99.3	136.9	167.3	41.2	0	0	0	0	109.9	S90	T88-S90 PolarHBondContact O-N 3.02Å
89	Y	31	Very low	31.5	Very low	96 Å²	96	107.9 Å²	107.9	38%	0.376	62%	0.617	S	S	.	*			trans	-71.6	116.3	177.5	179.9	-98.7	0	0	0	109.8	T60	T60-Y89 HydrophobicContact CG2-CE2 4.44Å
90	S	26.6	Very low	33.3	Very low	91 Å²	91	104.6 Å²	104.6	64%	0.636	59%	0.589	S	S	*	*			trans	-104.5	135.6	158.9	60.5	0	0	0	0	108.3	T88 F92	T88-S90 PolarHBondContact O-N 3.02Å; S90-F92 PolarHBondContact O-N 2.79Å
91	P	29.6	Very low	35.3	Very low	92 Å²	92	99 Å²	99	60%	0.597	56%	0.559	S	S	*	*			trans	-59.6	126.3	174.6	24.5	-31.1	0	0	0	107.9	H93	P91-H93 PolarHBondContact O-N 3.49Å
92	F	29.5	Very low	37.5	Very low	116 Å²	116	93.2 Å²	93.2	51%	0.509	52%	0.518	S	S	.	.			trans	-48.5	131.3	171.1	-72.5	-89.4	0	0	0	108.5	P59 S90 I94	P59-F92 WeakPolarHBondContact O-CE2 3.45Å; S90-F92 PolarHBondContact O-N 2.79Å; F92-I94 HydrophobicContact CB-CD1 4.29Å; F92-I94 HydrophobicContact CB-CG1 4.02Å; F92-I94 PolarHBondContact O-N 3.25Å
93	H	26.2	Very low	39.8	Very low	198 Å²	198	93.2 Å²	93.2	92%	0.917	50%	0.504	S	S	*	.			trans	-63.4	74.9	164.6	-96.1	-69.7	0	0	0	108.5	P91	P91-H93 PolarHBondContact O-N 3.49Å
94	I	33.6	Very low	42.1	Very low	57 Å²	57	89 Å²	89	29%	0.292	47%	0.471	S	S	.	.			trans	-82.3	130.9	160.2	-59	163.8	0	0	0	103.4	Y58 F92 N96 I98	Y58-I94 HydrophobicContact CD1-CD1 3.69Å; Y58-I94 HydrophobicContact CE1-CD1 3.37Å; Y58-I94 HydrophobicContact CE1-CG1 4.36Å; F92-I94 HydrophobicContact CB-CD1 4.29Å; F92-I94 HydrophobicContact CB-CG1 4.02Å; F92-I94 PolarHBondContact O-N 3.25Å; I94-N96 HydrophobicContact CG2-CB 4.44Å; I94-N96 CarbonylContact O-C 3.4Å; I94-N96 PolarHBondContact O-N 2.75Å; I94-N96 VanDerWaalsContact O-O 3.08Å; I94-I98 HydrophobicContact CD1-CD1 4.37Å
95	N	36.5	Very low	44.2	Very low	166 Å²	166	87.8 Å²	87.8	89%	0.888	47%	0.465	S	S	*	.	S	Bend	trans	-54.2	-4	-179.2	-78.2	-20	0	0	0	115
96	N	38.8	Very low	45.8	Very low	115 Å²	115	82.7 Å²	82.7	62%	0.615	43%	0.433	S	S	*	.	S	Bend	trans	-102.9	116.9	170.5	-62.7	-10.8	0	0	0	107.9	I94 I98	I94-N96 HydrophobicContact CG2-CB 4.44Å; I94-N96 CarbonylContact O-C 3.4Å; I94-N96 PolarHBondContact O-N 2.75Å; I94-N96 VanDerWaalsContact O-O 3.08Å; N96-I98 VanDerWaalsContact C-N 3.27Å; N96-I98 HydrophobicContact CB-CG1 4.5Å; N96-I98 WeakPolarHBondContact O-CG1 3.43Å; N96-I98 PolarHBondContact O-N 3.42Å
97	N	40.3	Very low	47.5	Very low	148 Å²	148	83 Å²	83	79%	0.791	42%	0.424	S	S	*	.			trans	-57.7	86.1	170.9	-70.3	-19.5	0	0	0	110.4	D99	N97-D99 PolarHBondContact O-N 2.71Å
98	I	50.7	Low	48.9	Very low	30 Å²	30	81.7 Å²	81.7	15%	0.154	42%	0.423	C	S	.	.			trans	-84.6	65.9	170.7	-51.7	171	0	0	0	107.2	I94 N96 W100 L101 Y229	I94-I98 HydrophobicContact CD1-CD1 4.37Å; N96-I98 VanDerWaalsContact C-N 3.27Å; N96-I98 HydrophobicContact CB-CG1 4.5Å; N96-I98 WeakPolarHBondContact O-CG1 3.43Å; N96-I98 PolarHBondContact O-N 3.42Å; I98-W100 HydrophobicContact CG2-CD2 4.17Å; I98-W100 HydrophobicContact CG2-CG 4.34Å; I98-W100 HydrophobicContact CG2-CZ2 4.22Å; I98-W100 PolarHBondContact O-N 3.04Å; I98-W100 VanDerWaalsContact O-N 3.16Å; I98-L101 HydrophobicContact CB-CD1 4.24Å; I98-L101 HydrophobicContact CG2-CB 4.28Å; I98-L101 HydrophobicContact CG2-CD1 3.52Å; I98-L101 HydrophobicContact CG2-CG 3.61Å; I98-Y229 HydrophobicContact CD1-CE1 3.76Å
99	D	52.8	Low	50.9	Low	75 Å²	75	80.9 Å²	80.9	40%	0.401	42%	0.418	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-3.2	-178.8	-90.4	35.1	0	0	0	113.3	N97 K141	N97-D99 PolarHBondContact O-N 2.71Å; D99-K141 IonicContact OD2-NZ 2.9Å; D99-K141 PolarHBondContact OD2-NZ 3.41Å
100	W	60.1	Low	52.6	Low	33 Å²	33	77.6 Å²	77.6	13%	0.125	41%	0.408	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108.1	-7.6	-170.5	62.2	-96.1	0	0	0	114.5	I98 F149 I222 H224 N227 Y229	I98-W100 HydrophobicContact CG2-CD2 4.17Å; I98-W100 HydrophobicContact CG2-CG 4.34Å; I98-W100 HydrophobicContact CG2-CZ2 4.22Å; I98-W100 PolarHBondContact O-N 3.04Å; I98-W100 VanDerWaalsContact O-N 3.16Å; W100-F149 HydrophobicContact CZ3-CE2 4.3Å; W100-I222 HydrophobicContact CZ3-CG2 4.28Å; W100-H224 HydrophobicContact CE3-CB 4.07Å; W100-H224 HydrophobicContact CH2-CB 3.93Å; W100-H224 HydrophobicContact CZ3-CB 3.54Å; W100-N227 HydrophobicContact CH2-CB 3.98Å; W100-N227 HydrophobicContact CZ2-CB 3.74Å; W100-Y229 AromaticContact CH2-CD2 3.33Å; W100-Y229 HydrophobicContact CH2-CD2 3.33Å; W100-Y229 AromaticContact CH2-CE2 3.1Å; W100-Y229 HydrophobicContact CH2-CE2 3.1Å; W100-Y229 AromaticContact CZ2-CD2 3.82Å; W100-Y229 HydrophobicContact CZ2-CD2 3.82Å; W100-Y229 AromaticContact CZ2-CE2 3.07Å; W100-Y229 HydrophobicContact CZ2-CE2 3.07Å; W100-Y229 AromaticContact CZ2-CZ 3.68Å; W100-Y229 HydrophobicContact CZ3-CD2 4.29Å; W100-Y229 HydrophobicContact CZ3-CE2 4.33Å
101	L	65.7	Low	54.7	Low	38 Å²	38	77.3 Å²	77.3	20%	0.199	40%	0.399	C	S	.	.	P	Polyproline II helix	trans	-59.8	127.3	175.8	-91.3	162.1	0	0	0	109.2	I98 L231	I98-L101 HydrophobicContact CB-CD1 4.24Å; I98-L101 HydrophobicContact CG2-CB 4.28Å; I98-L101 HydrophobicContact CG2-CD1 3.52Å; I98-L101 HydrophobicContact CG2-CG 3.61Å; L101-L231 HydrophobicContact CD2-CD2 4.12Å
102	P	70.1	Confident	56.8	Low	4 Å²	4	74.8 Å²	74.8	3%	0.026	38%	0.38	C	S	.	.	P	Polyproline II helix	trans	-69.9	151.3	177.1	29.3	-36.5	0	0	0	111.5	F104 M137 K138 I139 F149 I222	P102-F104 HydrophobicContact CB-CE2 4.43Å; P102-F104 HydrophobicContact CB-CZ 4.37Å; P102-F104 HydrophobicContact CG-CD2 4.49Å; P102-F104 HydrophobicContact CG-CE1 4.33Å; P102-F104 HydrophobicContact CG-CE2 3.58Å; P102-F104 HydrophobicContact CG-CZ 3.5Å; P102-F104 VanDerWaalsContact CG-CZ 3.5Å; P102-M137 HydrophobicContact CB-CG 3.23Å; P102-M137 HydrophobicContact CB-SD 3.79Å; P102-M137 HydrophobicContact CG-CG 3.7Å; P102-M137 HydrophobicContact CG-SD 3.73Å; P102-K138 CarbonylContact C-O 3.52Å; P102-K138 WeakPolarHBondContact CA-O 3.39Å; P102-I139 HydrophobicContact CB-CG1 3.85Å; P102-F149 HydrophobicContact CG-CE1 4.33Å; P102-F149 HydrophobicContact CG-CE2 4.04Å; P102-F149 HydrophobicContact CG-CZ 3.47Å; P102-F149 VanDerWaalsContact CG-CZ 3.47Å; P102-I222 HydrophobicContact CG-CD1 4.29Å
103	N	73.2	Confident	58.5	Low	57 Å²	57	72.6 Å²	72.6	31%	0.305	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	132.2	163.8	-66.5	-37.6	0	0	0	109.5	M137 K138 D140	N103-M137 CarbonylContact O-C 3.24Å; N103-M137 WeakPolarHBondContact O-CA 3.45Å; N103-K138 HydrophobicContact CB-CB 4.45Å; N103-K138 PolarHBondContact N-O 3.44Å; N103-K138 PolarHBondContact O-N 2.89Å; N103-D140 PolarHBondContact ND2-OD2 2.95Å
104	F	75.1	Confident	60.2	Low	29 Å²	29	64.5 Å²	64.5	13%	0.127	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	130.8	173.5	-68.6	-74.1	0	0	0	111.1	L62 P102 L135 S136 M137 L187 I220 I222 L231	L62-F104 HydrophobicContact CD2-CB 4.09Å; P102-F104 HydrophobicContact CB-CE2 4.43Å; P102-F104 HydrophobicContact CB-CZ 4.37Å; P102-F104 HydrophobicContact CG-CD2 4.49Å; P102-F104 HydrophobicContact CG-CE1 4.33Å; P102-F104 HydrophobicContact CG-CE2 3.58Å; P102-F104 HydrophobicContact CG-CZ 3.5Å; P102-F104 VanDerWaalsContact CG-CZ 3.5Å; F104-L135 HydrophobicContact CD1-CD1 3.48Å; F104-L135 VanDerWaalsContact CD1-CD1 3.48Å; F104-L135 HydrophobicContact CD1-CD2 3.96Å; F104-L135 HydrophobicContact CD1-CG 4.32Å; F104-L135 HydrophobicContact CE1-CD1 3.87Å; F104-L135 HydrophobicContact CE1-CD2 4.37Å; F104-S136 CarbonylContact C-O 3.59Å; F104-S136 VanDerWaalsContact CA-O 3.29Å; F104-S136 WeakPolarHBondContact CA-O 3.33Å; F104-M137 HydrophobicContact CD1-CB 4.25Å; F104-M137 HydrophobicContact CD1-CG 4.24Å; F104-M137 HydrophobicContact CE1-CB 3.97Å; F104-M137 HydrophobicContact CE1-CG 3.69Å; F104-M137 HydrophobicContact CE1-SD 4.14Å; F104-M137 HydrophobicContact CZ-CG 4.13Å; F104-M137 HydrophobicContact CZ-SD 4.29Å; F104-L187 HydrophobicContact CE1-CD1 4.49Å; F104-I220 HydrophobicContact CD1-CD1 4.32Å; F104-I220 HydrophobicContact CD2-CD1 4.47Å; F104-I220 HydrophobicContact CE1-CD1 4.45Å; F104-I220 HydrophobicContact CG-CD1 4.31Å; F104-I220 HydrophobicContact CZ-CG2 4.45Å; F104-I222 HydrophobicContact CE2-CD1 3.36Å; F104-I222 HydrophobicContact CZ-CD1 3.34Å; F104-I222 HydrophobicContact CZ-CG1 4.12Å; F104-L231 HydrophobicContact CD2-CD1 3.73Å; F104-L231 HydrophobicContact CE2-CD1 3.33Å; F104-L231 HydrophobicContact CZ-CD1 4.37Å
105	I	72.3	Confident	61.3	Low	69 Å²	69	63.3 Å²	63.3	35%	0.354	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	110	171.2	-60.8	169.1	0	0	0	106.8	H107 L135 S136	I105-H107 PolarHBondContact O-N 2.73Å; I105-L135 CarbonylContact O-C 3.46Å; I105-L135 VanDerWaalsContact O-CA 3.28Å; I105-L135 WeakPolarHBondContact O-CA 3.44Å; I105-S136 PolarHBondContact N-O 3.24Å; I105-S136 PolarHBondContact O-N 3.42Å
106	I	65.6	Low	61.9	Low	28 Å²	28	58.8 Å²	58.8	14%	0.144	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	113.4	175.3	-61.8	176.7	0	0	0	108.3	L62 I64 Q108 F133 L233	L62-I106 HydrophobicContact CB-CD1 4.01Å; L62-I106 HydrophobicContact CD2-CD1 3.57Å; L62-I106 HydrophobicContact CD2-CG1 3.93Å; L62-I106 HydrophobicContact CG-CD1 4.28Å; I64-I106 HydrophobicContact CG1-CG2 4.33Å; I106-Q108 WeakPolarHBondContact CG2-O 3.28Å; I106-F133 HydrophobicContact CB-CE2 4.5Å; I106-F133 HydrophobicContact CD1-CE2 4.17Å; I106-F133 HydrophobicContact CD1-CZ 3.68Å; I106-F133 HydrophobicContact CG1-CE2 4.09Å; I106-F133 HydrophobicContact CG1-CZ 3.72Å; I106-F133 HydrophobicContact CG2-CE2 3.72Å; I106-F133 HydrophobicContact CG2-CZ 4.25Å; I106-L233 HydrophobicContact CD1-CD2 4.15Å
107	H	61.6	Low	62.2	Low	92 Å²	92	57.8 Å²	57.8	43%	0.426	30%	0.298	S	S	.	.			trans	-78.6	-33.1	177	-67.3	-58.4	0	0	0	112.9	I105 S136 Q184 D186	I105-H107 PolarHBondContact O-N 2.73Å; H107-S136 PolarHBondContact CD2-OG 3.39Å; H107-S136 PolarHBondContact NE2-OG 3.47Å; H107-Q184 PolarHBondContact CE1-NE2 3.41Å; H107-D186 IonicContact NE2-OD1 2.64Å
108	Q	61.5	Low	62.1	Low	80 Å²	80	56.8 Å²	56.8	37%	0.374	30%	0.302	S	S	.	.	S	Bend	trans	-146.8	151.4	-174.9	64.5	-174.9	18.5	0	0	111.1	I106 R134	I106-Q108 WeakPolarHBondContact CG2-O 3.28Å; Q108-R134 HydrophobicContact CG-CB 4Å
109	T	67.6	Low	61.6	Low	84 Å²	84	57.1 Å²	57.1	52%	0.515	31%	0.307	S	S	.	.			trans	-56.5	138.1	169.7	46.7	0	0	0	0	109.6	I64 L111	I64-T109 HydrophobicContact CD1-CG2 3.42Å; I64-T109 VanDerWaalsContact CD1-CG2 3.42Å; T109-L111 PolarHBondContact O-N 2.8Å
110	P	67.4	Low	61.1	Low	28 Å²	28	61.6 Å²	61.6	18%	0.182	33%	0.33	C	S	.	.			trans	-48.9	139.8	168.6	-21	27.5	0	0	0	110.5	C132 F133 L218 F237	P110-C132 WeakPolarHBondContact CA-O 3.11Å; P110-F133 HydrophobicContact CB-CB 4.35Å; P110-F133 HydrophobicContact CB-CD2 3.96Å; P110-F133 HydrophobicContact CB-CG 4.35Å; P110-F133 HydrophobicContact CG-CD2 3.48Å; P110-F133 VanDerWaalsContact CG-CD2 3.48Å; P110-F133 HydrophobicContact CG-CE2 3.68Å; P110-F133 HydrophobicContact CG-CG 4.09Å; P110-F133 HydrophobicContact CG-CZ 4.43Å; P110-L218 HydrophobicContact CB-CD1 3.5Å; P110-L218 HydrophobicContact CG-CD1 3.53Å; P110-F237 HydrophobicContact CB-CE1 4.2Å; P110-F237 HydrophobicContact CB-CE2 4.09Å; P110-F237 HydrophobicContact CB-CZ 3.47Å; P110-F237 VanDerWaalsContact CB-CZ 3.47Å; P110-F237 WeakPolarHBondContact O-CE1 3.37Å; P110-F237 WeakPolarHBondContact O-CZ 3.07Å
111	L	71.4	Confident	59.9	Low	84 Å²	84	65.7 Å²	65.7	44%	0.44	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	130.1	177.1	-63.8	174.7	0	0	0	108.9	T109 I113 I131 C132	T109-L111 PolarHBondContact O-N 2.8Å; L111-I113 HydrophobicContact CB-CG1 4.41Å; L111-I131 CarbonylContact O-C 3.6Å; L111-I131 VanDerWaalsContact O-CA 3.29Å; L111-I131 WeakPolarHBondContact O-CA 3.11Å; L111-C132 HydrophobicContact CB-CB 4.43Å; L111-C132 PolarHBondContact N-O 2.86Å; L111-C132 PolarHBondContact O-N 2.86Å
112	L	72.3	Confident	58.5	Low	39 Å²	39	65.9 Å²	65.9	20%	0.204	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	120.6	166.5	-179.9	71.5	0	0	0	108.7	W129 I131 I216 F237 I239	L112-W129 HydrophobicContact CD1-CB 4.36Å; L112-W129 HydrophobicContact CD1-CE3 3.91Å; L112-W129 HydrophobicContact CD2-CE3 3.85Å; L112-W129 HydrophobicContact CD2-CZ3 3.75Å; L112-W129 HydrophobicContact CG-CE3 3.82Å; L112-W129 HydrophobicContact CG-CZ3 4.07Å; L112-I131 HydrophobicContact CD1-CD1 4.29Å; L112-I131 HydrophobicContact CD1-CG1 3.49Å; L112-I131 VanDerWaalsContact CD1-CG1 3.49Å; L112-I216 HydrophobicContact CD1-CD1 4.46Å; L112-I216 HydrophobicContact CD2-CD1 4.17Å; L112-F237 HydrophobicContact CB-CD1 4.2Å; L112-F237 HydrophobicContact CB-CD2 4.42Å; L112-F237 HydrophobicContact CB-CE1 3.93Å; L112-F237 HydrophobicContact CB-CE2 4.14Å; L112-F237 HydrophobicContact CB-CG 4.41Å; L112-F237 HydrophobicContact CB-CZ 3.88Å; L112-I239 HydrophobicContact CD2-CD1 3.16Å; L112-I239 HydrophobicContact CD2-CG1 3.55Å
113	I	65.8	Low	56.9	Low	70 Å²	70	70.1 Å²	70.1	36%	0.359	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	127.3	-176.6	-54.7	175.2	0	0	0	107.9	L111 I115 W129 L130	L111-I113 HydrophobicContact CB-CG1 4.41Å; I113-I115 HydrophobicContact CG2-CG1 4.48Å; I113-W129 WeakPolarHBondContact O-CA 3.4Å; I113-L130 HydrophobicContact CB-CB 4.43Å; I113-L130 PolarHBondContact N-O 2.76Å; I113-L130 PolarHBondContact O-N 2.81Å
114	N	61.5	Low	55.2	Low	28 Å²	28	73.8 Å²	73.8	15%	0.15	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	121.8	165.7	174.2	-10.4	0	0	0	108.2	P116 V127 W129 Y248	N114-P116 WeakPolarHBondContact O-CD 3.12Å; N114-V127 VanDerWaalsContact CG-CG1 3.5Å; N114-V127 WeakPolarHBondContact ND2-CG1 3.05Å; N114-V127 WeakPolarHBondContact OD1-CG1 3.15Å; N114-W129 HydrophobicContact CB-CE3 4.05Å; N114-W129 HydrophobicContact CB-CH2 4.46Å; N114-W129 HydrophobicContact CB-CZ3 3.98Å; N114-Y248 WeakPolarHBondContact CB-OH 3.31Å
115	I	56.6	Low	53.5	Low	33 Å²	33	74.4 Å²	74.4	17%	0.169	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	105.4	173.1	-55.7	173.1	0	0	0	107.5	I113 R117 R128 L130	I113-I115 HydrophobicContact CG2-CG1 4.48Å; I115-R117 PolarHBondContact O-N 2.83Å; I115-R128 HydrophobicContact CB-CB 4.02Å; I115-R128 PolarHBondContact N-O 3.42Å; I115-R128 PolarHBondContact O-N 2.99Å; I115-L130 HydrophobicContact CD1-CB 3.76Å; I115-L130 HydrophobicContact CD1-CD2 4.16Å; I115-L130 HydrophobicContact CG1-CB 4.29Å
116	P	48.5	Very low	52.2	Low	70 Å²	70	72.7 Å²	72.7	46%	0.455	41%	0.407	S	S	.	.			trans	-63.3	129.4	169.5	25.5	-31.1	0	0	0	108.8	N114 S118	N114-P116 WeakPolarHBondContact O-CD 3.12Å; P116-S118 PolarHBondContact O-N 3.02Å
117	R	46.3	Very low	51.6	Low	94 Å²	94	73 Å²	73	36%	0.355	41%	0.41	S	S	.	.			trans	-65.2	132.4	165.2	-97.9	-178.5	150.5	162.6	-6.4	108.2	I115 S119 M125 R128	I115-R117 PolarHBondContact O-N 2.83Å; R117-S119 VanDerWaalsContact C-N 3.3Å; R117-S119 PolarHBondContact O-N 3.23Å; R117-M125 WeakPolarHBondContact O-CE 3.41Å; R117-R128 VanDerWaalsContact NH2-NH2 3.11Å
118	S	38.7	Very low	51.8	Low	127 Å²	127	72.5 Å²	72.5	89%	0.888	40%	0.404	S	S	*	.			trans	-64.3	94.1	160.2	49.8	0	0	0	0	107.9	P116	P116-S118 PolarHBondContact O-N 3.02Å
119	S	40	Very low	52.2	Low	37 Å²	37	69 Å²	69	26%	0.259	39%	0.388	S	S	.	.			trans	-98.6	112.1	177.2	79.6	0	0	0	0	110.2	R117 N121 M125	R117-S119 VanDerWaalsContact C-N 3.3Å; R117-S119 PolarHBondContact O-N 3.23Å; S119-N121 VanDerWaalsContact CB-O 3.27Å; S119-N121 WeakPolarHBondContact CB-O 3.37Å; S119-N121 PolarHBondContact O-N 3.32Å; S119-N121 PolarHBondContact OG-O 2.85Å; S119-M125 WeakPolarHBondContact OG-CE 3.4Å; S119-M125 VanDerWaalsContact OG-CG 3.29Å; S119-M125 WeakPolarHBondContact OG-CG 3.09Å
120	I	42.6	Very low	52.5	Low	169 Å²	169	66.6 Å²	66.6	87%	0.867	37%	0.372	S	S	*	.	S	Bend	trans	-61	-16.2	158.4	-68.8	166.5	0	0	0	110.6
121	N	34.6	Very low	52.9	Low	119 Å²	119	65.2 Å²	65.2	64%	0.636	36%	0.363	S	S	*	.	S	Bend	trans	-129.1	109.7	174.2	-132.3	-11.1	0	0	0	112.3	S119 S123	S119-N121 VanDerWaalsContact CB-O 3.27Å; S119-N121 WeakPolarHBondContact CB-O 3.37Å; S119-N121 PolarHBondContact O-N 3.32Å; S119-N121 PolarHBondContact OG-O 2.85Å; N121-S123 VanDerWaalsContact C-N 3.27Å; N121-S123 PolarHBondContact O-N 3.21Å
122	P	35.5	Very low	53.2	Low	42 Å²	42	62.1 Å²	62.1	27%	0.273	35%	0.348	S	S	.	.	G	3₁₀ helix	trans	-67.8	-19.5	-168.7	-17.6	28.2	0	0	0	115.9	N124 T260	P122-N124 VanDerWaalsContact C-N 3.3Å; P122-N124 PolarHBondContact O-N 3.02Å; P122-T260 WeakPolarHBondContact CB-O 3.46Å
123	S	36.6	Very low	53.4	Low	93 Å²	93	60.4 Å²	60.4	65%	0.65	34%	0.339	S	S	*	.	G	3₁₀ helix	trans	-72.3	-15	-171.3	53	0	0	0	0	115.5	N121	N121-S123 VanDerWaalsContact C-N 3.27Å; N121-S123 PolarHBondContact O-N 3.21Å
124	N	37.4	Very low	54	Low	135 Å²	135	61.8 Å²	61.8	72%	0.722	34%	0.339	S	S	*	.	G	3₁₀ helix	trans	-131.7	43.3	-176.6	-88.3	-7.1	0	0	0	112.3	P122 A126	P122-N124 VanDerWaalsContact C-N 3.3Å; P122-N124 PolarHBondContact O-N 3.02Å; N124-A126 VanDerWaalsContact C-N 3.31Å; N124-A126 PolarHBondContact O-N 2.83Å
125	M	40.2	Very low	54.6	Low	41 Å²	41	60.4 Å²	60.4	20%	0.202	33%	0.332	C	S	.	.			trans	-68.9	88.1	169.5	-80	-144.4	-174.7	0	0	110.9	R117 S119 V127 T261	R117-M125 WeakPolarHBondContact O-CE 3.41Å; S119-M125 WeakPolarHBondContact OG-CE 3.4Å; S119-M125 VanDerWaalsContact OG-CG 3.29Å; S119-M125 WeakPolarHBondContact OG-CG 3.09Å; M125-V127 PolarHBondContact O-N 2.81Å; M125-T261 HydrophobicContact CE-CG2 3.31Å; M125-T261 HydrophobicContact CG-CG2 4.15Å; M125-T261 HydrophobicContact SD-CG2 3.23Å; M125-T261 WeakPolarHBondContact SD-CG2 3.14Å
126	A	45.5	Very low	55.7	Low	33 Å²	33	58.9 Å²	58.9	27%	0.273	32%	0.324	S	S	.	.			trans	-68.5	109.7	161.5	0	0	0	0	0	108.4	N124 R128	N124-A126 VanDerWaalsContact C-N 3.31Å; N124-A126 PolarHBondContact O-N 2.83Å; A126-R128 PolarHBondContact O-N 3.16Å
127	V	52.8	Low	57.1	Low	36 Å²	36	55.6 Å²	55.6	22%	0.218	30%	0.303	C	S	.	.			trans	-61	125.2	173.7	-179	0	0	0	0	108.6	N114 M125 W129	N114-V127 VanDerWaalsContact CG-CG1 3.5Å; N114-V127 WeakPolarHBondContact ND2-CG1 3.05Å; N114-V127 WeakPolarHBondContact OD1-CG1 3.15Å; M125-V127 PolarHBondContact O-N 2.81Å; V127-W129 HydrophobicContact CG1-CD2 4.34Å; V127-W129 HydrophobicContact CG1-CZ2 4.02Å
128	R	64.2	Low	58.5	Low	80 Å²	80	54.1 Å²	54.1	30%	0.302	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	140.8	173.1	-71.9	178.6	178.7	-177.2	-4.2	109.2	I115 R117 A126 T193	I115-R128 HydrophobicContact CB-CB 4.02Å; I115-R128 PolarHBondContact N-O 3.42Å; I115-R128 PolarHBondContact O-N 2.99Å; R117-R128 VanDerWaalsContact NH2-NH2 3.11Å; A126-R128 PolarHBondContact O-N 3.16Å; R128-T193 WeakPolarHBondContact CA-O 3.34Å
129	W	70.8	Confident	60.2	Low	7 Å²	7	49.2 Å²	49.2	3%	0.027	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	135	178.6	-61.9	89.2	0	0	0	109.8	L112 I113 N114 V127 W167 Y192 T193 L197 F198 L244	L112-W129 HydrophobicContact CD1-CB 4.36Å; L112-W129 HydrophobicContact CD1-CE3 3.91Å; L112-W129 HydrophobicContact CD2-CE3 3.85Å; L112-W129 HydrophobicContact CD2-CZ3 3.75Å; L112-W129 HydrophobicContact CG-CE3 3.82Å; L112-W129 HydrophobicContact CG-CZ3 4.07Å; I113-W129 WeakPolarHBondContact O-CA 3.4Å; N114-W129 HydrophobicContact CB-CE3 4.05Å; N114-W129 HydrophobicContact CB-CH2 4.46Å; N114-W129 HydrophobicContact CB-CZ3 3.98Å; V127-W129 HydrophobicContact CG1-CD2 4.34Å; V127-W129 HydrophobicContact CG1-CZ2 4.02Å; W129-W167 HydrophobicContact CB-CH2 4.28Å; W129-Y192 CarbonylContact O-C 3.55Å; W129-Y192 VanDerWaalsContact O-CA 3.27Å; W129-Y192 WeakPolarHBondContact O-CA 3.49Å; W129-T193 HydrophobicContact CB-CG2 3.82Å; W129-T193 HydrophobicContact CG-CG2 4.43Å; W129-T193 PolarHBondContact N-O 3.3Å; W129-T193 PolarHBondContact O-N 2.93Å; W129-L197 HydrophobicContact CB-CD1 3.96Å; W129-L197 HydrophobicContact CB-CG 4.45Å; W129-L197 VanDerWaalsContact CD1-CG 3.49Å; W129-L197 HydrophobicContact CD2-CD1 3.54Å; W129-L197 HydrophobicContact CD2-CG 4.11Å; W129-L197 HydrophobicContact CE3-CD1 4.1Å; W129-L197 HydrophobicContact CG-CD1 3.48Å; W129-L197 VanDerWaalsContact CG-CD1 3.48Å; W129-L197 HydrophobicContact CG-CG 3.79Å; W129-L197 HydrophobicContact CZ2-CB 4.34Å; W129-L197 HydrophobicContact CZ2-CD1 4.39Å; W129-F198 HydrophobicContact CH2-CD2 4.42Å; W129-F198 AromaticContact CH2-CE2 3.57Å; W129-F198 HydrophobicContact CH2-CE2 3.57Å; W129-F198 HydrophobicContact CH2-CZ 4.16Å; W129-F198 AromaticContact CZ2-CD2 3.81Å; W129-F198 HydrophobicContact CZ2-CD2 3.81Å; W129-F198 AromaticContact CZ2-CE2 3.4Å; W129-F198 HydrophobicContact CZ2-CE2 3.4Å; W129-F198 HydrophobicContact CZ2-CZ 4.32Å; W129-L244 HydrophobicContact CH2-CD1 3.31Å; W129-L244 HydrophobicContact CZ2-CD1 4.24Å; W129-L244 HydrophobicContact CZ3-CD1 3.91Å
130	L	73	Confident	61.3	Low	33 Å²	33	51.1 Å²	51.1	17%	0.173	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	128.4	177	175.5	68.7	0	0	0	108.8	I113 I115 C132 F190	I113-L130 HydrophobicContact CB-CB 4.43Å; I113-L130 PolarHBondContact N-O 2.76Å; I113-L130 PolarHBondContact O-N 2.81Å; I115-L130 HydrophobicContact CD1-CB 3.76Å; I115-L130 HydrophobicContact CD1-CD2 4.16Å; I115-L130 HydrophobicContact CG1-CB 4.29Å; L130-C132 VanDerWaalsContact CD2-SG 3.56Å; L130-F190 HydrophobicContact CD1-CB 4.4Å; L130-F190 HydrophobicContact CD1-CD1 4.32Å
131	I	77.5	Confident	62.2	Low	0 Å²	0	48.8 Å²	48.8	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	124.2	168.3	-60.6	160.5	0	0	0	107.9	L111 L112 L153 P155 W167 F190 A191 I216 L218 F237	L111-I131 CarbonylContact O-C 3.6Å; L111-I131 VanDerWaalsContact O-CA 3.29Å; L111-I131 WeakPolarHBondContact O-CA 3.11Å; L112-I131 HydrophobicContact CD1-CD1 4.29Å; L112-I131 HydrophobicContact CD1-CG1 3.49Å; L112-I131 VanDerWaalsContact CD1-CG1 3.49Å; I131-L153 HydrophobicContact CB-CD2 3.97Å; I131-L153 HydrophobicContact CG2-CD2 3.52Å; I131-P155 HydrophobicContact CD1-CB 3.69Å; I131-P155 HydrophobicContact CD1-CG 3.52Å; I131-W167 HydrophobicContact CD1-CE3 4.24Å; I131-W167 HydrophobicContact CD1-CH2 3.39Å; I131-W167 HydrophobicContact CD1-CZ2 4.09Å; I131-W167 HydrophobicContact CD1-CZ3 3.49Å; I131-W167 VanDerWaalsContact CD1-CZ3 3.49Å; I131-W167 HydrophobicContact CG1-CH2 4.01Å; I131-W167 HydrophobicContact CG1-CZ3 3.95Å; I131-F190 VanDerWaalsContact O-CA 3.28Å; I131-F190 WeakPolarHBondContact O-CA 3.1Å; I131-A191 PolarHBondContact N-O 3.18Å; I131-A191 PolarHBondContact O-N 3.19Å; I131-I216 HydrophobicContact CD1-CG2 4.28Å; I131-L218 HydrophobicContact CD1-CD2 3.76Å; I131-L218 HydrophobicContact CG2-CD1 4.39Å; I131-L218 HydrophobicContact CG2-CD2 4.14Å; I131-F237 HydrophobicContact CD1-CE2 4.22Å; I131-F237 HydrophobicContact CG1-CE2 3.99Å; I131-F237 HydrophobicContact CG2-CE2 3.71Å; I131-F237 HydrophobicContact CG2-CZ 4.12Å
132	C	76.4	Confident	63.3	Low	19 Å²	19	48.7 Å²	48.7	13%	0.128	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	126	174	-60.5	0	0	0	0	108.9	P110 L111 L130 F190	P110-C132 WeakPolarHBondContact CA-O 3.11Å; L111-C132 HydrophobicContact CB-CB 4.43Å; L111-C132 PolarHBondContact N-O 2.86Å; L111-C132 PolarHBondContact O-N 2.86Å; L130-C132 VanDerWaalsContact CD2-SG 3.56Å; C132-F190 HydrophobicContact CB-CD1 4.12Å; C132-F190 HydrophobicContact CB-CE1 4.01Å; C132-F190 VanDerWaalsContact SG-CE1 3.59Å
133	F	77.7	Confident	64.3	Low	2 Å²	2	51.2 Å²	51.2	1%	0.009	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	112	178.9	-177	-141.1	0	0	0	111	I106 P110 L135 L153 L189 I220 L233	I106-F133 HydrophobicContact CB-CE2 4.5Å; I106-F133 HydrophobicContact CD1-CE2 4.17Å; I106-F133 HydrophobicContact CD1-CZ 3.68Å; I106-F133 HydrophobicContact CG1-CE2 4.09Å; I106-F133 HydrophobicContact CG1-CZ 3.72Å; I106-F133 HydrophobicContact CG2-CE2 3.72Å; I106-F133 HydrophobicContact CG2-CZ 4.25Å; P110-F133 HydrophobicContact CB-CB 4.35Å; P110-F133 HydrophobicContact CB-CD2 3.96Å; P110-F133 HydrophobicContact CB-CG 4.35Å; P110-F133 HydrophobicContact CG-CD2 3.48Å; P110-F133 VanDerWaalsContact CG-CD2 3.48Å; P110-F133 HydrophobicContact CG-CE2 3.68Å; P110-F133 HydrophobicContact CG-CG 4.09Å; P110-F133 HydrophobicContact CG-CZ 4.43Å; F133-L135 HydrophobicContact CD1-CD2 3.91Å; F133-L135 HydrophobicContact CE1-CD2 3.48Å; F133-L135 VanDerWaalsContact CE1-CD2 3.48Å; F133-L135 HydrophobicContact CZ-CB 4.4Å; F133-L135 HydrophobicContact CZ-CD2 4.07Å; F133-L153 HydrophobicContact CB-CD1 4.49Å; F133-L153 HydrophobicContact CB-CD2 4.22Å; F133-L153 HydrophobicContact CD1-CD1 4.1Å; F133-L189 HydrophobicContact CD1-CD1 4.28Å; F133-L189 PolarHBondContact N-O 3.32Å; F133-L189 PolarHBondContact O-N 3.48Å; F133-I220 HydrophobicContact CE1-CD1 3.92Å; F133-I220 HydrophobicContact CE1-CG1 4.05Å; F133-L233 HydrophobicContact CD1-CD1 4.12Å; F133-L233 HydrophobicContact CE1-CD1 3.47Å; F133-L233 VanDerWaalsContact CE1-CD1 3.47Å; F133-L233 HydrophobicContact CE1-CD2 4.36Å; F133-L233 HydrophobicContact CE2-CD1 4.49Å; F133-L233 HydrophobicContact CZ-CD1 3.69Å; F133-L233 HydrophobicContact CZ-CD2 4.25Å
134	R	77.8	Confident	65	Low	99 Å²	99	58.2 Å²	58.2	37%	0.374	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	126	177.9	-177	174	-179.8	-174.9	1.4	109.9	Q108 D186 L187 N188	Q108-R134 HydrophobicContact CG-CB 4Å; R134-D186 IonicContact CZ-OD2 3.94Å; R134-D186 IonicContact NE-OD2 2.85Å; R134-D186 IonicContact NH2-OD2 3.6Å; R134-D186 PolarHBondContact NH2-OD2 3.29Å; R134-L187 WeakPolarHBondContact CA-O 3.13Å; R134-N188 WeakPolarHBondContact CD-OD1 3.23Å; R134-N188 VanDerWaalsContact CG-OD1 3.28Å; R134-N188 WeakPolarHBondContact CG-OD1 3.44Å
135	L	75.1	Confident	66.2	Low	0 Å²	0	53.6 Å²	53.6	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	171.9	177.5	64.6	76.9	0	0	0	108.6	F104 I105 F133 L187 L189 I220	F104-L135 HydrophobicContact CD1-CD1 3.48Å; F104-L135 VanDerWaalsContact CD1-CD1 3.48Å; F104-L135 HydrophobicContact CD1-CD2 3.96Å; F104-L135 HydrophobicContact CD1-CG 4.32Å; F104-L135 HydrophobicContact CE1-CD1 3.87Å; F104-L135 HydrophobicContact CE1-CD2 4.37Å; I105-L135 CarbonylContact O-C 3.46Å; I105-L135 VanDerWaalsContact O-CA 3.28Å; I105-L135 WeakPolarHBondContact O-CA 3.44Å; F133-L135 HydrophobicContact CD1-CD2 3.91Å; F133-L135 HydrophobicContact CE1-CD2 3.48Å; F133-L135 VanDerWaalsContact CE1-CD2 3.48Å; F133-L135 HydrophobicContact CZ-CB 4.4Å; F133-L135 HydrophobicContact CZ-CD2 4.07Å; L135-L187 HydrophobicContact CD1-CB 3.73Å; L135-L187 HydrophobicContact CD1-CD1 3.81Å; L135-L187 HydrophobicContact CD1-CG 3.92Å; L135-L187 HydrophobicContact CG-CB 4.26Å; L135-L187 PolarHBondContact N-O 3.48Å; L135-L187 PolarHBondContact O-N 3.45Å; L135-L189 HydrophobicContact CD2-CD1 3.71Å; L135-L189 HydrophobicContact CD2-CG 4.46Å; L135-L189 HydrophobicContact CG-CD1 4.49Å; L135-I220 HydrophobicContact CD2-CD1 3.5Å; L135-I220 VanDerWaalsContact CD2-CD1 3.5Å; L135-I220 HydrophobicContact CD2-CG1 4.32Å
136	S	78.2	Confident	67.3	Low	0 Å²	0	56.2 Å²	56.2	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	153.9	158.7	-46.9	0	0	0	0	112.3	F104 I105 H107 Q184 I185 D186	F104-S136 CarbonylContact C-O 3.59Å; F104-S136 VanDerWaalsContact CA-O 3.29Å; F104-S136 WeakPolarHBondContact CA-O 3.33Å; I105-S136 PolarHBondContact N-O 3.24Å; I105-S136 PolarHBondContact O-N 3.42Å; H107-S136 PolarHBondContact CD2-OG 3.39Å; H107-S136 PolarHBondContact NE2-OG 3.47Å; S136-Q184 PolarHBondContact OG-NE2 2.95Å; S136-I185 CarbonylContact C-O 3.51Å; S136-I185 WeakPolarHBondContact CA-O 3.12Å; S136-I185 VanDerWaalsContact CB-O 3.25Å; S136-I185 WeakPolarHBondContact CB-O 3.35Å; S136-D186 PolarHBondContact OG-OD1 2.92Å
137	M	78.4	Confident	68.5	Low	1 Å²	1	58.1 Å²	58.1	1%	0.005	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	133.2	178.7	-167.6	-176.4	74.1	0	0	109.1	P102 N103 F104 I139 F149 I174 Q184 I185 L187	P102-M137 HydrophobicContact CB-CG 3.23Å; P102-M137 HydrophobicContact CB-SD 3.79Å; P102-M137 HydrophobicContact CG-CG 3.7Å; P102-M137 HydrophobicContact CG-SD 3.73Å; N103-M137 CarbonylContact O-C 3.24Å; N103-M137 WeakPolarHBondContact O-CA 3.45Å; F104-M137 HydrophobicContact CD1-CB 4.25Å; F104-M137 HydrophobicContact CD1-CG 4.24Å; F104-M137 HydrophobicContact CE1-CB 3.97Å; F104-M137 HydrophobicContact CE1-CG 3.69Å; F104-M137 HydrophobicContact CE1-SD 4.14Å; F104-M137 HydrophobicContact CZ-CG 4.13Å; F104-M137 HydrophobicContact CZ-SD 4.29Å; M137-I139 HydrophobicContact CE-CD1 3.83Å; M137-I139 HydrophobicContact CE-CG1 4.28Å; M137-F149 HydrophobicContact CE-CD1 4.03Å; M137-F149 HydrophobicContact CE-CE1 4.13Å; M137-F149 HydrophobicContact SD-CD1 3.78Å; M137-F149 HydrophobicContact SD-CE1 3.28Å; M137-F149 WeakPolarHBondContact SD-CE1 3.38Å; M137-F149 HydrophobicContact SD-CZ 3.74Å; M137-I174 HydrophobicContact CE-CD1 3.35Å; M137-I174 HydrophobicContact CE-CG2 4.41Å; M137-I174 HydrophobicContact SD-CD1 4.03Å; M137-Q184 WeakPolarHBondContact O-CA 3.38Å; M137-I185 HydrophobicContact CE-CD1 3.97Å; M137-I185 PolarHBondContact N-O 3.16Å; M137-I185 PolarHBondContact O-N 3.36Å; M137-L187 HydrophobicContact CB-CD1 3.82Å; M137-L187 HydrophobicContact CB-CG 4.27Å; M137-L187 HydrophobicContact CG-CD1 4.49Å; M137-L187 HydrophobicContact SD-CD1 4.11Å
138	K	75.9	Confident	69.7	Low	63 Å²	63	61.4 Å²	61.4	27%	0.274	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	126.8	173.8	-174.8	-177.2	-178.5	-119.3	0	109.3	P102 N103 D140 N182	P102-K138 CarbonylContact C-O 3.52Å; P102-K138 WeakPolarHBondContact CA-O 3.39Å; N103-K138 HydrophobicContact CB-CB 4.45Å; N103-K138 PolarHBondContact N-O 3.44Å; N103-K138 PolarHBondContact O-N 2.89Å; K138-D140 WeakPolarHBondContact CE-OD1 3.29Å; K138-D140 IonicContact NZ-OD1 2.65Å; K138-D140 PolarHBondContact NZ-OD1 3.35Å; K138-N182 WeakPolarHBondContact CE-O 3.28Å
139	I	73.1	Confident	70.4	Confident	25 Å²	25	57.7 Å²	57.7	13%	0.128	27%	0.271	C	S	.	.			trans	-104.8	113.6	176.5	-61	165.8	0	0	0	107.9	P102 M137 K141 L176 N182	P102-I139 HydrophobicContact CB-CG1 3.85Å; M137-I139 HydrophobicContact CE-CD1 3.83Å; M137-I139 HydrophobicContact CE-CG1 4.28Å; I139-K141 WeakPolarHBondContact CG2-O 3.27Å; I139-L176 HydrophobicContact CD1-CD2 3.35Å; I139-N182 PolarHBondContact O-N 3.2Å
140	D	63.8	Low	70.9	Confident	76 Å²	76	59 Å²	59	41%	0.406	28%	0.278	S	S	.	.	S	Bend	trans	-80.5	-31.4	-174.5	-75.1	-18.7	0	0	0	113	N103 K138 N182	N103-D140 PolarHBondContact ND2-OD2 2.95Å; K138-D140 WeakPolarHBondContact CE-OD1 3.29Å; K138-D140 IonicContact NZ-OD1 2.65Å; K138-D140 PolarHBondContact NZ-OD1 3.35Å; D140-N182 PolarHBondContact O-OD1 3.19Å
141	K	62.3	Low	71.4	Confident	120 Å²	120	57.5 Å²	57.5	52%	0.522	27%	0.27	S	S	.	.			trans	-129.2	122.4	176.7	-70.4	-176.1	-172.5	174.2	0	110.5	D99 I139	D99-K141 IonicContact OD2-NZ 2.9Å; D99-K141 PolarHBondContact OD2-NZ 3.41Å; I139-K141 WeakPolarHBondContact CG2-O 3.27Å
142	R	57.9	Low	71.6	Confident	118 Å²	118	57.5 Å²	57.5	45%	0.445	27%	0.27	S	S	.	.			trans	-78.7	119.9	160.5	-79.1	-168.9	-175.3	-175.8	2.8	107.8	L176 Q177 F179	R142-L176 PolarHBondContact NH2-O 3.49Å; R142-Q177 PolarHBondContact NH2-O 2.98Å; R142-Q177 VanDerWaalsContact NH2-O 3.09Å; R142-F179 VanDerWaalsContact NH2-C 3.33Å; R142-F179 PolarHBondContact NH2-O 3.44Å
143	N	56.2	Low	72	Confident	95 Å²	95	56.6 Å²	56.6	51%	0.508	26%	0.264	S	S	.	.			trans	-73.9	146.6	141.9	-71.9	-15.4	0	0	0	106.1	S145	N143-S145 PolarHBondContact O-N 3.05Å; N143-S145 PolarHBondContact O-OG 3.39Å
144	Y	51.1	Low	72.1	Confident	239 Å²	239	60 Å²	60	94%	0.937	28%	0.28	S	S	*	.	S	Bend	trans	-66.1	30.7	-177.7	-68.2	-89.7	0	0	0	113.7	T146	Y144-T146 PolarHBondContact O-N 3.16Å
145	S	62	Low	72.3	Confident	38 Å²	38	56 Å²	56	27%	0.266	27%	0.266	S	S	.	.			trans	-68.6	130.6	173.5	51.9	0	0	0	0	109.6	N143 D147 H224	N143-S145 PolarHBondContact O-N 3.05Å; N143-S145 PolarHBondContact O-OG 3.39Å; S145-D147 PolarHBondContact O-N 3.42Å; S145-H224 PolarHBondContact OG-CE1 3.24Å; S145-H224 PolarHBondContact OG-NE2 3.49Å
146	T	63.7	Low	72.3	Confident	97 Å²	97	61.4 Å²	61.4	60%	0.595	29%	0.291	S	S	*	.			trans	-81.9	1.7	170.7	47.1	0	0	0	0	112.4	Y144	Y144-T146 PolarHBondContact O-N 3.16Å
147	D	70.5	Confident	72	Confident	72 Å²	72	62.7 Å²	62.7	39%	0.385	30%	0.299	S	S	.	.	P	Polyproline II helix	trans	-73.6	145	-169.1	-58.1	-27.4	0	0	0	111.5	S145	S145-D147 PolarHBondContact O-N 3.42Å
148	E	77.9	Confident	71.2	Confident	106 Å²	106	66.5 Å²	66.5	50%	0.495	32%	0.319	S	S	.	.	P	Polyproline II helix	trans	-70.8	143.4	174.9	-64.3	-177.6	164.6	0	0	110.4
149	F	78.9	Confident	70.2	Confident	2 Å²	2	67.4 Å²	67.4	1%	0.009	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	124.2	172.5	-168.1	-78.9	0	0	0	109.1	W100 P102 M137 A151 M173 I174 L176 I222 V223 H224	W100-F149 HydrophobicContact CZ3-CE2 4.3Å; P102-F149 HydrophobicContact CG-CE1 4.33Å; P102-F149 HydrophobicContact CG-CE2 4.04Å; P102-F149 HydrophobicContact CG-CZ 3.47Å; P102-F149 VanDerWaalsContact CG-CZ 3.47Å; M137-F149 HydrophobicContact CE-CD1 4.03Å; M137-F149 HydrophobicContact CE-CE1 4.13Å; M137-F149 HydrophobicContact SD-CD1 3.78Å; M137-F149 HydrophobicContact SD-CE1 3.28Å; M137-F149 WeakPolarHBondContact SD-CE1 3.38Å; M137-F149 HydrophobicContact SD-CZ 3.74Å; F149-A151 HydrophobicContact CE1-CB 4.39Å; F149-M173 CarbonylContact O-C 3.44Å; F149-I174 HydrophobicContact CB-CB 4.24Å; F149-I174 HydrophobicContact CD1-CD1 4.14Å; F149-I174 PolarHBondContact N-O 3.24Å; F149-I174 PolarHBondContact O-N 3.49Å; F149-L176 HydrophobicContact CB-CD1 4.09Å; F149-L176 HydrophobicContact CB-CD2 3.94Å; F149-L176 HydrophobicContact CB-CG 3.91Å; F149-I222 HydrophobicContact CD2-CG2 4.49Å; F149-I222 HydrophobicContact CE1-CB 4.49Å; F149-I222 HydrophobicContact CE1-CG1 4.21Å; F149-I222 HydrophobicContact CE1-CG2 3.76Å; F149-I222 HydrophobicContact CE2-CG2 3.53Å; F149-I222 HydrophobicContact CZ-CB 4.12Å; F149-I222 HydrophobicContact CZ-CD1 4.19Å; F149-I222 HydrophobicContact CZ-CG1 4.01Å; F149-I222 HydrophobicContact CZ-CG2 3.09Å; F149-V223 CarbonylContact C-O 3.57Å; F149-V223 WeakPolarHBondContact CA-O 3.39Å; F149-H224 HydrophobicContact CD2-CB 3.99Å; F149-H224 HydrophobicContact CE2-CB 4.39Å
150	I	82	Confident	68.8	Low	35 Å²	35	68.1 Å²	68.1	18%	0.179	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	128.4	-178.2	-51.8	179.2	0	0	0	109	K171 I172 M173 I222 V223	I150-K171 HydrophobicContact CG2-CB 3.66Å; I150-K171 HydrophobicContact CG2-CD 4.06Å; I150-K171 HydrophobicContact CG2-CG 4.05Å; I150-I172 CarbonylContact C-O 3.52Å; I150-I172 VanDerWaalsContact CA-O 3.31Å; I150-I172 WeakPolarHBondContact CA-O 3.42Å; I150-M173 HydrophobicContact CG1-CG 4.24Å; I150-I222 CarbonylContact O-C 3.6Å; I150-I222 VanDerWaalsContact O-CA 3.25Å; I150-I222 WeakPolarHBondContact O-CA 3.45Å; I150-V223 HydrophobicContact CB-CB 4.13Å; I150-V223 PolarHBondContact N-O 3.03Å; I150-V223 PolarHBondContact O-N 2.65Å
151	A	82.3	Confident	67.8	Low	0 Å²	0	73.2 Å²	73.2	0%	0	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	132.5	174.5	0	0	0	0	0	111.2	F149 I172 L187 L189 H221	F149-A151 HydrophobicContact CE1-CB 4.39Å; A151-I172 PolarHBondContact N-O 2.82Å; A151-I172 PolarHBondContact O-N 3.44Å; A151-L187 HydrophobicContact CB-CD1 4.11Å; A151-L189 HydrophobicContact CB-CD2 4.12Å; A151-H221 CarbonylContact C-O 3.56Å; A151-H221 WeakPolarHBondContact CA-O 3.45Å
152	S	82.8	Confident	67	Low	0 Å²	0	73.2 Å²	73.2	0%	0	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	155.2	172	57.5	0	0	0	0	111.9	H154 P170 I220 H221	S152-H154 PolarHBondContact OG-CD2 2.79Å; S152-H154 PolarHBondContact OG-NE2 3.35Å; S152-H154 VanDerWaalsContact OG-NE2 3.17Å; S152-P170 WeakPolarHBondContact CB-O 3.47Å; S152-I220 CarbonylContact O-C 3.51Å; S152-I220 WeakPolarHBondContact O-CA 3.28Å; S152-H221 PolarHBondContact N-O 2.75Å; S152-H221 PolarHBondContact O-N 2.65Å
153	L	84.3	Confident	66.6	Low	0 Å²	0	70.1 Å²	70.1	0%	0	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	127.8	173.7	-178.9	68.3	0	0	0	110	I131 F133 S169 L189 A191 L218 S219	I131-L153 HydrophobicContact CB-CD2 3.97Å; I131-L153 HydrophobicContact CG2-CD2 3.52Å; F133-L153 HydrophobicContact CB-CD1 4.49Å; F133-L153 HydrophobicContact CB-CD2 4.22Å; F133-L153 HydrophobicContact CD1-CD1 4.1Å; L153-S169 WeakPolarHBondContact O-CB 3.19Å; L153-S169 PolarHBondContact O-OG 2.84Å; L153-L189 HydrophobicContact CB-CB 3.86Å; L153-A191 HydrophobicContact CB-CB 4.36Å; L153-A191 HydrophobicContact CD2-CB 3.9Å; L153-A191 HydrophobicContact CG-CB 4.17Å; L153-L218 HydrophobicContact CD1-CB 4.31Å; L153-L218 HydrophobicContact CD1-CD2 4.47Å; L153-S219 CarbonylContact C-O 3.56Å
154	H	80.9	Confident	66.6	Low	75 Å²	75	71.1 Å²	71.1	35%	0.347	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	102.1	175.9	-82.2	-100.2	0	0	0	110.3	S152 S219 H221	S152-H154 PolarHBondContact OG-CD2 2.79Å; S152-H154 PolarHBondContact OG-NE2 3.35Å; S152-H154 VanDerWaalsContact OG-NE2 3.17Å; H154-S219 PolarHBondContact N-O 3.01Å; H154-S219 PolarHBondContact O-N 2.94Å; H154-H221 WeakPolarHBondContact CD2-CB 3.5Å; H154-H221 AromaticContact NE2-ND1 3.79Å
155	P	80.2	Confident	67.3	Low	14 Å²	14	61.2 Å²	61.2	9%	0.091	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	141.9	169	-14	31.7	0	0	0	110.5	I131 W167 A191 I216 H217 L218	I131-P155 HydrophobicContact CD1-CB 3.69Å; I131-P155 HydrophobicContact CD1-CG 3.52Å; P155-W167 HydrophobicContact CB-CD2 3.66Å; P155-W167 HydrophobicContact CB-CE3 4.14Å; P155-W167 HydrophobicContact CB-CG 3.93Å; P155-W167 HydrophobicContact CB-CH2 4.47Å; P155-W167 HydrophobicContact CB-CZ2 4.05Å; P155-W167 HydrophobicContact CG-CB 4.31Å; P155-W167 HydrophobicContact CG-CD2 3.58Å; P155-W167 HydrophobicContact CG-CE3 3.65Å; P155-W167 HydrophobicContact CG-CG 3.88Å; P155-W167 HydrophobicContact CG-CZ3 4.17Å; P155-A191 HydrophobicContact CG-CB 3.29Å; P155-I216 HydrophobicContact CB-CG2 3.85Å; P155-H217 CarbonylContact C-O 3.59Å; P155-H217 WeakPolarHBondContact CA-O 3.49Å; P155-L218 HydrophobicContact CB-CD2 4.08Å; P155-L218 HydrophobicContact CG-CD2 4.33Å
156	H	76	Confident	67.8	Low	113 Å²	113	62.8 Å²	62.8	52%	0.523	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	114.4	173.6	-177	-69	0	0	0	108.9	I158 H217	H156-I158 WeakPolarHBondContact ND1-CG1 3.15Å; H156-I158 PolarHBondContact O-N 2.73Å; H156-H217 HydrophobicContact CB-CB 4.45Å; H156-H217 PolarHBondContact N-O 2.64Å; H156-H217 PolarHBondContact O-N 3.47Å
157	V	71.7	Confident	68.5	Low	27 Å²	27	60 Å²	60	16%	0.164	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	113.3	177.1	-176.8	0	0	0	0	108.8	T165 W167 L197 I214 I216	V157-T165 HydrophobicContact CG2-CG2 4.29Å; V157-T165 WeakPolarHBondContact CG2-OG1 3.19Å; V157-W167 HydrophobicContact CG2-CZ2 4.27Å; V157-L197 HydrophobicContact CG2-CD2 4.22Å; V157-I214 HydrophobicContact CG1-CG2 3.77Å; V157-I216 HydrophobicContact CG2-CG1 4.24Å; V157-I216 HydrophobicContact CG2-CG2 4.35Å
158	I	60.8	Low	68.8	Low	81 Å²	81	61 Å²	61	42%	0.415	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	90.6	169.5	-57.7	-174.2	0	0	0	105.4	H156 T215 H217	H156-I158 WeakPolarHBondContact ND1-CG1 3.15Å; H156-I158 PolarHBondContact O-N 2.73Å; I158-T215 PolarHBondContact N-O 3.01Å; I158-H217 WeakPolarHBondContact CD1-CD2 3.28Å; I158-H217 WeakPolarHBondContact CD1-NE2 3.3Å
159	H	55.3	Low	68.9	Low	82 Å²	82	56.9 Å²	56.9	38%	0.38	32%	0.316	S	S	.	.	S	Bend	trans	179.8	10.9	154.6	-99.1	-58.1	0	0	0	117.9
160	S	45	Very low	68.8	Low	40 Å²	40	59.1 Å²	59.1	28%	0.28	33%	0.331	S	S	.	.			trans	-119.1	116.1	168.5	102.8	0	0	0	0	110.7	T162 S163 N200	S160-T162 PolarHBondContact O-N 2.9Å; S160-T162 VanDerWaalsContact O-N 3.16Å; S160-S163 PolarHBondContact OG-N 2.9Å; S160-S163 PolarHBondContact OG-O 2.74Å; S160-S163 PolarHBondContact OG-OG 3.38Å; S160-N200 PolarHBondContact OG-ND2 2.71Å
161	L	43	Very low	68.9	Low	183 Å²	183	63.2 Å²	63.2	96%	0.958	35%	0.348	S	S	*	.	S	Bend	trans	-64.6	-6.7	171.7	-88.9	150.5	0	0	0	112.4
162	T	45.1	Very low	68.8	Low	120 Å²	120	65.5 Å²	65.5	74%	0.736	36%	0.359	S	S	*	.	S	Bend	trans	-129.5	-11.4	-163.3	50.3	0	0	0	0	116.1	S160	S160-T162 PolarHBondContact O-N 2.9Å; S160-T162 VanDerWaalsContact O-N 3.16Å
163	S	48.2	Very low	68.8	Low	54 Å²	54	70.5 Å²	70.5	38%	0.378	38%	0.384	S	S	.	.			trans	-146.1	128.5	168.7	72.7	0	0	0	0	113.8	S160 T165 N200	S160-S163 PolarHBondContact OG-N 2.9Å; S160-S163 PolarHBondContact OG-O 2.74Å; S160-S163 PolarHBondContact OG-OG 3.38Å; S163-T165 PolarHBondContact O-N 2.78Å; S163-N200 PolarHBondContact OG-ND2 3.39Å
164	S	57.6	Low	68.6	Low	116 Å²	116	71 Å²	71	81%	0.811	39%	0.386	S	S	*	.			trans	-65.6	114.2	162	54	0	0	0	0	108.7	S166	S164-S166 PolarHBondContact O-N 3.42Å
165	T	65.2	Low	68.5	Low	30 Å²	30	69.6 Å²	69.6	18%	0.184	38%	0.381	C	S	.	.			trans	-65.8	123.8	165.9	45.8	0	0	0	0	108.2	V157 S163 W167 D195 L197	V157-T165 HydrophobicContact CG2-CG2 4.29Å; V157-T165 WeakPolarHBondContact CG2-OG1 3.19Å; S163-T165 PolarHBondContact O-N 2.78Å; T165-W167 PolarHBondContact O-N 3.44Å; T165-W167 PolarHBondContact OG1-NE1 2.82Å; T165-D195 HydrophobicContact CG2-CB 4.46Å; T165-L197 HydrophobicContact CG2-CD2 3.91Å
166	S	72.3	Confident	68.1	Low	71 Å²	71	69.9 Å²	69.9	50%	0.497	38%	0.382	S	S	.	.			trans	-81.7	114.1	178.2	64	0	0	0	0	108.9	S164 T193 D195	S164-S166 PolarHBondContact O-N 3.42Å; S166-T193 WeakPolarHBondContact O-CB 3.44Å; S166-T193 PolarHBondContact O-OG1 2.88Å; S166-D195 PolarHBondContact N-OD2 3.04Å; S166-D195 PolarHBondContact OG-OD2 2.85Å
167	W	77.9	Confident	67.9	Low	40 Å²	40	70 Å²	70	15%	0.152	38%	0.383	C	S	.	.			trans	-103.7	126.7	173.7	-69.2	88.3	0	0	0	109.1	W129 I131 P155 V157 T165 A191 Y192 T193 L197 I216	W129-W167 HydrophobicContact CB-CH2 4.28Å; I131-W167 HydrophobicContact CD1-CE3 4.24Å; I131-W167 HydrophobicContact CD1-CH2 3.39Å; I131-W167 HydrophobicContact CD1-CZ2 4.09Å; I131-W167 HydrophobicContact CD1-CZ3 3.49Å; I131-W167 VanDerWaalsContact CD1-CZ3 3.49Å; I131-W167 HydrophobicContact CG1-CH2 4.01Å; I131-W167 HydrophobicContact CG1-CZ3 3.95Å; P155-W167 HydrophobicContact CB-CD2 3.66Å; P155-W167 HydrophobicContact CB-CE3 4.14Å; P155-W167 HydrophobicContact CB-CG 3.93Å; P155-W167 HydrophobicContact CB-CH2 4.47Å; P155-W167 HydrophobicContact CB-CZ2 4.05Å; P155-W167 HydrophobicContact CG-CB 4.31Å; P155-W167 HydrophobicContact CG-CD2 3.58Å; P155-W167 HydrophobicContact CG-CE3 3.65Å; P155-W167 HydrophobicContact CG-CG 3.88Å; P155-W167 HydrophobicContact CG-CZ3 4.17Å; V157-W167 HydrophobicContact CG2-CZ2 4.27Å; T165-W167 PolarHBondContact O-N 3.44Å; T165-W167 PolarHBondContact OG1-NE1 2.82Å; W167-A191 HydrophobicContact CE3-CB 3.97Å; W167-Y192 CarbonylContact C-O 3.54Å; W167-Y192 WeakPolarHBondContact CA-O 3.22Å; W167-T193 HydrophobicContact CD2-CG2 4.06Å; W167-T193 HydrophobicContact CE3-CG2 3.88Å; W167-T193 HydrophobicContact CH2-CG2 3.6Å; W167-T193 HydrophobicContact CZ2-CG2 3.76Å; W167-T193 HydrophobicContact CZ3-CG2 3.66Å; W167-L197 HydrophobicContact CH2-CD1 4.3Å; W167-L197 HydrophobicContact CZ2-CD1 4.27Å; W167-L197 HydrophobicContact CZ2-CD2 3.85Å; W167-I216 HydrophobicContact CZ2-CD1 4.3Å; W167-I216 HydrophobicContact CZ2-CG2 4.49Å
168	F	77.5	Confident	67.9	Low	91 Å²	91	76.7 Å²	76.7	40%	0.399	41%	0.41	S	S	.	.	B	Isolated β-bridge	trans	-87.7	127.2	163.3	-178.3	-88.6	0	0	0	109.4	P170 A191 Y192	F168-P170 HydrophobicContact CD1-CG 4.09Å; F168-P170 HydrophobicContact CE1-CB 4.45Å; F168-P170 HydrophobicContact CE1-CG 3.77Å; F168-A191 CarbonylContact O-C 3.6Å; F168-A191 VanDerWaalsContact O-CA 3.29Å; F168-A191 WeakPolarHBondContact O-CA 3.41Å; F168-Y192 HydrophobicContact CB-CD1 3.82Å; F168-Y192 HydrophobicContact CB-CD2 3.89Å; F168-Y192 HydrophobicContact CB-CE1 3.45Å; F168-Y192 VanDerWaalsContact CB-CE1 3.45Å; F168-Y192 HydrophobicContact CB-CE2 3.44Å; F168-Y192 VanDerWaalsContact CB-CE2 3.44Å; F168-Y192 HydrophobicContact CB-CG 4.03Å; F168-Y192 WeakPolarHBondContact CB-OH 3.05Å; F168-Y192 AromaticContact CD1-CD1 3.44Å; F168-Y192 HydrophobicContact CD1-CD1 3.44Å; F168-Y192 VanDerWaalsContact CD1-CD1 3.44Å; F168-Y192 AromaticContact CD1-CE1 2.83Å; F168-Y192 HydrophobicContact CD1-CE1 2.83Å; F168-Y192 HydrophobicContact CD1-CE2 4.44Å; F168-Y192 HydrophobicContact CD1-CG 4.45Å; F168-Y192 AromaticContact CD1-CZ 3.4Å; F168-Y192 VanDerWaalsContact CD1-CZ 3.4Å; F168-Y192 HydrophobicContact CD2-CE1 4.27Å; F168-Y192 AromaticContact CD2-CZ 4Å; F168-Y192 WeakPolarHBondContact CD2-OH 3.35Å; F168-Y192 HydrophobicContact CE1-CD1 4.28Å; F168-Y192 AromaticContact CE1-CE1 3.48Å; F168-Y192 HydrophobicContact CE1-CE1 3.48Å; F168-Y192 VanDerWaalsContact CE1-CE1 3.48Å; F168-Y192 AromaticContact CG-CD1 3.99Å; F168-Y192 HydrophobicContact CG-CD1 3.99Å; F168-Y192 AromaticContact CG-CE1 3.27Å; F168-Y192 HydrophobicContact CG-CE1 3.27Å; F168-Y192 HydrophobicContact CG-CE2 4.07Å; F168-Y192 AromaticContact CG-CZ 3.25Å; F168-Y192 WeakPolarHBondContact CG-OH 3.35Å; F168-Y192 HydrophobicContact CZ-CE1 4.43Å; F168-Y192 PolarHBondContact N-O 3.41Å; F168-Y192 PolarHBondContact O-N 3.13Å
169	S	79.4	Confident	68.1	Low	20 Å²	20	76.2 Å²	76.2	14%	0.14	41%	0.405	C	S	.	.			trans	-129.3	99.8	-174.8	-65.6	0	0	0	0	109.6	L153 K171	L153-S169 WeakPolarHBondContact O-CB 3.19Å; L153-S169 PolarHBondContact O-OG 2.84Å; S169-K171 PolarHBondContact O-N 3.02Å
170	P	77.8	Confident	68.6	Low	49 Å²	49	75.2 Å²	75.2	32%	0.318	41%	0.406	S	S	.	.	P	Polyproline II helix	trans	-54.2	139.6	173.5	-17.9	25.9	0	0	0	111.2	S152 F168 F190	S152-P170 WeakPolarHBondContact CB-O 3.47Å; F168-P170 HydrophobicContact CD1-CG 4.09Å; F168-P170 HydrophobicContact CE1-CB 4.45Å; F168-P170 HydrophobicContact CE1-CG 3.77Å; P170-F190 WeakPolarHBondContact CD-O 3.48Å; P170-F190 HydrophobicContact CG-CB 4.48Å
171	K	83.6	Confident	69.6	Low	122 Å²	122	76.5 Å²	76.5	53%	0.53	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	124.7	175.2	-68.3	179.7	-177.5	-177.3	0	109.1	I150 S169	I150-K171 HydrophobicContact CG2-CB 3.66Å; I150-K171 HydrophobicContact CG2-CD 4.06Å; I150-K171 HydrophobicContact CG2-CG 4.05Å; S169-K171 PolarHBondContact O-N 3.02Å
172	I	80	Confident	70.8	Confident	48 Å²	48	72.3 Å²	72.3	25%	0.246	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	118.2	171.3	-57.2	-176.6	0	0	0	107.7	I150 A151 I174 L187 N188 L189	I150-I172 CarbonylContact C-O 3.52Å; I150-I172 VanDerWaalsContact CA-O 3.31Å; I150-I172 WeakPolarHBondContact CA-O 3.42Å; A151-I172 PolarHBondContact N-O 2.82Å; A151-I172 PolarHBondContact O-N 3.44Å; I172-I174 HydrophobicContact CG2-CG1 4.08Å; I172-L187 HydrophobicContact CD1-CB 4.33Å; I172-L187 HydrophobicContact CG2-CD2 4.37Å; I172-N188 WeakPolarHBondContact CD1-O 3.5Å; I172-L189 HydrophobicContact CD1-CD2 3.69Å; I172-L189 HydrophobicContact CG1-CD2 4.2Å
173	M	83.4	Confident	72.1	Confident	104 Å²	104	71.5 Å²	71.5	51%	0.512	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	127.9	172.6	-55	-167.7	-56.6	0	0	109.2	F149 I150	F149-M173 CarbonylContact O-C 3.44Å; I150-M173 HydrophobicContact CG1-CG 4.24Å
174	I	79	Confident	73.5	Confident	10 Å²	10	73.2 Å²	73.2	5%	0.051	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	112.5	-179.1	-55.8	171.2	0	0	0	106.7	M137 F149 I172 L176 F179 I185 L187	M137-I174 HydrophobicContact CE-CD1 3.35Å; M137-I174 HydrophobicContact CE-CG2 4.41Å; M137-I174 HydrophobicContact SD-CD1 4.03Å; F149-I174 HydrophobicContact CB-CB 4.24Å; F149-I174 HydrophobicContact CD1-CD1 4.14Å; F149-I174 PolarHBondContact N-O 3.24Å; F149-I174 PolarHBondContact O-N 3.49Å; I172-I174 HydrophobicContact CG2-CG1 4.08Å; I174-L176 HydrophobicContact CG2-CD2 4.35Å; I174-L176 PolarHBondContact O-N 2.78Å; I174-L176 VanDerWaalsContact O-N 3.13Å; I174-F179 HydrophobicContact CG2-CD2 4.42Å; I174-I185 HydrophobicContact CG2-CD1 3.66Å; I174-L187 HydrophobicContact CD1-CD1 3.99Å; I174-L187 HydrophobicContact CD1-CD2 3.58Å; I174-L187 HydrophobicContact CD1-CG 4.44Å; I174-L187 HydrophobicContact CG1-CD2 4.34Å
175	D	79.2	Confident	74.5	Confident	46 Å²	46	68.6 Å²	68.6	25%	0.246	35%	0.349	C	S	.	.			trans	-73	101.9	172.4	-178.5	-10.9	0	0	0	109	Q177 K178	D175-Q177 PolarHBondContact O-N 3.38Å; D175-Q177 VanDerWaalsContact OD1-CB 3.28Å; D175-Q177 WeakPolarHBondContact OD1-CB 3.45Å; D175-Q177 PolarHBondContact OD1-N 3.23Å; D175-K178 HydrophobicContact CB-CD 4.46Å; D175-K178 PolarHBondContact O-N 2.73Å; D175-K178 WeakPolarHBondContact OD2-CD 3.11Å; D175-K178 VanDerWaalsContact OD2-CE 3.31Å; D175-K178 WeakPolarHBondContact OD2-CE 3.44Å; D175-K178 WeakPolarHBondContact OD2-CG 3.42Å; D175-K178 IonicContact OD2-NZ 2.84Å; D175-K178 PolarHBondContact OD2-NZ 2.81Å
176	L	71.5	Confident	75.4	Confident	21 Å²	21	70.9 Å²	70.9	11%	0.11	36%	0.361	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-22.4	-180	-67.8	-175.7	0	0	0	112.6	I139 R142 F149 I174 F179	I139-L176 HydrophobicContact CD1-CD2 3.35Å; R142-L176 PolarHBondContact NH2-O 3.49Å; F149-L176 HydrophobicContact CB-CD1 4.09Å; F149-L176 HydrophobicContact CB-CD2 3.94Å; F149-L176 HydrophobicContact CB-CG 3.91Å; I174-L176 HydrophobicContact CG2-CD2 4.35Å; I174-L176 PolarHBondContact O-N 2.78Å; I174-L176 VanDerWaalsContact O-N 3.13Å; L176-F179 PolarHBondContact O-N 2.91Å
177	Q	72.1	Confident	75.7	Confident	115 Å²	115	67.8 Å²	67.8	54%	0.537	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-43.2	178.9	-58.7	-174.4	8.8	0	0	110.8	R142 D175 F179	R142-Q177 PolarHBondContact NH2-O 2.98Å; R142-Q177 VanDerWaalsContact NH2-O 3.09Å; D175-Q177 PolarHBondContact O-N 3.38Å; D175-Q177 VanDerWaalsContact OD1-CB 3.28Å; D175-Q177 WeakPolarHBondContact OD1-CB 3.45Å; D175-Q177 PolarHBondContact OD1-N 3.23Å; Q177-F179 VanDerWaalsContact C-N 3.3Å; Q177-F179 PolarHBondContact O-N 3.37Å
178	K	71.2	Confident	75.9	Confident	168 Å²	168	69.7 Å²	69.7	73%	0.73	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74	-17	-179	-68.8	-178.6	-175	116.5	0	113.9	D175	D175-K178 HydrophobicContact CB-CD 4.46Å; D175-K178 PolarHBondContact O-N 2.73Å; D175-K178 WeakPolarHBondContact OD2-CD 3.11Å; D175-K178 VanDerWaalsContact OD2-CE 3.31Å; D175-K178 WeakPolarHBondContact OD2-CE 3.44Å; D175-K178 WeakPolarHBondContact OD2-CG 3.42Å; D175-K178 IonicContact OD2-NZ 2.84Å; D175-K178 PolarHBondContact OD2-NZ 2.81Å
179	F	66.8	Low	76.2	Confident	70 Å²	70	65.4 Å²	65.4	31%	0.307	33%	0.333	S	S	.	.	S	Bend	trans	-103	109.7	-172.2	-120.6	-73.7	0	0	0	113.5	R142 I174 L176 Q177 Q183 I185	R142-F179 VanDerWaalsContact NH2-C 3.33Å; R142-F179 PolarHBondContact NH2-O 3.44Å; I174-F179 HydrophobicContact CG2-CD2 4.42Å; L176-F179 PolarHBondContact O-N 2.91Å; Q177-F179 VanDerWaalsContact C-N 3.3Å; Q177-F179 PolarHBondContact O-N 3.37Å; F179-Q183 HydrophobicContact CD1-CB 4.41Å; F179-Q183 HydrophobicContact CE1-CB 4.41Å; F179-I185 HydrophobicContact CB-CD1 4.14Å; F179-I185 HydrophobicContact CD1-CD1 3.42Å; F179-I185 VanDerWaalsContact CD1-CD1 3.42Å; F179-I185 HydrophobicContact CD1-CG1 3.61Å; F179-I185 HydrophobicContact CD2-CD1 3.62Å; F179-I185 HydrophobicContact CD2-CG1 4.4Å; F179-I185 HydrophobicContact CE1-CB 4.28Å; F179-I185 HydrophobicContact CE1-CD1 3.65Å; F179-I185 HydrophobicContact CE1-CG1 3.38Å; F179-I185 HydrophobicContact CE1-CG2 4.42Å; F179-I185 HydrophobicContact CE2-CD1 3.79Å; F179-I185 HydrophobicContact CE2-CG1 4.18Å; F179-I185 HydrophobicContact CE2-CG2 4.03Å; F179-I185 HydrophobicContact CG-CD1 3.4Å; F179-I185 VanDerWaalsContact CG-CD1 3.4Å; F179-I185 HydrophobicContact CG-CG1 4.12Å; F179-I185 HydrophobicContact CZ-CB 4.16Å; F179-I185 HydrophobicContact CZ-CD1 3.8Å; F179-I185 HydrophobicContact CZ-CG1 3.67Å; F179-I185 HydrophobicContact CZ-CG2 3.81Å
180	P	64.6	Low	76.3	Confident	61 Å²	61	68.3 Å²	68.3	40%	0.396	34%	0.343	S	S	.	.			trans	-54.8	140.8	-177.1	-22.5	31.4	0	0	0	113.2	Q183	P180-Q183 HydrophobicContact CB-CG 4.08Å; P180-Q183 HydrophobicContact CG-CG 4.45Å; P180-Q183 PolarHBondContact O-N 3.16Å
181	S	67.1	Low	76.4	Confident	67 Å²	67	66 Å²	66	47%	0.469	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.9	143.5	171.5	54	0	0	0	0	110.8	Q183	S181-Q183 VanDerWaalsContact C-N 3.29Å; S181-Q183 PolarHBondContact O-N 3.29Å
182	N	67.1	Low	76.2	Confident	96 Å²	96	64.9 Å²	64.9	51%	0.513	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	70.5	3	-176.6	-62.6	-32.7	0	0	0	117.3	K138 I139 D140	K138-N182 WeakPolarHBondContact CE-O 3.28Å; I139-N182 PolarHBondContact O-N 3.2Å; D140-N182 PolarHBondContact O-OD1 3.19Å
183	Q	72.6	Confident	75.8	Confident	103 Å²	103	62.7 Å²	62.7	48%	0.481	31%	0.31	S	S	.	.			trans	-84.7	148.9	170.2	-73	-172.7	-5.1	0	0	112.2	F179 P180 S181	F179-Q183 HydrophobicContact CD1-CB 4.41Å; F179-Q183 HydrophobicContact CE1-CB 4.41Å; P180-Q183 HydrophobicContact CB-CG 4.08Å; P180-Q183 HydrophobicContact CG-CG 4.45Å; P180-Q183 PolarHBondContact O-N 3.16Å; S181-Q183 VanDerWaalsContact C-N 3.29Å; S181-Q183 PolarHBondContact O-N 3.29Å
184	Q	77.7	Confident	75.1	Confident	89 Å²	89	60.4 Å²	60.4	42%	0.416	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	130.3	176.4	-178.8	172.3	-6.2	0	0	109.3	H107 S136 M137	H107-Q184 PolarHBondContact CE1-NE2 3.41Å; S136-Q184 PolarHBondContact OG-NE2 2.95Å; M137-Q184 WeakPolarHBondContact O-CA 3.38Å
185	I	79.6	Confident	74.6	Confident	19 Å²	19	62.4 Å²	62.4	10%	0.097	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	118.7	178.6	-42.7	-168	0	0	0	108.4	S136 M137 I174 F179 L187	S136-I185 CarbonylContact C-O 3.51Å; S136-I185 WeakPolarHBondContact CA-O 3.12Å; S136-I185 VanDerWaalsContact CB-O 3.25Å; S136-I185 WeakPolarHBondContact CB-O 3.35Å; M137-I185 HydrophobicContact CE-CD1 3.97Å; M137-I185 PolarHBondContact N-O 3.16Å; M137-I185 PolarHBondContact O-N 3.36Å; I174-I185 HydrophobicContact CG2-CD1 3.66Å; F179-I185 HydrophobicContact CB-CD1 4.14Å; F179-I185 HydrophobicContact CD1-CD1 3.42Å; F179-I185 VanDerWaalsContact CD1-CD1 3.42Å; F179-I185 HydrophobicContact CD1-CG1 3.61Å; F179-I185 HydrophobicContact CD2-CD1 3.62Å; F179-I185 HydrophobicContact CD2-CG1 4.4Å; F179-I185 HydrophobicContact CE1-CB 4.28Å; F179-I185 HydrophobicContact CE1-CD1 3.65Å; F179-I185 HydrophobicContact CE1-CG1 3.38Å; F179-I185 HydrophobicContact CE1-CG2 4.42Å; F179-I185 HydrophobicContact CE2-CD1 3.79Å; F179-I185 HydrophobicContact CE2-CG1 4.18Å; F179-I185 HydrophobicContact CE2-CG2 4.03Å; F179-I185 HydrophobicContact CG-CD1 3.4Å; F179-I185 VanDerWaalsContact CG-CD1 3.4Å; F179-I185 HydrophobicContact CG-CG1 4.12Å; F179-I185 HydrophobicContact CZ-CB 4.16Å; F179-I185 HydrophobicContact CZ-CD1 3.8Å; F179-I185 HydrophobicContact CZ-CG1 3.67Å; F179-I185 HydrophobicContact CZ-CG2 3.81Å; I185-L187 HydrophobicContact CB-CD2 4.43Å; I185-L187 HydrophobicContact CG2-CD2 3.77Å; I185-L187 PolarHBondContact O-N 3.13Å
186	D	83	Confident	74	Confident	79 Å²	79	62.8 Å²	62.8	42%	0.422	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	124.2	171.3	-79	8.4	0	0	0	110.2	H107 R134 S136	H107-D186 IonicContact NE2-OD1 2.64Å; R134-D186 IonicContact CZ-OD2 3.94Å; R134-D186 IonicContact NE-OD2 2.85Å; R134-D186 IonicContact NH2-OD2 3.6Å; R134-D186 PolarHBondContact NH2-OD2 3.29Å; S136-D186 PolarHBondContact OG-OD1 2.92Å
187	L	79.4	Confident	73.7	Confident	5 Å²	5	62.4 Å²	62.4	3%	0.026	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	130.3	174.7	-49.2	-179.1	0	0	0	109.9	F104 R134 L135 M137 A151 I172 I174 I185 L189	F104-L187 HydrophobicContact CE1-CD1 4.49Å; R134-L187 WeakPolarHBondContact CA-O 3.13Å; L135-L187 HydrophobicContact CD1-CB 3.73Å; L135-L187 HydrophobicContact CD1-CD1 3.81Å; L135-L187 HydrophobicContact CD1-CG 3.92Å; L135-L187 HydrophobicContact CG-CB 4.26Å; L135-L187 PolarHBondContact N-O 3.48Å; L135-L187 PolarHBondContact O-N 3.45Å; M137-L187 HydrophobicContact CB-CD1 3.82Å; M137-L187 HydrophobicContact CB-CG 4.27Å; M137-L187 HydrophobicContact CG-CD1 4.49Å; M137-L187 HydrophobicContact SD-CD1 4.11Å; A151-L187 HydrophobicContact CB-CD1 4.11Å; I172-L187 HydrophobicContact CD1-CB 4.33Å; I172-L187 HydrophobicContact CG2-CD2 4.37Å; I174-L187 HydrophobicContact CD1-CD1 3.99Å; I174-L187 HydrophobicContact CD1-CD2 3.58Å; I174-L187 HydrophobicContact CD1-CG 4.44Å; I174-L187 HydrophobicContact CG1-CD2 4.34Å; I185-L187 HydrophobicContact CB-CD2 4.43Å; I185-L187 HydrophobicContact CG2-CD2 3.77Å; I185-L187 PolarHBondContact O-N 3.13Å; L187-L189 HydrophobicContact CB-CD2 4.38Å; L187-L189 HydrophobicContact CB-CG 4.45Å
188	N	82	Confident	73.2	Confident	80 Å²	80	57.6 Å²	57.6	43%	0.428	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	94.7	168.8	-66	-42.5	0	0	0	108	R134 I172 F190	R134-N188 WeakPolarHBondContact CD-OD1 3.23Å; R134-N188 VanDerWaalsContact CG-OD1 3.28Å; R134-N188 WeakPolarHBondContact CG-OD1 3.44Å; I172-N188 WeakPolarHBondContact CD1-O 3.5Å; N188-F190 HydrophobicContact CB-CE2 3.6Å; N188-F190 HydrophobicContact CB-CZ 3.75Å; N188-F190 WeakPolarHBondContact O-CD2 3.1Å; N188-F190 WeakPolarHBondContact O-CE2 3.14Å
189	L	83.3	Confident	72.4	Confident	1 Å²	1	56.1 Å²	56.1	1%	0.005	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	140.1	177.3	-53.9	176.8	0	0	0	109.8	F133 L135 A151 L153 I172 L187 I220	F133-L189 HydrophobicContact CD1-CD1 4.28Å; F133-L189 PolarHBondContact N-O 3.32Å; F133-L189 PolarHBondContact O-N 3.48Å; L135-L189 HydrophobicContact CD2-CD1 3.71Å; L135-L189 HydrophobicContact CD2-CG 4.46Å; L135-L189 HydrophobicContact CG-CD1 4.49Å; A151-L189 HydrophobicContact CB-CD2 4.12Å; L153-L189 HydrophobicContact CB-CB 3.86Å; I172-L189 HydrophobicContact CD1-CD2 3.69Å; I172-L189 HydrophobicContact CG1-CD2 4.2Å; L187-L189 HydrophobicContact CB-CD2 4.38Å; L187-L189 HydrophobicContact CB-CG 4.45Å; L189-I220 HydrophobicContact CD1-CG1 4.17Å; L189-I220 HydrophobicContact CD1-CG2 3.87Å
190	F	80.7	Confident	71.6	Confident	81 Å²	81	54.7 Å²	54.7	36%	0.355	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	152.9	179.6	-58.2	-82.1	0	0	0	110.5	L130 I131 C132 P170 N188	L130-F190 HydrophobicContact CD1-CB 4.4Å; L130-F190 HydrophobicContact CD1-CD1 4.32Å; I131-F190 VanDerWaalsContact O-CA 3.28Å; I131-F190 WeakPolarHBondContact O-CA 3.1Å; C132-F190 HydrophobicContact CB-CD1 4.12Å; C132-F190 HydrophobicContact CB-CE1 4.01Å; C132-F190 VanDerWaalsContact SG-CE1 3.59Å; P170-F190 WeakPolarHBondContact CD-O 3.48Å; P170-F190 HydrophobicContact CG-CB 4.48Å; N188-F190 HydrophobicContact CB-CE2 3.6Å; N188-F190 HydrophobicContact CB-CZ 3.75Å; N188-F190 WeakPolarHBondContact O-CD2 3.1Å; N188-F190 WeakPolarHBondContact O-CE2 3.14Å
191	A	80.9	Confident	70.7	Confident	0 Å²	0	52.8 Å²	52.8	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	135.4	163.4	0	0	0	0	0	108.6	I131 L153 P155 W167 F168	I131-A191 PolarHBondContact N-O 3.18Å; I131-A191 PolarHBondContact O-N 3.19Å; L153-A191 HydrophobicContact CB-CB 4.36Å; L153-A191 HydrophobicContact CD2-CB 3.9Å; L153-A191 HydrophobicContact CG-CB 4.17Å; P155-A191 HydrophobicContact CG-CB 3.29Å; W167-A191 HydrophobicContact CE3-CB 3.97Å; F168-A191 CarbonylContact O-C 3.6Å; F168-A191 VanDerWaalsContact O-CA 3.29Å; F168-A191 WeakPolarHBondContact O-CA 3.41Å
192	Y	78.4	Confident	69.7	Low	99 Å²	99	51.9 Å²	51.9	39%	0.388	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	150.6	178.3	77.1	-109.8	0	0	0	111.3	W129 W167 F168	W129-Y192 CarbonylContact O-C 3.55Å; W129-Y192 VanDerWaalsContact O-CA 3.27Å; W129-Y192 WeakPolarHBondContact O-CA 3.49Å; W167-Y192 CarbonylContact C-O 3.54Å; W167-Y192 WeakPolarHBondContact CA-O 3.22Å; F168-Y192 HydrophobicContact CB-CD1 3.82Å; F168-Y192 HydrophobicContact CB-CD2 3.89Å; F168-Y192 HydrophobicContact CB-CE1 3.45Å; F168-Y192 VanDerWaalsContact CB-CE1 3.45Å; F168-Y192 HydrophobicContact CB-CE2 3.44Å; F168-Y192 VanDerWaalsContact CB-CE2 3.44Å; F168-Y192 HydrophobicContact CB-CG 4.03Å; F168-Y192 WeakPolarHBondContact CB-OH 3.05Å; F168-Y192 AromaticContact CD1-CD1 3.44Å; F168-Y192 HydrophobicContact CD1-CD1 3.44Å; F168-Y192 VanDerWaalsContact CD1-CD1 3.44Å; F168-Y192 AromaticContact CD1-CE1 2.83Å; F168-Y192 HydrophobicContact CD1-CE1 2.83Å; F168-Y192 HydrophobicContact CD1-CE2 4.44Å; F168-Y192 HydrophobicContact CD1-CG 4.45Å; F168-Y192 AromaticContact CD1-CZ 3.4Å; F168-Y192 VanDerWaalsContact CD1-CZ 3.4Å; F168-Y192 HydrophobicContact CD2-CE1 4.27Å; F168-Y192 AromaticContact CD2-CZ 4Å; F168-Y192 WeakPolarHBondContact CD2-OH 3.35Å; F168-Y192 HydrophobicContact CE1-CD1 4.28Å; F168-Y192 AromaticContact CE1-CE1 3.48Å; F168-Y192 HydrophobicContact CE1-CE1 3.48Å; F168-Y192 VanDerWaalsContact CE1-CE1 3.48Å; F168-Y192 AromaticContact CG-CD1 3.99Å; F168-Y192 HydrophobicContact CG-CD1 3.99Å; F168-Y192 AromaticContact CG-CE1 3.27Å; F168-Y192 HydrophobicContact CG-CE1 3.27Å; F168-Y192 HydrophobicContact CG-CE2 4.07Å; F168-Y192 AromaticContact CG-CZ 3.25Å; F168-Y192 WeakPolarHBondContact CG-OH 3.35Å; F168-Y192 HydrophobicContact CZ-CE1 4.43Å; F168-Y192 PolarHBondContact N-O 3.41Å; F168-Y192 PolarHBondContact O-N 3.13Å
193	T	73	Confident	68.4	Low	2 Å²	2	53.9 Å²	53.9	1%	0.012	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	142.8	166.6	-175.1	0	0	0	0	110.4	R128 W129 S166 W167 D195 L197	R128-T193 WeakPolarHBondContact CA-O 3.34Å; W129-T193 HydrophobicContact CB-CG2 3.82Å; W129-T193 HydrophobicContact CG-CG2 4.43Å; W129-T193 PolarHBondContact N-O 3.3Å; W129-T193 PolarHBondContact O-N 2.93Å; S166-T193 WeakPolarHBondContact O-CB 3.44Å; S166-T193 PolarHBondContact O-OG1 2.88Å; W167-T193 HydrophobicContact CD2-CG2 4.06Å; W167-T193 HydrophobicContact CE3-CG2 3.88Å; W167-T193 HydrophobicContact CH2-CG2 3.6Å; W167-T193 HydrophobicContact CZ2-CG2 3.76Å; W167-T193 HydrophobicContact CZ3-CG2 3.66Å; T193-D195 VanDerWaalsContact C-N 3.34Å; T193-D195 WeakPolarHBondContact OG1-CB 3.43Å; T193-D195 PolarHBondContact OG1-N 3Å; T193-D195 PolarHBondContact OG1-OD2 3.44Å; T193-L197 HydrophobicContact CG2-CD2 4.02Å; T193-L197 HydrophobicContact CG2-CG 4.39Å
194	S	68.3	Low	66.8	Low	57 Å²	57	54 Å²	54	40%	0.399	27%	0.269	S	S	.	.			trans	-90.7	-4.5	167.2	53.5	0	0	0	0	112.8
195	D	67.5	Low	65.1	Low	51 Å²	51	52.3 Å²	52.3	27%	0.273	26%	0.262	S	S	.	.	S	Bend	trans	-72.3	134.9	179.3	-59.6	-23.5	0	0	0	108.4	T165 S166 T193 L197	T165-D195 HydrophobicContact CG2-CB 4.46Å; S166-D195 PolarHBondContact N-OD2 3.04Å; S166-D195 PolarHBondContact OG-OD2 2.85Å; T193-D195 VanDerWaalsContact C-N 3.34Å; T193-D195 WeakPolarHBondContact OG1-CB 3.43Å; T193-D195 PolarHBondContact OG1-N 3Å; T193-D195 PolarHBondContact OG1-OD2 3.44Å; D195-L197 PolarHBondContact O-N 2.66Å
196	N	66.6	Low	63.2	Low	55 Å²	55	57.6 Å²	57.6	29%	0.294	29%	0.291	S	S	.	.			trans	-70.8	104.8	171.2	173.1	17.8	0	0	0	108	F198 F199	N196-F198 PolarHBondContact O-N 2.69Å; N196-F198 PolarHBondContact OD1-N 3.24Å; N196-F199 HydrophobicContact CB-CB 3.92Å; N196-F199 PolarHBondContact ND2-N 3.1Å; N196-F199 WeakPolarHBondContact O-CB 3.44Å; N196-F199 PolarHBondContact O-N 3.43Å
197	L	65.7	Low	61.1	Low	13 Å²	13	58.4 Å²	58.4	7%	0.068	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.4	-28	179.1	-65.1	-179.1	0	0	0	112.8	W129 V157 T165 W167 T193 D195 I214 I216	W129-L197 HydrophobicContact CB-CD1 3.96Å; W129-L197 HydrophobicContact CB-CG 4.45Å; W129-L197 VanDerWaalsContact CD1-CG 3.49Å; W129-L197 HydrophobicContact CD2-CD1 3.54Å; W129-L197 HydrophobicContact CD2-CG 4.11Å; W129-L197 HydrophobicContact CE3-CD1 4.1Å; W129-L197 HydrophobicContact CG-CD1 3.48Å; W129-L197 VanDerWaalsContact CG-CD1 3.48Å; W129-L197 HydrophobicContact CG-CG 3.79Å; W129-L197 HydrophobicContact CZ2-CB 4.34Å; W129-L197 HydrophobicContact CZ2-CD1 4.39Å; V157-L197 HydrophobicContact CG2-CD2 4.22Å; T165-L197 HydrophobicContact CG2-CD2 3.91Å; W167-L197 HydrophobicContact CH2-CD1 4.3Å; W167-L197 HydrophobicContact CZ2-CD1 4.27Å; W167-L197 HydrophobicContact CZ2-CD2 3.85Å; T193-L197 HydrophobicContact CG2-CD2 4.02Å; T193-L197 HydrophobicContact CG2-CG 4.39Å; D195-L197 PolarHBondContact O-N 2.66Å; L197-I214 VanDerWaalsContact C-CD1 3.45Å; L197-I214 HydrophobicContact CB-CD1 3.86Å; L197-I214 WeakPolarHBondContact O-CD1 3.5Å; L197-I216 HydrophobicContact CD1-CD1 3.85Å
198	F	61.3	Low	59.3	Low	14 Å²	14	64.3 Å²	64.3	6%	0.061	33%	0.327	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.7	-10.1	178.7	-63.7	-69.6	0	0	0	115.1	W129 N196 N200 N201 I214 I239 L241 L244	W129-F198 HydrophobicContact CH2-CD2 4.42Å; W129-F198 AromaticContact CH2-CE2 3.57Å; W129-F198 HydrophobicContact CH2-CE2 3.57Å; W129-F198 HydrophobicContact CH2-CZ 4.16Å; W129-F198 AromaticContact CZ2-CD2 3.81Å; W129-F198 HydrophobicContact CZ2-CD2 3.81Å; W129-F198 AromaticContact CZ2-CE2 3.4Å; W129-F198 HydrophobicContact CZ2-CE2 3.4Å; W129-F198 HydrophobicContact CZ2-CZ 4.32Å; N196-F198 PolarHBondContact O-N 2.69Å; N196-F198 PolarHBondContact OD1-N 3.24Å; F198-N200 PolarHBondContact O-N 2.76Å; F198-N201 PolarHBondContact O-N 3.29Å; F198-I214 HydrophobicContact CD1-CD1 3.33Å; F198-I214 HydrophobicContact CD1-CG1 4.23Å; F198-I214 HydrophobicContact CE1-CD1 3.46Å; F198-I214 VanDerWaalsContact CE1-CD1 3.46Å; F198-I214 HydrophobicContact CE1-CG1 4.2Å; F198-I214 HydrophobicContact CG-CD1 3.97Å; F198-I214 HydrophobicContact CZ-CD1 4.24Å; F198-I239 HydrophobicContact CZ-CG2 3.92Å; F198-L241 HydrophobicContact CD1-CB 3.95Å; F198-L241 HydrophobicContact CD1-CD1 4.24Å; F198-L241 HydrophobicContact CD2-CD1 3.92Å; F198-L241 HydrophobicContact CE1-CB 3.77Å; F198-L241 HydrophobicContact CE1-CD1 4.33Å; F198-L241 VanDerWaalsContact CE1-N 3.31Å; F198-L241 HydrophobicContact CE2-CD1 3.96Å; F198-L241 HydrophobicContact CG-CD1 4.06Å; F198-L241 HydrophobicContact CZ-CB 4.23Å; F198-L241 HydrophobicContact CZ-CD1 4.19Å; F198-L244 HydrophobicContact CE2-CD1 4.07Å; F198-L244 HydrophobicContact CZ-CD1 4.38Å
199	F	55.8	Low	57.3	Low	136 Å²	136	65.4 Å²	65.4	60%	0.596	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	-28.9	-170.9	-170.1	-103.5	0	0	0	114	N196 D202	N196-F199 HydrophobicContact CB-CB 3.92Å; N196-F199 PolarHBondContact ND2-N 3.1Å; N196-F199 WeakPolarHBondContact O-CB 3.44Å; N196-F199 PolarHBondContact O-N 3.43Å; F199-D202 WeakPolarHBondContact CA-OD2 3.06Å; F199-D202 WeakPolarHBondContact O-CB 3.43Å; F199-D202 VanDerWaalsContact O-CG 3.29Å
200	N	48.5	Very low	55.5	Low	41 Å²	41	71.5 Å²	71.5	22%	0.219	37%	0.366	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.1	-7.9	178	-71	0.5	0	0	0	114.1	S160 S163 F198	S160-N200 PolarHBondContact OG-ND2 2.71Å; S163-N200 PolarHBondContact OG-ND2 3.39Å; F198-N200 PolarHBondContact O-N 2.76Å
201	N	47.2	Very low	54	Low	20 Å²	20	71.8 Å²	71.8	11%	0.107	37%	0.371	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.8	-14.9	167.7	-84	15.3	0	0	0	111.1	F198 D203 H204 I205	F198-N201 PolarHBondContact O-N 3.29Å; N201-D203 VanDerWaalsContact C-N 3.25Å; N201-D203 PolarHBondContact O-N 2.78Å; N201-H204 PolarHBondContact O-N 3.28Å; N201-I205 PolarHBondContact O-N 2.63Å
202	D	44.9	Very low	52.8	Low	49 Å²	49	75.5 Å²	75.5	26%	0.262	39%	0.391	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.2	-35.8	-178.4	-66.2	-23.4	0	0	0	112.6	F199 W266	F199-D202 WeakPolarHBondContact CA-OD2 3.06Å; F199-D202 WeakPolarHBondContact O-CB 3.43Å; F199-D202 VanDerWaalsContact O-CG 3.29Å; D202-W266 HydrophobicContact CB-CZ3 4.16Å
203	D	39.5	Very low	52	Low	138 Å²	138	74.4 Å²	74.4	74%	0.738	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.8	-22.3	178.1	-76.9	-18.4	0	0	0	113.7	N201	N201-D203 VanDerWaalsContact C-N 3.25Å; N201-D203 PolarHBondContact O-N 2.78Å
204	H	39.3	Very low	51.6	Low	104 Å²	104	74.5 Å²	74.5	48%	0.481	39%	0.389	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.3	-13.3	-171.1	-76.8	-49.5	0	0	0	114.8	N201 N206 N207	N201-H204 PolarHBondContact O-N 3.28Å; H204-N206 PolarHBondContact O-N 3.41Å; H204-N207 PolarHBondContact O-N 3.07Å
205	I	41.9	Very low	51.5	Low	54 Å²	54	72.9 Å²	72.9	28%	0.277	38%	0.377	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-24.1	175.2	-66.5	164.5	0	0	0	111.9	N201	N201-I205 PolarHBondContact O-N 2.63Å
206	N	39.8	Very low	51.7	Low	130 Å²	130	70.5 Å²	70.5	70%	0.695	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79	-20.8	177.9	-78.8	-19.4	0	0	0	114.5	H204	H204-N206 PolarHBondContact O-N 3.41Å
207	N	39.5	Very low	52.2	Low	97 Å²	97	69.5 Å²	69.5	52%	0.519	36%	0.358	S	S	.	.	S	Bend	trans	-96.5	134.8	179.3	-76.3	-18.2	0	0	0	109.3	H204 N209	H204-N207 PolarHBondContact O-N 3.07Å; N207-N209 PolarHBondContact O-N 3.49Å
208	N	40.5	Very low	52.6	Low	128 Å²	128	68.9 Å²	68.9	68%	0.684	36%	0.355	S	S	*	.			trans	-59.6	20.1	179.5	-83	-27.4	0	0	0	115.6	R273	N208-R273 PolarHBondContact OD1-NH2 2.99Å
209	N	41.9	Very low	53.4	Low	104 Å²	104	68.8 Å²	68.8	56%	0.556	36%	0.356	S	S	*	.			trans	-82.2	124.2	176.2	-69.3	-9	0	0	0	108.9	N207 N211	N207-N209 PolarHBondContact O-N 3.49Å; N209-N211 PolarHBondContact O-N 3.06Å
210	D	43.9	Very low	54.6	Low	129 Å²	129	62.3 Å²	62.3	69%	0.69	33%	0.327	S	S	*	.	S	Bend	trans	-64	26.4	175.6	-68	-40.4	0	0	0	114	D212	D210-D212 PolarHBondContact O-N 3.06Å
211	N	49.6	Very low	56.1	Low	86 Å²	86	62 Å²	62	46%	0.46	32%	0.324	S	S	.	.			trans	-95.6	36.9	-176.3	-67.5	-8.3	0	0	0	112.5	N209 H213	N209-N211 PolarHBondContact O-N 3.06Å; N211-H213 PolarHBondContact O-N 3.01Å
212	D	56.9	Low	57.5	Low	79 Å²	79	61 Å²	61	42%	0.422	32%	0.319	S	S	.	.			trans	-71.5	8.5	174.5	-74.5	-17.5	0	0	0	113.3	D210 S240	D210-D212 PolarHBondContact O-N 3.06Å; D212-S240 WeakPolarHBondContact O-CA 3.5Å
213	H	59.8	Low	59.1	Low	76 Å²	76	60.1 Å²	60.1	35%	0.352	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	127.4	-175.3	-60.5	-62.2	0	0	0	111	N211 I238 I239 S240	N211-H213 PolarHBondContact O-N 3.01Å; H213-I238 HydrophobicContact CB-CG2 3.85Å; H213-I239 CarbonylContact C-O 3.49Å; H213-I239 WeakPolarHBondContact CA-O 3.29Å; H213-S240 WeakPolarHBondContact ND1-CB 3.09Å
214	I	65.5	Low	60.7	Low	4 Å²	4	54.3 Å²	54.3	2%	0.021	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	122.3	167.6	-59.2	173.5	0	0	0	107.5	V157 L197 F198 I216 I238 I239	V157-I214 HydrophobicContact CG1-CG2 3.77Å; L197-I214 VanDerWaalsContact C-CD1 3.45Å; L197-I214 HydrophobicContact CB-CD1 3.86Å; L197-I214 WeakPolarHBondContact O-CD1 3.5Å; F198-I214 HydrophobicContact CD1-CD1 3.33Å; F198-I214 HydrophobicContact CD1-CG1 4.23Å; F198-I214 HydrophobicContact CE1-CD1 3.46Å; F198-I214 VanDerWaalsContact CE1-CD1 3.46Å; F198-I214 HydrophobicContact CE1-CG1 4.2Å; F198-I214 HydrophobicContact CG-CD1 3.97Å; F198-I214 HydrophobicContact CZ-CD1 4.24Å; I214-I216 HydrophobicContact CG2-CG1 3.97Å; I214-I238 WeakPolarHBondContact O-CA 3.27Å; I214-I239 PolarHBondContact N-O 3.13Å; I214-I239 PolarHBondContact O-N 2.87Å
215	T	66.5	Low	62.3	Low	23 Å²	23	51 Å²	51	14%	0.141	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	116.5	174.3	-56.7	0	0	0	0	109.6	I158 P236 F237	I158-T215 PolarHBondContact N-O 3.01Å; T215-P236 HydrophobicContact CG2-CB 3.49Å; T215-P236 VanDerWaalsContact CG2-CB 3.49Å; T215-P236 HydrophobicContact CG2-CG 3.77Å; T215-F237 CarbonylContact C-O 3.59Å; T215-F237 VanDerWaalsContact CA-O 3.28Å; T215-F237 WeakPolarHBondContact CA-O 3.38Å
216	I	71.4	Confident	63.7	Low	0 Å²	0	53.9 Å²	53.9	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	108.7	176.5	-43.7	178.6	0	0	0	108.3	L112 I131 P155 V157 W167 L197 I214 L218 P236 F237 I239	L112-I216 HydrophobicContact CD1-CD1 4.46Å; L112-I216 HydrophobicContact CD2-CD1 4.17Å; I131-I216 HydrophobicContact CD1-CG2 4.28Å; P155-I216 HydrophobicContact CB-CG2 3.85Å; V157-I216 HydrophobicContact CG2-CG1 4.24Å; V157-I216 HydrophobicContact CG2-CG2 4.35Å; W167-I216 HydrophobicContact CZ2-CD1 4.3Å; W167-I216 HydrophobicContact CZ2-CG2 4.49Å; L197-I216 HydrophobicContact CD1-CD1 3.85Å; I214-I216 HydrophobicContact CG2-CG1 3.97Å; I216-L218 HydrophobicContact CG2-CD2 4.23Å; I216-P236 CarbonylContact O-C 3.59Å; I216-P236 WeakPolarHBondContact O-CA 3.37Å; I216-P236 VanDerWaalsContact O-CB 3.3Å; I216-P236 WeakPolarHBondContact O-CB 3.29Å; I216-F237 HydrophobicContact CB-CB 4.1Å; I216-F237 HydrophobicContact CB-CD2 4.23Å; I216-F237 HydrophobicContact CD1-CB 4.49Å; I216-F237 HydrophobicContact CG1-CB 4.38Å; I216-F237 PolarHBondContact N-O 2.86Å; I216-F237 PolarHBondContact O-N 3.18Å; I216-I239 HydrophobicContact CD1-CD1 3.6Å; I216-I239 HydrophobicContact CG1-CD1 4.01Å
217	H	76.1	Confident	65.1	Low	34 Å²	34	50.7 Å²	50.7	16%	0.157	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	144.4	167.4	-74.4	-89.4	0	0	0	109.9	P155 H156 I158 H232	P155-H217 CarbonylContact C-O 3.59Å; P155-H217 WeakPolarHBondContact CA-O 3.49Å; H156-H217 HydrophobicContact CB-CB 4.45Å; H156-H217 PolarHBondContact N-O 2.64Å; H156-H217 PolarHBondContact O-N 3.47Å; I158-H217 WeakPolarHBondContact CD1-CD2 3.28Å; I158-H217 WeakPolarHBondContact CD1-NE2 3.3Å; H217-H232 WeakPolarHBondContact CB-NE2 3.38Å; H217-H232 AromaticContact CG-NE2 3.47Å; H217-H232 AromaticContact ND1-CE1 3.25Å; H217-H232 PolarHBondContact ND1-CE1 2.98Å; H217-H232 AromaticContact ND1-NE2 3.01Å; H217-H232 PolarHBondContact ND1-NE2 3.31Å
218	L	75.2	Confident	66.8	Low	1 Å²	1	49.1 Å²	49.1	1%	0.005	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	141	177.6	-60.6	177.9	0	0	0	108.9	P110 I131 L153 P155 I216 L233 F237	P110-L218 HydrophobicContact CB-CD1 3.5Å; P110-L218 HydrophobicContact CG-CD1 3.53Å; I131-L218 HydrophobicContact CD1-CD2 3.76Å; I131-L218 HydrophobicContact CG2-CD1 4.39Å; I131-L218 HydrophobicContact CG2-CD2 4.14Å; L153-L218 HydrophobicContact CD1-CB 4.31Å; L153-L218 HydrophobicContact CD1-CD2 4.47Å; P155-L218 HydrophobicContact CB-CD2 4.08Å; P155-L218 HydrophobicContact CG-CD2 4.33Å; I216-L218 HydrophobicContact CG2-CD2 4.23Å; L218-L233 HydrophobicContact CB-CB 4.18Å; L218-L233 HydrophobicContact CB-CD1 3.7Å; L218-L233 HydrophobicContact CB-CG 4.29Å; L218-L233 HydrophobicContact CD1-CD1 4.23Å; L218-L233 WeakPolarHBondContact O-CB 3.24Å; L218-L233 PolarHBondContact O-N 2.78Å; L218-F237 HydrophobicContact CD1-CD2 4.07Å; L218-F237 HydrophobicContact CD1-CE2 3.56Å; L218-F237 HydrophobicContact CD1-CZ 4.18Å; L218-F237 HydrophobicContact CD2-CD2 4.17Å; L218-F237 HydrophobicContact CD2-CE2 3.98Å; L218-F237 HydrophobicContact CG-CD2 4.22Å; L218-F237 HydrophobicContact CG-CE2 4.1Å
219	S	79	Confident	68.3	Low	12 Å²	12	44.5 Å²	44.5	8%	0.084	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	146.9	171.3	-54.7	0	0	0	0	110.3	L153 H154 L231	L153-S219 CarbonylContact C-O 3.56Å; H154-S219 PolarHBondContact N-O 3.01Å; H154-S219 PolarHBondContact O-N 2.94Å; S219-L231 CarbonylContact C-O 3.57Å; S219-L231 WeakPolarHBondContact CA-O 3.46Å; S219-L231 WeakPolarHBondContact CB-O 3.5Å
220	I	80.3	Confident	69.6	Low	0 Å²	0	41.8 Å²	41.8	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	118.7	167.9	-52	167.5	0	0	0	106.6	L62 F104 F133 L135 S152 L189 I222 L231	L62-I220 HydrophobicContact CD1-CD1 4.41Å; F104-I220 HydrophobicContact CD1-CD1 4.32Å; F104-I220 HydrophobicContact CD2-CD1 4.47Å; F104-I220 HydrophobicContact CE1-CD1 4.45Å; F104-I220 HydrophobicContact CG-CD1 4.31Å; F104-I220 HydrophobicContact CZ-CG2 4.45Å; F133-I220 HydrophobicContact CE1-CD1 3.92Å; F133-I220 HydrophobicContact CE1-CG1 4.05Å; L135-I220 HydrophobicContact CD2-CD1 3.5Å; L135-I220 VanDerWaalsContact CD2-CD1 3.5Å; L135-I220 HydrophobicContact CD2-CG1 4.32Å; S152-I220 CarbonylContact O-C 3.51Å; S152-I220 WeakPolarHBondContact O-CA 3.28Å; L189-I220 HydrophobicContact CD1-CG1 4.17Å; L189-I220 HydrophobicContact CD1-CG2 3.87Å; I220-I222 HydrophobicContact CG2-CD1 4.43Å; I220-I222 HydrophobicContact CG2-CG1 4.05Å; I220-L231 HydrophobicContact CB-CB 4.38Å; I220-L231 PolarHBondContact N-O 2.79Å; I220-L231 PolarHBondContact O-N 2.92Å
221	H	78.8	Confident	70.8	Confident	33 Å²	33	35.9 Å²	35.9	15%	0.153	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	130.8	170	-179.8	-135.9	0	0	0	109.4	A151 S152 H154 V223 Y229	A151-H221 CarbonylContact C-O 3.56Å; A151-H221 WeakPolarHBondContact CA-O 3.45Å; S152-H221 PolarHBondContact N-O 2.75Å; S152-H221 PolarHBondContact O-N 2.65Å; H154-H221 WeakPolarHBondContact CD2-CB 3.5Å; H154-H221 AromaticContact NE2-ND1 3.79Å; H221-V223 WeakPolarHBondContact CE1-CG2 3.49Å; H221-Y229 CarbonylContact C-O 3.56Å; H221-Y229 WeakPolarHBondContact CA-O 3.42Å; H221-Y229 PolarHBondContact CD2-O 3.4Å; H221-Y229 VanDerWaalsContact CD2-O 3.32Å
222	I	78.5	Confident	71.6	Confident	0 Å²	0	34.3 Å²	34.3	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	129.1	-176.7	-70.2	166.8	0	0	0	108.2	W100 P102 F104 F149 I150 I220 S228 Y229 L231	W100-I222 HydrophobicContact CZ3-CG2 4.28Å; P102-I222 HydrophobicContact CG-CD1 4.29Å; F104-I222 HydrophobicContact CE2-CD1 3.36Å; F104-I222 HydrophobicContact CZ-CD1 3.34Å; F104-I222 HydrophobicContact CZ-CG1 4.12Å; F149-I222 HydrophobicContact CD2-CG2 4.49Å; F149-I222 HydrophobicContact CE1-CB 4.49Å; F149-I222 HydrophobicContact CE1-CG1 4.21Å; F149-I222 HydrophobicContact CE1-CG2 3.76Å; F149-I222 HydrophobicContact CE2-CG2 3.53Å; F149-I222 HydrophobicContact CZ-CB 4.12Å; F149-I222 HydrophobicContact CZ-CD1 4.19Å; F149-I222 HydrophobicContact CZ-CG1 4.01Å; F149-I222 HydrophobicContact CZ-CG2 3.09Å; I150-I222 CarbonylContact O-C 3.6Å; I150-I222 VanDerWaalsContact O-CA 3.25Å; I150-I222 WeakPolarHBondContact O-CA 3.45Å; I220-I222 HydrophobicContact CG2-CD1 4.43Å; I220-I222 HydrophobicContact CG2-CG1 4.05Å; I222-S228 CarbonylContact O-C 3.53Å; I222-S228 WeakPolarHBondContact O-CA 3.46Å; I222-Y229 PolarHBondContact N-O 3.37Å; I222-Y229 PolarHBondContact O-N 3.05Å; I222-L231 HydrophobicContact CD1-CD1 3.36Å; I222-L231 HydrophobicContact CD1-CG 3.81Å
223	V	78.4	Confident	72.1	Confident	30 Å²	30	30.9 Å²	30.9	18%	0.182	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	133.6	171.1	-172.5	0	0	0	0	108.9	F149 I150 H221 N227	F149-V223 CarbonylContact C-O 3.57Å; F149-V223 WeakPolarHBondContact CA-O 3.39Å; I150-V223 HydrophobicContact CB-CB 4.13Å; I150-V223 PolarHBondContact N-O 3.03Å; I150-V223 PolarHBondContact O-N 2.65Å; H221-V223 WeakPolarHBondContact CE1-CG2 3.49Å; V223-N227 CarbonylContact C-O 3.59Å; V223-N227 WeakPolarHBondContact CA-O 3.29Å
224	H	72.7	Confident	71.9	Confident	16 Å²	16	31 Å²	31	7%	0.074	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	111.3	172.6	174.2	-99	0	0	0	108.8	W100 S145 F149 S226 N227	W100-H224 HydrophobicContact CE3-CB 4.07Å; W100-H224 HydrophobicContact CH2-CB 3.93Å; W100-H224 HydrophobicContact CZ3-CB 3.54Å; S145-H224 PolarHBondContact OG-CE1 3.24Å; S145-H224 PolarHBondContact OG-NE2 3.49Å; F149-H224 HydrophobicContact CD2-CB 3.99Å; F149-H224 HydrophobicContact CE2-CB 4.39Å; H224-S226 PolarHBondContact O-N 3.02Å; H224-N227 PolarHBondContact N-O 3.12Å; H224-N227 PolarHBondContact O-N 3.42Å
225	G	72.8	Confident	71.6	Confident	34 Å²	34	36.4 Å²	36.4	35%	0.351	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	58	-124.6	-170.1	0	0	0	0	0	111.1	N227	G225-N227 VanDerWaalsContact C-N 3.34Å
226	S	71	Confident	71.5	Confident	116 Å²	116	37.2 Å²	37.2	81%	0.811	21%	0.21	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.2	-8.3	176.7	57.9	0	0	0	0	114.5	H224	H224-S226 PolarHBondContact O-N 3.02Å
227	N	69.5	Low	71.1	Confident	63 Å²	63	38.9 Å²	38.9	34%	0.337	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	128.3	-170.8	-49.6	-37.6	0	0	0	111.1	W100 V223 H224 G225 Y229	W100-N227 HydrophobicContact CH2-CB 3.98Å; W100-N227 HydrophobicContact CZ2-CB 3.74Å; V223-N227 CarbonylContact C-O 3.59Å; V223-N227 WeakPolarHBondContact CA-O 3.29Å; H224-N227 PolarHBondContact N-O 3.12Å; H224-N227 PolarHBondContact O-N 3.42Å; G225-N227 VanDerWaalsContact C-N 3.34Å; N227-Y229 HydrophobicContact CB-CE2 3.67Å
228	S	74.1	Confident	70.5	Confident	63 Å²	63	42.7 Å²	42.7	44%	0.441	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	133.1	176.8	62.2	0	0	0	0	111.7	I222	I222-S228 CarbonylContact O-C 3.53Å; I222-S228 WeakPolarHBondContact O-CA 3.46Å
229	Y	71.7	Confident	70	Confident	32 Å²	32	43.8 Å²	43.8	13%	0.125	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	140.4	177.9	-64.6	-96.3	0	0	0	110.8	Y58 I98 W100 H221 I222 N227	Y58-Y229 AromaticContact CD2-CD1 3.93Å; Y58-Y229 HydrophobicContact CD2-CD1 3.93Å; Y58-Y229 HydrophobicContact CD2-CE1 4.42Å; Y58-Y229 AromaticContact CE2-CD1 3.72Å; Y58-Y229 HydrophobicContact CE2-CD1 3.72Å; Y58-Y229 AromaticContact CE2-CE1 3.79Å; Y58-Y229 HydrophobicContact CE2-CE1 3.79Å; I98-Y229 HydrophobicContact CD1-CE1 3.76Å; W100-Y229 AromaticContact CH2-CD2 3.33Å; W100-Y229 HydrophobicContact CH2-CD2 3.33Å; W100-Y229 AromaticContact CH2-CE2 3.1Å; W100-Y229 HydrophobicContact CH2-CE2 3.1Å; W100-Y229 AromaticContact CZ2-CD2 3.82Å; W100-Y229 HydrophobicContact CZ2-CD2 3.82Å; W100-Y229 AromaticContact CZ2-CE2 3.07Å; W100-Y229 HydrophobicContact CZ2-CE2 3.07Å; W100-Y229 AromaticContact CZ2-CZ 3.68Å; W100-Y229 HydrophobicContact CZ3-CD2 4.29Å; W100-Y229 HydrophobicContact CZ3-CE2 4.33Å; H221-Y229 CarbonylContact C-O 3.56Å; H221-Y229 WeakPolarHBondContact CA-O 3.42Å; H221-Y229 PolarHBondContact CD2-O 3.4Å; H221-Y229 VanDerWaalsContact CD2-O 3.32Å; I222-Y229 PolarHBondContact N-O 3.37Å; I222-Y229 PolarHBondContact O-N 3.05Å; N227-Y229 HydrophobicContact CB-CE2 3.67Å
230	I	70.1	Confident	69.2	Low	46 Å²	46	43.4 Å²	43.4	24%	0.236	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	114.7	173	-60.7	175.4	0	0	0	107.4
231	L	69.7	Low	68.2	Low	6 Å²	6	45.3 Å²	45.3	3%	0.031	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	107.5	175.6	-52.3	-172.8	0	0	0	109	T60 L101 F104 S219 I220 I222	T60-L231 HydrophobicContact CG2-CB 3.92Å; T60-L231 HydrophobicContact CG2-CD1 4.42Å; T60-L231 HydrophobicContact CG2-CD2 3.54Å; T60-L231 HydrophobicContact CG2-CG 4.13Å; T60-L231 VanDerWaalsContact OG1-C 3.23Å; T60-L231 WeakPolarHBondContact OG1-CA 3.27Å; T60-L231 WeakPolarHBondContact OG1-CB 3.34Å; L101-L231 HydrophobicContact CD2-CD2 4.12Å; F104-L231 HydrophobicContact CD2-CD1 3.73Å; F104-L231 HydrophobicContact CE2-CD1 3.33Å; F104-L231 HydrophobicContact CZ-CD1 4.37Å; S219-L231 CarbonylContact C-O 3.57Å; S219-L231 WeakPolarHBondContact CA-O 3.46Å; S219-L231 WeakPolarHBondContact CB-O 3.5Å; I220-L231 HydrophobicContact CB-CB 4.38Å; I220-L231 PolarHBondContact N-O 2.79Å; I220-L231 PolarHBondContact O-N 2.92Å; I222-L231 HydrophobicContact CD1-CD1 3.36Å; I222-L231 HydrophobicContact CD1-CG 3.81Å
232	H	66.4	Low	67	Low	53 Å²	53	47.7 Å²	47.7	25%	0.245	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	133.1	178.8	-176.1	-94.4	0	0	0	112.1	T60 H217	T60-H232 PolarHBondContact OG1-N 3.21Å; T60-H232 PolarHBondContact OG1-O 2.55Å; H217-H232 WeakPolarHBondContact CB-NE2 3.38Å; H217-H232 AromaticContact CG-NE2 3.47Å; H217-H232 AromaticContact ND1-CE1 3.25Å; H217-H232 PolarHBondContact ND1-CE1 2.98Å; H217-H232 AromaticContact ND1-NE2 3.01Å; H217-H232 PolarHBondContact ND1-NE2 3.31Å
233	L	67.6	Low	65.8	Low	7 Å²	7	53 Å²	53	4%	0.037	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	122.7	172.2	-60.6	175.8	0	0	0	109.3	L62 I106 F133 L218 H235	L62-L233 HydrophobicContact CB-CD2 3.59Å; L62-L233 HydrophobicContact CD1-CD2 3.37Å; L62-L233 HydrophobicContact CG-CD2 3.99Å; I106-L233 HydrophobicContact CD1-CD2 4.15Å; F133-L233 HydrophobicContact CD1-CD1 4.12Å; F133-L233 HydrophobicContact CE1-CD1 3.47Å; F133-L233 VanDerWaalsContact CE1-CD1 3.47Å; F133-L233 HydrophobicContact CE1-CD2 4.36Å; F133-L233 HydrophobicContact CE2-CD1 4.49Å; F133-L233 HydrophobicContact CZ-CD1 3.69Å; F133-L233 HydrophobicContact CZ-CD2 4.25Å; L218-L233 HydrophobicContact CB-CB 4.18Å; L218-L233 HydrophobicContact CB-CD1 3.7Å; L218-L233 HydrophobicContact CB-CG 4.29Å; L218-L233 HydrophobicContact CD1-CD1 4.23Å; L218-L233 WeakPolarHBondContact O-CB 3.24Å; L218-L233 PolarHBondContact O-N 2.78Å; L233-H235 VanDerWaalsContact C-N 3.29Å; L233-H235 PolarHBondContact O-N 3.29Å
234	F	54.9	Low	64.7	Low	78 Å²	78	53 Å²	53	34%	0.342	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.4	-23.3	-173.3	-89	-93.8	0	0	0	115.3	P59 T60 N61 P236	P59-F234 HydrophobicContact CB-CE2 4.2Å; P59-F234 HydrophobicContact CB-CZ 3.82Å; T60-F234 WeakPolarHBondContact O-CD2 3.47Å; T60-F234 VanDerWaalsContact O-CE2 3.22Å; T60-F234 WeakPolarHBondContact O-CE2 3.45Å; N61-F234 VanDerWaalsContact CA-CD2 3.49Å; N61-F234 VanDerWaalsContact CA-CE2 3.48Å; N61-F234 HydrophobicContact CB-CD2 4.45Å; N61-F234 HydrophobicContact CB-CE2 4.21Å; N61-F234 VanDerWaalsContact N-CE2 3.32Å; N61-F234 WeakPolarHBondContact OD1-CD2 3.47Å; N61-F234 WeakPolarHBondContact OD1-CE2 3.41Å; N61-F234 WeakPolarHBondContact OD1-CZ 3.34Å; F234-P236 WeakPolarHBondContact O-CD 3.4Å
235	H	58.7	Low	63.7	Low	117 Å²	117	53.1 Å²	53.1	54%	0.542	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	104	179.1	-67.1	87	0	0	0	109.9	F63 L233	F63-H235 AromaticContact CD1-CE1 3.83Å; F63-H235 AromaticContact CE1-CE1 3.93Å; L233-H235 VanDerWaalsContact C-N 3.29Å; L233-H235 PolarHBondContact O-N 3.29Å
236	P	64.9	Low	62.5	Low	40 Å²	40	56.7 Å²	56.7	26%	0.26	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	157.1	172.2	32	-35.1	0	0	0	110.8	T215 I216 F234 I238	T215-P236 HydrophobicContact CG2-CB 3.49Å; T215-P236 VanDerWaalsContact CG2-CB 3.49Å; T215-P236 HydrophobicContact CG2-CG 3.77Å; I216-P236 CarbonylContact O-C 3.59Å; I216-P236 WeakPolarHBondContact O-CA 3.37Å; I216-P236 VanDerWaalsContact O-CB 3.3Å; I216-P236 WeakPolarHBondContact O-CB 3.29Å; F234-P236 WeakPolarHBondContact O-CD 3.4Å; P236-I238 HydrophobicContact CG-CG1 4.37Å
237	F	63	Low	61.4	Low	35 Å²	35	56 Å²	56	15%	0.154	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	131.9	157.9	-65.2	-68.7	0	0	0	109.3	P110 L112 I131 T215 I216 L218 I239	P110-F237 HydrophobicContact CB-CE1 4.2Å; P110-F237 HydrophobicContact CB-CE2 4.09Å; P110-F237 HydrophobicContact CB-CZ 3.47Å; P110-F237 VanDerWaalsContact CB-CZ 3.47Å; P110-F237 WeakPolarHBondContact O-CE1 3.37Å; P110-F237 WeakPolarHBondContact O-CZ 3.07Å; L112-F237 HydrophobicContact CB-CD1 4.2Å; L112-F237 HydrophobicContact CB-CD2 4.42Å; L112-F237 HydrophobicContact CB-CE1 3.93Å; L112-F237 HydrophobicContact CB-CE2 4.14Å; L112-F237 HydrophobicContact CB-CG 4.41Å; L112-F237 HydrophobicContact CB-CZ 3.88Å; I131-F237 HydrophobicContact CD1-CE2 4.22Å; I131-F237 HydrophobicContact CG1-CE2 3.99Å; I131-F237 HydrophobicContact CG2-CE2 3.71Å; I131-F237 HydrophobicContact CG2-CZ 4.12Å; T215-F237 CarbonylContact C-O 3.59Å; T215-F237 VanDerWaalsContact CA-O 3.28Å; T215-F237 WeakPolarHBondContact CA-O 3.38Å; I216-F237 HydrophobicContact CB-CB 4.1Å; I216-F237 HydrophobicContact CB-CD2 4.23Å; I216-F237 HydrophobicContact CD1-CB 4.49Å; I216-F237 HydrophobicContact CG1-CB 4.38Å; I216-F237 PolarHBondContact N-O 2.86Å; I216-F237 PolarHBondContact O-N 3.18Å; L218-F237 HydrophobicContact CD1-CD2 4.07Å; L218-F237 HydrophobicContact CD1-CE2 3.56Å; L218-F237 HydrophobicContact CD1-CZ 4.18Å; L218-F237 HydrophobicContact CD2-CD2 4.17Å; L218-F237 HydrophobicContact CD2-CE2 3.98Å; L218-F237 HydrophobicContact CG-CD2 4.22Å; L218-F237 HydrophobicContact CG-CE2 4.1Å; F237-I239 HydrophobicContact CB-CD1 3.8Å; F237-I239 HydrophobicContact CB-CG1 4.37Å
238	I	63.6	Low	60.3	Low	114 Å²	114	55.8 Å²	55.8	59%	0.585	27%	0.272	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-114.7	109.7	169.1	-56.5	175.8	0	0	0	106.3	H213 I214 P236	H213-I238 HydrophobicContact CB-CG2 3.85Å; I214-I238 WeakPolarHBondContact O-CA 3.27Å; P236-I238 HydrophobicContact CG-CG1 4.37Å
239	I	64.2	Low	58.8	Low	24 Å²	24	57 Å²	57	12%	0.123	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	126.7	179.3	-47.6	111.9	0	0	0	108.6	L112 F198 H213 I214 I216 F237	L112-I239 HydrophobicContact CD2-CD1 3.16Å; L112-I239 HydrophobicContact CD2-CG1 3.55Å; F198-I239 HydrophobicContact CZ-CG2 3.92Å; H213-I239 CarbonylContact C-O 3.49Å; H213-I239 WeakPolarHBondContact CA-O 3.29Å; I214-I239 PolarHBondContact N-O 3.13Å; I214-I239 PolarHBondContact O-N 2.87Å; I216-I239 HydrophobicContact CD1-CD1 3.6Å; I216-I239 HydrophobicContact CG1-CD1 4.01Å; F237-I239 HydrophobicContact CB-CD1 3.8Å; F237-I239 HydrophobicContact CB-CG1 4.37Å
240	S	61.8	Low	57.4	Low	5 Å²	5	60.1 Å²	60.1	4%	0.035	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	149.5	161.5	44.1	0	0	0	0	110.2	D212 H213 H242 H243 L244	D212-S240 WeakPolarHBondContact O-CA 3.5Å; H213-S240 WeakPolarHBondContact ND1-CB 3.09Å; S240-H242 PolarHBondContact O-N 3.21Å; S240-H243 PolarHBondContact O-N 3.31Å; S240-H243 WeakPolarHBondContact OG-CB 3.45Å; S240-H243 PolarHBondContact OG-N 3.18Å; S240-H243 VanDerWaalsContact OG-N 3.15Å; S240-H243 PolarHBondContact OG-ND1 2.88Å; S240-L244 PolarHBondContact O-N 2.69Å; S240-L244 VanDerWaalsContact O-N 3.09Å
241	L	60.3	Low	55.9	Low	39 Å²	39	63.4 Å²	63.4	20%	0.204	30%	0.304	C	S	.	.	H	α-helix	trans	-55.7	-39.3	167.8	-174	61	0	0	0	110.5	F198 L244 I245 C270	F198-L241 HydrophobicContact CD1-CB 3.95Å; F198-L241 HydrophobicContact CD1-CD1 4.24Å; F198-L241 HydrophobicContact CD2-CD1 3.92Å; F198-L241 HydrophobicContact CE1-CB 3.77Å; F198-L241 HydrophobicContact CE1-CD1 4.33Å; F198-L241 VanDerWaalsContact CE1-N 3.31Å; F198-L241 HydrophobicContact CE2-CD1 3.96Å; F198-L241 HydrophobicContact CG-CD1 4.06Å; F198-L241 HydrophobicContact CZ-CB 4.23Å; F198-L241 HydrophobicContact CZ-CD1 4.19Å; L241-L244 PolarHBondContact O-N 3.26Å; L241-I245 HydrophobicContact CD1-CD1 4.26Å; L241-I245 HydrophobicContact CD1-CG1 4.46Å; L241-I245 HydrophobicContact CG-CD1 3.96Å; L241-I245 VanDerWaalsContact O-CG1 3.29Å; L241-I245 WeakPolarHBondContact O-CG1 2.87Å; L241-I245 PolarHBondContact O-N 3.41Å; L241-C270 HydrophobicContact CD2-CB 3.73Å; L241-C270 HydrophobicContact CG-CB 4.25Å
242	H	53.1	Low	54.4	Low	84 Å²	84	72.2 Å²	72.2	39%	0.389	35%	0.345	S	S	.	.	H	α-helix	trans	-55.5	-53.1	174.6	-176.7	79.9	0	0	0	113.4	S240 L244 I245 Y246 F326	S240-H242 PolarHBondContact O-N 3.21Å; H242-L244 VanDerWaalsContact C-N 3.3Å; H242-L244 PolarHBondContact O-N 3.35Å; H242-I245 PolarHBondContact O-N 3.21Å; H242-Y246 WeakPolarHBondContact O-CB 3.31Å; H242-Y246 PolarHBondContact O-N 2.9Å; H242-F326 AromaticContact CE1-CD1 3.61Å
243	H	53.4	Low	53	Low	110 Å²	110	76.3 Å²	76.3	51%	0.509	37%	0.369	S	S	.	.	H	α-helix	trans	-64.1	-35.9	179.5	-86.7	74.7	0	0	0	112.3	S240 Y246 N247	S240-H243 PolarHBondContact O-N 3.31Å; S240-H243 WeakPolarHBondContact OG-CB 3.45Å; S240-H243 PolarHBondContact OG-N 3.18Å; S240-H243 VanDerWaalsContact OG-N 3.15Å; S240-H243 PolarHBondContact OG-ND1 2.88Å; H243-Y246 PolarHBondContact O-N 3.31Å; H243-N247 PolarHBondContact O-N 2.96Å
244	L	56.3	Low	51.8	Low	30 Å²	30	78.6 Å²	78.6	16%	0.157	38%	0.377	C	S	.	.	H	α-helix	trans	-63.2	-51.7	176.8	-171.9	139	0	0	0	110.7	W129 F198 S240 L241 H242 Y246 N247 Y248	W129-L244 HydrophobicContact CH2-CD1 3.31Å; W129-L244 HydrophobicContact CZ2-CD1 4.24Å; W129-L244 HydrophobicContact CZ3-CD1 3.91Å; F198-L244 HydrophobicContact CE2-CD1 4.07Å; F198-L244 HydrophobicContact CZ-CD1 4.38Å; S240-L244 PolarHBondContact O-N 2.69Å; S240-L244 VanDerWaalsContact O-N 3.09Å; L241-L244 PolarHBondContact O-N 3.26Å; H242-L244 VanDerWaalsContact C-N 3.3Å; H242-L244 PolarHBondContact O-N 3.35Å; L244-Y246 VanDerWaalsContact C-N 3.27Å; L244-Y246 PolarHBondContact O-N 3.18Å; L244-N247 PolarHBondContact O-N 2.94Å; L244-Y248 HydrophobicContact CD1-CE2 4.26Å; L244-Y248 HydrophobicContact CD2-CD2 3.55Å; L244-Y248 HydrophobicContact CD2-CE2 3.62Å; L244-Y248 HydrophobicContact CG-CD2 3.81Å; L244-Y248 HydrophobicContact CG-CE2 3.71Å; L244-Y248 VanDerWaalsContact O-CD2 3.22Å; L244-Y248 WeakPolarHBondContact O-CD2 3.1Å; L244-Y248 PolarHBondContact O-N 3.48Å
245	I	51	Low	51.1	Low	20 Å²	20	77.7 Å²	77.7	10%	0.103	37%	0.373	C	S	.	.	H	α-helix	trans	-60.7	-39.1	178.1	-60	168.7	0	0	0	110.4	L241 H242 Y248 Y249 C270 I271 I325 F326	L241-I245 HydrophobicContact CD1-CD1 4.26Å; L241-I245 HydrophobicContact CD1-CG1 4.46Å; L241-I245 HydrophobicContact CG-CD1 3.96Å; L241-I245 VanDerWaalsContact O-CG1 3.29Å; L241-I245 WeakPolarHBondContact O-CG1 2.87Å; L241-I245 PolarHBondContact O-N 3.41Å; H242-I245 PolarHBondContact O-N 3.21Å; I245-Y248 PolarHBondContact O-N 3.47Å; I245-Y249 WeakPolarHBondContact O-CB 3.04Å; I245-Y249 PolarHBondContact O-N 2.96Å; I245-C270 HydrophobicContact CD1-CB 3.44Å; I245-C270 VanDerWaalsContact CD1-CB 3.44Å; I245-I271 HydrophobicContact CD1-CG1 4.37Å; I245-I271 HydrophobicContact CG2-CD1 4.4Å; I245-I271 HydrophobicContact CG2-CG1 4.35Å; I245-I325 HydrophobicContact CG2-CD1 4.33Å; I245-F326 HydrophobicContact CB-CE1 4.25Å; I245-F326 HydrophobicContact CB-CZ 4.28Å; I245-F326 HydrophobicContact CG2-CE1 3.92Å; I245-F326 HydrophobicContact CG2-CZ 3.76Å
246	Y	47.2	Very low	50.4	Low	108 Å²	108	76.1 Å²	76.1	42%	0.424	38%	0.375	S	S	.	.	H	α-helix	trans	-59.9	-47.7	176.2	-175.3	-94.1	0	0	0	112.7	H242 H243 L244 Y248 Y249 N250 F326	H242-Y246 WeakPolarHBondContact O-CB 3.31Å; H242-Y246 PolarHBondContact O-N 2.9Å; H243-Y246 PolarHBondContact O-N 3.31Å; L244-Y246 VanDerWaalsContact C-N 3.27Å; L244-Y246 PolarHBondContact O-N 3.18Å; Y246-Y248 VanDerWaalsContact C-N 3.34Å; Y246-Y248 PolarHBondContact O-N 2.93Å; Y246-Y249 PolarHBondContact O-N 3.17Å; Y246-N250 PolarHBondContact O-N 3.46Å; Y246-F326 VanDerWaalsContact CA-CZ 3.42Å; Y246-F326 AromaticContact CD2-CD2 3.78Å; Y246-F326 HydrophobicContact CD2-CD2 3.78Å; Y246-F326 AromaticContact CD2-CE2 3.69Å; Y246-F326 HydrophobicContact CD2-CE2 3.69Å; Y246-F326 HydrophobicContact CD2-CG 4.38Å; Y246-F326 HydrophobicContact CD2-CZ 4.22Å; Y246-F326 HydrophobicContact CE2-CD2 4.37Å; Y246-F326 HydrophobicContact CG-CE2 4.41Å
247	N	47.5	Very low	49	Very low	102 Å²	102	77.2 Å²	77.2	55%	0.545	38%	0.379	S	S	.	.	H	α-helix	trans	-63.2	-39.9	177.6	-73.8	-17.7	0	0	0	112	H243 L244	H243-N247 PolarHBondContact O-N 2.96Å; L244-N247 PolarHBondContact O-N 2.94Å
248	Y	48	Very low	47.9	Very low	58 Å²	58	76.9 Å²	76.9	23%	0.227	38%	0.378	C	S	.	.	H	α-helix	trans	-71.6	-33.1	177.1	-82.7	-76	0	0	0	113.3	N114 L244 I245 Y246 N250 L251 Y254	N114-Y248 WeakPolarHBondContact CB-OH 3.31Å; L244-Y248 HydrophobicContact CD1-CE2 4.26Å; L244-Y248 HydrophobicContact CD2-CD2 3.55Å; L244-Y248 HydrophobicContact CD2-CE2 3.62Å; L244-Y248 HydrophobicContact CG-CD2 3.81Å; L244-Y248 HydrophobicContact CG-CE2 3.71Å; L244-Y248 VanDerWaalsContact O-CD2 3.22Å; L244-Y248 WeakPolarHBondContact O-CD2 3.1Å; L244-Y248 PolarHBondContact O-N 3.48Å; I245-Y248 PolarHBondContact O-N 3.47Å; Y246-Y248 VanDerWaalsContact C-N 3.34Å; Y246-Y248 PolarHBondContact O-N 2.93Å; Y248-N250 VanDerWaalsContact C-N 3.33Å; Y248-N250 PolarHBondContact O-N 2.85Å; Y248-L251 HydrophobicContact CD1-CD1 4.47Å; Y248-L251 WeakPolarHBondContact O-CB 3.05Å; Y248-L251 PolarHBondContact O-N 2.69Å; Y248-L251 VanDerWaalsContact O-N 3.1Å; Y248-Y254 HydrophobicContact CD1-CD2 4.4Å; Y248-Y254 HydrophobicContact CD1-CE2 4.3Å
249	Y	41.8	Very low	46.9	Very low	88 Å²	88	73.2 Å²	73.2	35%	0.345	36%	0.363	S	S	.	.	H	α-helix	trans	-63.8	-36.6	178.2	177	-92	0	0	0	112.8	I245 Y246 L251 F255 I325 F326	I245-Y249 WeakPolarHBondContact O-CB 3.04Å; I245-Y249 PolarHBondContact O-N 2.96Å; Y246-Y249 PolarHBondContact O-N 3.17Å; Y249-L251 PolarHBondContact O-N 3.2Å; Y249-F255 AromaticContact CD2-CE2 3.97Å; Y249-F255 HydrophobicContact CD2-CE2 3.97Å; Y249-F255 AromaticContact CE2-CE2 3.69Å; Y249-F255 HydrophobicContact CE2-CE2 3.69Å; Y249-F255 HydrophobicContact CE2-CZ 4.27Å; Y249-I325 HydrophobicContact CD2-CD1 3.36Å; Y249-I325 HydrophobicContact CD2-CG1 3.81Å; Y249-I325 HydrophobicContact CE2-CD1 3.86Å; Y249-I325 HydrophobicContact CE2-CG1 3.83Å; Y249-I325 HydrophobicContact CE2-CG2 4.43Å; Y249-I325 HydrophobicContact CG-CD1 4.01Å; Y249-I325 HydrophobicContact CG-CG1 4.42Å; Y249-F326 HydrophobicContact CD1-CE2 4.23Å; Y249-F326 AromaticContact CG-CE2 3.99Å; Y249-F326 HydrophobicContact CG-CE2 3.99Å
250	N	41.6	Very low	45.7	Very low	98 Å²	98	75.1 Å²	75.1	52%	0.524	38%	0.375	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-17.7	176.3	-74.2	-23.8	0	0	0	112.7	Y246 Y248 Q252	Y246-N250 PolarHBondContact O-N 3.46Å; Y248-N250 VanDerWaalsContact C-N 3.33Å; Y248-N250 PolarHBondContact O-N 2.85Å; N250-Q252 PolarHBondContact O-N 3.1Å
251	L	39.7	Very low	44.6	Very low	116 Å²	116	75.9 Å²	75.9	61%	0.607	38%	0.38	S	S	*	.	S	Bend	trans	-85.9	94.6	168.1	-61.8	166.6	0	0	0	107.7	Y248 Y249 N253	Y248-L251 HydrophobicContact CD1-CD1 4.47Å; Y248-L251 WeakPolarHBondContact O-CB 3.05Å; Y248-L251 PolarHBondContact O-N 2.69Å; Y248-L251 VanDerWaalsContact O-N 3.1Å; Y249-L251 PolarHBondContact O-N 3.2Å; L251-N253 PolarHBondContact O-N 2.93Å
252	Q	37.4	Very low	43.6	Very low	190 Å²	190	77.9 Å²	77.9	89%	0.888	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-44	-10.3	-168.5	-81.5	177.4	-31.5	0	0	119	N250	N250-Q252 PolarHBondContact O-N 3.1Å
253	N	37.5	Very low	43.2	Very low	140 Å²	140	77.4 Å²	77.4	75%	0.749	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107	13	-167.6	-76.9	-18.6	0	0	0	116.2	L251 S256	L251-N253 PolarHBondContact O-N 2.93Å; N253-S256 PolarHBondContact O-OG 2.96Å
254	Y	42.6	Very low	42.7	Very low	55 Å²	55	73.6 Å²	73.6	22%	0.216	38%	0.38	C	S	.	.			trans	-98.2	-12.9	-164.7	-141.5	-99.3	0	0	0	117.4	Y248 S256 L257 I258	Y248-Y254 HydrophobicContact CD1-CD2 4.4Å; Y248-Y254 HydrophobicContact CD1-CE2 4.3Å; Y254-S256 PolarHBondContact O-N 3.33Å; Y254-L257 HydrophobicContact CD1-CB 4.2Å; Y254-L257 HydrophobicContact CD2-CB 4.17Å; Y254-L257 HydrophobicContact CE1-CB 4.04Å; Y254-L257 HydrophobicContact CE2-CB 4.03Å; Y254-L257 HydrophobicContact CE2-CD1 4.41Å; Y254-L257 HydrophobicContact CE2-CD2 3.81Å; Y254-L257 HydrophobicContact CE2-CG 4.3Å; Y254-L257 HydrophobicContact CG-CB 4.26Å; Y254-L257 PolarHBondContact O-N 3.4Å; Y254-L257 WeakPolarHBondContact OH-CD2 3.38Å; Y254-I258 HydrophobicContact CD1-CD1 3.65Å; Y254-I258 HydrophobicContact CD1-CG1 3.51Å; Y254-I258 HydrophobicContact CE1-CD1 4.1Å; Y254-I258 HydrophobicContact CE1-CG1 3.63Å; Y254-I258 PolarHBondContact O-N 3.38Å
255	F	39.2	Very low	42.2	Very low	59 Å²	59	76.2 Å²	76.2	26%	0.259	39%	0.394	S	S	.	.	H	α-helix	trans	-62.3	-30.7	176.2	-90.8	-80.2	0	0	0	113.4	Y249 L257 S259 F267 I325	Y249-F255 AromaticContact CD2-CE2 3.97Å; Y249-F255 HydrophobicContact CD2-CE2 3.97Å; Y249-F255 AromaticContact CE2-CE2 3.69Å; Y249-F255 HydrophobicContact CE2-CE2 3.69Å; Y249-F255 HydrophobicContact CE2-CZ 4.27Å; F255-L257 VanDerWaalsContact C-N 3.3Å; F255-S259 PolarHBondContact O-N 3.5Å; F255-F267 HydrophobicContact CD1-CE1 4.42Å; F255-F267 HydrophobicContact CD1-CZ 4.35Å; F255-F267 AromaticContact CE1-CE1 3.56Å; F255-F267 HydrophobicContact CE1-CE1 3.56Å; F255-F267 AromaticContact CE1-CZ 3.61Å; F255-F267 HydrophobicContact CE1-CZ 3.61Å; F255-F267 HydrophobicContact CZ-CE1 4.22Å; F255-F267 HydrophobicContact CZ-CZ 4.03Å; F255-I325 HydrophobicContact CE1-CG2 4.42Å; F255-I325 HydrophobicContact CZ-CG2 3.64Å
256	S	43.5	Very low	41.9	Very low	83 Å²	83	80.2 Å²	80.2	58%	0.58	41%	0.408	S	S	*	.	H	α-helix	trans	-69.8	-28.2	174.8	57	0	0	0	0	112.4	N253 Y254 S259	N253-S256 PolarHBondContact O-OG 2.96Å; Y254-S256 PolarHBondContact O-N 3.33Å; S256-S259 PolarHBondContact O-OG 3.04Å; S256-S259 VanDerWaalsContact O-OG 3.06Å
257	L	36.8	Very low	42	Very low	64 Å²	64	75.6 Å²	75.6	34%	0.335	39%	0.39	S	S	.	.	H	α-helix	trans	-80.2	-47.5	177.2	-117.6	109.1	0	0	0	110.8	Y254 F255 S259 T260 T261	Y254-L257 HydrophobicContact CD1-CB 4.2Å; Y254-L257 HydrophobicContact CD2-CB 4.17Å; Y254-L257 HydrophobicContact CE1-CB 4.04Å; Y254-L257 HydrophobicContact CE2-CB 4.03Å; Y254-L257 HydrophobicContact CE2-CD1 4.41Å; Y254-L257 HydrophobicContact CE2-CD2 3.81Å; Y254-L257 HydrophobicContact CE2-CG 4.3Å; Y254-L257 HydrophobicContact CG-CB 4.26Å; Y254-L257 PolarHBondContact O-N 3.4Å; Y254-L257 WeakPolarHBondContact OH-CD2 3.38Å; F255-L257 VanDerWaalsContact C-N 3.3Å; L257-S259 VanDerWaalsContact C-N 3.29Å; L257-S259 PolarHBondContact O-N 3.13Å; L257-T260 WeakPolarHBondContact O-CA 3.34Å; L257-T260 WeakPolarHBondContact O-CB 3.21Å; L257-T260 PolarHBondContact O-N 3.34Å; L257-T260 PolarHBondContact O-OG1 2.67Å; L257-T261 HydrophobicContact CD2-CG2 4.17Å; L257-T261 WeakPolarHBondContact O-CG2 3.45Å; L257-T261 PolarHBondContact O-N 3.16Å
258	I	39.8	Very low	42.2	Very low	28 Å²	28	70.9 Å²	70.9	14%	0.144	37%	0.365	C	S	.	.	H	α-helix	trans	-62.8	-33.7	-176.4	-69.9	171.5	0	0	0	113.2	Y254 T260 T261 L262 F267	Y254-I258 HydrophobicContact CD1-CD1 3.65Å; Y254-I258 HydrophobicContact CD1-CG1 3.51Å; Y254-I258 HydrophobicContact CE1-CD1 4.1Å; Y254-I258 HydrophobicContact CE1-CG1 3.63Å; Y254-I258 PolarHBondContact O-N 3.38Å; I258-T260 PolarHBondContact O-N 3.06Å; I258-T260 VanDerWaalsContact O-N 3.13Å; I258-T261 PolarHBondContact O-N 2.96Å; I258-L262 HydrophobicContact CG2-CD1 4.27Å; I258-L262 PolarHBondContact O-N 3.05Å; I258-F267 HydrophobicContact CD1-CD2 4Å; I258-F267 HydrophobicContact CD1-CE2 3.57Å; I258-F267 HydrophobicContact CG2-CB 4.14Å; I258-F267 HydrophobicContact CG2-CD2 3.49Å; I258-F267 VanDerWaalsContact CG2-CD2 3.49Å; I258-F267 HydrophobicContact CG2-CE2 4.05Å; I258-F267 HydrophobicContact CG2-CG 3.96Å
259	S	41.7	Very low	42.4	Very low	37 Å²	37	70.7 Å²	70.7	26%	0.259	37%	0.367	S	S	.	.	H	α-helix	trans	-60.8	-21	173.9	64.6	0	0	0	0	112.8	F255 S256 L257 I264	F255-S259 PolarHBondContact O-N 3.5Å; S256-S259 PolarHBondContact O-OG 3.04Å; S256-S259 VanDerWaalsContact O-OG 3.06Å; L257-S259 VanDerWaalsContact C-N 3.29Å; L257-S259 PolarHBondContact O-N 3.13Å; S259-I264 WeakPolarHBondContact O-CD1 3.35Å; S259-I264 WeakPolarHBondContact O-CG1 3.5Å
260	T	40.1	Very low	42.8	Very low	63 Å²	63	67.9 Å²	67.9	39%	0.387	36%	0.361	S	S	.	.	H	α-helix	trans	-90.4	-49	172	70.4	0	0	0	0	110.9	P122 L257 I258	P122-T260 WeakPolarHBondContact CB-O 3.46Å; L257-T260 WeakPolarHBondContact O-CA 3.34Å; L257-T260 WeakPolarHBondContact O-CB 3.21Å; L257-T260 PolarHBondContact O-N 3.34Å; L257-T260 PolarHBondContact O-OG1 2.67Å; I258-T260 PolarHBondContact O-N 3.06Å; I258-T260 VanDerWaalsContact O-N 3.13Å
261	T	38	Very low	43.5	Very low	22 Å²	22	63.8 Å²	63.8	14%	0.135	34%	0.339	C	S	.	.	H	α-helix	trans	-81.9	-30.6	-159	60.6	0	0	0	0	117.3	M125 L257 I258	M125-T261 HydrophobicContact CE-CG2 3.31Å; M125-T261 HydrophobicContact CG-CG2 4.15Å; M125-T261 HydrophobicContact SD-CG2 3.23Å; M125-T261 WeakPolarHBondContact SD-CG2 3.14Å; L257-T261 HydrophobicContact CD2-CG2 4.17Å; L257-T261 WeakPolarHBondContact O-CG2 3.45Å; L257-T261 PolarHBondContact O-N 3.16Å; I258-T261 PolarHBondContact O-N 2.96Å
262	L	39.5	Very low	44.3	Very low	81 Å²	81	58.5 Å²	58.5	42%	0.424	31%	0.311	S	S	.	.	S	Bend	trans	-104.1	146	177.2	-72.9	167.7	0	0	0	108.1	I258 I264	I258-L262 HydrophobicContact CG2-CD1 4.27Å; I258-L262 PolarHBondContact O-N 3.05Å; L262-I264 PolarHBondContact O-N 2.92Å
263	S	43.7	Very low	45.4	Very low	74 Å²	74	55.3 Å²	55.3	52%	0.517	29%	0.29	S	S	.	.			trans	-55.4	116.3	163.5	74.1	0	0	0	0	106.5	N265 W266	S263-N265 PolarHBondContact O-N 3.46Å; S263-W266 PolarHBondContact O-N 3.37Å; S263-W266 PolarHBondContact OG-NE1 3.36Å
264	I	44.7	Very low	46.7	Very low	29 Å²	29	51.4 Å²	51.4	15%	0.149	27%	0.267	C	S	.	.	G	3₁₀ helix	trans	-53.6	-23.1	-161.8	-71.5	165	0	0	0	112.6	S259 L262 W266 L312 N313 L316	S259-I264 WeakPolarHBondContact O-CD1 3.35Å; S259-I264 WeakPolarHBondContact O-CG1 3.5Å; L262-I264 PolarHBondContact O-N 2.92Å; I264-W266 PolarHBondContact O-N 3.29Å; I264-W266 VanDerWaalsContact O-N 3.17Å; I264-L312 HydrophobicContact CG2-CB 3.48Å; I264-L312 VanDerWaalsContact CG2-CB 3.48Å; I264-L312 HydrophobicContact CG2-CD1 3.69Å; I264-L312 HydrophobicContact CG2-CG 4.13Å; I264-N313 HydrophobicContact CD1-CB 3.79Å; I264-N313 WeakPolarHBondContact CD1-ND2 3.29Å; I264-L316 HydrophobicContact CG2-CD1 4.25Å; I264-L316 HydrophobicContact CG2-CD2 3.96Å
265	N	45.5	Very low	48.3	Very low	86 Å²	86	54 Å²	54	46%	0.46	28%	0.277	S	S	.	.	G	3₁₀ helix	trans	-58.7	-20.5	174.4	-61.6	-15.2	0	0	0	114.3	S263 Y332	S263-N265 PolarHBondContact O-N 3.46Å; N265-Y332 VanDerWaalsContact CA-OH 3.29Å; N265-Y332 WeakPolarHBondContact CA-OH 3.35Å; N265-Y332 PolarHBondContact N-OH 3.44Å; N265-Y332 PolarHBondContact OD1-OH 2.97Å
266	W	45.1	Very low	49.9	Very low	104 Å²	104	54.4 Å²	54.4	39%	0.394	28%	0.278	S	S	.	.	G	3₁₀ helix	trans	-98.7	-21.3	-168.9	-66.6	60.1	0	0	0	114.8	D202 S263 I264 P268 L269 C270	D202-W266 HydrophobicContact CB-CZ3 4.16Å; S263-W266 PolarHBondContact O-N 3.37Å; S263-W266 PolarHBondContact OG-NE1 3.36Å; I264-W266 PolarHBondContact O-N 3.29Å; I264-W266 VanDerWaalsContact O-N 3.17Å; W266-P268 VanDerWaalsContact C-N 3.33Å; W266-L269 HydrophobicContact CD2-CD1 4.3Å; W266-L269 HydrophobicContact CE3-CD1 4.47Å; W266-L269 HydrophobicContact CG-CD1 4.33Å; W266-L269 WeakPolarHBondContact O-CA 3.36Å; W266-L269 VanDerWaalsContact O-CB 3.3Å; W266-L269 WeakPolarHBondContact O-CB 3.47Å; W266-L269 PolarHBondContact O-N 3.04Å; W266-C270 PolarHBondContact O-N 2.92Å; W266-C270 PolarHBondContact O-SG 3.2Å
267	F	48.6	Very low	51.7	Low	11 Å²	11	52.1 Å²	52.1	5%	0.048	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.3	-42.6	-176.3	178.3	-107.6	0	0	0	113.5	F255 I258 I271 I325	F255-F267 HydrophobicContact CD1-CE1 4.42Å; F255-F267 HydrophobicContact CD1-CZ 4.35Å; F255-F267 AromaticContact CE1-CE1 3.56Å; F255-F267 HydrophobicContact CE1-CE1 3.56Å; F255-F267 AromaticContact CE1-CZ 3.61Å; F255-F267 HydrophobicContact CE1-CZ 3.61Å; F255-F267 HydrophobicContact CZ-CE1 4.22Å; F255-F267 HydrophobicContact CZ-CZ 4.03Å; I258-F267 HydrophobicContact CD1-CD2 4Å; I258-F267 HydrophobicContact CD1-CE2 3.57Å; I258-F267 HydrophobicContact CG2-CB 4.14Å; I258-F267 HydrophobicContact CG2-CD2 3.49Å; I258-F267 VanDerWaalsContact CG2-CD2 3.49Å; I258-F267 HydrophobicContact CG2-CE2 4.05Å; I258-F267 HydrophobicContact CG2-CG 3.96Å; F267-I271 HydrophobicContact CD1-CD1 4.12Å; F267-I271 HydrophobicContact CD2-CD1 4.07Å; F267-I271 HydrophobicContact CE1-CD1 3.65Å; F267-I271 HydrophobicContact CE2-CD1 3.63Å; F267-I271 HydrophobicContact CG-CD1 4.34Å; F267-I271 HydrophobicContact CZ-CD1 3.42Å; F267-I271 VanDerWaalsContact CZ-CD1 3.42Å; F267-I271 WeakPolarHBondContact O-CD1 3.19Å; F267-I325 HydrophobicContact CE1-CG2 4.48Å; F267-I325 HydrophobicContact CZ-CD1 4.14Å
268	P	51.5	Low	53.5	Low	2 Å²	2	50.1 Å²	50.1	1%	0.013	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.7	-27.9	174.9	-19.6	34.9	0	0	0	114.3	W266 C270 I271 Y272 L318 Y332	W266-P268 VanDerWaalsContact C-N 3.33Å; P268-C270 VanDerWaalsContact C-N 3.29Å; P268-C270 PolarHBondContact O-N 2.84Å; P268-I271 PolarHBondContact O-N 3.44Å; P268-Y272 HydrophobicContact CB-CD2 4.26Å; P268-Y272 PolarHBondContact O-N 2.97Å; P268-L318 HydrophobicContact CG-CD1 4.23Å; P268-Y332 HydrophobicContact CG-CD2 4.2Å; P268-Y332 HydrophobicContact CG-CE2 4.32Å
269	L	51.5	Low	55.1	Low	54 Å²	54	49.8 Å²	49.8	28%	0.283	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-40.7	176.1	-78.1	162.2	0	0	0	111.3	W266 I271 R348	W266-L269 HydrophobicContact CD2-CD1 4.3Å; W266-L269 HydrophobicContact CE3-CD1 4.47Å; W266-L269 HydrophobicContact CG-CD1 4.33Å; W266-L269 WeakPolarHBondContact O-CA 3.36Å; W266-L269 VanDerWaalsContact O-CB 3.3Å; W266-L269 WeakPolarHBondContact O-CB 3.47Å; W266-L269 PolarHBondContact O-N 3.04Å; L269-I271 PolarHBondContact O-N 3.37Å; L269-R348 VanDerWaalsContact CG-NH1 3.35Å; L269-R348 VanDerWaalsContact CG-NH2 3.26Å
270	C	50.6	Low	56.3	Low	30 Å²	30	48.3 Å²	48.3	20%	0.203	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.1	-16.9	-177.4	-51.2	0	0	0	0	113.7	L241 I245 W266 P268	L241-C270 HydrophobicContact CD2-CB 3.73Å; L241-C270 HydrophobicContact CG-CB 4.25Å; I245-C270 HydrophobicContact CD1-CB 3.44Å; I245-C270 VanDerWaalsContact CD1-CB 3.44Å; W266-C270 PolarHBondContact O-N 2.92Å; W266-C270 PolarHBondContact O-SG 3.2Å; P268-C270 VanDerWaalsContact C-N 3.29Å; P268-C270 PolarHBondContact O-N 2.84Å
271	I	55.6	Low	57.4	Low	12 Å²	12	46.8 Å²	46.8	6%	0.062	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-110	-38.1	-172.4	-61.3	164.1	0	0	0	111.5	I245 F267 P268 L269 I325 F326	I245-I271 HydrophobicContact CD1-CG1 4.37Å; I245-I271 HydrophobicContact CG2-CD1 4.4Å; I245-I271 HydrophobicContact CG2-CG1 4.35Å; F267-I271 HydrophobicContact CD1-CD1 4.12Å; F267-I271 HydrophobicContact CD2-CD1 4.07Å; F267-I271 HydrophobicContact CE1-CD1 3.65Å; F267-I271 HydrophobicContact CE2-CD1 3.63Å; F267-I271 HydrophobicContact CG-CD1 4.34Å; F267-I271 HydrophobicContact CZ-CD1 3.42Å; F267-I271 VanDerWaalsContact CZ-CD1 3.42Å; F267-I271 WeakPolarHBondContact O-CD1 3.19Å; P268-I271 PolarHBondContact O-N 3.44Å; L269-I271 PolarHBondContact O-N 3.37Å; I271-I325 HydrophobicContact CD1-CB 4.17Å; I271-I325 HydrophobicContact CD1-CD1 3.85Å; I271-I325 HydrophobicContact CD1-CG1 4.42Å; I271-I325 HydrophobicContact CG2-CB 4.3Å; I271-I325 WeakPolarHBondContact CG2-O 3.39Å; I271-F326 HydrophobicContact CG1-CE1 4.41Å; I271-F326 HydrophobicContact CG2-CD1 3.98Å; I271-F326 HydrophobicContact CG2-CE1 4.43Å
272	Y	58.2	Low	58.4	Low	5 Å²	5	48.8 Å²	48.8	2%	0.02	23%	0.231	C	C	.	.			trans	-118.9	108.4	-172.5	-58.5	-69	0	0	0	111	P268 F274 L320 I325 G328 C330 R348	P268-Y272 HydrophobicContact CB-CD2 4.26Å; P268-Y272 PolarHBondContact O-N 2.97Å; Y272-F274 VanDerWaalsContact C-N 3.35Å; Y272-F274 PolarHBondContact O-N 2.58Å; Y272-L320 WeakPolarHBondContact OH-CD2 3.43Å; Y272-I325 WeakPolarHBondContact CE1-O 3.29Å; Y272-I325 PolarHBondContact OH-O 2.74Å; Y272-G328 VanDerWaalsContact CE1-O 3.24Å; Y272-G328 WeakPolarHBondContact CE1-O 3.31Å; Y272-C330 HydrophobicContact CD2-CB 4.3Å; Y272-C330 WeakPolarHBondContact CD2-SG 2.98Å; Y272-C330 HydrophobicContact CE2-CB 3.56Å; Y272-C330 WeakPolarHBondContact CE2-SG 3.48Å; Y272-R348 HydrophobicContact CD2-CB 4.11Å; Y272-R348 HydrophobicContact CG-CB 4.02Å
273	R	58.8	Low	59.3	Low	122 Å²	122	48.4 Å²	48.4	46%	0.46	25%	0.247	S	C	.	.	S	Bend	trans	-62.8	-34.4	-178	-178.4	174.9	175.5	169.7	-0.7	113.9	N208	N208-R273 PolarHBondContact OD1-NH2 2.99Å
274	F	64.9	Low	59.8	Low	58 Å²	58	52 Å²	52	25%	0.254	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	139.7	-174.1	-52.7	-73.8	0	0	0	110.8	Y272 R348 S349 S350 H352 L355	Y272-F274 VanDerWaalsContact C-N 3.35Å; Y272-F274 PolarHBondContact O-N 2.58Å; F274-R348 CarbonylContact O-C 3.41Å; F274-R348 WeakPolarHBondContact O-CA 3.46Å; F274-S349 WeakPolarHBondContact CB-O 3.13Å; F274-S349 PolarHBondContact N-O 3.45Å; F274-S349 PolarHBondContact O-N 3.5Å; F274-S350 WeakPolarHBondContact CE2-O 3.35Å; F274-H352 HydrophobicContact CD1-CB 4.29Å; F274-H352 HydrophobicContact CD2-CB 4.23Å; F274-H352 HydrophobicContact CE1-CB 4.22Å; F274-H352 HydrophobicContact CE2-CB 4.16Å; F274-H352 HydrophobicContact CG-CB 4.29Å; F274-H352 HydrophobicContact CZ-CB 4.15Å; F274-L355 HydrophobicContact CB-CD2 3.57Å
275	Y	76.8	Confident	60.6	Low	111 Å²	111	51.3 Å²	51.3	44%	0.435	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	157.8	176.5	74.8	-84.4	0	0	0	112.9	Q277 E346 I347	Y275-Q277 HydrophobicContact CD2-CG 4.11Å; Y275-Q277 HydrophobicContact CE2-CG 4.31Å; Y275-E346 HydrophobicContact CD2-CG 4.45Å; Y275-I347 CarbonylContact C-O 3.42Å; Y275-I347 WeakPolarHBondContact CA-O 3.45Å
276	K	74	Confident	61.5	Low	66 Å²	66	50.5 Å²	50.5	29%	0.287	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	139.2	167.1	-80.5	-176.9	171.3	-178.3	0	109.4	E346 I347 L355 D359	K276-E346 CarbonylContact O-C 3.52Å; K276-E346 WeakPolarHBondContact O-CA 3.48Å; K276-I347 HydrophobicContact CB-CD1 4.15Å; K276-I347 HydrophobicContact CB-CG1 3.81Å; K276-I347 PolarHBondContact N-O 2.92Å; K276-I347 WeakPolarHBondContact O-CG1 3.19Å; K276-I347 PolarHBondContact O-N 3.38Å; K276-L355 HydrophobicContact CG-CD2 4.26Å; K276-D359 HydrophobicContact CD-CB 4.04Å; K276-D359 VanDerWaalsContact CD-CG 3.43Å; K276-D359 WeakPolarHBondContact CD-OD2 3.27Å; K276-D359 IonicContact NZ-OD2 2.59Å; K276-D359 PolarHBondContact NZ-OD2 3.46Å
277	Q	81	Confident	62.5	Low	36 Å²	36	51 Å²	51	17%	0.168	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	142.5	-179.5	-74.2	175.9	-18.4	0	0	111.5	Y275 I345 E346 Y376	Y275-Q277 HydrophobicContact CD2-CG 4.11Å; Y275-Q277 HydrophobicContact CE2-CG 4.31Å; Q277-I345 CarbonylContact C-O 3.6Å; Q277-I345 WeakPolarHBondContact CA-O 3.47Å; Q277-E346 HydrophobicContact CG-CB 3.86Å; Q277-E346 HydrophobicContact CG-CG 3.56Å; Q277-E346 PolarHBondContact NE2-OE2 2.64Å; Q277-Y376 HydrophobicContact CB-CD1 4.3Å; Q277-Y376 PolarHBondContact O-N 3.01Å; Q277-Y376 VanDerWaalsContact OE1-CD1 3.3Å
278	W	73.4	Confident	63.4	Low	22 Å²	22	57.6 Å²	57.6	8%	0.083	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	131.4	-180	-65.8	92.4	0	0	0	108.7	M344 I345 D359 F363 F373 I374 P375	W278-M344 WeakPolarHBondContact O-CA 3.35Å; W278-I345 HydrophobicContact CB-CB 4.49Å; W278-I345 PolarHBondContact N-O 3.21Å; W278-I345 PolarHBondContact O-N 3.27Å; W278-D359 WeakPolarHBondContact CZ2-OD1 3.46Å; W278-D359 PolarHBondContact NE1-OD1 2.89Å; W278-F363 AromaticContact CD1-CD2 3.77Å; W278-F363 AromaticContact CD1-CG 3.96Å; W278-F363 HydrophobicContact CD2-CB 3.86Å; W278-F363 HydrophobicContact CD2-CG 4.09Å; W278-F363 AromaticContact CE2-CG 3.89Å; W278-F363 HydrophobicContact CE3-CB 4.2Å; W278-F363 HydrophobicContact CG-CB 4.44Å; W278-F363 HydrophobicContact CG-CD1 4.4Å; W278-F363 HydrophobicContact CG-CD2 4.41Å; W278-F363 HydrophobicContact CG-CG 4.16Å; W278-F363 HydrophobicContact CH2-CB 3.93Å; W278-F363 HydrophobicContact CZ2-CB 3.58Å; W278-F363 HydrophobicContact CZ2-CG 4.43Å; W278-F363 HydrophobicContact CZ3-CB 4.21Å; W278-F363 AromaticContact NE1-CD2 3.52Å; W278-F363 AromaticContact NE1-CG 3.77Å; W278-F373 HydrophobicContact CE3-CB 3.79Å; W278-F373 HydrophobicContact CZ3-CB 4.19Å; W278-I374 WeakPolarHBondContact CA-O 3.14Å; W278-P375 HydrophobicContact CE3-CB 4.31Å; W278-P375 HydrophobicContact CE3-CG 4.15Å; W278-P375 HydrophobicContact CH2-CB 4.34Å; W278-P375 HydrophobicContact CH2-CG 3.85Å; W278-P375 HydrophobicContact CZ3-CB 4.07Å; W278-P375 HydrophobicContact CZ3-CG 3.5Å; W278-P375 VanDerWaalsContact CZ3-CG 3.5Å
279	I	74	Confident	64.2	Low	20 Å²	20	60.4 Å²	60.4	10%	0.103	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	126.7	166.4	-65.1	177.3	0	0	0	107.9	T281 Q342 I374 Y376	I279-T281 HydrophobicContact CG2-CG2 3.63Å; I279-Q342 HydrophobicContact CG2-CB 3.87Å; I279-Q342 HydrophobicContact CG2-CG 4.07Å; I279-I374 PolarHBondContact N-O 2.75Å; I279-I374 PolarHBondContact O-N 3.18Å; I279-Y376 HydrophobicContact CD1-CD2 3.24Å; I279-Y376 HydrophobicContact CD1-CE2 3.68Å; I279-Y376 HydrophobicContact CD1-CG 4.11Å; I279-Y376 HydrophobicContact CG1-CD2 3.88Å; I279-Y376 HydrophobicContact CG1-CG 4.26Å
280	I	67.4	Low	65.1	Low	7 Å²	7	60.3 Å²	60.3	4%	0.036	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	121.2	162.3	-56.2	171.6	0	0	0	108.4	M293 L343 I345 F371 H372 F373	I280-M293 HydrophobicContact CB-SD 4.34Å; I280-M293 HydrophobicContact CG2-SD 3.59Å; I280-M293 VanDerWaalsContact CG2-SD 3.59Å; I280-L343 HydrophobicContact CB-CB 4.38Å; I280-L343 HydrophobicContact CD1-CD2 3.99Å; I280-L343 PolarHBondContact N-O 2.79Å; I280-L343 PolarHBondContact O-N 3.44Å; I280-I345 HydrophobicContact CD1-CD1 3.19Å; I280-I345 HydrophobicContact CD1-CG1 3.98Å; I280-I345 HydrophobicContact CG1-CD1 3.88Å; I280-I345 HydrophobicContact CG1-CG1 4.47Å; I280-F371 HydrophobicContact CG2-CB 4.04Å; I280-F371 HydrophobicContact CG2-CD1 3.77Å; I280-F371 HydrophobicContact CG2-CG 4.27Å; I280-H372 WeakPolarHBondContact CA-O 3.45Å; I280-F373 HydrophobicContact CD1-CD1 4.39Å; I280-F373 HydrophobicContact CD1-CE1 3.63Å; I280-F373 HydrophobicContact CD1-CZ 4.01Å; I280-F373 HydrophobicContact CG1-CD1 3.75Å; I280-F373 HydrophobicContact CG1-CE1 3.49Å; I280-F373 VanDerWaalsContact CG1-CE1 3.49Å; I280-F373 HydrophobicContact CG1-CZ 4.09Å
281	T	63	Low	66.1	Low	30 Å²	30	63.9 Å²	63.9	18%	0.184	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	134.4	170	60.1	0	0	0	0	110.3	I279 Q342 H372 I374	I279-T281 HydrophobicContact CG2-CG2 3.63Å; T281-Q342 HydrophobicContact CG2-CG 4.16Å; T281-H372 PolarHBondContact N-O 3.33Å; T281-H372 VanDerWaalsContact N-O 3.13Å; T281-H372 PolarHBondContact O-N 2.76Å; T281-I374 HydrophobicContact CG2-CD1 4.02Å
282	K	57.6	Low	66.9	Low	64 Å²	64	68 Å²	68	28%	0.278	35%	0.35	S	S	.	.			trans	-153.1	94.6	163.1	-173.8	176.3	-174.4	173.4	0	109.5	V285 D370 F371	K282-V285 WeakPolarHBondContact O-CG2 3.25Å; K282-D370 HydrophobicContact CD-CB 4.22Å; K282-D370 IonicContact NZ-OD2 2.87Å; K282-D370 PolarHBondContact NZ-OD2 2.89Å; K282-F371 HydrophobicContact CB-CD1 3.8Å; K282-F371 HydrophobicContact CB-CE1 3.86Å; K282-F371 HydrophobicContact CD-CD1 3.75Å; K282-F371 HydrophobicContact CD-CE1 3.29Å; K282-F371 HydrophobicContact CD-CZ 3.76Å; K282-F371 HydrophobicContact CG-CD1 4.36Å; K282-F371 HydrophobicContact CG-CE1 4.18Å
283	G	59.4	Low	67.5	Low	73 Å²	73	68.2 Å²	68.2	75%	0.753	35%	0.351	S	S	*	.	S	Bend	trans	42.3	-146.1	173.2	0	0	0	0	0	115.1	V285	G283-V285 PolarHBondContact O-N 3.24Å
284	L	54.9	Low	68.3	Low	150 Å²	150	63.6 Å²	63.6	79%	0.785	34%	0.336	S	S	*	.	S	Bend	trans	-73.3	104.3	167.8	-90.1	140.7	0	0	0	109.4	T286 Q289	L284-T286 PolarHBondContact O-N 2.64Å; L284-Q289 PolarHBondContact O-OE1 3.18Å
285	V	59.9	Low	68.9	Low	14 Å²	14	64.1 Å²	64.1	9%	0.085	34%	0.341	C	S	.	.			trans	-81.2	113.6	178.6	-172.4	0	0	0	0	110.8	K282 G283 Q289 Q290 M293 N341	K282-V285 WeakPolarHBondContact O-CG2 3.25Å; G283-V285 PolarHBondContact O-N 3.24Å; V285-Q289 HydrophobicContact CG1-CB 3.83Å; V285-Q290 HydrophobicContact CG1-CB 4.48Å; V285-Q290 HydrophobicContact CG1-CG 3.58Å; V285-M293 HydrophobicContact CG1-CE 3.4Å; V285-M293 HydrophobicContact CG2-CE 4.33Å; V285-N341 HydrophobicContact CB-CB 4.09Å; V285-N341 HydrophobicContact CG2-CB 4.19Å; V285-N341 VanDerWaalsContact CG2-O 3.28Å; V285-N341 WeakPolarHBondContact CG2-O 3.47Å
286	T	65.9	Low	68.8	Low	70 Å²	70	61.7 Å²	61.7	43%	0.429	33%	0.334	S	S	.	.			trans	-79.7	162.9	169.5	64.4	0	0	0	0	111.8	L284 Q288 Q289 Q290	L284-T286 PolarHBondContact O-N 2.64Å; T286-Q288 PolarHBondContact O-N 3.15Å; T286-Q289 WeakPolarHBondContact O-CA 3.14Å; T286-Q289 WeakPolarHBondContact O-CB 3.16Å; T286-Q289 PolarHBondContact O-N 3.04Å; T286-Q289 WeakPolarHBondContact OG1-CG 3.43Å; T286-Q289 PolarHBondContact OG1-N 3.37Å; T286-Q290 PolarHBondContact O-N 3.24Å
287	T	66	Low	68.9	Low	113 Å²	113	59.5 Å²	59.5	69%	0.693	33%	0.325	S	S	*	.	H	α-helix	trans	-55.5	-34.8	173.6	49.4	0	0	0	0	112.8	Q290 L291	T287-Q290 WeakPolarHBondContact O-CB 3.49Å; T287-Q290 PolarHBondContact O-N 2.99Å; T287-L291 PolarHBondContact O-N 3.06Å; T287-L291 VanDerWaalsContact O-N 3.16Å
288	Q	67.2	Low	68.9	Low	151 Å²	151	59.8 Å²	59.8	71%	0.706	33%	0.326	S	S	*	.	H	α-helix	trans	-64.5	-39.8	173.1	-74.4	179.9	-20.2	0	0	112.1	T286 L291 L292	T286-Q288 PolarHBondContact O-N 3.15Å; Q288-L291 PolarHBondContact O-N 3.24Å; Q288-L292 WeakPolarHBondContact O-CG 3.2Å; Q288-L292 PolarHBondContact O-N 3.25Å
289	Q	68.9	Low	69	Low	61 Å²	61	63.8 Å²	63.8	29%	0.285	35%	0.349	S	S	.	.	H	α-helix	trans	-71.6	-35	177.7	-70.7	169.6	-15	0	0	112.3	L284 V285 T286 L291 L292 M293	L284-Q289 PolarHBondContact O-OE1 3.18Å; V285-Q289 HydrophobicContact CG1-CB 3.83Å; T286-Q289 WeakPolarHBondContact O-CA 3.14Å; T286-Q289 WeakPolarHBondContact O-CB 3.16Å; T286-Q289 PolarHBondContact O-N 3.04Å; T286-Q289 WeakPolarHBondContact OG1-CG 3.43Å; T286-Q289 PolarHBondContact OG1-N 3.37Å; Q289-L291 VanDerWaalsContact C-N 3.29Å; Q289-L291 PolarHBondContact O-N 2.91Å; Q289-L292 PolarHBondContact O-N 3.24Å; Q289-M293 WeakPolarHBondContact O-CG 3.33Å; Q289-M293 PolarHBondContact O-N 3.32Å
290	Q	69.8	Low	69	Low	51 Å²	51	65.1 Å²	65.1	24%	0.238	35%	0.354	C	S	.	.	H	α-helix	trans	-56.6	-44.2	169.1	-78.4	-175.3	-9.3	0	0	112.2	V285 T286 T287 M293 I294 M335	V285-Q290 HydrophobicContact CG1-CB 4.48Å; V285-Q290 HydrophobicContact CG1-CG 3.58Å; T286-Q290 PolarHBondContact O-N 3.24Å; T287-Q290 WeakPolarHBondContact O-CB 3.49Å; T287-Q290 PolarHBondContact O-N 2.99Å; Q290-M293 HydrophobicContact CB-CE 4.39Å; Q290-M293 HydrophobicContact CG-CE 4.06Å; Q290-M293 WeakPolarHBondContact O-CB 3.21Å; Q290-M293 PolarHBondContact O-N 3.09Å; Q290-I294 WeakPolarHBondContact O-CG1 3.27Å; Q290-I294 PolarHBondContact O-N 2.7Å; Q290-M335 HydrophobicContact CB-CE 3.58Å; Q290-M335 HydrophobicContact CG-CE 3.91Å
291	L	71.5	Confident	69.2	Low	105 Å²	105	64.9 Å²	64.9	55%	0.55	35%	0.352	S	S	.	.	H	α-helix	trans	-68.7	-39	178.8	-150.1	151.7	0	0	0	111.5	T287 Q288 Q289 M293 I294 N295	T287-L291 PolarHBondContact O-N 3.06Å; T287-L291 VanDerWaalsContact O-N 3.16Å; Q288-L291 PolarHBondContact O-N 3.24Å; Q289-L291 VanDerWaalsContact C-N 3.29Å; Q289-L291 PolarHBondContact O-N 2.91Å; L291-M293 VanDerWaalsContact C-N 3.35Å; L291-M293 PolarHBondContact O-N 3.33Å; L291-I294 PolarHBondContact O-N 2.65Å; L291-N295 WeakPolarHBondContact O-CB 3.32Å; L291-N295 VanDerWaalsContact O-CG 3.25Å; L291-N295 PolarHBondContact O-N 2.87Å
292	L	72.4	Confident	69.7	Low	100 Å²	100	68.2 Å²	68.2	52%	0.524	37%	0.369	S	S	.	.	H	α-helix	trans	-60.5	-41.4	171.5	-74.8	166.5	0	0	0	112.3	Q288 Q289 N295 Q296	Q288-L292 WeakPolarHBondContact O-CG 3.2Å; Q288-L292 PolarHBondContact O-N 3.25Å; Q289-L292 PolarHBondContact O-N 3.24Å; L292-N295 PolarHBondContact O-N 3.47Å; L292-Q296 WeakPolarHBondContact O-CG 3.3Å; L292-Q296 PolarHBondContact O-N 2.73Å
293	M	71.2	Confident	70.3	Confident	8 Å²	8	74 Å²	74	4%	0.039	39%	0.394	C	S	.	.	H	α-helix	trans	-62.8	-44.3	176.4	-74.7	-173.7	-66.7	0	0	112.1	I280 V285 Q289 Q290 L291 Q296 L297 L343 F371	I280-M293 HydrophobicContact CB-SD 4.34Å; I280-M293 HydrophobicContact CG2-SD 3.59Å; I280-M293 VanDerWaalsContact CG2-SD 3.59Å; V285-M293 HydrophobicContact CG1-CE 3.4Å; V285-M293 HydrophobicContact CG2-CE 4.33Å; Q289-M293 WeakPolarHBondContact O-CG 3.33Å; Q289-M293 PolarHBondContact O-N 3.32Å; Q290-M293 HydrophobicContact CB-CE 4.39Å; Q290-M293 HydrophobicContact CG-CE 4.06Å; Q290-M293 WeakPolarHBondContact O-CB 3.21Å; Q290-M293 PolarHBondContact O-N 3.09Å; L291-M293 VanDerWaalsContact C-N 3.35Å; L291-M293 PolarHBondContact O-N 3.33Å; M293-Q296 PolarHBondContact O-N 3.47Å; M293-L297 PolarHBondContact O-N 2.89Å; M293-L343 HydrophobicContact CB-CD1 4.3Å; M293-L343 HydrophobicContact CE-CB 4.21Å; M293-L343 HydrophobicContact CE-CD1 3.72Å; M293-L343 HydrophobicContact SD-CD1 4.37Å; M293-F371 HydrophobicContact CG-CD1 3.7Å; M293-F371 HydrophobicContact CG-CE1 3.11Å; M293-F371 HydrophobicContact CG-CE2 4.2Å; M293-F371 HydrophobicContact CG-CG 4.44Å; M293-F371 HydrophobicContact CG-CZ 3.4Å; M293-F371 HydrophobicContact SD-CD1 3.63Å; M293-F371 HydrophobicContact SD-CE1 3.38Å; M293-F371 WeakPolarHBondContact SD-CE1 3.38Å; M293-F371 HydrophobicContact SD-CZ 4.28Å
294	I	75.3	Confident	70.6	Confident	26 Å²	26	74.7 Å²	74.7	13%	0.133	38%	0.381	C	S	.	.	H	α-helix	trans	-61.1	-47.9	175.4	-70.5	165.8	0	0	0	110.5	Q290 L291 Q296 L297 E298 L317 Y319 M335	Q290-I294 WeakPolarHBondContact O-CG1 3.27Å; Q290-I294 PolarHBondContact O-N 2.7Å; L291-I294 PolarHBondContact O-N 2.65Å; I294-Q296 VanDerWaalsContact C-N 3.26Å; I294-Q296 PolarHBondContact O-N 2.94Å; I294-L297 WeakPolarHBondContact O-CB 3.2Å; I294-L297 PolarHBondContact O-N 3.37Å; I294-L297 VanDerWaalsContact O-N 3.12Å; I294-E298 HydrophobicContact CG2-CG 4.34Å; I294-E298 WeakPolarHBondContact CG2-OE1 3.15Å; I294-E298 WeakPolarHBondContact O-CG 3.23Å; I294-E298 PolarHBondContact O-N 3.3Å; I294-L317 HydrophobicContact CD1-CD1 3.8Å; I294-L317 HydrophobicContact CG1-CD1 4.36Å; I294-L317 HydrophobicContact CG2-CD1 4.45Å; I294-Y319 WeakPolarHBondContact CG2-OH 3.35Å; I294-M335 HydrophobicContact CD1-CE 3.46Å; I294-M335 VanDerWaalsContact CD1-CE 3.46Å; I294-M335 HydrophobicContact CD1-SD 3.86Å; I294-M335 HydrophobicContact CG1-CE 4.18Å; I294-M335 HydrophobicContact CG1-SD 4.3Å
295	N	77	Confident	71.1	Confident	68 Å²	68	69.2 Å²	69.2	36%	0.364	35%	0.354	S	S	.	.	H	α-helix	trans	-58.5	-38.8	178.1	-72.3	-10.6	0	0	0	111.8	L291 L292 E298 L299	L291-N295 WeakPolarHBondContact O-CB 3.32Å; L291-N295 VanDerWaalsContact O-CG 3.25Å; L291-N295 PolarHBondContact O-N 2.87Å; L292-N295 PolarHBondContact O-N 3.47Å; N295-E298 PolarHBondContact O-N 3.3Å; N295-L299 WeakPolarHBondContact O-CB 3.43Å; N295-L299 WeakPolarHBondContact O-CG 2.88Å; N295-L299 PolarHBondContact O-N 2.87Å
296	Q	75.4	Confident	71.5	Confident	61 Å²	61	75.3 Å²	75.3	29%	0.285	39%	0.385	S	S	.	.	H	α-helix	trans	-68.2	-40.6	176	-76.4	-173.1	-11.3	0	0	112.9	L292 M293 I294 L299 K300	L292-Q296 WeakPolarHBondContact O-CG 3.3Å; L292-Q296 PolarHBondContact O-N 2.73Å; M293-Q296 PolarHBondContact O-N 3.47Å; I294-Q296 VanDerWaalsContact C-N 3.26Å; I294-Q296 PolarHBondContact O-N 2.94Å; Q296-L299 PolarHBondContact O-N 3.41Å; Q296-K300 PolarHBondContact O-N 3.3Å
297	L	76.3	Confident	71.6	Confident	20 Å²	20	74.1 Å²	74.1	11%	0.105	37%	0.373	C	S	.	.	H	α-helix	trans	-60.4	-46.8	173.4	179.6	125.8	0	0	0	110.6	M293 I294 K300 L301 Y319 V333 I345	M293-L297 PolarHBondContact O-N 2.89Å; I294-L297 WeakPolarHBondContact O-CB 3.2Å; I294-L297 PolarHBondContact O-N 3.37Å; I294-L297 VanDerWaalsContact O-N 3.12Å; L297-K300 WeakPolarHBondContact O-CB 3.29Å; L297-K300 PolarHBondContact O-N 3.49Å; L297-L301 HydrophobicContact CD2-CD1 3.65Å; L297-L301 HydrophobicContact CG-CD1 4.18Å; L297-L301 WeakPolarHBondContact O-CG 2.94Å; L297-L301 PolarHBondContact O-N 2.93Å; L297-Y319 HydrophobicContact CD2-CD2 4.11Å; L297-Y319 HydrophobicContact CD2-CE1 4.19Å; L297-Y319 HydrophobicContact CD2-CE2 3.76Å; L297-V333 HydrophobicContact CD2-CG2 4.32Å; L297-I345 HydrophobicContact CD1-CD1 3.46Å; L297-I345 VanDerWaalsContact CD1-CD1 3.46Å; L297-I345 HydrophobicContact CD1-CG1 4.31Å
298	E	79.7	Confident	71.6	Confident	41 Å²	41	72.4 Å²	72.4	19%	0.192	36%	0.359	C	S	.	.	H	α-helix	trans	-62.7	-42.1	176.7	-74.8	179.1	-170.8	0	0	112.6	I294 N295 K300 L301 N302 W307 I309 Y319	I294-E298 HydrophobicContact CG2-CG 4.34Å; I294-E298 WeakPolarHBondContact CG2-OE1 3.15Å; I294-E298 WeakPolarHBondContact O-CG 3.23Å; I294-E298 PolarHBondContact O-N 3.3Å; N295-E298 PolarHBondContact O-N 3.3Å; E298-K300 VanDerWaalsContact C-N 3.3Å; E298-K300 PolarHBondContact O-N 3.3Å; E298-L301 PolarHBondContact O-N 2.93Å; E298-N302 VanDerWaalsContact O-CB 3.32Å; E298-N302 WeakPolarHBondContact O-CB 3.36Å; E298-N302 PolarHBondContact O-N 3.26Å; E298-N302 PolarHBondContact O-ND2 2.87Å; E298-W307 HydrophobicContact CB-CH2 4.48Å; E298-W307 HydrophobicContact CB-CZ2 3.93Å; E298-W307 HydrophobicContact CG-CH2 4.02Å; E298-W307 HydrophobicContact CG-CZ2 3.85Å; E298-I309 VanDerWaalsContact OE1-CD1 3.25Å; E298-I309 WeakPolarHBondContact OE1-CD1 3.47Å; E298-Y319 HydrophobicContact CG-CE1 3.6Å; E298-Y319 PolarHBondContact OE1-OH 2.99Å
299	L	77.2	Confident	71.6	Confident	107 Å²	107	68.4 Å²	68.4	56%	0.56	34%	0.342	S	S	*	.	H	α-helix	trans	-60.9	-38.3	174.3	-77.5	169.6	0	0	0	112.2	N295 Q296 K303	N295-L299 WeakPolarHBondContact O-CB 3.43Å; N295-L299 WeakPolarHBondContact O-CG 2.88Å; N295-L299 PolarHBondContact O-N 2.87Å; Q296-L299 PolarHBondContact O-N 3.41Å; L299-K303 WeakPolarHBondContact O-CG 2.98Å; L299-K303 PolarHBondContact O-N 3.33Å
300	K	72.4	Confident	71.3	Confident	48 Å²	48	69.4 Å²	69.4	21%	0.209	34%	0.343	C	S	.	.	H	α-helix	trans	-68.1	-46.4	173.4	-83.4	-171.9	166.5	-165.2	0	112	Q296 L297 E298 N302 K303 L304 L362	Q296-K300 PolarHBondContact O-N 3.3Å; L297-K300 WeakPolarHBondContact O-CB 3.29Å; L297-K300 PolarHBondContact O-N 3.49Å; E298-K300 VanDerWaalsContact C-N 3.3Å; E298-K300 PolarHBondContact O-N 3.3Å; K300-N302 VanDerWaalsContact C-N 3.29Å; K300-N302 PolarHBondContact O-N 2.87Å; K300-K303 WeakPolarHBondContact O-CB 3.25Å; K300-K303 PolarHBondContact O-N 2.99Å; K300-K303 VanDerWaalsContact O-N 3.1Å; K300-L304 WeakPolarHBondContact O-CG 3.31Å; K300-L304 PolarHBondContact O-N 3.27Å; K300-L362 HydrophobicContact CB-CD2 4.28Å; K300-L362 PolarHBondContact NZ-O 3.3Å; K300-L362 VanDerWaalsContact NZ-O 3.07Å
301	L	72.2	Confident	70.7	Confident	1 Å²	1	73.8 Å²	73.8	1%	0.005	36%	0.362	C	S	.	.	H	α-helix	trans	-60.7	-42.2	178.5	-68.9	172.8	0	0	0	111	L297 E298 K303 L304 C305 W307 Y319 I321 I331 L362	L297-L301 HydrophobicContact CD2-CD1 3.65Å; L297-L301 HydrophobicContact CG-CD1 4.18Å; L297-L301 WeakPolarHBondContact O-CG 2.94Å; L297-L301 PolarHBondContact O-N 2.93Å; E298-L301 PolarHBondContact O-N 2.93Å; L301-K303 PolarHBondContact O-N 2.9Å; L301-L304 PolarHBondContact O-N 3.41Å; L301-C305 PolarHBondContact O-N 3.37Å; L301-C305 PolarHBondContact O-SG 3.21Å; L301-C305 VanDerWaalsContact O-SG 3.35Å; L301-W307 HydrophobicContact CB-CG 4.19Å; L301-W307 VanDerWaalsContact CB-NE1 3.33Å; L301-W307 HydrophobicContact CD1-CG 4.46Å; L301-Y319 HydrophobicContact CD1-CD1 3.8Å; L301-Y319 HydrophobicContact CD1-CE1 4.35Å; L301-Y319 HydrophobicContact CD1-CG 4.07Å; L301-I321 HydrophobicContact CD2-CD1 3.87Å; L301-I331 HydrophobicContact CD1-CD1 4.14Å; L301-I331 HydrophobicContact CD2-CD1 3.52Å; L301-I331 HydrophobicContact CG-CD1 4.36Å; L301-L362 HydrophobicContact CD2-CD1 4.17Å; L301-L362 HydrophobicContact CD2-CD2 4.35Å
302	N	74.3	Confident	70	Confident	100 Å²	100	69.9 Å²	69.9	54%	0.535	34%	0.341	S	S	.	.	H	α-helix	trans	-58.3	-30.1	174.9	-75.1	-19	0	0	0	113.8	E298 K300 W307	E298-N302 VanDerWaalsContact O-CB 3.32Å; E298-N302 WeakPolarHBondContact O-CB 3.36Å; E298-N302 PolarHBondContact O-N 3.26Å; E298-N302 PolarHBondContact O-ND2 2.87Å; K300-N302 VanDerWaalsContact C-N 3.29Å; K300-N302 PolarHBondContact O-N 2.87Å; N302-W307 VanDerWaalsContact OD1-CE2 3.31Å; N302-W307 WeakPolarHBondContact OD1-CZ2 3.4Å; N302-W307 PolarHBondContact OD1-NE1 3.2Å
303	K	70.5	Confident	69.3	Low	185 Å²	185	67.6 Å²	67.6	80%	0.804	33%	0.33	S	S	*	.	H	α-helix	trans	-76.3	-24.3	175.5	-72.7	177.9	-179.1	-179.5	0	113	L299 K300 L301	L299-K303 WeakPolarHBondContact O-CG 2.98Å; L299-K303 PolarHBondContact O-N 3.33Å; K300-K303 WeakPolarHBondContact O-CB 3.25Å; K300-K303 PolarHBondContact O-N 2.99Å; K300-K303 VanDerWaalsContact O-N 3.1Å; L301-K303 PolarHBondContact O-N 2.9Å
304	L	64.6	Low	68.7	Low	89 Å²	89	75.6 Å²	75.6	47%	0.466	36%	0.364	S	S	.	.	H	α-helix	trans	-107.6	-34	-167.7	-66.7	170.5	0	0	0	113	K300 L301 V361 L362	K300-L304 WeakPolarHBondContact O-CG 3.31Å; K300-L304 PolarHBondContact O-N 3.27Å; L301-L304 PolarHBondContact O-N 3.41Å; L304-V361 HydrophobicContact CD1-CG1 3.5Å; L304-V361 VanDerWaalsContact CD1-CG1 3.5Å; L304-V361 HydrophobicContact CD2-CG1 3.44Å; L304-V361 VanDerWaalsContact CD2-CG1 3.44Å; L304-V361 HydrophobicContact CG-CG1 4.09Å; L304-L362 HydrophobicContact CD1-CD2 3.43Å; L304-L362 VanDerWaalsContact CD1-CD2 3.43Å; L304-L362 HydrophobicContact CD1-CG 4.21Å
305	C	65.6	Low	68	Low	34 Å²	34	79.6 Å²	79.6	23%	0.23	38%	0.378	C	S	.	.			trans	-162.3	161.5	-168.1	54.9	0	0	0	0	112.8	L301 I321	L301-C305 PolarHBondContact O-N 3.37Å; L301-C305 PolarHBondContact O-SG 3.21Å; L301-C305 VanDerWaalsContact O-SG 3.35Å; C305-I321 HydrophobicContact CB-CG2 3.53Å; C305-I321 VanDerWaalsContact SG-CG2 3.53Å
306	I	68.5	Low	67.4	Low	142 Å²	142	76.6 Å²	76.6	73%	0.728	36%	0.362	S	S	*	.			trans	-84.4	136.6	165.9	-58.1	171.2	0	0	0	107.3	I321	I306-I321 CarbonylContact O-C 3.57Å
307	W	67.4	Low	67.2	Low	46 Å²	46	75 Å²	75	17%	0.174	36%	0.355	C	S	.	.			trans	-138.7	154.9	179.8	51.1	-91.6	0	0	0	111.2	E298 L301 N302 I309 Y319 L320 I321	E298-W307 HydrophobicContact CB-CH2 4.48Å; E298-W307 HydrophobicContact CB-CZ2 3.93Å; E298-W307 HydrophobicContact CG-CH2 4.02Å; E298-W307 HydrophobicContact CG-CZ2 3.85Å; L301-W307 HydrophobicContact CB-CG 4.19Å; L301-W307 VanDerWaalsContact CB-NE1 3.33Å; L301-W307 HydrophobicContact CD1-CG 4.46Å; N302-W307 VanDerWaalsContact OD1-CE2 3.31Å; N302-W307 WeakPolarHBondContact OD1-CZ2 3.4Å; N302-W307 PolarHBondContact OD1-NE1 3.2Å; W307-I309 HydrophobicContact CE3-CB 4.48Å; W307-I309 HydrophobicContact CE3-CD1 3.98Å; W307-I309 HydrophobicContact CE3-CG1 3.59Å; W307-I309 HydrophobicContact CH2-CD1 3.46Å; W307-I309 VanDerWaalsContact CH2-CD1 3.46Å; W307-I309 HydrophobicContact CH2-CG1 4.06Å; W307-I309 HydrophobicContact CZ3-CB 4.13Å; W307-I309 HydrophobicContact CZ3-CD1 3.08Å; W307-I309 HydrophobicContact CZ3-CG1 3.21Å; W307-Y319 HydrophobicContact CD2-CD1 4.07Å; W307-Y319 AromaticContact CE3-CD1 3.88Å; W307-Y319 HydrophobicContact CE3-CD1 3.88Å; W307-Y319 HydrophobicContact CE3-CE1 4.31Å; W307-Y319 HydrophobicContact CH2-CE1 4.45Å; W307-Y319 HydrophobicContact CZ3-CD1 4.32Å; W307-Y319 HydrophobicContact CZ3-CE1 4.3Å; W307-L320 CarbonylContact C-O 3.48Å; W307-L320 WeakPolarHBondContact CA-O 2.8Å; W307-I321 HydrophobicContact CB-CG1 4.47Å
308	N	65.9	Low	67	Low	77 Å²	77	74.1 Å²	74.1	41%	0.412	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	126.5	171.7	-68.3	-34.1	0	0	0	109.2	Y310 L320	N308-Y310 HydrophobicContact CB-CD2 4.4Å; N308-Y310 HydrophobicContact CB-CE2 3.62Å; N308-L320 PolarHBondContact N-O 3.27Å; N308-L320 PolarHBondContact O-N 2.94Å
309	I	67.6	Low	66.6	Low	66 Å²	66	72.2 Å²	72.2	34%	0.338	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	133.2	171.9	-74.9	162.5	0	0	0	110	E298 W307 L317 L318 Y319	E298-I309 VanDerWaalsContact OE1-CD1 3.25Å; E298-I309 WeakPolarHBondContact OE1-CD1 3.47Å; W307-I309 HydrophobicContact CE3-CB 4.48Å; W307-I309 HydrophobicContact CE3-CD1 3.98Å; W307-I309 HydrophobicContact CE3-CG1 3.59Å; W307-I309 HydrophobicContact CH2-CD1 3.46Å; W307-I309 VanDerWaalsContact CH2-CD1 3.46Å; W307-I309 HydrophobicContact CH2-CG1 4.06Å; W307-I309 HydrophobicContact CZ3-CB 4.13Å; W307-I309 HydrophobicContact CZ3-CD1 3.08Å; W307-I309 HydrophobicContact CZ3-CG1 3.21Å; I309-L317 HydrophobicContact CG2-CD2 4.38Å; I309-L318 WeakPolarHBondContact CA-O 3.23Å; I309-Y319 HydrophobicContact CD1-CD1 4.1Å; I309-Y319 HydrophobicContact CD1-CE1 3.4Å; I309-Y319 VanDerWaalsContact CD1-CE1 3.4Å; I309-Y319 HydrophobicContact CG1-CD1 3.38Å; I309-Y319 HydrophobicContact CG1-CE1 3.18Å; I309-Y319 HydrophobicContact CG1-CG 4.24Å
310	Y	62.2	Low	66.1	Low	82 Å²	82	67.4 Å²	67.4	32%	0.322	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	118.7	164.9	-63.3	-94.2	0	0	0	108.7	N308 L312 L318 L320	N308-Y310 HydrophobicContact CB-CD2 4.4Å; N308-Y310 HydrophobicContact CB-CE2 3.62Å; Y310-L312 PolarHBondContact O-N 2.82Å; Y310-L318 PolarHBondContact N-O 3.48Å; Y310-L318 PolarHBondContact O-N 2.63Å; Y310-L320 HydrophobicContact CD2-CD1 3.73Å; Y310-L320 HydrophobicContact CD2-CG 4.38Å; Y310-L320 HydrophobicContact CE2-CB 4.36Å; Y310-L320 HydrophobicContact CE2-CD1 3.48Å; Y310-L320 VanDerWaalsContact CE2-CD1 3.48Å; Y310-L320 HydrophobicContact CE2-CG 4.35Å
311	K	58.7	Low	65.7	Low	144 Å²	144	66.1 Å²	66.1	63%	0.626	31%	0.312	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.3	104.5	172.8	-172.9	170.8	-175	173.4	0	108.6	N313 L317	K311-N313 VanDerWaalsContact CE-O 3.29Å; K311-N313 WeakPolarHBondContact CE-O 3.34Å; K311-N313 VanDerWaalsContact CG-O 3.25Å; K311-N313 WeakPolarHBondContact CG-O 3.5Å; K311-L317 HydrophobicContact CB-CD2 4.13Å; K311-L317 HydrophobicContact CD-CD2 4.44Å; K311-L317 HydrophobicContact CG-CD2 4Å
312	L	56.7	Low	65.1	Low	22 Å²	22	67.7 Å²	67.7	12%	0.115	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	-37.9	-177.8	-65	170.1	0	0	0	111.4	I264 Y310 L316 L318 Y332	I264-L312 HydrophobicContact CG2-CB 3.48Å; I264-L312 VanDerWaalsContact CG2-CB 3.48Å; I264-L312 HydrophobicContact CG2-CD1 3.69Å; I264-L312 HydrophobicContact CG2-CG 4.13Å; Y310-L312 PolarHBondContact O-N 2.82Å; L312-L316 HydrophobicContact CB-CD2 4.16Å; L312-L316 HydrophobicContact CD1-CD2 3.81Å; L312-L316 PolarHBondContact N-O 2.69Å; L312-L318 HydrophobicContact CD1-CB 3.8Å; L312-L318 HydrophobicContact CD1-CD2 4.35Å; L312-L318 HydrophobicContact CG-CB 4.17Å; L312-Y332 HydrophobicContact CD1-CE2 4.17Å
313	N	56.8	Low	64	Low	52 Å²	52	70.8 Å²	70.8	28%	0.278	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.3	-172.1	169.6	67.9	39.4	0	0	0	111.6	I264 K311 Y315 L316	I264-N313 HydrophobicContact CD1-CB 3.79Å; I264-N313 WeakPolarHBondContact CD1-ND2 3.29Å; K311-N313 VanDerWaalsContact CE-O 3.29Å; K311-N313 WeakPolarHBondContact CE-O 3.34Å; K311-N313 VanDerWaalsContact CG-O 3.25Å; K311-N313 WeakPolarHBondContact CG-O 3.5Å; N313-Y315 PolarHBondContact O-N 3.33Å; N313-Y315 WeakPolarHBondContact OD1-CA 3.22Å; N313-Y315 PolarHBondContact OD1-N 2.79Å; N313-L316 VanDerWaalsContact CG-CB 3.49Å; N313-L316 PolarHBondContact N-O 3.21Å; N313-L316 PolarHBondContact O-N 3.28Å; N313-L316 WeakPolarHBondContact OD1-CB 3.09Å; N313-L316 PolarHBondContact OD1-N 2.92Å
314	K	58.5	Low	62.9	Low	176 Å²	176	62.8 Å²	62.8	77%	0.765	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.9	-31.8	179.1	-81.9	-172.5	178.7	179.3	0	113.8
315	Y	61.5	Low	62.2	Low	111 Å²	111	58.7 Å²	58.7	44%	0.435	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.2	5.4	-170.5	-54.4	-72.5	0	0	0	113.2	N313 M335 N336	N313-Y315 PolarHBondContact O-N 3.33Å; N313-Y315 WeakPolarHBondContact OD1-CA 3.22Å; N313-Y315 PolarHBondContact OD1-N 2.79Å; Y315-M335 WeakPolarHBondContact O-CA 3.25Å; Y315-M335 WeakPolarHBondContact O-CB 3.42Å; Y315-M335 WeakPolarHBondContact O-CG 3.26Å; Y315-M335 PolarHBondContact O-N 3.33Å; Y315-N336 HydrophobicContact CD1-CB 4.37Å; Y315-N336 WeakPolarHBondContact CD1-OD1 3.38Å; Y315-N336 HydrophobicContact CD2-CB 4.34Å; Y315-N336 VanDerWaalsContact CD2-CG 3.47Å; Y315-N336 WeakPolarHBondContact CD2-ND2 3.46Å; Y315-N336 WeakPolarHBondContact CD2-OD1 3.39Å; Y315-N336 HydrophobicContact CG-CB 3.86Å; Y315-N336 VanDerWaalsContact CG-OD1 3.29Å
316	L	64.6	Low	61.5	Low	5 Å²	5	58.5 Å²	58.5	3%	0.026	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	115	-158.8	-146.7	148.6	0	0	0	111.7	I264 L312 N313 Y332	I264-L316 HydrophobicContact CG2-CD1 4.25Å; I264-L316 HydrophobicContact CG2-CD2 3.96Å; L312-L316 HydrophobicContact CB-CD2 4.16Å; L312-L316 HydrophobicContact CD1-CD2 3.81Å; L312-L316 PolarHBondContact N-O 2.69Å; N313-L316 VanDerWaalsContact CG-CB 3.49Å; N313-L316 PolarHBondContact N-O 3.21Å; N313-L316 PolarHBondContact O-N 3.28Å; N313-L316 WeakPolarHBondContact OD1-CB 3.09Å; N313-L316 PolarHBondContact OD1-N 2.92Å; L316-Y332 HydrophobicContact CD1-CE1 3.64Å; L316-Y332 HydrophobicContact CD1-CE2 4.36Å; L316-Y332 WeakPolarHBondContact CD1-OH 3.34Å; L316-Y332 HydrophobicContact CD2-CD1 4.21Å; L316-Y332 HydrophobicContact CD2-CD2 3.72Å; L316-Y332 HydrophobicContact CD2-CE1 3.57Å; L316-Y332 HydrophobicContact CD2-CE2 3.02Å; L316-Y332 HydrophobicContact CD2-CG 4.29Å; L316-Y332 WeakPolarHBondContact CD2-OH 3.44Å; L316-Y332 HydrophobicContact CG-CD1 4.45Å; L316-Y332 HydrophobicContact CG-CE1 3.62Å; L316-Y332 HydrophobicContact CG-CE2 4.02Å; L316-Y332 VanDerWaalsContact CG-CZ 3.4Å; L316-Y332 WeakPolarHBondContact CG-OH 3.32Å
317	L	70.5	Confident	60.8	Low	26 Å²	26	60.8 Å²	60.8	14%	0.136	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	133.2	-175.7	-61.1	169.4	0	0	0	109.5	I294 I309 K311 Y319 V333	I294-L317 HydrophobicContact CD1-CD1 3.8Å; I294-L317 HydrophobicContact CG1-CD1 4.36Å; I294-L317 HydrophobicContact CG2-CD1 4.45Å; I309-L317 HydrophobicContact CG2-CD2 4.38Å; K311-L317 HydrophobicContact CB-CD2 4.13Å; K311-L317 HydrophobicContact CD-CD2 4.44Å; K311-L317 HydrophobicContact CG-CD2 4Å; L317-Y319 HydrophobicContact CB-CE2 3.88Å; L317-Y319 HydrophobicContact CD1-CE2 4.49Å; L317-V333 HydrophobicContact CB-CB 4.28Å; L317-V333 PolarHBondContact N-O 3.38Å; L317-V333 VanDerWaalsContact N-O 3.11Å; L317-V333 PolarHBondContact O-N 3.46Å
318	L	71.4	Confident	60.8	Low	3 Å²	3	58.8 Å²	58.8	2%	0.016	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	118.6	173	-177.8	76.8	0	0	0	108.8	P268 I309 Y310 L312 L320 C330 I331 Y332	P268-L318 HydrophobicContact CG-CD1 4.23Å; I309-L318 WeakPolarHBondContact CA-O 3.23Å; Y310-L318 PolarHBondContact N-O 3.48Å; Y310-L318 PolarHBondContact O-N 2.63Å; L312-L318 HydrophobicContact CD1-CB 3.8Å; L312-L318 HydrophobicContact CD1-CD2 4.35Å; L312-L318 HydrophobicContact CG-CB 4.17Å; L318-L320 HydrophobicContact CD2-CD1 4.32Å; L318-L320 HydrophobicContact CD2-CG 4.27Å; L318-C330 HydrophobicContact CD1-CB 3.81Å; L318-I331 CarbonylContact C-O 3.59Å; L318-I331 WeakPolarHBondContact CA-O 3.48Å; L318-Y332 HydrophobicContact CD1-CD2 4.23Å
319	Y	70.7	Confident	60.9	Low	0 Å²	0	55.6 Å²	55.6	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	118.6	170.4	-59.9	-101.2	0	0	0	108.5	I294 L297 E298 L301 W307 I309 L317 C330 I331 V333	I294-Y319 WeakPolarHBondContact CG2-OH 3.35Å; L297-Y319 HydrophobicContact CD2-CD2 4.11Å; L297-Y319 HydrophobicContact CD2-CE1 4.19Å; L297-Y319 HydrophobicContact CD2-CE2 3.76Å; E298-Y319 HydrophobicContact CG-CE1 3.6Å; E298-Y319 PolarHBondContact OE1-OH 2.99Å; L301-Y319 HydrophobicContact CD1-CD1 3.8Å; L301-Y319 HydrophobicContact CD1-CE1 4.35Å; L301-Y319 HydrophobicContact CD1-CG 4.07Å; W307-Y319 HydrophobicContact CD2-CD1 4.07Å; W307-Y319 AromaticContact CE3-CD1 3.88Å; W307-Y319 HydrophobicContact CE3-CD1 3.88Å; W307-Y319 HydrophobicContact CE3-CE1 4.31Å; W307-Y319 HydrophobicContact CH2-CE1 4.45Å; W307-Y319 HydrophobicContact CZ3-CD1 4.32Å; W307-Y319 HydrophobicContact CZ3-CE1 4.3Å; I309-Y319 HydrophobicContact CD1-CD1 4.1Å; I309-Y319 HydrophobicContact CD1-CE1 3.4Å; I309-Y319 VanDerWaalsContact CD1-CE1 3.4Å; I309-Y319 HydrophobicContact CG1-CD1 3.38Å; I309-Y319 HydrophobicContact CG1-CE1 3.18Å; I309-Y319 HydrophobicContact CG1-CG 4.24Å; L317-Y319 HydrophobicContact CB-CE2 3.88Å; L317-Y319 HydrophobicContact CD1-CE2 4.49Å; Y319-C330 CarbonylContact O-C 3.52Å; Y319-C330 VanDerWaalsContact O-CA 3.23Å; Y319-C330 WeakPolarHBondContact O-CA 3.5Å; Y319-I331 PolarHBondContact N-O 3.35Å; Y319-I331 PolarHBondContact O-N 3.03Å; Y319-V333 HydrophobicContact CD2-CG2 4.02Å; Y319-V333 HydrophobicContact CE2-CB 4.49Å; Y319-V333 HydrophobicContact CE2-CG2 3.68Å
320	L	66.9	Low	61.3	Low	6 Å²	6	52.5 Å²	52.5	3%	0.031	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	116.6	171.5	-80.2	165.8	0	0	0	109.1	Y272 W307 N308 Y310 L318 I325 C330	Y272-L320 WeakPolarHBondContact OH-CD2 3.43Å; W307-L320 CarbonylContact C-O 3.48Å; W307-L320 WeakPolarHBondContact CA-O 2.8Å; N308-L320 PolarHBondContact N-O 3.27Å; N308-L320 PolarHBondContact O-N 2.94Å; Y310-L320 HydrophobicContact CD2-CD1 3.73Å; Y310-L320 HydrophobicContact CD2-CG 4.38Å; Y310-L320 HydrophobicContact CE2-CB 4.36Å; Y310-L320 HydrophobicContact CE2-CD1 3.48Å; Y310-L320 VanDerWaalsContact CE2-CD1 3.48Å; Y310-L320 HydrophobicContact CE2-CG 4.35Å; L318-L320 HydrophobicContact CD2-CD1 4.32Å; L318-L320 HydrophobicContact CD2-CG 4.27Å; L320-I325 HydrophobicContact CD1-CG2 3.75Å; L320-I325 HydrophobicContact CD2-CG2 4.02Å; L320-C330 HydrophobicContact CD2-CB 3.92Å
321	I	64.9	Low	62	Low	21 Å²	21	48.6 Å²	48.6	11%	0.108	23%	0.232	C	C	.	.			trans	-87	-21.2	-177.5	-60.8	-177.9	0	0	0	111.8	L301 C305 I306 W307 I329 I331 L358	L301-I321 HydrophobicContact CD2-CD1 3.87Å; C305-I321 HydrophobicContact CB-CG2 3.53Å; C305-I321 VanDerWaalsContact SG-CG2 3.53Å; I306-I321 CarbonylContact O-C 3.57Å; W307-I321 HydrophobicContact CB-CG1 4.47Å; I321-I329 HydrophobicContact CB-CB 4.16Å; I321-I329 HydrophobicContact CD1-CB 4.25Å; I321-I329 HydrophobicContact CD1-CG2 3.82Å; I321-I329 HydrophobicContact CG1-CG2 4.45Å; I321-I329 PolarHBondContact N-O 2.98Å; I321-I331 HydrophobicContact CD1-CD1 3.8Å; I321-I331 HydrophobicContact CD1-CG1 3.97Å; I321-L358 HydrophobicContact CD1-CD1 3.88Å
322	T	59	Low	62.8	Low	35 Å²	35	42.2 Å²	42.2	22%	0.215	20%	0.204	C	C	.	.	S	Bend	trans	-107.5	155.9	179.6	51.2	0	0	0	0	112.1	G324 K327 G328 I329	T322-G324 PolarHBondContact O-N 3.03Å; T322-G324 PolarHBondContact OG1-O 3.32Å; T322-G324 VanDerWaalsContact OG1-O 3.09Å; T322-K327 WeakPolarHBondContact CB-O 3.4Å; T322-K327 WeakPolarHBondContact CG2-O 3.39Å; T322-K327 PolarHBondContact OG1-O 3.28Å; T322-G328 VanDerWaalsContact CG2-CA 3.49Å; T322-G328 WeakPolarHBondContact OG1-CA 3.27Å; T322-G328 PolarHBondContact OG1-N 3.46Å; T322-I329 PolarHBondContact OG1-N 3.3Å
323	N	50.9	Low	63.6	Low	164 Å²	164	41.3 Å²	41.3	88%	0.877	20%	0.2	S	C	*	.	S	Bend	trans	-61.9	11.8	-179.1	-72.9	-7.8	0	0	0	115.3
324	G	47.1	Very low	64.2	Low	18 Å²	18	39.8 Å²	39.8	19%	0.186	19%	0.191	C	C	.	.	S	Bend	trans	-176.2	156.9	175.9	0	0	0	0	0	111.7	T322 F326	T322-G324 PolarHBondContact O-N 3.03Å; T322-G324 PolarHBondContact OG1-O 3.32Å; T322-G324 VanDerWaalsContact OG1-O 3.09Å; G324-F326 PolarHBondContact O-N 3.31Å
325	I	51	Low	64.5	Low	3 Å²	3	32.7 Å²	32.7	2%	0.015	16%	0.161	C	C	.	.	S	Bend	trans	-64.4	-32.6	-177	54.7	174.8	0	0	0	113.6	I245 Y249 F255 F267 I271 Y272 L320	I245-I325 HydrophobicContact CG2-CD1 4.33Å; Y249-I325 HydrophobicContact CD2-CD1 3.36Å; Y249-I325 HydrophobicContact CD2-CG1 3.81Å; Y249-I325 HydrophobicContact CE2-CD1 3.86Å; Y249-I325 HydrophobicContact CE2-CG1 3.83Å; Y249-I325 HydrophobicContact CE2-CG2 4.43Å; Y249-I325 HydrophobicContact CG-CD1 4.01Å; Y249-I325 HydrophobicContact CG-CG1 4.42Å; F255-I325 HydrophobicContact CE1-CG2 4.42Å; F255-I325 HydrophobicContact CZ-CG2 3.64Å; F267-I325 HydrophobicContact CE1-CG2 4.48Å; F267-I325 HydrophobicContact CZ-CD1 4.14Å; I271-I325 HydrophobicContact CD1-CB 4.17Å; I271-I325 HydrophobicContact CD1-CD1 3.85Å; I271-I325 HydrophobicContact CD1-CG1 4.42Å; I271-I325 HydrophobicContact CG2-CB 4.3Å; I271-I325 WeakPolarHBondContact CG2-O 3.39Å; Y272-I325 WeakPolarHBondContact CE1-O 3.29Å; Y272-I325 PolarHBondContact OH-O 2.74Å; L320-I325 HydrophobicContact CD1-CG2 3.75Å; L320-I325 HydrophobicContact CD2-CG2 4.02Å
326	F	50.9	Low	64.2	Low	30 Å²	30	30.5 Å²	30.5	13%	0.132	16%	0.157	C	C	.	.	S	Bend	trans	-85	-24.3	-171.5	-57.6	-72.4	0	0	0	114.8	H242 I245 Y246 Y249 I271 G324 S350	H242-F326 AromaticContact CE1-CD1 3.61Å; I245-F326 HydrophobicContact CB-CE1 4.25Å; I245-F326 HydrophobicContact CB-CZ 4.28Å; I245-F326 HydrophobicContact CG2-CE1 3.92Å; I245-F326 HydrophobicContact CG2-CZ 3.76Å; Y246-F326 VanDerWaalsContact CA-CZ 3.42Å; Y246-F326 AromaticContact CD2-CD2 3.78Å; Y246-F326 HydrophobicContact CD2-CD2 3.78Å; Y246-F326 AromaticContact CD2-CE2 3.69Å; Y246-F326 HydrophobicContact CD2-CE2 3.69Å; Y246-F326 HydrophobicContact CD2-CG 4.38Å; Y246-F326 HydrophobicContact CD2-CZ 4.22Å; Y246-F326 HydrophobicContact CE2-CD2 4.37Å; Y246-F326 HydrophobicContact CG-CE2 4.41Å; Y249-F326 HydrophobicContact CD1-CE2 4.23Å; Y249-F326 AromaticContact CG-CE2 3.99Å; Y249-F326 HydrophobicContact CG-CE2 3.99Å; I271-F326 HydrophobicContact CG1-CE1 4.41Å; I271-F326 HydrophobicContact CG2-CD1 3.98Å; I271-F326 HydrophobicContact CG2-CE1 4.43Å; G324-F326 PolarHBondContact O-N 3.31Å; F326-S350 PolarHBondContact O-OG 3.37Å
327	K	54.6	Low	63.5	Low	190 Å²	190	35 Å²	35	83%	0.826	17%	0.174	S	C	*	.	S	Bend	trans	-116.5	53	-170.7	-70.2	-170.4	178.1	-178.6	0	112.7	T322	T322-K327 WeakPolarHBondContact CB-O 3.4Å; T322-K327 WeakPolarHBondContact CG2-O 3.39Å; T322-K327 PolarHBondContact OG1-O 3.28Å
328	G	65.8	Low	62.3	Low	3 Å²	3	39.9 Å²	39.9	3%	0.031	21%	0.206	C	C	.	.	S	Bend	trans	173	-124	167	0	0	0	0	0	118	Y272 T322 S349	Y272-G328 VanDerWaalsContact CE1-O 3.24Å; Y272-G328 WeakPolarHBondContact CE1-O 3.31Å; T322-G328 VanDerWaalsContact CG2-CA 3.49Å; T322-G328 WeakPolarHBondContact OG1-CA 3.27Å; T322-G328 PolarHBondContact OG1-N 3.46Å; G328-S349 WeakPolarHBondContact O-CA 3.41Å; G328-S349 PolarHBondContact O-OG 2.93Å
329	I	69.6	Low	61	Low	11 Å²	11	47.6 Å²	47.6	6%	0.056	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	133.4	-164.5	-54.4	173.6	0	0	0	108.7	I321 T322 R348 L354 L358	I321-I329 HydrophobicContact CB-CB 4.16Å; I321-I329 HydrophobicContact CD1-CB 4.25Å; I321-I329 HydrophobicContact CD1-CG2 3.82Å; I321-I329 HydrophobicContact CG1-CG2 4.45Å; I321-I329 PolarHBondContact N-O 2.98Å; T322-I329 PolarHBondContact OG1-N 3.3Å; I329-R348 VanDerWaalsContact CA-O 3.31Å; I329-R348 WeakPolarHBondContact CA-O 3.44Å; I329-L354 HydrophobicContact CD1-CD2 3.58Å; I329-L354 HydrophobicContact CD1-CG 3.79Å; I329-L354 HydrophobicContact CG1-CD2 3.22Å; I329-L354 HydrophobicContact CG1-CG 3.98Å; I329-L358 HydrophobicContact CD1-CB 4.09Å; I329-L358 HydrophobicContact CD1-CD1 3.84Å; I329-L358 HydrophobicContact CD1-CD2 4.23Å; I329-L358 HydrophobicContact CD1-CG 4.25Å; I329-L358 HydrophobicContact CG2-CD1 4.46Å; I329-L358 HydrophobicContact CG2-CD2 3.42Å; I329-L358 VanDerWaalsContact CG2-CD2 3.42Å; I329-L358 HydrophobicContact CG2-CG 4.45Å
330	C	74.5	Confident	59.9	Low	0 Å²	0	49.6 Å²	49.6	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	150.2	161.4	78.7	0	0	0	0	111.3	Y272 L318 Y319 L320 R348	Y272-C330 HydrophobicContact CD2-CB 4.3Å; Y272-C330 WeakPolarHBondContact CD2-SG 2.98Å; Y272-C330 HydrophobicContact CE2-CB 3.56Å; Y272-C330 WeakPolarHBondContact CE2-SG 3.48Å; L318-C330 HydrophobicContact CD1-CB 3.81Å; Y319-C330 CarbonylContact O-C 3.52Å; Y319-C330 VanDerWaalsContact O-CA 3.23Å; Y319-C330 WeakPolarHBondContact O-CA 3.5Å; L320-C330 HydrophobicContact CD2-CB 3.92Å; C330-R348 PolarHBondContact N-O 3.12Å; C330-R348 PolarHBondContact O-N 3.48Å
331	I	76.8	Confident	59.3	Low	0 Å²	0	52.8 Å²	52.8	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	123.7	169.3	-51.8	-173.5	0	0	0	107.3	L301 L318 Y319 I321 V333 I345 E346 I347 L362	L301-I331 HydrophobicContact CD1-CD1 4.14Å; L301-I331 HydrophobicContact CD2-CD1 3.52Å; L301-I331 HydrophobicContact CG-CD1 4.36Å; L318-I331 CarbonylContact C-O 3.59Å; L318-I331 WeakPolarHBondContact CA-O 3.48Å; Y319-I331 PolarHBondContact N-O 3.35Å; Y319-I331 PolarHBondContact O-N 3.03Å; I321-I331 HydrophobicContact CD1-CD1 3.8Å; I321-I331 HydrophobicContact CD1-CG1 3.97Å; I331-V333 HydrophobicContact CG2-CG2 4.29Å; I331-I345 HydrophobicContact CG2-CG2 3.66Å; I331-E346 CarbonylContact C-O 3.51Å; I331-E346 WeakPolarHBondContact CA-O 3.37Å; I331-I347 HydrophobicContact CB-CG2 4.38Å; I331-I347 HydrophobicContact CD1-CG2 4.21Å; I331-I347 HydrophobicContact CG1-CG2 3.85Å; I331-I347 HydrophobicContact CG2-CG2 4.14Å; I331-L362 HydrophobicContact CD1-CD1 3.73Å
332	Y	75.6	Confident	59.3	Low	11 Å²	11	55.5 Å²	55.5	4%	0.043	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	134.1	172.1	-159.3	-102.7	0	0	0	109.2	N265 P268 L312 L316 L318 N334 I345 E346	N265-Y332 VanDerWaalsContact CA-OH 3.29Å; N265-Y332 WeakPolarHBondContact CA-OH 3.35Å; N265-Y332 PolarHBondContact N-OH 3.44Å; N265-Y332 PolarHBondContact OD1-OH 2.97Å; P268-Y332 HydrophobicContact CG-CD2 4.2Å; P268-Y332 HydrophobicContact CG-CE2 4.32Å; L312-Y332 HydrophobicContact CD1-CE2 4.17Å; L316-Y332 HydrophobicContact CD1-CE1 3.64Å; L316-Y332 HydrophobicContact CD1-CE2 4.36Å; L316-Y332 WeakPolarHBondContact CD1-OH 3.34Å; L316-Y332 HydrophobicContact CD2-CD1 4.21Å; L316-Y332 HydrophobicContact CD2-CD2 3.72Å; L316-Y332 HydrophobicContact CD2-CE1 3.57Å; L316-Y332 HydrophobicContact CD2-CE2 3.02Å; L316-Y332 HydrophobicContact CD2-CG 4.29Å; L316-Y332 WeakPolarHBondContact CD2-OH 3.44Å; L316-Y332 HydrophobicContact CG-CD1 4.45Å; L316-Y332 HydrophobicContact CG-CE1 3.62Å; L316-Y332 HydrophobicContact CG-CE2 4.02Å; L316-Y332 VanDerWaalsContact CG-CZ 3.4Å; L316-Y332 WeakPolarHBondContact CG-OH 3.32Å; L318-Y332 HydrophobicContact CD1-CD2 4.23Å; Y332-N334 HydrophobicContact CD1-CB 4.19Å; Y332-N334 HydrophobicContact CE1-CB 4.01Å; Y332-I345 WeakPolarHBondContact O-CA 3.34Å; Y332-E346 PolarHBondContact N-O 3.07Å; Y332-E346 PolarHBondContact O-N 2.92Å
333	V	73.1	Confident	59.8	Low	3 Å²	3	54.1 Å²	54.1	2%	0.018	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	108.4	172.3	-173.1	0	0	0	0	107.3	L297 L317 Y319 I331 M335 L343 I345	L297-V333 HydrophobicContact CD2-CG2 4.32Å; L317-V333 HydrophobicContact CB-CB 4.28Å; L317-V333 PolarHBondContact N-O 3.38Å; L317-V333 VanDerWaalsContact N-O 3.11Å; L317-V333 PolarHBondContact O-N 3.46Å; Y319-V333 HydrophobicContact CD2-CG2 4.02Å; Y319-V333 HydrophobicContact CE2-CB 4.49Å; Y319-V333 HydrophobicContact CE2-CG2 3.68Å; I331-V333 HydrophobicContact CG2-CG2 4.29Å; V333-M335 HydrophobicContact CG1-SD 3.66Å; V333-L343 HydrophobicContact CG1-CD1 4.33Å; V333-L343 HydrophobicContact CG1-CD2 3.46Å; V333-L343 VanDerWaalsContact CG1-CD2 3.46Å; V333-L343 HydrophobicContact CG1-CG 4.13Å; V333-I345 HydrophobicContact CG2-CG1 4.43Å
334	N	70.9	Confident	60.9	Low	19 Å²	19	47.1 Å²	47.1	10%	0.102	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	114.1	173.7	-172.5	6.2	0	0	0	109.7	Y332 N336 M344	Y332-N334 HydrophobicContact CD1-CB 4.19Å; Y332-N334 HydrophobicContact CE1-CB 4.01Å; N334-N336 WeakPolarHBondContact OD1-CA 3.3Å; N334-N336 VanDerWaalsContact OD1-CB 3.31Å; N334-N336 WeakPolarHBondContact OD1-CB 3.49Å; N334-N336 PolarHBondContact OD1-N 2.94Å; N334-M344 HydrophobicContact CB-CB 4.48Å; N334-M344 PolarHBondContact N-O 2.83Å; N334-M344 PolarHBondContact O-N 3.23Å
335	M	63.4	Low	62.3	Low	27 Å²	27	46.4 Å²	46.4	13%	0.133	23%	0.234	C	C	.	.			trans	-91.8	-6.1	176.2	-49.5	-64	-73.9	0	0	112.2	Q290 I294 Y315 V333 Y337 L343	Q290-M335 HydrophobicContact CB-CE 3.58Å; Q290-M335 HydrophobicContact CG-CE 3.91Å; I294-M335 HydrophobicContact CD1-CE 3.46Å; I294-M335 VanDerWaalsContact CD1-CE 3.46Å; I294-M335 HydrophobicContact CD1-SD 3.86Å; I294-M335 HydrophobicContact CG1-CE 4.18Å; I294-M335 HydrophobicContact CG1-SD 4.3Å; Y315-M335 WeakPolarHBondContact O-CA 3.25Å; Y315-M335 WeakPolarHBondContact O-CB 3.42Å; Y315-M335 WeakPolarHBondContact O-CG 3.26Å; Y315-M335 PolarHBondContact O-N 3.33Å; V333-M335 HydrophobicContact CG1-SD 3.66Å; M335-Y337 PolarHBondContact O-N 3.41Å; M335-L343 HydrophobicContact CE-CD1 3.77Å; M335-L343 HydrophobicContact SD-CD1 3.44Å; M335-L343 WeakPolarHBondContact SD-CD1 3.29Å; M335-L343 HydrophobicContact SD-CG 3.79Å
336	N	55.2	Low	63.7	Low	66 Å²	66	47 Å²	47	35%	0.353	24%	0.236	S	C	.	.			trans	-91.9	89.4	-176	-133.5	11.1	0	0	0	110.8	Y315 N334	Y315-N336 HydrophobicContact CD1-CB 4.37Å; Y315-N336 WeakPolarHBondContact CD1-OD1 3.38Å; Y315-N336 HydrophobicContact CD2-CB 4.34Å; Y315-N336 VanDerWaalsContact CD2-CG 3.47Å; Y315-N336 WeakPolarHBondContact CD2-ND2 3.46Å; Y315-N336 WeakPolarHBondContact CD2-OD1 3.39Å; Y315-N336 HydrophobicContact CG-CB 3.86Å; Y315-N336 VanDerWaalsContact CG-OD1 3.29Å; N334-N336 WeakPolarHBondContact OD1-CA 3.3Å; N334-N336 VanDerWaalsContact OD1-CB 3.31Å; N334-N336 WeakPolarHBondContact OD1-CB 3.49Å; N334-N336 PolarHBondContact OD1-N 2.94Å
337	Y	50.2	Low	64.9	Low	98 Å²	98	45.5 Å²	45.5	38%	0.384	23%	0.23	S	C	.	.			trans	-136.9	94.6	157.9	-84.5	-83.3	0	0	0	108.3	M335 I339 S340 M344	M335-Y337 PolarHBondContact O-N 3.41Å; Y337-I339 PolarHBondContact O-N 2.97Å; Y337-S340 VanDerWaalsContact CB-O 3.25Å; Y337-S340 WeakPolarHBondContact CB-O 3.09Å; Y337-M344 HydrophobicContact CE2-CB 4.15Å; Y337-M344 HydrophobicContact CE2-CE 4.09Å; Y337-M344 WeakPolarHBondContact OH-CE 3.2Å
338	T	45.4	Very low	65.7	Low	129 Å²	129	37 Å²	37	79%	0.791	19%	0.193	S	C	*	.	S	Bend	trans	-70.9	-3.9	-179.9	43	0	0	0	0	113.8
339	I	45.1	Very low	65.8	Low	166 Å²	166	36.8 Å²	36.8	85%	0.851	19%	0.191	S	C	*	.	S	Bend	trans	-122.3	-20.5	-174.9	-54.3	176.3	0	0	0	112.7	Y337	Y337-I339 PolarHBondContact O-N 2.97Å
340	S	47.3	Very low	65.5	Low	42 Å²	42	38.9 Å²	38.9	29%	0.294	21%	0.206	S	C	.	.	S	Bend	trans	-136.6	123.9	176.5	55.7	0	0	0	0	109.2	Y337 Q342	Y337-S340 VanDerWaalsContact CB-O 3.25Å; Y337-S340 WeakPolarHBondContact CB-O 3.09Å; S340-Q342 PolarHBondContact O-N 3.42Å
341	N	54.4	Low	64.9	Low	72 Å²	72	41 Å²	41	39%	0.385	22%	0.222	S	C	.	.			trans	-65.8	53.9	177.7	-68.1	-30.8	0	0	0	112.9	V285	V285-N341 HydrophobicContact CB-CB 4.09Å; V285-N341 HydrophobicContact CG2-CB 4.19Å; V285-N341 VanDerWaalsContact CG2-O 3.28Å; V285-N341 WeakPolarHBondContact CG2-O 3.47Å
342	Q	63.7	Low	64.5	Low	78 Å²	78	46.2 Å²	46.2	36%	0.364	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	127.9	-172.7	-68.6	-171.5	-9	0	0	108.1	I279 T281 S340	I279-Q342 HydrophobicContact CG2-CB 3.87Å; I279-Q342 HydrophobicContact CG2-CG 4.07Å; T281-Q342 HydrophobicContact CG2-CG 4.16Å; S340-Q342 PolarHBondContact O-N 3.42Å
343	L	69.5	Low	64.2	Low	6 Å²	6	50.9 Å²	50.9	3%	0.031	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	121	178.3	-170.7	165	0	0	0	107.3	I280 M293 V333 M335 I345	I280-L343 HydrophobicContact CB-CB 4.38Å; I280-L343 HydrophobicContact CD1-CD2 3.99Å; I280-L343 PolarHBondContact N-O 2.79Å; I280-L343 PolarHBondContact O-N 3.44Å; M293-L343 HydrophobicContact CB-CD1 4.3Å; M293-L343 HydrophobicContact CE-CB 4.21Å; M293-L343 HydrophobicContact CE-CD1 3.72Å; M293-L343 HydrophobicContact SD-CD1 4.37Å; V333-L343 HydrophobicContact CG1-CD1 4.33Å; V333-L343 HydrophobicContact CG1-CD2 3.46Å; V333-L343 VanDerWaalsContact CG1-CD2 3.46Å; V333-L343 HydrophobicContact CG1-CG 4.13Å; M335-L343 HydrophobicContact CE-CD1 3.77Å; M335-L343 HydrophobicContact SD-CD1 3.44Å; M335-L343 WeakPolarHBondContact SD-CD1 3.29Å; M335-L343 HydrophobicContact SD-CG 3.79Å; L343-I345 HydrophobicContact CD2-CD1 4.29Å; L343-I345 HydrophobicContact CD2-CG1 3.65Å
344	M	74.2	Confident	64	Low	18 Å²	18	54.2 Å²	54.2	9%	0.089	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	122.1	179.8	-175.9	-174.6	-76	0	0	109	W278 N334 Y337 Y376	W278-M344 WeakPolarHBondContact O-CA 3.35Å; N334-M344 HydrophobicContact CB-CB 4.48Å; N334-M344 PolarHBondContact N-O 2.83Å; N334-M344 PolarHBondContact O-N 3.23Å; Y337-M344 HydrophobicContact CE2-CB 4.15Å; Y337-M344 HydrophobicContact CE2-CE 4.09Å; Y337-M344 WeakPolarHBondContact OH-CE 3.2Å; M344-Y376 HydrophobicContact CE-CD1 4.44Å; M344-Y376 HydrophobicContact CE-CE1 4.2Å
345	I	77.9	Confident	63.9	Low	2 Å²	2	53.5 Å²	53.5	1%	0.01	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	132	169.6	-64.5	171.6	0	0	0	108	Q277 W278 I280 L297 I331 Y332 V333 L343 I347 F363 F373	Q277-I345 CarbonylContact C-O 3.6Å; Q277-I345 WeakPolarHBondContact CA-O 3.47Å; W278-I345 HydrophobicContact CB-CB 4.49Å; W278-I345 PolarHBondContact N-O 3.21Å; W278-I345 PolarHBondContact O-N 3.27Å; I280-I345 HydrophobicContact CD1-CD1 3.19Å; I280-I345 HydrophobicContact CD1-CG1 3.98Å; I280-I345 HydrophobicContact CG1-CD1 3.88Å; I280-I345 HydrophobicContact CG1-CG1 4.47Å; L297-I345 HydrophobicContact CD1-CD1 3.46Å; L297-I345 VanDerWaalsContact CD1-CD1 3.46Å; L297-I345 HydrophobicContact CD1-CG1 4.31Å; I331-I345 HydrophobicContact CG2-CG2 3.66Å; Y332-I345 WeakPolarHBondContact O-CA 3.34Å; V333-I345 HydrophobicContact CG2-CG1 4.43Å; L343-I345 HydrophobicContact CD2-CD1 4.29Å; L343-I345 HydrophobicContact CD2-CG1 3.65Å; I345-I347 HydrophobicContact CG2-CG2 4.42Å; I345-F363 HydrophobicContact CD1-CE1 4.22Å; I345-F363 HydrophobicContact CG2-CE1 4.27Å; I345-F363 HydrophobicContact CG2-CZ 3.8Å; I345-F373 HydrophobicContact CD1-CE1 3.9Å
346	E	79.2	Confident	64.2	Low	15 Å²	15	55.9 Å²	55.9	7%	0.07	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	128	173.8	-176.9	176.8	159.8	0	0	109.8	Y275 K276 Q277 I331 Y332 R348	Y275-E346 HydrophobicContact CD2-CG 4.45Å; K276-E346 CarbonylContact O-C 3.52Å; K276-E346 WeakPolarHBondContact O-CA 3.48Å; Q277-E346 HydrophobicContact CG-CB 3.86Å; Q277-E346 HydrophobicContact CG-CG 3.56Å; Q277-E346 PolarHBondContact NE2-OE2 2.64Å; I331-E346 CarbonylContact C-O 3.51Å; I331-E346 WeakPolarHBondContact CA-O 3.37Å; Y332-E346 PolarHBondContact N-O 3.07Å; Y332-E346 PolarHBondContact O-N 2.92Å; E346-R348 HydrophobicContact CG-CG 4.19Å; E346-R348 IonicContact OE1-CZ 2.72Å; E346-R348 IonicContact OE1-NE 2.86Å; E346-R348 PolarHBondContact OE1-NE 3.32Å; E346-R348 IonicContact OE1-NH2 2.73Å; E346-R348 PolarHBondContact OE1-NH2 3.2Å
347	I	76.4	Confident	65	Low	0 Å²	0	57.8 Å²	57.8	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	138.3	174.3	55.7	167.9	0	0	0	109.4	Y275 K276 I331 I345 L355 L358 D359 F363	Y275-I347 CarbonylContact C-O 3.42Å; Y275-I347 WeakPolarHBondContact CA-O 3.45Å; K276-I347 HydrophobicContact CB-CD1 4.15Å; K276-I347 HydrophobicContact CB-CG1 3.81Å; K276-I347 PolarHBondContact N-O 2.92Å; K276-I347 WeakPolarHBondContact O-CG1 3.19Å; K276-I347 PolarHBondContact O-N 3.38Å; I331-I347 HydrophobicContact CB-CG2 4.38Å; I331-I347 HydrophobicContact CD1-CG2 4.21Å; I331-I347 HydrophobicContact CG1-CG2 3.85Å; I331-I347 HydrophobicContact CG2-CG2 4.14Å; I345-I347 HydrophobicContact CG2-CG2 4.42Å; I347-L355 HydrophobicContact CB-CD1 4.16Å; I347-L355 HydrophobicContact CD1-CD1 3.85Å; I347-L355 HydrophobicContact CG1-CD1 3.77Å; I347-L358 HydrophobicContact CB-CD2 3.97Å; I347-L358 HydrophobicContact CD1-CD2 4.05Å; I347-L358 HydrophobicContact CG2-CD2 3.87Å; I347-D359 HydrophobicContact CD1-CB 3.84Å; I347-F363 HydrophobicContact CD1-CD2 4.22Å; I347-F363 HydrophobicContact CD1-CE2 4.09Å; I347-F363 HydrophobicContact CG1-CE2 4.5Å; I347-F363 HydrophobicContact CG2-CE2 3.55Å; I347-F363 HydrophobicContact CG2-CZ 4.06Å
348	R	72.2	Confident	65.9	Low	10 Å²	10	53.9 Å²	53.9	4%	0.038	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	148.7	-179.3	-55	177.7	157.9	-105.2	-1.7	111.9	L269 Y272 F274 I329 C330 E346	L269-R348 VanDerWaalsContact CG-NH1 3.35Å; L269-R348 VanDerWaalsContact CG-NH2 3.26Å; Y272-R348 HydrophobicContact CD2-CB 4.11Å; Y272-R348 HydrophobicContact CG-CB 4.02Å; F274-R348 CarbonylContact O-C 3.41Å; F274-R348 WeakPolarHBondContact O-CA 3.46Å; I329-R348 VanDerWaalsContact CA-O 3.31Å; I329-R348 WeakPolarHBondContact CA-O 3.44Å; C330-R348 PolarHBondContact N-O 3.12Å; C330-R348 PolarHBondContact O-N 3.48Å; E346-R348 HydrophobicContact CG-CG 4.19Å; E346-R348 IonicContact OE1-CZ 2.72Å; E346-R348 IonicContact OE1-NE 2.86Å; E346-R348 PolarHBondContact OE1-NE 3.32Å; E346-R348 IonicContact OE1-NH2 2.73Å; E346-R348 PolarHBondContact OE1-NH2 3.2Å
349	S	68.1	Low	67.1	Low	0 Å²	0	48.1 Å²	48.1	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.1	158.4	174.3	-169	0	0	0	0	112.7	F274 G328 S351 L354	F274-S349 WeakPolarHBondContact CB-O 3.13Å; F274-S349 PolarHBondContact N-O 3.45Å; F274-S349 PolarHBondContact O-N 3.5Å; G328-S349 WeakPolarHBondContact O-CA 3.41Å; G328-S349 PolarHBondContact O-OG 2.93Å; S349-S351 VanDerWaalsContact C-N 3.29Å; S349-S351 PolarHBondContact OG-N 2.82Å; S349-S351 VanDerWaalsContact OG-N 3.12Å; S349-S351 PolarHBondContact OG-O 3.29Å; S349-L354 WeakPolarHBondContact OG-CD2 3.47Å
350	S	62.4	Low	68.3	Low	54 Å²	54	45 Å²	45	38%	0.378	24%	0.241	S	C	.	.	S	Bend	trans	-79.7	-10.9	166.2	51.8	0	0	0	0	112.8	F274 F326	F274-S350 WeakPolarHBondContact CE2-O 3.35Å; F326-S350 PolarHBondContact O-OG 3.37Å
351	S	62.6	Low	69.3	Low	46 Å²	46	46.4 Å²	46.4	32%	0.322	25%	0.248	S	C	.	.			trans	-121	123	177.7	171.1	0	0	0	0	111.6	S349 T353 L354 L355	S349-S351 VanDerWaalsContact C-N 3.29Å; S349-S351 PolarHBondContact OG-N 2.82Å; S349-S351 VanDerWaalsContact OG-N 3.12Å; S349-S351 PolarHBondContact OG-O 3.29Å; S351-T353 VanDerWaalsContact C-N 3.31Å; S351-T353 PolarHBondContact O-N 2.63Å; S351-T353 PolarHBondContact OG-N 2.87Å; S351-L354 PolarHBondContact O-N 2.77Å; S351-L354 PolarHBondContact OG-N 2.88Å; S351-L355 WeakPolarHBondContact O-CB 3.3Å; S351-L355 PolarHBondContact O-N 3.41Å
352	H	67.1	Low	70	Confident	109 Å²	109	43.2 Å²	43.2	51%	0.505	23%	0.231	S	C	.	.	H	α-helix	trans	-59.7	-40.9	175.9	-177	-85.9	0	0	0	112.1	F274 L354 L355 H356	F274-H352 HydrophobicContact CD1-CB 4.29Å; F274-H352 HydrophobicContact CD2-CB 4.23Å; F274-H352 HydrophobicContact CE1-CB 4.22Å; F274-H352 HydrophobicContact CE2-CB 4.16Å; F274-H352 HydrophobicContact CG-CB 4.29Å; F274-H352 HydrophobicContact CZ-CB 4.15Å; H352-L354 VanDerWaalsContact C-N 3.35Å; H352-L354 PolarHBondContact O-N 2.88Å; H352-L355 PolarHBondContact O-N 3.24Å; H352-H356 WeakPolarHBondContact O-CB 3.23Å; H352-H356 PolarHBondContact O-N 3.13Å
353	T	69.7	Low	70.1	Confident	109 Å²	109	39.8 Å²	39.8	67%	0.669	21%	0.214	S	C	*	.	H	α-helix	trans	-64.4	-41.5	179.5	-35.2	0	0	0	0	111.6	S351 H356 L357	S351-T353 VanDerWaalsContact C-N 3.31Å; S351-T353 PolarHBondContact O-N 2.63Å; S351-T353 PolarHBondContact OG-N 2.87Å; T353-H356 PolarHBondContact O-N 2.88Å; T353-L357 WeakPolarHBondContact O-CB 3.47Å; T353-L357 PolarHBondContact O-N 3.26Å
354	L	68.1	Low	69.6	Low	72 Å²	72	43.2 Å²	43.2	38%	0.377	24%	0.236	S	C	.	.	H	α-helix	trans	-68.8	-43	178.8	-162.7	92.1	0	0	0	111.2	I329 S349 S351 H352 L357 L358	I329-L354 HydrophobicContact CD1-CD2 3.58Å; I329-L354 HydrophobicContact CD1-CG 3.79Å; I329-L354 HydrophobicContact CG1-CD2 3.22Å; I329-L354 HydrophobicContact CG1-CG 3.98Å; S349-L354 WeakPolarHBondContact OG-CD2 3.47Å; S351-L354 PolarHBondContact O-N 2.77Å; S351-L354 PolarHBondContact OG-N 2.88Å; H352-L354 VanDerWaalsContact C-N 3.35Å; H352-L354 PolarHBondContact O-N 2.88Å; L354-L357 PolarHBondContact O-N 2.83Å; L354-L358 PolarHBondContact O-N 3.41Å
355	L	69.9	Low	68.7	Low	5 Å²	5	48.3 Å²	48.3	3%	0.026	26%	0.259	C	S	.	.	H	α-helix	trans	-58.2	-48.1	173.8	-175.3	69.1	0	0	0	111.1	F274 K276 I347 S351 H352 L357 L358 D359	F274-L355 HydrophobicContact CB-CD2 3.57Å; K276-L355 HydrophobicContact CG-CD2 4.26Å; I347-L355 HydrophobicContact CB-CD1 4.16Å; I347-L355 HydrophobicContact CD1-CD1 3.85Å; I347-L355 HydrophobicContact CG1-CD1 3.77Å; S351-L355 WeakPolarHBondContact O-CB 3.3Å; S351-L355 PolarHBondContact O-N 3.41Å; H352-L355 PolarHBondContact O-N 3.24Å; L355-L357 PolarHBondContact O-N 3.01Å; L355-L358 PolarHBondContact O-N 3.05Å; L355-D359 VanDerWaalsContact O-CB 3.28Å; L355-D359 WeakPolarHBondContact O-CB 3.26Å; L355-D359 PolarHBondContact O-N 2.57Å
356	H	70.2	Confident	67.5	Low	77 Å²	77	55.8 Å²	55.8	36%	0.356	29%	0.292	S	S	.	.	H	α-helix	trans	-63.2	-40.6	179.9	-173.5	-83.6	0	0	0	112.4	H352 T353 D359 Q360	H352-H356 WeakPolarHBondContact O-CB 3.23Å; H352-H356 PolarHBondContact O-N 3.13Å; T353-H356 PolarHBondContact O-N 2.88Å; H356-D359 WeakPolarHBondContact O-CB 3.36Å; H356-D359 PolarHBondContact O-N 3.17Å; H356-Q360 VanDerWaalsContact CE1-CD 3.4Å; H356-Q360 PolarHBondContact CE1-NE2 2.59Å; H356-Q360 WeakPolarHBondContact O-CG 3.36Å; H356-Q360 PolarHBondContact O-N 2.7Å
357	L	70.7	Confident	65.9	Low	106 Å²	106	63.4 Å²	63.4	56%	0.555	32%	0.321	S	S	*	.	H	α-helix	trans	-65.6	-44.4	177.5	-171	146.8	0	0	0	111.5	T353 L354 L355 D359 Q360 V361	T353-L357 WeakPolarHBondContact O-CB 3.47Å; T353-L357 PolarHBondContact O-N 3.26Å; L354-L357 PolarHBondContact O-N 2.83Å; L355-L357 PolarHBondContact O-N 3.01Å; L357-D359 VanDerWaalsContact C-N 3.34Å; L357-D359 PolarHBondContact O-N 3.46Å; L357-Q360 PolarHBondContact O-N 3.31Å; L357-V361 HydrophobicContact CD2-CG2 4.19Å; L357-V361 VanDerWaalsContact O-CG2 3.25Å; L357-V361 WeakPolarHBondContact O-CG2 3.2Å; L357-V361 PolarHBondContact O-N 2.65Å
358	L	70.7	Confident	64.7	Low	15 Å²	15	64.2 Å²	64.2	8%	0.079	33%	0.325	C	S	.	.	H	α-helix	trans	-61.8	-43.7	175.3	-172.5	87.2	0	0	0	111.6	I321 I329 I347 L354 L355 Q360 V361 L362	I321-L358 HydrophobicContact CD1-CD1 3.88Å; I329-L358 HydrophobicContact CD1-CB 4.09Å; I329-L358 HydrophobicContact CD1-CD1 3.84Å; I329-L358 HydrophobicContact CD1-CD2 4.23Å; I329-L358 HydrophobicContact CD1-CG 4.25Å; I329-L358 HydrophobicContact CG2-CD1 4.46Å; I329-L358 HydrophobicContact CG2-CD2 3.42Å; I329-L358 VanDerWaalsContact CG2-CD2 3.42Å; I329-L358 HydrophobicContact CG2-CG 4.45Å; I347-L358 HydrophobicContact CB-CD2 3.97Å; I347-L358 HydrophobicContact CD1-CD2 4.05Å; I347-L358 HydrophobicContact CG2-CD2 3.87Å; L354-L358 PolarHBondContact O-N 3.41Å; L355-L358 PolarHBondContact O-N 3.05Å; L358-Q360 VanDerWaalsContact C-N 3.32Å; L358-Q360 PolarHBondContact O-N 3.46Å; L358-V361 PolarHBondContact O-N 2.94Å; L358-V361 VanDerWaalsContact O-N 3.17Å; L358-L362 HydrophobicContact CD1-CD1 3.82Å; L358-L362 HydrophobicContact CD1-CG 4.35Å; L358-L362 HydrophobicContact CD2-CD1 4.01Å; L358-L362 HydrophobicContact CG-CD1 3.7Å; L358-L362 HydrophobicContact CG-CG 4.3Å; L358-L362 WeakPolarHBondContact O-CB 2.84Å; L358-L362 PolarHBondContact O-N 2.91Å
359	D	69.6	Low	63.8	Low	9 Å²	9	69.7 Å²	69.7	5%	0.048	36%	0.355	C	S	.	.	H	α-helix	trans	-57.5	-45.1	177.2	-167.4	58.1	0	0	0	112	K276 W278 I347 L355 H356 L357 F363 T364	K276-D359 HydrophobicContact CD-CB 4.04Å; K276-D359 VanDerWaalsContact CD-CG 3.43Å; K276-D359 WeakPolarHBondContact CD-OD2 3.27Å; K276-D359 IonicContact NZ-OD2 2.59Å; K276-D359 PolarHBondContact NZ-OD2 3.46Å; W278-D359 WeakPolarHBondContact CZ2-OD1 3.46Å; W278-D359 PolarHBondContact NE1-OD1 2.89Å; I347-D359 HydrophobicContact CD1-CB 3.84Å; L355-D359 VanDerWaalsContact O-CB 3.28Å; L355-D359 WeakPolarHBondContact O-CB 3.26Å; L355-D359 PolarHBondContact O-N 2.57Å; H356-D359 WeakPolarHBondContact O-CB 3.36Å; H356-D359 PolarHBondContact O-N 3.17Å; L357-D359 VanDerWaalsContact C-N 3.34Å; L357-D359 PolarHBondContact O-N 3.46Å; D359-F363 PolarHBondContact O-N 2.87Å; D359-T364 PolarHBondContact O-N 3.1Å
360	Q	70.2	Confident	63.4	Low	101 Å²	101	75.4 Å²	75.4	47%	0.472	39%	0.386	S	S	.	.	H	α-helix	trans	-60.3	-47	173.6	-76.5	-177	-37.4	0	0	111.8	H356 L357 L358 T364	H356-Q360 VanDerWaalsContact CE1-CD 3.4Å; H356-Q360 PolarHBondContact CE1-NE2 2.59Å; H356-Q360 WeakPolarHBondContact O-CG 3.36Å; H356-Q360 PolarHBondContact O-N 2.7Å; L357-Q360 PolarHBondContact O-N 3.31Å; L358-Q360 VanDerWaalsContact C-N 3.32Å; L358-Q360 PolarHBondContact O-N 3.46Å; Q360-T364 HydrophobicContact CG-CG2 4.27Å; Q360-T364 PolarHBondContact O-OG1 3.2Å
361	V	68.8	Low	63.4	Low	70 Å²	70	73.2 Å²	73.2	42%	0.424	37%	0.369	S	S	.	.	H	α-helix	trans	-71.6	-38.4	-175	174.6	0	0	0	0	112.5	L304 L357 L358	L304-V361 HydrophobicContact CD1-CG1 3.5Å; L304-V361 VanDerWaalsContact CD1-CG1 3.5Å; L304-V361 HydrophobicContact CD2-CG1 3.44Å; L304-V361 VanDerWaalsContact CD2-CG1 3.44Å; L304-V361 HydrophobicContact CG-CG1 4.09Å; L357-V361 HydrophobicContact CD2-CG2 4.19Å; L357-V361 VanDerWaalsContact O-CG2 3.25Å; L357-V361 WeakPolarHBondContact O-CG2 3.2Å; L357-V361 PolarHBondContact O-N 2.65Å; L358-V361 PolarHBondContact O-N 2.94Å; L358-V361 VanDerWaalsContact O-N 3.17Å
362	L	68.3	Low	63.4	Low	6 Å²	6	74.8 Å²	74.8	3%	0.031	37%	0.372	C	S	.	.	H	α-helix	trans	-89.2	-43.2	-174.2	-74.1	178.4	0	0	0	114	K300 L301 L304 I331 L358	K300-L362 HydrophobicContact CB-CD2 4.28Å; K300-L362 PolarHBondContact NZ-O 3.3Å; K300-L362 VanDerWaalsContact NZ-O 3.07Å; L301-L362 HydrophobicContact CD2-CD1 4.17Å; L301-L362 HydrophobicContact CD2-CD2 4.35Å; L304-L362 HydrophobicContact CD1-CD2 3.43Å; L304-L362 VanDerWaalsContact CD1-CD2 3.43Å; L304-L362 HydrophobicContact CD1-CG 4.21Å; I331-L362 HydrophobicContact CD1-CD1 3.73Å; L358-L362 HydrophobicContact CD1-CD1 3.82Å; L358-L362 HydrophobicContact CD1-CG 4.35Å; L358-L362 HydrophobicContact CD2-CD1 4.01Å; L358-L362 HydrophobicContact CG-CD1 3.7Å; L358-L362 HydrophobicContact CG-CG 4.3Å; L358-L362 WeakPolarHBondContact O-CB 2.84Å; L358-L362 PolarHBondContact O-N 2.91Å
363	F	66.5	Low	63.2	Low	5 Å²	5	70.9 Å²	70.9	2%	0.022	35%	0.353	C	S	.	.	T	Hydrogen-bonded Turn	trans	-123.5	-16.7	-159.7	-54.7	-65.5	0	0	0	115.8	W278 I345 I347 D359 Q365 F373	W278-F363 AromaticContact CD1-CD2 3.77Å; W278-F363 AromaticContact CD1-CG 3.96Å; W278-F363 HydrophobicContact CD2-CB 3.86Å; W278-F363 HydrophobicContact CD2-CG 4.09Å; W278-F363 AromaticContact CE2-CG 3.89Å; W278-F363 HydrophobicContact CE3-CB 4.2Å; W278-F363 HydrophobicContact CG-CB 4.44Å; W278-F363 HydrophobicContact CG-CD1 4.4Å; W278-F363 HydrophobicContact CG-CD2 4.41Å; W278-F363 HydrophobicContact CG-CG 4.16Å; W278-F363 HydrophobicContact CH2-CB 3.93Å; W278-F363 HydrophobicContact CZ2-CB 3.58Å; W278-F363 HydrophobicContact CZ2-CG 4.43Å; W278-F363 HydrophobicContact CZ3-CB 4.21Å; W278-F363 AromaticContact NE1-CD2 3.52Å; W278-F363 AromaticContact NE1-CG 3.77Å; I345-F363 HydrophobicContact CD1-CE1 4.22Å; I345-F363 HydrophobicContact CG2-CE1 4.27Å; I345-F363 HydrophobicContact CG2-CZ 3.8Å; I347-F363 HydrophobicContact CD1-CD2 4.22Å; I347-F363 HydrophobicContact CD1-CE2 4.09Å; I347-F363 HydrophobicContact CG1-CE2 4.5Å; I347-F363 HydrophobicContact CG2-CE2 3.55Å; I347-F363 HydrophobicContact CG2-CZ 4.06Å; D359-F363 PolarHBondContact O-N 2.87Å; F363-Q365 PolarHBondContact O-N 3.34Å; F363-Q365 VanDerWaalsContact O-N 3.16Å; F363-F373 AromaticContact CD1-CD1 3.39Å; F363-F373 HydrophobicContact CD1-CD1 3.39Å; F363-F373 AromaticContact CD1-CE1 3.56Å; F363-F373 HydrophobicContact CD1-CE1 3.56Å; F363-F373 HydrophobicContact CD1-CG 4.08Å; F363-F373 HydrophobicContact CD1-CZ 4.41Å; F363-F373 AromaticContact CE1-CD1 3.82Å; F363-F373 HydrophobicContact CE1-CD1 3.82Å; F363-F373 AromaticContact CE1-CE1 3.57Å; F363-F373 HydrophobicContact CE1-CE1 3.57Å; F363-F373 HydrophobicContact CE1-CZ 4.47Å; F363-F373 HydrophobicContact CG-CD1 4.49Å
364	T	58.2	Low	63.2	Low	78 Å²	78	69.7 Å²	69.7	48%	0.479	34%	0.342	S	S	.	.			trans	-67.3	-15.4	179.6	55.5	0	0	0	0	114.7	D359 Q360 K366	D359-T364 PolarHBondContact O-N 3.1Å; Q360-T364 HydrophobicContact CG-CG2 4.27Å; Q360-T364 PolarHBondContact O-OG1 3.2Å; T364-K366 PolarHBondContact O-N 3.33Å
365	Q	55.1	Low	63.1	Low	126 Å²	126	69.2 Å²	69.2	59%	0.589	34%	0.343	S	S	*	.	S	Bend	trans	-71.9	94.8	164.6	-67.7	-178.5	-6.6	0	0	108.8	F363 Y367 I368	F363-Q365 PolarHBondContact O-N 3.34Å; F363-Q365 VanDerWaalsContact O-N 3.16Å; Q365-Y367 PolarHBondContact O-N 3.44Å; Q365-I368 HydrophobicContact CB-CD1 4.1Å; Q365-I368 HydrophobicContact CB-CG1 4.01Å; Q365-I368 VanDerWaalsContact O-CD1 3.27Å; Q365-I368 WeakPolarHBondContact O-CD1 3.37Å
366	K	52.4	Low	62.6	Low	158 Å²	158	71.4 Å²	71.4	69%	0.687	35%	0.352	S	S	*	.	S	Bend	trans	-52.6	-18	-179.5	-72.5	-176.5	176.8	-179.7	0	114.7	T364	T364-K366 PolarHBondContact O-N 3.33Å
367	Y	46.3	Very low	61.6	Low	175 Å²	175	74.6 Å²	74.6	69%	0.686	37%	0.371	S	S	*	.			trans	-133	119.6	178.4	-64.6	-97	0	0	0	108.9	Q365 H372	Q365-Y367 PolarHBondContact O-N 3.44Å; Y367-H372 AromaticContact CD1-CE1 3.4Å; Y367-H372 WeakPolarHBondContact CD1-CE1 3.38Å; Y367-H372 AromaticContact CD1-ND1 3.65Å; Y367-H372 AromaticContact CE1-CE1 3.15Å; Y367-H372 WeakPolarHBondContact CE1-CE1 3.42Å; Y367-H372 AromaticContact CE1-ND1 3.6Å
368	I	51.3	Low	60.2	Low	17 Å²	17	75.3 Å²	75.3	9%	0.087	37%	0.372	C	S	.	.	B	Isolated β-bridge	trans	-131	115.6	166.7	-62.9	125.5	0	0	0	107.2	Q365 D370 F371 F373	Q365-I368 HydrophobicContact CB-CD1 4.1Å; Q365-I368 HydrophobicContact CB-CG1 4.01Å; Q365-I368 VanDerWaalsContact O-CD1 3.27Å; Q365-I368 WeakPolarHBondContact O-CD1 3.37Å; I368-D370 VanDerWaalsContact C-N 3.25Å; I368-D370 PolarHBondContact O-N 3.42Å; I368-F371 PolarHBondContact N-O 2.96Å; I368-F371 PolarHBondContact O-N 3.41Å; I368-F373 HydrophobicContact CB-CE2 4.42Å; I368-F373 HydrophobicContact CD1-CD2 3.74Å; I368-F373 HydrophobicContact CD1-CE2 3.55Å; I368-F373 HydrophobicContact CD1-CZ 4.48Å
369	D	54.3	Low	58.1	Low	126 Å²	126	79.7 Å²	79.7	67%	0.674	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	38.8	49.4	164.9	-55.1	-27.7	0	0	0	114.8
370	D	59.5	Low	56.2	Low	119 Å²	119	85.4 Å²	85.4	64%	0.636	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	89	-1.2	179.8	-54.6	-23.8	0	0	0	119.2	K282 I368	K282-D370 HydrophobicContact CD-CB 4.22Å; K282-D370 IonicContact NZ-OD2 2.87Å; K282-D370 PolarHBondContact NZ-OD2 2.89Å; I368-D370 VanDerWaalsContact C-N 3.25Å; I368-D370 PolarHBondContact O-N 3.42Å
371	F	61	Low	54	Low	8 Å²	8	88.7 Å²	88.7	4%	0.035	45%	0.448	C	S	.	.	B	Isolated β-bridge	trans	-107	133.2	-177.7	-62.9	-79.1	0	0	0	112.2	I280 K282 M293 I368 F373	I280-F371 HydrophobicContact CG2-CB 4.04Å; I280-F371 HydrophobicContact CG2-CD1 3.77Å; I280-F371 HydrophobicContact CG2-CG 4.27Å; K282-F371 HydrophobicContact CB-CD1 3.8Å; K282-F371 HydrophobicContact CB-CE1 3.86Å; K282-F371 HydrophobicContact CD-CD1 3.75Å; K282-F371 HydrophobicContact CD-CE1 3.29Å; K282-F371 HydrophobicContact CD-CZ 3.76Å; K282-F371 HydrophobicContact CG-CD1 4.36Å; K282-F371 HydrophobicContact CG-CE1 4.18Å; M293-F371 HydrophobicContact CG-CD1 3.7Å; M293-F371 HydrophobicContact CG-CE1 3.11Å; M293-F371 HydrophobicContact CG-CE2 4.2Å; M293-F371 HydrophobicContact CG-CG 4.44Å; M293-F371 HydrophobicContact CG-CZ 3.4Å; M293-F371 HydrophobicContact SD-CD1 3.63Å; M293-F371 HydrophobicContact SD-CE1 3.38Å; M293-F371 WeakPolarHBondContact SD-CE1 3.38Å; M293-F371 HydrophobicContact SD-CZ 4.28Å; I368-F371 PolarHBondContact N-O 2.96Å; I368-F371 PolarHBondContact O-N 3.41Å; F371-F373 HydrophobicContact CB-CE2 4.16Å
372	H	62.5	Low	51.9	Low	80 Å²	80	91.6 Å²	91.6	37%	0.37	46%	0.461	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	114.4	173.1	-63.1	-42.3	0	0	0	110.1	I280 T281 Y367	I280-H372 WeakPolarHBondContact CA-O 3.45Å; T281-H372 PolarHBondContact N-O 3.33Å; T281-H372 VanDerWaalsContact N-O 3.13Å; T281-H372 PolarHBondContact O-N 2.76Å; Y367-H372 AromaticContact CD1-CE1 3.4Å; Y367-H372 WeakPolarHBondContact CD1-CE1 3.38Å; Y367-H372 AromaticContact CD1-ND1 3.65Å; Y367-H372 AromaticContact CE1-CE1 3.15Å; Y367-H372 WeakPolarHBondContact CE1-CE1 3.42Å; Y367-H372 AromaticContact CE1-ND1 3.6Å
373	F	64.5	Low	49.7	Very low	27 Å²	27	99.3 Å²	99.3	12%	0.118	50%	0.502	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	107.1	168.9	-67.1	-94.2	0	0	0	108.2	W278 I280 I345 F363 I368 F371	W278-F373 HydrophobicContact CE3-CB 3.79Å; W278-F373 HydrophobicContact CZ3-CB 4.19Å; I280-F373 HydrophobicContact CD1-CD1 4.39Å; I280-F373 HydrophobicContact CD1-CE1 3.63Å; I280-F373 HydrophobicContact CD1-CZ 4.01Å; I280-F373 HydrophobicContact CG1-CD1 3.75Å; I280-F373 HydrophobicContact CG1-CE1 3.49Å; I280-F373 VanDerWaalsContact CG1-CE1 3.49Å; I280-F373 HydrophobicContact CG1-CZ 4.09Å; I345-F373 HydrophobicContact CD1-CE1 3.9Å; F363-F373 AromaticContact CD1-CD1 3.39Å; F363-F373 HydrophobicContact CD1-CD1 3.39Å; F363-F373 AromaticContact CD1-CE1 3.56Å; F363-F373 HydrophobicContact CD1-CE1 3.56Å; F363-F373 HydrophobicContact CD1-CG 4.08Å; F363-F373 HydrophobicContact CD1-CZ 4.41Å; F363-F373 AromaticContact CE1-CD1 3.82Å; F363-F373 HydrophobicContact CE1-CD1 3.82Å; F363-F373 AromaticContact CE1-CE1 3.57Å; F363-F373 HydrophobicContact CE1-CE1 3.57Å; F363-F373 HydrophobicContact CE1-CZ 4.47Å; F363-F373 HydrophobicContact CG-CD1 4.49Å; I368-F373 HydrophobicContact CB-CE2 4.42Å; I368-F373 HydrophobicContact CD1-CD2 3.74Å; I368-F373 HydrophobicContact CD1-CE2 3.55Å; I368-F373 HydrophobicContact CD1-CZ 4.48Å; F371-F373 HydrophobicContact CB-CE2 4.16Å
374	I	68.7	Low	47.9	Very low	83 Å²	83	104.5 Å²	104.5	43%	0.426	54%	0.535	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	122.4	176.6	-55.7	176.3	0	0	0	107.2	W278 I279 T281 Y376	W278-I374 WeakPolarHBondContact CA-O 3.14Å; I279-I374 PolarHBondContact N-O 2.75Å; I279-I374 PolarHBondContact O-N 3.18Å; T281-I374 HydrophobicContact CG2-CD1 4.02Å; I374-Y376 PolarHBondContact O-N 3.45Å
375	P	65.9	Low	46.6	Very low	62 Å²	62	110 Å²	110	40%	0.403	55%	0.552	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-57.5	123.7	170.2	-12.4	22.3	0	0	0	108.5	W278 N377	W278-P375 HydrophobicContact CE3-CB 4.31Å; W278-P375 HydrophobicContact CE3-CG 4.15Å; W278-P375 HydrophobicContact CH2-CB 4.34Å; W278-P375 HydrophobicContact CH2-CG 3.85Å; W278-P375 HydrophobicContact CZ3-CB 4.07Å; W278-P375 HydrophobicContact CZ3-CG 3.5Å; W278-P375 VanDerWaalsContact CZ3-CG 3.5Å; P375-N377 PolarHBondContact O-N 3.39Å; P375-N377 VanDerWaalsContact O-N 3.11Å
376	Y	60.5	Low	45.3	Very low	52 Å²	52	111.7 Å²	111.7	20%	0.204	56%	0.564	C	S	.	*			trans	-81.2	95.6	175.9	-172.5	-115.8	0	0	0	108.8	Q277 I279 M344 I374 Q378 I380	Q277-Y376 HydrophobicContact CB-CD1 4.3Å; Q277-Y376 PolarHBondContact O-N 3.01Å; Q277-Y376 VanDerWaalsContact OE1-CD1 3.3Å; I279-Y376 HydrophobicContact CD1-CD2 3.24Å; I279-Y376 HydrophobicContact CD1-CE2 3.68Å; I279-Y376 HydrophobicContact CD1-CG 4.11Å; I279-Y376 HydrophobicContact CG1-CD2 3.88Å; I279-Y376 HydrophobicContact CG1-CG 4.26Å; M344-Y376 HydrophobicContact CE-CD1 4.44Å; M344-Y376 HydrophobicContact CE-CE1 4.2Å; I374-Y376 PolarHBondContact O-N 3.45Å; Y376-Q378 VanDerWaalsContact C-N 3.31Å; Y376-Q378 HydrophobicContact CD1-CB 4.31Å; Y376-Q378 HydrophobicContact CE1-CB 3.77Å; Y376-Q378 HydrophobicContact CE2-CB 4.04Å; Y376-Q378 HydrophobicContact CE2-CG 3.89Å; Y376-Q378 VanDerWaalsContact CZ-OE1 3.23Å; Y376-Q378 PolarHBondContact O-N 3.02Å; Y376-Q378 PolarHBondContact OH-OE1 3.41Å; Y376-I380 HydrophobicContact CE1-CD1 4.49Å
377	N	47.7	Very low	44.1	Very low	144 Å²	144	111.6 Å²	111.6	77%	0.77	57%	0.57	S	S	*	*			trans	-94.1	34.7	179.1	-72.8	-4.8	0	0	0	112.2	P375 S379	P375-N377 PolarHBondContact O-N 3.39Å; P375-N377 VanDerWaalsContact O-N 3.11Å; N377-S379 PolarHBondContact O-N 3.43Å
378	Q	41.7	Very low	43.2	Very low	121 Å²	121	110.6 Å²	110.6	57%	0.565	58%	0.576	S	S	*	*			trans	-82.5	104.2	165.2	-75.2	-170.8	-13.7	0	0	108.3	Y376 I380	Y376-Q378 VanDerWaalsContact C-N 3.31Å; Y376-Q378 HydrophobicContact CD1-CB 4.31Å; Y376-Q378 HydrophobicContact CE1-CB 3.77Å; Y376-Q378 HydrophobicContact CE2-CB 4.04Å; Y376-Q378 HydrophobicContact CE2-CG 3.89Å; Y376-Q378 VanDerWaalsContact CZ-OE1 3.23Å; Y376-Q378 PolarHBondContact O-N 3.02Å; Y376-Q378 PolarHBondContact OH-OE1 3.41Å; Q378-I380 VanDerWaalsContact C-N 3.32Å; Q378-I380 HydrophobicContact CB-CG1 4.46Å; Q378-I380 PolarHBondContact O-N 2.97Å
379	S	28	Very low	42.4	Very low	106 Å²	106	116.9 Å²	116.9	74%	0.741	61%	0.61	S	S	*	*			trans	-58.3	100.4	152	50.4	0	0	0	0	107.1	N377 E381	N377-S379 PolarHBondContact O-N 3.43Å; S379-E381 PolarHBondContact O-N 3.17Å
380	I	28.2	Very low	41.4	Very low	130 Å²	130	119 Å²	119	67%	0.667	61%	0.613	S	S	*	*			trans	-75.2	87	171.3	-61	173	0	0	0	106.4	Y376 Q378	Y376-I380 HydrophobicContact CE1-CD1 4.49Å; Q378-I380 VanDerWaalsContact C-N 3.32Å; Q378-I380 HydrophobicContact CB-CG1 4.46Å; Q378-I380 PolarHBondContact O-N 2.97Å
381	E	23.9	Very low	40.4	Very low	170 Å²	170	118.7 Å²	118.7	79%	0.794	62%	0.616	S	S	*	*			trans	-76.7	120.9	150.4	-78.6	-176.9	154.9	0	0	107.6	S379	S379-E381 PolarHBondContact O-N 3.17Å
382	N	25.1	Very low	39.7	Very low	130 Å²	130	123 Å²	123	70%	0.695	65%	0.646	S	S	*	*			trans	44	102.7	153.6	-65	-21.6	0	0	0	119.5
383	D	23.5	Very low	38.7	Very low	168 Å²	168	124.6 Å²	124.6	90%	0.898	66%	0.658	S	S	*	*			trans	-107.9	75.5	139.4	-99.4	-25.1	0	0	0	109.3
384	T	27.1	Very low	37.8	Very low	115 Å²	115	127.2 Å²	127.2	71%	0.706	67%	0.672	S	S	*	*			trans	-122	53.2	165.6	48.2	0	0	0	0	110.2
385	K	30.7	Very low	36.8	Very low	194 Å²	194	129.8 Å²	129.8	84%	0.843	68%	0.682	S	S	*	*			trans	-140.9	50.7	167.3	-79.7	-167.1	178.8	175.1	0	113.2
386	L	27.7	Very low	36.5	Very low	161 Å²	161	133.7 Å²	133.7	84%	0.843	69%	0.693	S	S	*	*	S	Bend	trans	-171.6	95.4	160.7	-113.5	123.5	0	0	0	104.7
387	I	28.4	Very low	36.2	Very low	156 Å²	156	132.6 Å²	132.6	80%	0.8	69%	0.693	S	S	*	*				-168.3	97.9	84.4	-73.6	140.3	0	0	0	105.6
388	N	27.9	Very low	36.4	Very low	154 Å²	154	129.3 Å²	129.3	82%	0.824	68%	0.675	S	S	*	*			trans	-109.4	139	160.2	-90.1	-18.2	0	0	0	106.7
389	N	33.3	Very low	37.2	Very low	149 Å²	149	126.7 Å²	126.7	80%	0.797	67%	0.667	S	S	*	*	S	Bend	trans	100.2	79.7	179.3	-55.2	-13.1	0	0	0	115.4
390	K	32.9	Very low	38.9	Very low	170 Å²	170	125.1 Å²	125.1	74%	0.739	65%	0.651	S	S	*	*			trans	173.9	38.6	138.3	-94.5	174.5	-176	-174.2	0	113
391	T	39.9	Very low	40.4	Very low	113 Å²	113	119.3 Å²	119.3	69%	0.693	62%	0.621	S	S	*	*	H	α-helix	trans	-91.5	-16.6	-170.6	39.1	0	0	0	0	116.5	Q395	T391-Q395 PolarHBondContact O-N 2.84Å
392	S	44.7	Very low	42	Very low	97 Å²	97	115.2 Å²	115.2	68%	0.678	60%	0.604	S	S	*	*	H	α-helix	trans	-72.5	-37.3	-175.2	57.4	0	0	0	0	114.1
393	N	42.4	Very low	44.1	Very low	114 Å²	114	112.9 Å²	112.9	61%	0.61	59%	0.592	S	S	*	*	H	α-helix	trans	-80.6	-29.5	-178.6	-79.1	-11	0	0	0	113.4	S397	N393-S397 PolarHBondContact O-N 3.42Å; N393-S397 PolarHBondContact O-OG 3.33Å
394	I	45.4	Very low	46.2	Very low	82 Å²	82	106.1 Å²	106.1	42%	0.421	56%	0.557	S	S	.	*	H	α-helix	trans	-71.1	-40.5	-180	-62.8	173	0	0	0	110.6	K396 S397 I398	I394-K396 PolarHBondContact O-N 3.47Å; I394-S397 PolarHBondContact O-N 3.13Å; I394-I398 HydrophobicContact CG2-CD1 3.66Å; I394-I398 HydrophobicContact CG2-CG1 4.2Å; I394-I398 VanDerWaalsContact O-CG1 3.28Å; I394-I398 WeakPolarHBondContact O-CG1 3.47Å; I394-I398 PolarHBondContact O-N 2.97Å
395	Q	47.3	Very low	47.8	Very low	137 Å²	137	103.1 Å²	103.1	64%	0.64	54%	0.537	S	S	*	.	H	α-helix	trans	-63.9	-41	-177.4	-167.3	172.2	-1.5	0	0	112.3	T391 I398 T399	T391-Q395 PolarHBondContact O-N 2.84Å; Q395-I398 PolarHBondContact O-N 3.32Å; Q395-T399 PolarHBondContact O-N 3.04Å; Q395-T399 PolarHBondContact O-OG1 3.09Å
396	K	60	Low	49.4	Very low	144 Å²	144	98 Å²	98	63%	0.626	52%	0.518	S	S	*	.	H	α-helix	trans	-62.8	-47.3	174.4	-172.4	178.6	177.5	-177.7	0	111.7	I394 I398 T399 D400	I394-K396 PolarHBondContact O-N 3.47Å; K396-I398 VanDerWaalsContact C-N 3.29Å; K396-I398 PolarHBondContact O-N 2.95Å; K396-T399 PolarHBondContact O-N 3.35Å; K396-D400 PolarHBondContact O-N 3.41Å
397	S	55.1	Low	51.5	Low	29 Å²	29	94.4 Å²	94.4	20%	0.203	50%	0.499	C	S	.	.	H	α-helix	trans	-61.8	-34.9	177.8	-60.7	0	0	0	0	113.1	N393 I394 T401	N393-S397 PolarHBondContact O-N 3.42Å; N393-S397 PolarHBondContact O-OG 3.33Å; I394-S397 PolarHBondContact O-N 3.13Å; S397-T401 WeakPolarHBondContact O-CB 3.32Å; S397-T401 PolarHBondContact O-N 3.39Å; S397-T401 VanDerWaalsContact O-N 3.16Å; S397-T401 PolarHBondContact O-OG1 2.85Å
398	I	51.4	Low	53.2	Low	75 Å²	75	88.1 Å²	88.1	39%	0.385	47%	0.466	S	S	.	.	H	α-helix	trans	-66.1	-48.3	174	-69.6	168.5	0	0	0	110.5	I394 Q395 K396 D400 T401 L402 L486	I394-I398 HydrophobicContact CG2-CD1 3.66Å; I394-I398 HydrophobicContact CG2-CG1 4.2Å; I394-I398 VanDerWaalsContact O-CG1 3.28Å; I394-I398 WeakPolarHBondContact O-CG1 3.47Å; I394-I398 PolarHBondContact O-N 2.97Å; Q395-I398 PolarHBondContact O-N 3.32Å; K396-I398 VanDerWaalsContact C-N 3.29Å; K396-I398 PolarHBondContact O-N 2.95Å; I398-D400 PolarHBondContact O-N 3.4Å; I398-T401 PolarHBondContact O-N 3.1Å; I398-L402 HydrophobicContact CG2-CD1 3.99Å; I398-L402 HydrophobicContact CG2-CG 4.46Å; I398-L402 WeakPolarHBondContact O-CG 3.46Å; I398-L402 PolarHBondContact O-N 3.46Å; I398-L486 HydrophobicContact CG1-CD1 3.76Å
399	T	58.6	Low	54.7	Low	66 Å²	66	84.3 Å²	84.3	41%	0.405	45%	0.449	S	S	.	.	H	α-helix	trans	-60.8	-44.2	179.4	-61.7	0	0	0	0	112	Q395 K396 T401 L402 N403	Q395-T399 PolarHBondContact O-N 3.04Å; Q395-T399 PolarHBondContact O-OG1 3.09Å; K396-T399 PolarHBondContact O-N 3.35Å; T399-T401 VanDerWaalsContact C-N 3.31Å; T399-T401 PolarHBondContact O-N 3.5Å; T399-L402 PolarHBondContact O-N 3.32Å; T399-N403 PolarHBondContact O-N 2.88Å; T399-N403 PolarHBondContact O-ND2 3.37Å
400	D	64	Low	56.3	Low	74 Å²	74	82.9 Å²	82.9	40%	0.396	44%	0.437	S	S	.	.	H	α-helix	trans	-62.7	-38.7	178.6	-69.1	-19.5	0	0	0	111.7	K396 I398 N403 C404	K396-D400 PolarHBondContact O-N 3.41Å; I398-D400 PolarHBondContact O-N 3.4Å; D400-N403 PolarHBondContact O-N 2.85Å; D400-C404 PolarHBondContact O-N 2.85Å; D400-C404 VanDerWaalsContact O-N 3.13Å; D400-C404 PolarHBondContact O-SG 3.13Å
401	T	59.9	Low	58.1	Low	7 Å²	7	76.3 Å²	76.3	4%	0.043	41%	0.408	C	S	.	.	H	α-helix	trans	-67.7	-41.5	177.1	-53.4	0	0	0	0	112.1	S397 I398 T399 N403 C404 L405 S482 F483	S397-T401 WeakPolarHBondContact O-CB 3.32Å; S397-T401 PolarHBondContact O-N 3.39Å; S397-T401 VanDerWaalsContact O-N 3.16Å; S397-T401 PolarHBondContact O-OG1 2.85Å; I398-T401 PolarHBondContact O-N 3.1Å; T399-T401 VanDerWaalsContact C-N 3.31Å; T399-T401 PolarHBondContact O-N 3.5Å; T401-N403 VanDerWaalsContact C-N 3.35Å; T401-N403 PolarHBondContact O-N 3.19Å; T401-C404 PolarHBondContact O-N 3.12Å; T401-L405 PolarHBondContact O-N 2.65Å; T401-L405 VanDerWaalsContact O-N 3.13Å; T401-S482 WeakPolarHBondContact CA-OG 3.48Å; T401-S482 WeakPolarHBondContact CB-OG 3.39Å; T401-S482 PolarHBondContact N-OG 2.88Å; T401-S482 PolarHBondContact OG1-OG 3.39Å; T401-F483 HydrophobicContact CG2-CD1 4.07Å; T401-F483 HydrophobicContact CG2-CD2 4.23Å; T401-F483 HydrophobicContact CG2-CE1 3.91Å; T401-F483 HydrophobicContact CG2-CE2 4.06Å; T401-F483 HydrophobicContact CG2-CG 4.23Å; T401-F483 HydrophobicContact CG2-CZ 3.91Å
402	L	57.3	Low	59.3	Low	84 Å²	84	74 Å²	74	44%	0.44	39%	0.391	S	S	.	.	H	α-helix	trans	-63.1	-41.7	176.5	-72.2	171.7	0	0	0	111.8	I398 T399 C404 L405 I406	I398-L402 HydrophobicContact CG2-CD1 3.99Å; I398-L402 HydrophobicContact CG2-CG 4.46Å; I398-L402 WeakPolarHBondContact O-CG 3.46Å; I398-L402 PolarHBondContact O-N 3.46Å; T399-L402 PolarHBondContact O-N 3.32Å; L402-C404 VanDerWaalsContact C-N 3.34Å; L402-C404 PolarHBondContact O-N 2.92Å; L402-L405 PolarHBondContact O-N 2.74Å; L402-I406 WeakPolarHBondContact O-CG1 3.48Å; L402-I406 PolarHBondContact O-N 3.06Å
403	N	68.6	Low	60	Low	81 Å²	81	74.1 Å²	74.1	43%	0.433	38%	0.383	S	S	.	.	H	α-helix	trans	-63.8	-39.1	177.2	-71	-21.9	0	0	0	112	T399 D400 T401 N407	T399-N403 PolarHBondContact O-N 2.88Å; T399-N403 PolarHBondContact O-ND2 3.37Å; D400-N403 PolarHBondContact O-N 2.85Å; T401-N403 VanDerWaalsContact C-N 3.35Å; T401-N403 PolarHBondContact O-N 3.19Å; N403-N407 VanDerWaalsContact O-CG 3.23Å; N403-N407 PolarHBondContact O-N 2.97Å; N403-N407 PolarHBondContact O-ND2 2.93Å
404	C	68.4	Low	61.4	Low	26 Å²	26	73.5 Å²	73.5	18%	0.176	38%	0.376	C	S	.	.	H	α-helix	trans	-62.7	-44.6	176	-65.7	0	0	0	0	111.8	D400 T401 L402 N407 E408	D400-C404 PolarHBondContact O-N 2.85Å; D400-C404 VanDerWaalsContact O-N 3.13Å; D400-C404 PolarHBondContact O-SG 3.13Å; T401-C404 PolarHBondContact O-N 3.12Å; L402-C404 VanDerWaalsContact C-N 3.34Å; L402-C404 PolarHBondContact O-N 2.92Å; C404-N407 PolarHBondContact O-N 3.17Å; C404-E408 PolarHBondContact O-N 3.25Å
405	L	59.8	Low	62.2	Low	53 Å²	53	72.6 Å²	72.6	28%	0.277	37%	0.371	S	S	.	.	H	α-helix	trans	-62.9	-43.9	178.4	-76.8	169.2	0	0	0	112.9	T401 L402 E408 T409 T479 F483	T401-L405 PolarHBondContact O-N 2.65Å; T401-L405 VanDerWaalsContact O-N 3.13Å; L402-L405 PolarHBondContact O-N 2.74Å; L405-E408 PolarHBondContact O-N 3.44Å; L405-T409 WeakPolarHBondContact O-CB 3.31Å; L405-T409 PolarHBondContact O-N 3.18Å; L405-T409 PolarHBondContact O-OG1 2.81Å; L405-T479 HydrophobicContact CD2-CG2 3.86Å; L405-T479 HydrophobicContact CG-CG2 4.28Å; L405-F483 HydrophobicContact CD1-CE2 4.36Å; L405-F483 HydrophobicContact CD1-CZ 4.02Å; L405-F483 HydrophobicContact CD2-CE2 4.08Å; L405-F483 HydrophobicContact CD2-CZ 4.39Å; L405-F483 HydrophobicContact CG-CE2 4.32Å; L405-F483 HydrophobicContact CG-CZ 4.48Å
406	I	63.8	Low	62.9	Low	87 Å²	87	70.6 Å²	70.6	45%	0.446	36%	0.363	S	S	.	.	H	α-helix	trans	-59.9	-49	178.4	-69.5	167.3	0	0	0	109.9	L402 E408 T409 E410	L402-I406 WeakPolarHBondContact O-CG1 3.48Å; L402-I406 PolarHBondContact O-N 3.06Å; I406-E408 VanDerWaalsContact C-N 3.33Å; I406-E408 PolarHBondContact O-N 3.23Å; I406-T409 PolarHBondContact O-N 2.97Å; I406-T409 VanDerWaalsContact O-N 3.16Å; I406-E410 HydrophobicContact CG2-CG 4.37Å; I406-E410 WeakPolarHBondContact O-CG 3.19Å; I406-E410 PolarHBondContact O-N 3.03Å
407	N	71.9	Confident	62.9	Low	84 Å²	84	66.6 Å²	66.6	45%	0.449	35%	0.351	S	S	.	.	H	α-helix	trans	-60.6	-40.5	179.8	-67.9	-22.4	0	0	0	112.6	N403 C404 Y411 L475	N403-N407 VanDerWaalsContact O-CG 3.23Å; N403-N407 PolarHBondContact O-N 2.97Å; N403-N407 PolarHBondContact O-ND2 2.93Å; C404-N407 PolarHBondContact O-N 3.17Å; N407-Y411 WeakPolarHBondContact O-CB 3.35Å; N407-Y411 PolarHBondContact O-N 3.27Å; N407-Y411 VanDerWaalsContact O-N 3.13Å; N407-L475 HydrophobicContact CB-CD2 3.9Å
408	E	64	Low	63.3	Low	24 Å²	24	69.3 Å²	69.3	11%	0.112	36%	0.36	C	S	.	.	H	α-helix	trans	-66.2	-40.2	176.6	-171.5	174.2	176.8	0	0	111.9	C404 L405 I406 Y411 L412 Y472 L475 T479	C404-E408 PolarHBondContact O-N 3.25Å; L405-E408 PolarHBondContact O-N 3.44Å; I406-E408 VanDerWaalsContact C-N 3.33Å; I406-E408 PolarHBondContact O-N 3.23Å; E408-Y411 PolarHBondContact O-N 2.93Å; E408-L412 WeakPolarHBondContact O-CG 3.21Å; E408-L412 PolarHBondContact O-N 3.11Å; E408-Y472 HydrophobicContact CG-CD2 4.32Å; E408-Y472 HydrophobicContact CG-CE2 3.65Å; E408-Y472 PolarHBondContact OE1-OH 2.91Å; E408-L475 HydrophobicContact CB-CB 4.5Å; E408-T479 VanDerWaalsContact OE2-CB 3.27Å; E408-T479 WeakPolarHBondContact OE2-CB 3.46Å; E408-T479 WeakPolarHBondContact OE2-CG2 3.32Å; E408-T479 PolarHBondContact OE2-OG1 3.41Å
409	T	60.5	Low	63.6	Low	75 Å²	75	68.2 Å²	68.2	46%	0.46	36%	0.355	S	S	.	.	H	α-helix	trans	-68.3	-45.2	180	-45.6	0	0	0	0	111.6	L405 I406 Y411 L412 I413	L405-T409 WeakPolarHBondContact O-CB 3.31Å; L405-T409 PolarHBondContact O-N 3.18Å; L405-T409 PolarHBondContact O-OG1 2.81Å; I406-T409 PolarHBondContact O-N 2.97Å; I406-T409 VanDerWaalsContact O-N 3.16Å; T409-Y411 VanDerWaalsContact C-N 3.3Å; T409-Y411 PolarHBondContact O-N 2.86Å; T409-L412 PolarHBondContact O-N 3.41Å; T409-I413 HydrophobicContact CG2-CD1 4.17Å; T409-I413 WeakPolarHBondContact O-CG1 3.24Å; T409-I413 PolarHBondContact O-N 2.64Å
410	E	66.1	Low	63.5	Low	118 Å²	118	69.3 Å²	69.3	55%	0.551	36%	0.358	S	S	*	.	H	α-helix	trans	-60.7	-41.4	176.2	-73.4	-176.8	165.8	0	0	111.7	I406 I413 H414	I406-E410 HydrophobicContact CG2-CG 4.37Å; I406-E410 WeakPolarHBondContact O-CG 3.19Å; I406-E410 PolarHBondContact O-N 3.03Å; E410-I413 PolarHBondContact O-N 3.48Å; E410-H414 WeakPolarHBondContact O-CB 3.04Å; E410-H414 PolarHBondContact O-N 2.88Å
411	Y	71.9	Confident	63.3	Low	32 Å²	32	71 Å²	71	13%	0.125	36%	0.363	C	S	.	.	H	α-helix	trans	-61	-47.2	176	-171.5	-90	0	0	0	112	N407 E408 T409 H414 Q415 S469 E471 Y472 L475	N407-Y411 WeakPolarHBondContact O-CB 3.35Å; N407-Y411 PolarHBondContact O-N 3.27Å; N407-Y411 VanDerWaalsContact O-N 3.13Å; E408-Y411 PolarHBondContact O-N 2.93Å; T409-Y411 VanDerWaalsContact C-N 3.3Å; T409-Y411 PolarHBondContact O-N 2.86Å; Y411-H414 PolarHBondContact O-N 3.05Å; Y411-Q415 HydrophobicContact CD1-CG 3.91Å; Y411-Q415 HydrophobicContact CE1-CG 3.47Å; Y411-Q415 VanDerWaalsContact CE1-CG 3.47Å; Y411-Q415 WeakPolarHBondContact O-CG 3.45Å; Y411-Q415 PolarHBondContact O-N 2.88Å; Y411-Q415 PolarHBondContact OH-NE2 2.76Å; Y411-S469 VanDerWaalsContact CE1-OG 3.28Å; Y411-S469 WeakPolarHBondContact CE1-OG 3.46Å; Y411-S469 VanDerWaalsContact CZ-OG 3.32Å; Y411-S469 VanDerWaalsContact OH-CB 3.24Å; Y411-S469 WeakPolarHBondContact OH-CB 3.25Å; Y411-S469 PolarHBondContact OH-OG 2.99Å; Y411-E471 HydrophobicContact CE2-CB 3.79Å; Y411-E471 WeakPolarHBondContact CE2-OE2 3.36Å; Y411-E471 WeakPolarHBondContact OH-CB 3.48Å; Y411-E471 PolarHBondContact OH-OE2 2.94Å; Y411-Y472 AromaticContact CD1-CD2 3.99Å; Y411-Y472 HydrophobicContact CD1-CD2 3.99Å; Y411-Y472 HydrophobicContact CD1-CG 4.47Å; Y411-Y472 HydrophobicContact CE1-CD2 4.48Å; Y411-L475 HydrophobicContact CD1-CD1 4.36Å; Y411-L475 HydrophobicContact CD2-CD1 3.89Å; Y411-L475 HydrophobicContact CG-CD1 3.68Å
412	L	64.7	Low	63.1	Low	65 Å²	65	77.5 Å²	77.5	34%	0.34	39%	0.388	S	S	.	.	H	α-helix	trans	-62.9	-43	178.6	-76.2	172.8	0	0	0	112.3	E408 T409 Q415 I416 Y472	E408-L412 WeakPolarHBondContact O-CG 3.21Å; E408-L412 PolarHBondContact O-N 3.11Å; T409-L412 PolarHBondContact O-N 3.41Å; L412-Q415 PolarHBondContact O-N 3.41Å; L412-I416 WeakPolarHBondContact O-CB 3.4Å; L412-I416 VanDerWaalsContact O-CG1 3.27Å; L412-I416 WeakPolarHBondContact O-CG1 3.34Å; L412-I416 PolarHBondContact O-N 3.09Å; L412-Y472 HydrophobicContact CD1-CE2 3.77Å; L412-Y472 HydrophobicContact CD2-CD2 3.9Å; L412-Y472 HydrophobicContact CD2-CE2 3.45Å; L412-Y472 VanDerWaalsContact CD2-CE2 3.45Å; L412-Y472 HydrophobicContact CG-CD2 4.14Å; L412-Y472 HydrophobicContact CG-CE2 3.56Å
413	I	60	Low	63.1	Low	100 Å²	100	74.2 Å²	74.2	51%	0.513	37%	0.371	S	S	.	.	H	α-helix	trans	-60.3	-48.5	176	-69.5	168.4	0	0	0	109.8	T409 E410 Q415 I416 T417	T409-I413 HydrophobicContact CG2-CD1 4.17Å; T409-I413 WeakPolarHBondContact O-CG1 3.24Å; T409-I413 PolarHBondContact O-N 2.64Å; E410-I413 PolarHBondContact O-N 3.48Å; I413-Q415 VanDerWaalsContact C-N 3.34Å; I413-Q415 PolarHBondContact O-N 3.12Å; I413-I416 PolarHBondContact O-N 2.91Å; I413-T417 PolarHBondContact O-N 2.94Å; I413-T417 PolarHBondContact O-OG1 3.44Å; I413-T417 VanDerWaalsContact O-OG1 3.04Å
414	H	70	Confident	62.7	Low	100 Å²	100	72.6 Å²	72.6	46%	0.463	36%	0.362	S	S	.	.	H	α-helix	trans	-58.7	-45	179.2	-175.1	65.4	0	0	0	112.3	E410 Y411 T417 Q418	E410-H414 WeakPolarHBondContact O-CB 3.04Å; E410-H414 PolarHBondContact O-N 2.88Å; Y411-H414 PolarHBondContact O-N 3.05Å; H414-T417 PolarHBondContact O-N 3.41Å; H414-Q418 PolarHBondContact CE1-NE2 3.48Å; H414-Q418 VanDerWaalsContact NE2-CD 3.3Å; H414-Q418 PolarHBondContact NE2-NE2 3.31Å; H414-Q418 WeakPolarHBondContact O-CB 3.41Å; H414-Q418 WeakPolarHBondContact O-CG 3.39Å; H414-Q418 PolarHBondContact O-N 3.44Å
415	Q	63.6	Low	62.3	Low	64 Å²	64	77.3 Å²	77.3	30%	0.299	39%	0.385	S	S	.	.	H	α-helix	trans	-61.7	-44.7	176.4	-73.8	-66.6	-29.1	0	0	111.8	Y411 L412 I413 Q418 L419	Y411-Q415 HydrophobicContact CD1-CG 3.91Å; Y411-Q415 HydrophobicContact CE1-CG 3.47Å; Y411-Q415 VanDerWaalsContact CE1-CG 3.47Å; Y411-Q415 WeakPolarHBondContact O-CG 3.45Å; Y411-Q415 PolarHBondContact O-N 2.88Å; Y411-Q415 PolarHBondContact OH-NE2 2.76Å; L412-Q415 PolarHBondContact O-N 3.41Å; I413-Q415 VanDerWaalsContact C-N 3.34Å; I413-Q415 PolarHBondContact O-N 3.12Å; Q415-Q418 PolarHBondContact O-N 2.88Å; Q415-L419 WeakPolarHBondContact O-CB 3.44Å; Q415-L419 PolarHBondContact O-N 3.43Å
416	I	60.6	Low	62.5	Low	95 Å²	95	81.7 Å²	81.7	49%	0.487	40%	0.402	S	S	.	.	H	α-helix	trans	-63.2	-45	177.3	-70.4	167.5	0	0	0	110.8	L412 I413 L419 I420	L412-I416 WeakPolarHBondContact O-CB 3.4Å; L412-I416 VanDerWaalsContact O-CG1 3.27Å; L412-I416 WeakPolarHBondContact O-CG1 3.34Å; L412-I416 PolarHBondContact O-N 3.09Å; I413-I416 PolarHBondContact O-N 2.91Å; I416-L419 PolarHBondContact O-N 3.35Å; I416-I420 HydrophobicContact CG2-CD1 3.63Å; I416-I420 HydrophobicContact CG2-CG1 4.3Å; I416-I420 WeakPolarHBondContact O-CB 3.28Å; I416-I420 VanDerWaalsContact O-CG1 3.25Å; I416-I420 WeakPolarHBondContact O-CG1 3.48Å; I416-I420 PolarHBondContact O-N 2.95Å
417	T	61.4	Low	62.6	Low	59 Å²	59	81.2 Å²	81.2	36%	0.362	39%	0.394	S	S	.	.	H	α-helix	trans	-60.4	-50.1	177.6	-59.1	0	0	0	0	111.1	I413 H414 L419 I420 E421	I413-T417 PolarHBondContact O-N 2.94Å; I413-T417 PolarHBondContact O-OG1 3.44Å; I413-T417 VanDerWaalsContact O-OG1 3.04Å; H414-T417 PolarHBondContact O-N 3.41Å; T417-L419 VanDerWaalsContact C-N 3.29Å; T417-L419 PolarHBondContact O-N 3.46Å; T417-I420 PolarHBondContact O-N 2.82Å; T417-E421 HydrophobicContact CG2-CG 4.4Å; T417-E421 WeakPolarHBondContact O-CB 3.34Å; T417-E421 WeakPolarHBondContact O-CG 3.48Å; T417-E421 PolarHBondContact O-N 3.45Å
418	Q	63.4	Low	62.4	Low	87 Å²	87	78.3 Å²	78.3	41%	0.407	38%	0.379	S	S	.	.	H	α-helix	trans	-60.7	-39.7	177.5	-75.3	-172.6	-27.3	0	0	112.1	H414 Q415 Y422	H414-Q418 PolarHBondContact CE1-NE2 3.48Å; H414-Q418 VanDerWaalsContact NE2-CD 3.3Å; H414-Q418 PolarHBondContact NE2-NE2 3.31Å; H414-Q418 WeakPolarHBondContact O-CB 3.41Å; H414-Q418 WeakPolarHBondContact O-CG 3.39Å; H414-Q418 PolarHBondContact O-N 3.44Å; Q415-Q418 PolarHBondContact O-N 2.88Å; Q418-Y422 WeakPolarHBondContact O-CB 3.33Å; Q418-Y422 PolarHBondContact O-N 3.5Å
419	L	57.7	Low	62.8	Low	51 Å²	51	79.6 Å²	79.6	27%	0.267	39%	0.389	S	S	.	.	H	α-helix	trans	-65.1	-45.2	177.9	-166	85.6	0	0	0	111.3	Q415 I416 T417 T423 I463 V466	Q415-L419 WeakPolarHBondContact O-CB 3.44Å; Q415-L419 PolarHBondContact O-N 3.43Å; I416-L419 PolarHBondContact O-N 3.35Å; T417-L419 VanDerWaalsContact C-N 3.29Å; T417-L419 PolarHBondContact O-N 3.46Å; L419-T423 VanDerWaalsContact O-CB 3.31Å; L419-T423 WeakPolarHBondContact O-CB 3.26Å; L419-T423 VanDerWaalsContact O-CG2 3.29Å; L419-T423 WeakPolarHBondContact O-CG2 3.13Å; L419-T423 PolarHBondContact O-N 2.95Å; L419-T423 PolarHBondContact O-OG1 2.95Å; L419-I463 HydrophobicContact CD1-CG2 3.97Å; L419-I463 HydrophobicContact CD2-CB 4.36Å; L419-I463 HydrophobicContact CD2-CD1 3.41Å; L419-I463 VanDerWaalsContact CD2-CD1 3.41Å; L419-I463 HydrophobicContact CD2-CG1 4.46Å; L419-I463 HydrophobicContact CD2-CG2 3.99Å; L419-I463 HydrophobicContact CG-CD1 3.83Å; L419-I463 HydrophobicContact CG-CG2 4.07Å; L419-V466 HydrophobicContact CD1-CG2 3.65Å; L419-V466 HydrophobicContact CD2-CG2 3.99Å; L419-V466 HydrophobicContact CG-CG2 4.49Å
420	I	56.6	Low	63.3	Low	90 Å²	90	82.6 Å²	82.6	46%	0.462	40%	0.398	S	S	.	.	H	α-helix	trans	-62.7	-49.9	176.6	-69.5	168.8	0	0	0	109.9	I416 T417 Y422 T423 M424	I416-I420 HydrophobicContact CG2-CD1 3.63Å; I416-I420 HydrophobicContact CG2-CG1 4.3Å; I416-I420 WeakPolarHBondContact O-CB 3.28Å; I416-I420 VanDerWaalsContact O-CG1 3.25Å; I416-I420 WeakPolarHBondContact O-CG1 3.48Å; I416-I420 PolarHBondContact O-N 2.95Å; T417-I420 PolarHBondContact O-N 2.82Å; I420-Y422 PolarHBondContact O-N 3.23Å; I420-T423 PolarHBondContact O-N 3.21Å; I420-T423 PolarHBondContact O-OG1 3.21Å; I420-M424 HydrophobicContact CG2-CG 4.01Å; I420-M424 WeakPolarHBondContact O-CB 3.49Å; I420-M424 WeakPolarHBondContact O-CG 3.45Å; I420-M424 PolarHBondContact O-N 3.35Å
421	E	59.8	Low	63.4	Low	109 Å²	109	80.9 Å²	80.9	51%	0.509	39%	0.392	S	S	.	.	H	α-helix	trans	-60.1	-48.8	179.5	-74.2	178.3	173.6	0	0	111.6	T417 T423 N425	T417-E421 HydrophobicContact CG2-CG 4.4Å; T417-E421 WeakPolarHBondContact O-CB 3.34Å; T417-E421 WeakPolarHBondContact O-CG 3.48Å; T417-E421 PolarHBondContact O-N 3.45Å; E421-T423 PolarHBondContact O-N 3.28Å; E421-N425 WeakPolarHBondContact O-CB 3.32Å; E421-N425 PolarHBondContact O-N 3.06Å; E421-N425 PolarHBondContact O-ND2 3.12Å
422	Y	55.8	Low	63.6	Low	143 Å²	143	84.1 Å²	84.1	56%	0.561	42%	0.417	S	S	*	.	H	α-helix	trans	-62.6	-43.8	180	-179.5	-97	0	0	0	112.3	Q418 I420 K426	Q418-Y422 WeakPolarHBondContact O-CB 3.33Å; Q418-Y422 PolarHBondContact O-N 3.5Å; I420-Y422 PolarHBondContact O-N 3.23Å; Y422-K426 HydrophobicContact CD1-CD 4.4Å; Y422-K426 HydrophobicContact CE1-CD 3.86Å; Y422-K426 HydrophobicContact CE2-CD 4.33Å; Y422-K426 VanDerWaalsContact CZ-CE 3.41Å; Y422-K426 VanDerWaalsContact CZ-NZ 3.31Å; Y422-K426 WeakPolarHBondContact O-CB 3.31Å; Y422-K426 WeakPolarHBondContact O-CG 2.99Å; Y422-K426 PolarHBondContact O-N 2.64Å; Y422-K426 WeakPolarHBondContact OH-CE 3.48Å; Y422-K426 PolarHBondContact OH-NZ 2.96Å
423	T	56.2	Low	64.2	Low	16 Å²	16	85.5 Å²	85.5	10%	0.098	43%	0.428	C	S	.	.	H	α-helix	trans	-74.7	-39.7	-178.3	53.7	0	0	0	0	112.1	L419 I420 E421 R427 I463	L419-T423 VanDerWaalsContact O-CB 3.31Å; L419-T423 WeakPolarHBondContact O-CB 3.26Å; L419-T423 VanDerWaalsContact O-CG2 3.29Å; L419-T423 WeakPolarHBondContact O-CG2 3.13Å; L419-T423 PolarHBondContact O-N 2.95Å; L419-T423 PolarHBondContact O-OG1 2.95Å; I420-T423 PolarHBondContact O-N 3.21Å; I420-T423 PolarHBondContact O-OG1 3.21Å; E421-T423 PolarHBondContact O-N 3.28Å; T423-R427 WeakPolarHBondContact O-CB 3.25Å; T423-R427 VanDerWaalsContact O-CD 3.26Å; T423-R427 WeakPolarHBondContact O-CD 3.33Å; T423-R427 WeakPolarHBondContact O-CG 3.41Å; T423-R427 PolarHBondContact O-N 2.92Å; T423-I463 HydrophobicContact CG2-CD1 4.05Å; T423-I463 HydrophobicContact CG2-CG1 4.06Å; T423-I463 HydrophobicContact CG2-CG2 3.94Å
424	M	59.8	Low	65	Low	47 Å²	47	83.6 Å²	83.6	23%	0.232	42%	0.415	C	S	.	.	H	α-helix	trans	-68.6	-46.1	178	-68.9	-71.6	-81.1	0	0	111.5	I420 K426 R427 I428 V455	I420-M424 HydrophobicContact CG2-CG 4.01Å; I420-M424 WeakPolarHBondContact O-CB 3.49Å; I420-M424 WeakPolarHBondContact O-CG 3.45Å; I420-M424 PolarHBondContact O-N 3.35Å; M424-K426 VanDerWaalsContact C-N 3.27Å; M424-K426 PolarHBondContact O-N 2.77Å; M424-R427 PolarHBondContact O-N 3.19Å; M424-R427 VanDerWaalsContact O-N 3.07Å; M424-I428 HydrophobicContact CB-CD1 4.37Å; M424-I428 HydrophobicContact CE-CD1 3.3Å; M424-I428 PolarHBondContact O-N 2.86Å; M424-I428 HydrophobicContact SD-CD1 3.68Å; M424-V455 HydrophobicContact CE-CG1 4.39Å
425	N	60.5	Low	65.4	Low	124 Å²	124	80.4 Å²	80.4	66%	0.663	40%	0.4	S	S	*	.	H	α-helix	trans	-64	-30.3	179.2	-72.3	-17	0	0	0	113.1	E421	E421-N425 WeakPolarHBondContact O-CB 3.32Å; E421-N425 PolarHBondContact O-N 3.06Å; E421-N425 PolarHBondContact O-ND2 3.12Å
426	K	63.7	Low	66.2	Low	145 Å²	145	84.2 Å²	84.2	63%	0.63	42%	0.415	S	S	*	.	H	α-helix	trans	-76.2	-27.8	173.7	-82.8	-171.1	166.1	-166.7	0	113.8	Y422 M424	Y422-K426 HydrophobicContact CD1-CD 4.4Å; Y422-K426 HydrophobicContact CE1-CD 3.86Å; Y422-K426 HydrophobicContact CE2-CD 4.33Å; Y422-K426 VanDerWaalsContact CZ-CE 3.41Å; Y422-K426 VanDerWaalsContact CZ-NZ 3.31Å; Y422-K426 WeakPolarHBondContact O-CB 3.31Å; Y422-K426 WeakPolarHBondContact O-CG 2.99Å; Y422-K426 PolarHBondContact O-N 2.64Å; Y422-K426 WeakPolarHBondContact OH-CE 3.48Å; Y422-K426 PolarHBondContact OH-NZ 2.96Å; M424-K426 VanDerWaalsContact C-N 3.27Å; M424-K426 PolarHBondContact O-N 2.77Å
427	R	65.8	Low	67.2	Low	77 Å²	77	86.5 Å²	86.5	29%	0.291	43%	0.429	S	S	.	.	H	α-helix	trans	-97.7	-24.8	-171	-69.5	171.1	-177.3	-174	-1.9	113.1	T423 M424 A458 I461 P462	T423-R427 WeakPolarHBondContact O-CB 3.25Å; T423-R427 VanDerWaalsContact O-CD 3.26Å; T423-R427 WeakPolarHBondContact O-CD 3.33Å; T423-R427 WeakPolarHBondContact O-CG 3.41Å; T423-R427 PolarHBondContact O-N 2.92Å; M424-R427 PolarHBondContact O-N 3.19Å; M424-R427 VanDerWaalsContact O-N 3.07Å; R427-A458 HydrophobicContact CB-CB 3.69Å; R427-A458 PolarHBondContact NH1-O 2.68Å; R427-I461 PolarHBondContact NH1-O 2.99Å; R427-P462 PolarHBondContact NH2-O 3.43Å
428	I	68.8	Low	68	Low	23 Å²	23	85.9 Å²	85.9	12%	0.118	42%	0.423	C	S	.	.	S	Bend	trans	-118.3	120.7	-174	-60.1	160.9	0	0	0	109	M424 W451 V455 A458	M424-I428 HydrophobicContact CB-CD1 4.37Å; M424-I428 HydrophobicContact CE-CD1 3.3Å; M424-I428 PolarHBondContact O-N 2.86Å; M424-I428 HydrophobicContact SD-CD1 3.68Å; I428-W451 HydrophobicContact CG2-CH2 4.37Å; I428-W451 HydrophobicContact CG2-CZ2 3.45Å; I428-W451 VanDerWaalsContact CG2-CZ2 3.45Å; I428-V455 HydrophobicContact CD1-CB 4.17Å; I428-V455 HydrophobicContact CD1-CG1 3.97Å; I428-V455 HydrophobicContact CD1-CG2 3.92Å; I428-V455 HydrophobicContact CG1-CG2 4.16Å; I428-V455 HydrophobicContact CG2-CG2 3.76Å; I428-A458 HydrophobicContact CD1-CB 3.96Å; I428-A458 HydrophobicContact CG1-CB 3.66Å
429	P	71.9	Confident	68.5	Low	52 Å²	52	88.1 Å²	88.1	34%	0.338	44%	0.443	S	S	.	.			trans	-66.7	138.2	171.9	27.2	-32	0	0	0	110.6	L431 Y434 W451	P429-L431 PolarHBondContact O-N 2.75Å; P429-Y434 HydrophobicContact CB-CD2 4.29Å; P429-Y434 HydrophobicContact CG-CD2 3.58Å; P429-Y434 HydrophobicContact CG-CE2 4.19Å; P429-Y434 HydrophobicContact CG-CG 4.45Å; P429-W451 PolarHBondContact O-NE1 3.4Å
430	E	71	Confident	69.6	Low	137 Å²	137	89 Å²	89	64%	0.64	45%	0.447	S	S	*	.			trans	-57	137.1	177.8	-65.7	-175.5	173	0	0	111.5	V433 Y434	E430-V433 HydrophobicContact CB-CB 4.49Å; E430-V433 HydrophobicContact CB-CG2 4.17Å; E430-V433 WeakPolarHBondContact O-CA 3.42Å; E430-V433 WeakPolarHBondContact O-CB 3.25Å; E430-V433 PolarHBondContact O-N 3.42Å; E430-Y434 PolarHBondContact O-N 3.42Å
431	L	69.1	Low	70.6	Confident	83 Å²	83	91 Å²	91	44%	0.435	46%	0.459	S	S	.	.	H	α-helix	trans	-48.3	-49.9	-178.1	-117.9	115.6	0	0	0	113.4	P429 V433 Y434 F435 W451	P429-L431 PolarHBondContact O-N 2.75Å; L431-V433 PolarHBondContact O-N 3.36Å; L431-Y434 PolarHBondContact O-N 3.38Å; L431-Y434 VanDerWaalsContact O-N 3.12Å; L431-F435 HydrophobicContact CB-CD2 4.39Å; L431-F435 HydrophobicContact CD2-CD2 3.65Å; L431-F435 HydrophobicContact CD2-CE2 3.36Å; L431-F435 HydrophobicContact CG-CD2 3.96Å; L431-F435 HydrophobicContact CG-CE2 3.68Å; L431-F435 WeakPolarHBondContact O-CD2 3.16Å; L431-F435 PolarHBondContact O-N 3.03Å; L431-W451 HydrophobicContact CD1-CD2 4.13Å; L431-W451 HydrophobicContact CD1-CE3 4.04Å; L431-W451 HydrophobicContact CD1-CH2 3.36Å; L431-W451 HydrophobicContact CD1-CZ2 3.47Å; L431-W451 VanDerWaalsContact CD1-CZ2 3.47Å; L431-W451 HydrophobicContact CD1-CZ3 3.65Å; L431-W451 HydrophobicContact CG-CZ2 4.31Å
432	P	74.6	Confident	71.3	Confident	100 Å²	100	92.1 Å²	92.1	65%	0.649	47%	0.468	S	S	*	.	H	α-helix	trans	-63	-30.7	-179.3	-22.4	34.1	0	0	0	113.5	K436	P432-K436 PolarHBondContact O-N 3.05Å
433	V	78.7	Confident	72.2	Confident	93 Å²	93	88.7 Å²	88.7	56%	0.564	46%	0.459	S	S	*	.	H	α-helix	trans	-75.4	-40.3	175.7	-179	0	0	0	0	110	E430 L431 K436	E430-V433 HydrophobicContact CB-CB 4.49Å; E430-V433 HydrophobicContact CB-CG2 4.17Å; E430-V433 WeakPolarHBondContact O-CA 3.42Å; E430-V433 WeakPolarHBondContact O-CB 3.25Å; E430-V433 PolarHBondContact O-N 3.42Å; L431-V433 PolarHBondContact O-N 3.36Å; V433-K436 WeakPolarHBondContact O-CB 2.84Å; V433-K436 PolarHBondContact O-N 3.1Å
434	Y	76.5	Confident	73.1	Confident	60 Å²	60	90.6 Å²	90.6	24%	0.235	47%	0.468	C	S	.	.	H	α-helix	trans	-69	-37.1	179.7	-164.5	-95.8	0	0	0	112.9	P429 E430 L431 K436 H447 W451 I454	P429-Y434 HydrophobicContact CB-CD2 4.29Å; P429-Y434 HydrophobicContact CG-CD2 3.58Å; P429-Y434 HydrophobicContact CG-CE2 4.19Å; P429-Y434 HydrophobicContact CG-CG 4.45Å; E430-Y434 PolarHBondContact O-N 3.42Å; L431-Y434 PolarHBondContact O-N 3.38Å; L431-Y434 VanDerWaalsContact O-N 3.12Å; Y434-K436 VanDerWaalsContact C-N 3.31Å; Y434-H447 HydrophobicContact CE1-CB 4.16Å; Y434-H447 WeakPolarHBondContact CE1-O 3.37Å; Y434-W451 HydrophobicContact CD1-CB 3.93Å; Y434-W451 AromaticContact CD1-CD1 3.62Å; Y434-W451 HydrophobicContact CD1-CG 4.1Å; Y434-W451 AromaticContact CD2-CD1 3.85Å; Y434-W451 HydrophobicContact CE1-CB 3.75Å; Y434-W451 HydrophobicContact CE1-CG 4.34Å; Y434-W451 AromaticContact CG-CD1 3.49Å; Y434-W451 VanDerWaalsContact CG-CD1 3.49Å; Y434-W451 HydrophobicContact CG-CG 4.39Å; Y434-I454 HydrophobicContact CE2-CD1 3.77Å
435	F	78.8	Confident	73.7	Confident	34 Å²	34	91 Å²	91	15%	0.149	48%	0.479	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.2	9.2	177.7	-68.6	-72.5	0	0	0	114.3	L431 D437 L438 I444 H447 S448	L431-F435 HydrophobicContact CB-CD2 4.39Å; L431-F435 HydrophobicContact CD2-CD2 3.65Å; L431-F435 HydrophobicContact CD2-CE2 3.36Å; L431-F435 HydrophobicContact CG-CD2 3.96Å; L431-F435 HydrophobicContact CG-CE2 3.68Å; L431-F435 WeakPolarHBondContact O-CD2 3.16Å; L431-F435 PolarHBondContact O-N 3.03Å; F435-D437 PolarHBondContact O-N 3.21Å; F435-L438 HydrophobicContact CD1-CD1 3.69Å; F435-L438 HydrophobicContact CE1-CD1 4.42Å; F435-L438 PolarHBondContact O-N 3.09Å; F435-I444 HydrophobicContact CD1-CG2 4.25Å; F435-I444 HydrophobicContact CE1-CG2 4.15Å; F435-I444 WeakPolarHBondContact CE1-O 3.48Å; F435-H447 HydrophobicContact CD1-CB 4.43Å; F435-H447 HydrophobicContact CE1-CB 3.87Å; F435-S448 VanDerWaalsContact CZ-OG 3.23Å; F435-S448 WeakPolarHBondContact CZ-OG 3.4Å
436	K	80.8	Confident	74.4	Confident	144 Å²	144	91.5 Å²	91.5	63%	0.626	47%	0.473	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.7	133.5	-179.2	-164.9	177.2	175.6	-176.7	0	109.6	P432 V433 Y434 L438	P432-K436 PolarHBondContact O-N 3.05Å; V433-K436 WeakPolarHBondContact O-CB 2.84Å; V433-K436 PolarHBondContact O-N 3.1Å; Y434-K436 VanDerWaalsContact C-N 3.31Å; K436-L438 VanDerWaalsContact C-N 3.27Å; K436-L438 PolarHBondContact O-N 3.31Å
437	D	80.9	Confident	75	Confident	143 Å²	143	87.1 Å²	87.1	77%	0.765	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.9	3.5	179.9	-47.1	-40.6	0	0	0	116.4	F435	F435-D437 PolarHBondContact O-N 3.21Å
438	L	76.9	Confident	75.4	Confident	45 Å²	45	85.2 Å²	85.2	24%	0.236	45%	0.453	C	S	.	.			trans	-86.1	114.3	173.9	-65.5	175.4	0	0	0	111.2	F435 K436 D443 I444 H447	F435-L438 HydrophobicContact CD1-CD1 3.69Å; F435-L438 HydrophobicContact CE1-CD1 4.42Å; F435-L438 PolarHBondContact O-N 3.09Å; K436-L438 VanDerWaalsContact C-N 3.27Å; K436-L438 PolarHBondContact O-N 3.31Å; L438-D443 HydrophobicContact CD2-CB 4.07Å; L438-I444 HydrophobicContact CB-CG1 3.95Å; L438-H447 HydrophobicContact CD1-CB 3.87Å; L438-H447 WeakPolarHBondContact CD1-CD2 3.48Å
439	T	75.6	Confident	75.7	Confident	135 Å²	135	88.2 Å²	88.2	83%	0.828	47%	0.472	S	S	*	.			trans	-108.5	-21.1	-179.9	54	0	0	0	0	113.6
440	N	80.2	Confident	75.9	Confident	69 Å²	69	88.8 Å²	88.8	37%	0.369	47%	0.471	S	S	.	.			trans	-90.2	129	-176.9	174.8	13.3	0	0	0	111.3	L442 D443 I444	N440-L442 VanDerWaalsContact C-N 3.26Å; N440-L442 PolarHBondContact O-N 3.19Å; N440-L442 PolarHBondContact OD1-N 3.01Å; N440-L442 VanDerWaalsContact OD1-N 3.13Å; N440-D443 HydrophobicContact CB-CB 4.2Å; N440-D443 VanDerWaalsContact CB-OD2 3.26Å; N440-D443 WeakPolarHBondContact CB-OD2 3.5Å; N440-D443 PolarHBondContact ND2-OD2 2.81Å; N440-D443 PolarHBondContact O-N 2.95Å; N440-D443 VanDerWaalsContact O-N 3.12Å; N440-I444 WeakPolarHBondContact O-CG1 3.47Å; N440-I444 PolarHBondContact O-N 2.96Å
441	N	77.1	Confident	76.1	Confident	132 Å²	132	84.3 Å²	84.3	71%	0.706	45%	0.448	S	S	*	.	H	α-helix	trans	-59.3	-33.4	-179.6	-70.2	-22.8	0	0	0	113.6	A445	N441-A445 WeakPolarHBondContact O-CB 3.43Å; N441-A445 PolarHBondContact O-N 3.11Å
442	L	74.2	Confident	76	Confident	132 Å²	132	84.6 Å²	84.6	69%	0.691	45%	0.446	S	S	*	.	H	α-helix	trans	-68.5	-42	176.5	-78.7	165.2	0	0	0	111.4	N440 A445 Y446	N440-L442 VanDerWaalsContact C-N 3.26Å; N440-L442 PolarHBondContact O-N 3.19Å; N440-L442 PolarHBondContact OD1-N 3.01Å; N440-L442 VanDerWaalsContact OD1-N 3.13Å; L442-A445 PolarHBondContact O-N 2.87Å; L442-Y446 WeakPolarHBondContact O-CB 3.4Å; L442-Y446 PolarHBondContact O-N 2.89Å
443	D	75.8	Confident	76	Confident	71 Å²	71	83.7 Å²	83.7	38%	0.38	44%	0.442	S	S	.	.	H	α-helix	trans	-68.4	-40.2	178.1	-60.1	-28.2	0	0	0	110.4	L438 N440 A445 Y446 H447	L438-D443 HydrophobicContact CD2-CB 4.07Å; N440-D443 HydrophobicContact CB-CB 4.2Å; N440-D443 VanDerWaalsContact CB-OD2 3.26Å; N440-D443 WeakPolarHBondContact CB-OD2 3.5Å; N440-D443 PolarHBondContact ND2-OD2 2.81Å; N440-D443 PolarHBondContact O-N 2.95Å; N440-D443 VanDerWaalsContact O-N 3.12Å; D443-A445 PolarHBondContact O-N 2.79Å; D443-Y446 PolarHBondContact O-N 3.35Å; D443-H447 WeakPolarHBondContact O-CB 3.39Å; D443-H447 PolarHBondContact O-CD2 2.77Å; D443-H447 PolarHBondContact O-N 2.86Å
444	I	74.2	Confident	75.8	Confident	57 Å²	57	81.9 Å²	81.9	29%	0.292	43%	0.428	S	S	.	.	H	α-helix	trans	-60.3	-44.9	173.2	-65.4	166.2	0	0	0	110.7	F435 L438 N440 S448	F435-I444 HydrophobicContact CD1-CG2 4.25Å; F435-I444 HydrophobicContact CE1-CG2 4.15Å; F435-I444 WeakPolarHBondContact CE1-O 3.48Å; L438-I444 HydrophobicContact CB-CG1 3.95Å; N440-I444 WeakPolarHBondContact O-CG1 3.47Å; N440-I444 PolarHBondContact O-N 2.96Å; I444-S448 VanDerWaalsContact O-CB 3.23Å; I444-S448 WeakPolarHBondContact O-CB 3.16Å; I444-S448 PolarHBondContact O-N 2.73Å; I444-S448 PolarHBondContact O-OG 2.8Å
445	A	72.5	Confident	75.3	Confident	56 Å²	56	80.2 Å²	80.2	46%	0.463	42%	0.424	S	S	.	.	H	α-helix	trans	-64.3	-44.3	178.7	0	0	0	0	0	111.9	N441 L442 D443 S448 T449	N441-A445 WeakPolarHBondContact O-CB 3.43Å; N441-A445 PolarHBondContact O-N 3.11Å; L442-A445 PolarHBondContact O-N 2.87Å; D443-A445 PolarHBondContact O-N 2.79Å; A445-S448 WeakPolarHBondContact O-CB 3.23Å; A445-S448 PolarHBondContact O-N 2.88Å; A445-T449 PolarHBondContact O-N 2.84Å
446	Y	75.6	Confident	74.8	Confident	133 Å²	133	84.9 Å²	84.9	52%	0.522	45%	0.446	S	S	.	.	H	α-helix	trans	-60.5	-55.1	175.7	176.3	-95.6	0	0	0	111	L442 D443 S448 T449 E450	L442-Y446 WeakPolarHBondContact O-CB 3.4Å; L442-Y446 PolarHBondContact O-N 2.89Å; D443-Y446 PolarHBondContact O-N 3.35Å; Y446-S448 PolarHBondContact O-N 3.08Å; Y446-T449 PolarHBondContact O-N 3.4Å; Y446-T449 PolarHBondContact O-OG1 3.47Å; Y446-E450 VanDerWaalsContact CE1-CD 3.4Å; Y446-E450 HydrophobicContact CE1-CG 4.09Å; Y446-E450 WeakPolarHBondContact CE1-OE1 3.07Å; Y446-E450 VanDerWaalsContact CZ-OE1 3.29Å; Y446-E450 PolarHBondContact O-N 2.85Å; Y446-E450 PolarHBondContact OH-OE1 2.81Å
447	H	75.6	Confident	74.2	Confident	53 Å²	53	84.9 Å²	84.9	25%	0.245	45%	0.446	C	S	.	.	H	α-helix	trans	-64.9	-24.9	179.6	-72.2	-59.3	0	0	0	113.3	Y434 F435 L438 D443 T449 E450 W451	Y434-H447 HydrophobicContact CE1-CB 4.16Å; Y434-H447 WeakPolarHBondContact CE1-O 3.37Å; F435-H447 HydrophobicContact CD1-CB 4.43Å; F435-H447 HydrophobicContact CE1-CB 3.87Å; L438-H447 HydrophobicContact CD1-CB 3.87Å; L438-H447 WeakPolarHBondContact CD1-CD2 3.48Å; D443-H447 WeakPolarHBondContact O-CB 3.39Å; D443-H447 PolarHBondContact O-CD2 2.77Å; D443-H447 PolarHBondContact O-N 2.86Å; H447-T449 VanDerWaalsContact C-N 3.34Å; H447-E450 IonicContact CE1-OE2 3.85Å; H447-E450 IonicContact CG-OE2 3.65Å; H447-E450 IonicContact ND1-OE2 3.79Å; H447-E450 PolarHBondContact ND1-OE2 2.83Å; H447-E450 PolarHBondContact O-N 2.88Å; H447-W451 WeakPolarHBondContact O-CB 3.47Å; H447-W451 PolarHBondContact O-N 3Å
448	S	74.9	Confident	73.4	Confident	38 Å²	38	78.2 Å²	78.2	27%	0.266	41%	0.411	S	S	.	.	H	α-helix	trans	-65.4	-35.1	170.1	-63.7	0	0	0	0	113.1	F435 I444 A445 Y446 K452	F435-S448 VanDerWaalsContact CZ-OG 3.23Å; F435-S448 WeakPolarHBondContact CZ-OG 3.4Å; I444-S448 VanDerWaalsContact O-CB 3.23Å; I444-S448 WeakPolarHBondContact O-CB 3.16Å; I444-S448 PolarHBondContact O-N 2.73Å; I444-S448 PolarHBondContact O-OG 2.8Å; A445-S448 WeakPolarHBondContact O-CB 3.23Å; A445-S448 PolarHBondContact O-N 2.88Å; Y446-S448 PolarHBondContact O-N 3.08Å; S448-K452 VanDerWaalsContact O-CG 3.3Å; S448-K452 WeakPolarHBondContact O-CG 3.37Å; S448-K452 PolarHBondContact O-N 2.92Å; S448-K452 VanDerWaalsContact O-N 3.13Å
449	T	75.2	Confident	72.6	Confident	85 Å²	85	79.6 Å²	79.6	52%	0.521	42%	0.424	S	S	.	.	H	α-helix	trans	-72.8	-38.1	175.4	62.8	0	0	0	0	111.5	A445 Y446 H447 K452 S453	A445-T449 PolarHBondContact O-N 2.84Å; Y446-T449 PolarHBondContact O-N 3.4Å; Y446-T449 PolarHBondContact O-OG1 3.47Å; H447-T449 VanDerWaalsContact C-N 3.34Å; T449-K452 PolarHBondContact O-N 3.49Å; T449-S453 PolarHBondContact O-N 3.39Å; T449-S453 VanDerWaalsContact O-N 3.12Å
450	E	76.6	Confident	71.9	Confident	64 Å²	64	77.3 Å²	77.3	30%	0.299	41%	0.41	S	S	.	.	H	α-helix	trans	-60.9	-48.5	171.6	-71.1	-175.4	153.6	0	0	111.9	Y446 H447 K452 S453 I454	Y446-E450 VanDerWaalsContact CE1-CD 3.4Å; Y446-E450 HydrophobicContact CE1-CG 4.09Å; Y446-E450 WeakPolarHBondContact CE1-OE1 3.07Å; Y446-E450 VanDerWaalsContact CZ-OE1 3.29Å; Y446-E450 PolarHBondContact O-N 2.85Å; Y446-E450 PolarHBondContact OH-OE1 2.81Å; H447-E450 IonicContact CE1-OE2 3.85Å; H447-E450 IonicContact CG-OE2 3.65Å; H447-E450 IonicContact ND1-OE2 3.79Å; H447-E450 PolarHBondContact ND1-OE2 2.83Å; H447-E450 PolarHBondContact O-N 2.88Å; E450-K452 VanDerWaalsContact C-N 3.31Å; E450-K452 PolarHBondContact O-N 3.42Å; E450-S453 WeakPolarHBondContact O-CA 3.42Å; E450-S453 VanDerWaalsContact O-CB 3.28Å; E450-S453 WeakPolarHBondContact O-CB 3.29Å; E450-S453 PolarHBondContact O-N 3.01Å; E450-I454 WeakPolarHBondContact O-CG1 3.16Å; E450-I454 PolarHBondContact O-N 3.48Å
451	W	75.2	Confident	70.7	Confident	43 Å²	43	78 Å²	78	16%	0.163	41%	0.413	C	S	.	.	H	α-helix	trans	-59.3	-41.4	178.5	-170.7	87.5	0	0	0	111.8	I428 P429 L431 Y434 H447 S453 I454 V455	I428-W451 HydrophobicContact CG2-CH2 4.37Å; I428-W451 HydrophobicContact CG2-CZ2 3.45Å; I428-W451 VanDerWaalsContact CG2-CZ2 3.45Å; P429-W451 PolarHBondContact O-NE1 3.4Å; L431-W451 HydrophobicContact CD1-CD2 4.13Å; L431-W451 HydrophobicContact CD1-CE3 4.04Å; L431-W451 HydrophobicContact CD1-CH2 3.36Å; L431-W451 HydrophobicContact CD1-CZ2 3.47Å; L431-W451 VanDerWaalsContact CD1-CZ2 3.47Å; L431-W451 HydrophobicContact CD1-CZ3 3.65Å; L431-W451 HydrophobicContact CG-CZ2 4.31Å; Y434-W451 HydrophobicContact CD1-CB 3.93Å; Y434-W451 AromaticContact CD1-CD1 3.62Å; Y434-W451 HydrophobicContact CD1-CG 4.1Å; Y434-W451 AromaticContact CD2-CD1 3.85Å; Y434-W451 HydrophobicContact CE1-CB 3.75Å; Y434-W451 HydrophobicContact CE1-CG 4.34Å; Y434-W451 AromaticContact CG-CD1 3.49Å; Y434-W451 VanDerWaalsContact CG-CD1 3.49Å; Y434-W451 HydrophobicContact CG-CG 4.39Å; H447-W451 WeakPolarHBondContact O-CB 3.47Å; H447-W451 PolarHBondContact O-N 3Å; W451-S453 VanDerWaalsContact C-N 3.32Å; W451-S453 PolarHBondContact O-N 2.76Å; W451-I454 WeakPolarHBondContact O-CB 3.28Å; W451-I454 PolarHBondContact O-N 3.37Å; W451-I454 VanDerWaalsContact O-N 3.09Å; W451-V455 HydrophobicContact CD2-CG2 3.91Å; W451-V455 HydrophobicContact CE3-CG2 3.66Å; W451-V455 HydrophobicContact CH2-CG2 3.43Å; W451-V455 VanDerWaalsContact CH2-CG2 3.43Å; W451-V455 HydrophobicContact CZ2-CG2 3.67Å; W451-V455 HydrophobicContact CZ3-CG2 3.44Å; W451-V455 VanDerWaalsContact CZ3-CG2 3.44Å; W451-V455 WeakPolarHBondContact O-CG2 3.44Å; W451-V455 PolarHBondContact O-N 3.01Å
452	K	67	Low	69.6	Low	89 Å²	89	76.1 Å²	76.1	39%	0.387	41%	0.409	S	S	.	.	H	α-helix	trans	-59.4	-40.8	173.7	-76.5	176	-177.2	-173.9	0	112.7	P14 S448 T449 E450 I454 V455 H456	P14-K452 HydrophobicContact CG-CD 4.01Å; P14-K452 HydrophobicContact CG-CG 4.31Å; S448-K452 VanDerWaalsContact O-CG 3.3Å; S448-K452 WeakPolarHBondContact O-CG 3.37Å; S448-K452 PolarHBondContact O-N 2.92Å; S448-K452 VanDerWaalsContact O-N 3.13Å; T449-K452 PolarHBondContact O-N 3.49Å; E450-K452 VanDerWaalsContact C-N 3.31Å; E450-K452 PolarHBondContact O-N 3.42Å; K452-I454 VanDerWaalsContact C-N 3.3Å; K452-I454 PolarHBondContact O-N 3.45Å; K452-V455 PolarHBondContact O-N 3.26Å; K452-H456 WeakPolarHBondContact O-CB 3.28Å; K452-H456 PolarHBondContact O-N 3.13Å
453	S	73.9	Confident	68.7	Low	81 Å²	81	73 Å²	73	57%	0.566	39%	0.392	S	S	*	.	H	α-helix	trans	-61.1	-40.3	174.9	-173.4	0	0	0	0	111.4	T449 E450 W451 K457	T449-S453 PolarHBondContact O-N 3.39Å; T449-S453 VanDerWaalsContact O-N 3.12Å; E450-S453 WeakPolarHBondContact O-CA 3.42Å; E450-S453 VanDerWaalsContact O-CB 3.28Å; E450-S453 WeakPolarHBondContact O-CB 3.29Å; E450-S453 PolarHBondContact O-N 3.01Å; W451-S453 VanDerWaalsContact C-N 3.32Å; W451-S453 PolarHBondContact O-N 2.76Å; S453-K457 VanDerWaalsContact O-CB 3.26Å; S453-K457 WeakPolarHBondContact O-CB 3.21Å; S453-K457 PolarHBondContact O-N 3.26Å
454	I	73.5	Confident	67.2	Low	56 Å²	56	76.2 Å²	76.2	29%	0.287	41%	0.409	S	S	.	.	H	α-helix	trans	-62.8	-47.4	175.2	-62.7	169.2	0	0	0	111	Y434 E450 W451 K452 K457 A458	Y434-I454 HydrophobicContact CE2-CD1 3.77Å; E450-I454 WeakPolarHBondContact O-CG1 3.16Å; E450-I454 PolarHBondContact O-N 3.48Å; W451-I454 WeakPolarHBondContact O-CB 3.28Å; W451-I454 PolarHBondContact O-N 3.37Å; W451-I454 VanDerWaalsContact O-N 3.09Å; K452-I454 VanDerWaalsContact C-N 3.3Å; K452-I454 PolarHBondContact O-N 3.45Å; I454-K457 PolarHBondContact O-N 3.24Å; I454-A458 WeakPolarHBondContact O-CB 3.49Å; I454-A458 PolarHBondContact O-N 2.67Å
455	V	67.5	Low	65.9	Low	25 Å²	25	80.9 Å²	80.9	15%	0.152	43%	0.434	C	S	.	.	H	α-helix	trans	-61	-48	178.4	176	0	0	0	0	111.9	M424 I428 W451 K452 K457 A458 S459	M424-V455 HydrophobicContact CE-CG1 4.39Å; I428-V455 HydrophobicContact CD1-CB 4.17Å; I428-V455 HydrophobicContact CD1-CG1 3.97Å; I428-V455 HydrophobicContact CD1-CG2 3.92Å; I428-V455 HydrophobicContact CG1-CG2 4.16Å; I428-V455 HydrophobicContact CG2-CG2 3.76Å; W451-V455 HydrophobicContact CD2-CG2 3.91Å; W451-V455 HydrophobicContact CE3-CG2 3.66Å; W451-V455 HydrophobicContact CH2-CG2 3.43Å; W451-V455 VanDerWaalsContact CH2-CG2 3.43Å; W451-V455 HydrophobicContact CZ2-CG2 3.67Å; W451-V455 HydrophobicContact CZ3-CG2 3.44Å; W451-V455 VanDerWaalsContact CZ3-CG2 3.44Å; W451-V455 WeakPolarHBondContact O-CG2 3.44Å; W451-V455 PolarHBondContact O-N 3.01Å; K452-V455 PolarHBondContact O-N 3.26Å; V455-K457 VanDerWaalsContact C-N 3.3Å; V455-K457 PolarHBondContact O-N 3.44Å; V455-A458 PolarHBondContact O-N 3.28Å; V455-S459 PolarHBondContact O-N 2.84Å; V455-S459 PolarHBondContact O-OG 3.39Å
456	H	66.6	Low	64.9	Low	132 Å²	132	82.3 Å²	82.3	61%	0.611	44%	0.437	S	S	*	.	H	α-helix	trans	-63.6	-37.3	179	-174.3	-75.1	0	0	0	111.9	K452 S459 T460	K452-H456 WeakPolarHBondContact O-CB 3.28Å; K452-H456 PolarHBondContact O-N 3.13Å; H456-S459 PolarHBondContact O-OG 3.16Å; H456-T460 WeakPolarHBondContact O-CG2 3.35Å; H456-T460 PolarHBondContact O-N 3.07Å; H456-T460 PolarHBondContact O-OG1 3.25Å
457	K	69.1	Low	63.6	Low	143 Å²	143	83.4 Å²	83.4	62%	0.622	45%	0.451	S	S	*	.	H	α-helix	trans	-68.7	-38.9	174.3	-164.7	175.3	-178.5	-178.7	0	111.4	S453 I454 V455 T460 I461	S453-K457 VanDerWaalsContact O-CB 3.26Å; S453-K457 WeakPolarHBondContact O-CB 3.21Å; S453-K457 PolarHBondContact O-N 3.26Å; I454-K457 PolarHBondContact O-N 3.24Å; V455-K457 VanDerWaalsContact C-N 3.3Å; V455-K457 PolarHBondContact O-N 3.44Å; K457-T460 PolarHBondContact O-N 3.35Å; K457-T460 PolarHBondContact O-OG1 3.01Å; K457-I461 WeakPolarHBondContact O-CG1 3.43Å; K457-I461 PolarHBondContact O-N 3.35Å
458	A	63.9	Low	62.6	Low	3 Å²	3	86.5 Å²	86.5	3%	0.025	48%	0.476	C	S	.	.	H	α-helix	trans	-66.6	-38.2	178.8	0	0	0	0	0	113.2	R427 I428 I454 V455 T460	R427-A458 HydrophobicContact CB-CB 3.69Å; R427-A458 PolarHBondContact NH1-O 2.68Å; I428-A458 HydrophobicContact CD1-CB 3.96Å; I428-A458 HydrophobicContact CG1-CB 3.66Å; I454-A458 WeakPolarHBondContact O-CB 3.49Å; I454-A458 PolarHBondContact O-N 2.67Å; V455-A458 PolarHBondContact O-N 3.28Å; A458-T460 VanDerWaalsContact C-N 3.28Å; A458-T460 PolarHBondContact O-N 2.63Å
459	S	61.2	Low	62.1	Low	74 Å²	74	86.3 Å²	86.3	52%	0.517	48%	0.475	S	S	.	.	H	α-helix	trans	-71.6	-19.7	178.4	66.1	0	0	0	0	113.8	V455 H456	V455-S459 PolarHBondContact O-N 2.84Å; V455-S459 PolarHBondContact O-OG 3.39Å; H456-S459 PolarHBondContact O-OG 3.16Å
460	T	60.6	Low	62	Low	87 Å²	87	88.4 Å²	88.4	53%	0.534	48%	0.481	S	S	.	.	H	α-helix	trans	-94	-10.6	179.8	47.7	0	0	0	0	113.7	H456 K457 A458 P462	H456-T460 WeakPolarHBondContact O-CG2 3.35Å; H456-T460 PolarHBondContact O-N 3.07Å; H456-T460 PolarHBondContact O-OG1 3.25Å; K457-T460 PolarHBondContact O-N 3.35Å; K457-T460 PolarHBondContact O-OG1 3.01Å; A458-T460 VanDerWaalsContact C-N 3.28Å; A458-T460 PolarHBondContact O-N 2.63Å; T460-P462 WeakPolarHBondContact O-CD 3.17Å
461	I	55.1	Low	61.7	Low	83 Å²	83	90.9 Å²	90.9	43%	0.426	49%	0.493	S	S	.	.	S	Bend	trans	-77.7	119.6	176.9	-65	161.9	0	0	0	108.9	R427 K457	R427-I461 PolarHBondContact NH1-O 2.99Å; K457-I461 WeakPolarHBondContact O-CG1 3.43Å; K457-I461 PolarHBondContact O-N 3.35Å
462	P	54.1	Low	61.3	Low	94 Å²	94	91.8 Å²	91.8	61%	0.61	50%	0.497	S	S	*	.			trans	-59.6	153.4	177.9	22.9	-31.8	0	0	0	111.9	R427 T460	R427-P462 PolarHBondContact NH2-O 3.43Å; T460-P462 WeakPolarHBondContact O-CD 3.17Å
463	I	54.1	Low	61.6	Low	67 Å²	67	90.7 Å²	90.7	34%	0.344	50%	0.5	S	S	.	.			trans	-95	102	-178.6	-55.2	173	0	0	0	107.3	L419 T423 V466	L419-I463 HydrophobicContact CD1-CG2 3.97Å; L419-I463 HydrophobicContact CD2-CB 4.36Å; L419-I463 HydrophobicContact CD2-CD1 3.41Å; L419-I463 VanDerWaalsContact CD2-CD1 3.41Å; L419-I463 HydrophobicContact CD2-CG1 4.46Å; L419-I463 HydrophobicContact CD2-CG2 3.99Å; L419-I463 HydrophobicContact CG-CD1 3.83Å; L419-I463 HydrophobicContact CG-CG2 4.07Å; T423-I463 HydrophobicContact CG2-CD1 4.05Å; T423-I463 HydrophobicContact CG2-CG1 4.06Å; T423-I463 HydrophobicContact CG2-CG2 3.94Å; I463-V466 HydrophobicContact CG2-CG2 4.33Å
464	D	44.7	Very low	61.7	Low	137 Å²	137	92.1 Å²	92.1	73%	0.733	50%	0.498	S	S	*	.			trans	-75.1	137.3	177.8	-68.1	-31.5	0	0	0	111.1
465	N	46.8	Very low	61.6	Low	155 Å²	155	91.1 Å²	91.1	83%	0.829	49%	0.493	S	S	*	.			trans	63.3	62.3	168.7	-64.2	-21.2	0	0	0	117.5	L467	N465-L467 PolarHBondContact O-N 2.85Å
466	V	52.5	Low	61.9	Low	87 Å²	87	96.5 Å²	96.5	53%	0.527	51%	0.51	S	S	.	.			trans	-76.6	103.4	157.5	-171.7	0	0	0	0	108.4	L419 I463	L419-V466 HydrophobicContact CD1-CG2 3.65Å; L419-V466 HydrophobicContact CD2-CG2 3.99Å; L419-V466 HydrophobicContact CG-CG2 4.49Å; I463-V466 HydrophobicContact CG2-CG2 4.33Å
467	L	48.8	Very low	62.2	Low	156 Å²	156	95.2 Å²	95.2	82%	0.817	51%	0.508	S	S	*	.	P	Polyproline II helix	trans	-63.8	129.2	171.6	-80.7	153.3	0	0	0	109	N465 S469	N465-L467 PolarHBondContact O-N 2.85Å; L467-S469 PolarHBondContact O-N 3.17Å
468	P	53.4	Low	62.4	Low	118 Å²	118	94.6 Å²	94.6	77%	0.766	51%	0.505	S	S	*	.	P	Polyproline II helix	trans	-61.8	124.6	177.9	23	-30.8	0	0	0	109.9
469	S	65.4	Low	62.7	Low	33 Å²	33	94.7 Å²	94.7	23%	0.231	51%	0.505	C	S	.	.	P	Polyproline II helix	trans	-74.7	139.2	-179.3	74.9	0	0	0	0	111	Y411 L467 E471 Y472 S473	Y411-S469 VanDerWaalsContact CE1-OG 3.28Å; Y411-S469 WeakPolarHBondContact CE1-OG 3.46Å; Y411-S469 VanDerWaalsContact CZ-OG 3.32Å; Y411-S469 VanDerWaalsContact OH-CB 3.24Å; Y411-S469 WeakPolarHBondContact OH-CB 3.25Å; Y411-S469 PolarHBondContact OH-OG 2.99Å; L467-S469 PolarHBondContact O-N 3.17Å; S469-E471 PolarHBondContact O-N 2.95Å; S469-Y472 PolarHBondContact O-N 3.16Å; S469-Y472 VanDerWaalsContact OG-CB 3.29Å; S469-Y472 WeakPolarHBondContact OG-CB 3.49Å; S469-Y472 PolarHBondContact OG-N 3.46Å; S469-Y472 VanDerWaalsContact OG-N 3.13Å; S469-S473 PolarHBondContact O-N 3.45Å
470	I	73.1	Confident	63.1	Low	129 Å²	129	95.5 Å²	95.5	66%	0.662	50%	0.504	S	S	*	.	H	α-helix	trans	-58.4	-37.5	175.5	-66.6	168.1	0	0	0	110	Y472 S473 Q474	I470-Y472 PolarHBondContact O-N 2.93Å; I470-S473 WeakPolarHBondContact CA-OG 3.5Å; I470-S473 PolarHBondContact O-N 3.5Å; I470-S473 PolarHBondContact O-OG 3.34Å; I470-Q474 WeakPolarHBondContact O-CG 3.38Å; I470-Q474 PolarHBondContact O-N 3.21Å
471	E	68.9	Low	63.5	Low	116 Å²	116	95.5 Å²	95.5	54%	0.542	50%	0.499	S	S	.	.	H	α-helix	trans	-61.1	-43.4	177.5	-67.4	172.8	161.8	0	0	112.6	Y411 S469 Q474 L475	Y411-E471 HydrophobicContact CE2-CB 3.79Å; Y411-E471 WeakPolarHBondContact CE2-OE2 3.36Å; Y411-E471 WeakPolarHBondContact OH-CB 3.48Å; Y411-E471 PolarHBondContact OH-OE2 2.94Å; S469-E471 PolarHBondContact O-N 2.95Å; E471-Q474 PolarHBondContact O-N 3.07Å; E471-L475 WeakPolarHBondContact O-CG 3.49Å; E471-L475 PolarHBondContact O-N 3.36Å
472	Y	68.6	Low	63.9	Low	63 Å²	63	92 Å²	92	25%	0.247	48%	0.483	C	S	.	.	H	α-helix	trans	-64.3	-42.3	175.4	-178.2	-112.4	0	0	0	111.5	E408 Y411 L412 S469 I470 Q474 L475 R476	E408-Y472 HydrophobicContact CG-CD2 4.32Å; E408-Y472 HydrophobicContact CG-CE2 3.65Å; E408-Y472 PolarHBondContact OE1-OH 2.91Å; Y411-Y472 AromaticContact CD1-CD2 3.99Å; Y411-Y472 HydrophobicContact CD1-CD2 3.99Å; Y411-Y472 HydrophobicContact CD1-CG 4.47Å; Y411-Y472 HydrophobicContact CE1-CD2 4.48Å; L412-Y472 HydrophobicContact CD1-CE2 3.77Å; L412-Y472 HydrophobicContact CD2-CD2 3.9Å; L412-Y472 HydrophobicContact CD2-CE2 3.45Å; L412-Y472 VanDerWaalsContact CD2-CE2 3.45Å; L412-Y472 HydrophobicContact CG-CD2 4.14Å; L412-Y472 HydrophobicContact CG-CE2 3.56Å; S469-Y472 PolarHBondContact O-N 3.16Å; S469-Y472 VanDerWaalsContact OG-CB 3.29Å; S469-Y472 WeakPolarHBondContact OG-CB 3.49Å; S469-Y472 PolarHBondContact OG-N 3.46Å; S469-Y472 VanDerWaalsContact OG-N 3.13Å; I470-Y472 PolarHBondContact O-N 2.93Å; Y472-Q474 PolarHBondContact O-N 3.31Å; Y472-L475 PolarHBondContact O-N 3.3Å; Y472-R476 WeakPolarHBondContact O-CB 3.49Å; Y472-R476 PolarHBondContact O-N 3.3Å
473	S	72.8	Confident	64.1	Low	65 Å²	65	91.5 Å²	91.5	46%	0.455	47%	0.471	S	S	.	.	H	α-helix	trans	-61.3	-34.9	178	71.4	0	0	0	0	112.5	S469 I470 L477	S469-S473 PolarHBondContact O-N 3.45Å; I470-S473 WeakPolarHBondContact CA-OG 3.5Å; I470-S473 PolarHBondContact O-N 3.5Å; I470-S473 PolarHBondContact O-OG 3.34Å; S473-L477 VanDerWaalsContact O-CB 3.27Å; S473-L477 WeakPolarHBondContact O-CB 3.37Å; S473-L477 PolarHBondContact O-N 2.98Å
474	Q	75.5	Confident	64.4	Low	112 Å²	112	94.9 Å²	94.9	52%	0.523	48%	0.483	S	S	.	.	H	α-helix	trans	-72.1	-41.2	174.8	-71.4	179.6	-2.5	0	0	112.7	I470 E471 Y472 L477 K478	I470-Q474 WeakPolarHBondContact O-CG 3.38Å; I470-Q474 PolarHBondContact O-N 3.21Å; E471-Q474 PolarHBondContact O-N 3.07Å; Y472-Q474 PolarHBondContact O-N 3.31Å; Q474-L477 PolarHBondContact O-N 2.95Å; Q474-K478 WeakPolarHBondContact O-CG 3.46Å; Q474-K478 PolarHBondContact O-N 3.38Å
475	L	72.1	Confident	64.9	Low	34 Å²	34	92.9 Å²	92.9	18%	0.178	47%	0.472	C	S	.	.	H	α-helix	trans	-61.5	-49.9	175.5	-76.8	169	0	0	0	110.7	N407 E408 Y411 E471 Y472 L477 K478 T479	N407-L475 HydrophobicContact CB-CD2 3.9Å; E408-L475 HydrophobicContact CB-CB 4.5Å; Y411-L475 HydrophobicContact CD1-CD1 4.36Å; Y411-L475 HydrophobicContact CD2-CD1 3.89Å; Y411-L475 HydrophobicContact CG-CD1 3.68Å; E471-L475 WeakPolarHBondContact O-CG 3.49Å; E471-L475 PolarHBondContact O-N 3.36Å; Y472-L475 PolarHBondContact O-N 3.3Å; L475-L477 VanDerWaalsContact C-N 3.33Å; L475-L477 PolarHBondContact O-N 3.49Å; L475-K478 WeakPolarHBondContact O-CB 3.25Å; L475-K478 PolarHBondContact O-N 3.28Å; L475-K478 VanDerWaalsContact O-N 3.12Å; L475-T479 PolarHBondContact O-N 3.42Å; L475-T479 PolarHBondContact O-OG1 2.81Å; L475-T479 VanDerWaalsContact O-OG1 3.1Å
476	R	72.4	Confident	65.2	Low	138 Å²	138	88.5 Å²	88.5	52%	0.521	45%	0.449	S	S	.	.	H	α-helix	trans	-57.9	-44.2	176.6	-175.8	178.4	174.5	-177.5	2.6	112.2	Y472 K478 T479 D480	Y472-R476 WeakPolarHBondContact O-CB 3.49Å; Y472-R476 PolarHBondContact O-N 3.3Å; R476-K478 VanDerWaalsContact C-N 3.32Å; R476-K478 PolarHBondContact O-N 3.12Å; R476-T479 WeakPolarHBondContact O-CB 3.15Å; R476-T479 PolarHBondContact O-N 3.01Å; R476-D480 PolarHBondContact O-N 3.27Å
477	L	73.1	Confident	64.8	Low	106 Å²	106	89 Å²	89	56%	0.555	46%	0.455	S	S	*	.	H	α-helix	trans	-65.3	-34.9	178.7	-166	144.3	0	0	0	112	S473 Q474 L475 I481	S473-L477 VanDerWaalsContact O-CB 3.27Å; S473-L477 WeakPolarHBondContact O-CB 3.37Å; S473-L477 PolarHBondContact O-N 2.98Å; Q474-L477 PolarHBondContact O-N 2.95Å; L475-L477 VanDerWaalsContact C-N 3.33Å; L475-L477 PolarHBondContact O-N 3.49Å; L477-I481 HydrophobicContact CD2-CD1 3.56Å; L477-I481 HydrophobicContact CD2-CG1 4.35Å; L477-I481 VanDerWaalsContact O-CG1 3.29Å; L477-I481 WeakPolarHBondContact O-CG1 3.34Å; L477-I481 PolarHBondContact O-N 2.86Å
478	K	74.4	Confident	64.2	Low	130 Å²	130	88.1 Å²	88.1	57%	0.565	45%	0.445	S	S	*	.	H	α-helix	trans	-66.2	-43.6	171.4	-75.3	177.1	-179.9	177.6	0	111.8	Q474 L475 R476 I481 S482	Q474-K478 WeakPolarHBondContact O-CG 3.46Å; Q474-K478 PolarHBondContact O-N 3.38Å; L475-K478 WeakPolarHBondContact O-CB 3.25Å; L475-K478 PolarHBondContact O-N 3.28Å; L475-K478 VanDerWaalsContact O-N 3.12Å; R476-K478 VanDerWaalsContact C-N 3.32Å; R476-K478 PolarHBondContact O-N 3.12Å; K478-I481 PolarHBondContact O-N 3.49Å; K478-S482 WeakPolarHBondContact O-CB 3.47Å; K478-S482 PolarHBondContact O-N 2.87Å
479	T	69.4	Low	63.6	Low	5 Å²	5	86.1 Å²	86.1	3%	0.031	43%	0.43	C	S	.	.	H	α-helix	trans	-58.1	-48	174.3	-55.3	0	0	0	0	110.8	L405 E408 L475 R476 I481 S482 F483	L405-T479 HydrophobicContact CD2-CG2 3.86Å; L405-T479 HydrophobicContact CG-CG2 4.28Å; E408-T479 VanDerWaalsContact OE2-CB 3.27Å; E408-T479 WeakPolarHBondContact OE2-CB 3.46Å; E408-T479 WeakPolarHBondContact OE2-CG2 3.32Å; E408-T479 PolarHBondContact OE2-OG1 3.41Å; L475-T479 PolarHBondContact O-N 3.42Å; L475-T479 PolarHBondContact O-OG1 2.81Å; L475-T479 VanDerWaalsContact O-OG1 3.1Å; R476-T479 WeakPolarHBondContact O-CB 3.15Å; R476-T479 PolarHBondContact O-N 3.01Å; T479-I481 PolarHBondContact O-N 3.32Å; T479-S482 WeakPolarHBondContact O-CB 3.34Å; T479-S482 PolarHBondContact O-N 3.49Å; T479-F483 HydrophobicContact CG2-CD2 3.76Å; T479-F483 HydrophobicContact CG2-CE2 3.61Å; T479-F483 VanDerWaalsContact O-CD2 3.29Å; T479-F483 WeakPolarHBondContact O-CD2 3.4Å; T479-F483 PolarHBondContact O-N 2.9Å
480	D	69.8	Low	61.9	Low	90 Å²	90	90.2 Å²	90.2	48%	0.481	45%	0.45	S	S	.	.	H	α-helix	trans	-60.7	-44	178.3	-73.6	-19.6	0	0	0	112.3	R476 F483 K484	R476-D480 PolarHBondContact O-N 3.27Å; D480-F483 PolarHBondContact O-N 3Å; D480-K484 WeakPolarHBondContact O-CB 3.43Å; D480-K484 PolarHBondContact O-N 3.1Å
481	I	69.6	Low	60	Low	87 Å²	87	92.5 Å²	92.5	45%	0.446	46%	0.461	S	S	.	.	H	α-helix	trans	-63.2	-42.8	174.8	-69.8	170.3	0	0	0	110.9	L477 K478 T479 F483 K484 N485	L477-I481 HydrophobicContact CD2-CD1 3.56Å; L477-I481 HydrophobicContact CD2-CG1 4.35Å; L477-I481 VanDerWaalsContact O-CG1 3.29Å; L477-I481 WeakPolarHBondContact O-CG1 3.34Å; L477-I481 PolarHBondContact O-N 2.86Å; K478-I481 PolarHBondContact O-N 3.49Å; T479-I481 PolarHBondContact O-N 3.32Å; I481-F483 PolarHBondContact O-N 3.42Å; I481-K484 WeakPolarHBondContact O-CB 3.41Å; I481-K484 PolarHBondContact O-N 3.33Å; I481-N485 PolarHBondContact O-N 3.37Å
482	S	63	Low	58	Low	11 Å²	11	90.5 Å²	90.5	8%	0.077	46%	0.46	C	S	.	.	H	α-helix	trans	-63.1	-42.1	179.8	-163.5	0	0	0	0	111.7	T401 K478 T479 N485 L486	T401-S482 WeakPolarHBondContact CA-OG 3.48Å; T401-S482 WeakPolarHBondContact CB-OG 3.39Å; T401-S482 PolarHBondContact N-OG 2.88Å; T401-S482 PolarHBondContact OG1-OG 3.39Å; K478-S482 WeakPolarHBondContact O-CB 3.47Å; K478-S482 PolarHBondContact O-N 2.87Å; T479-S482 WeakPolarHBondContact O-CB 3.34Å; T479-S482 PolarHBondContact O-N 3.49Å; S482-N485 PolarHBondContact O-N 2.99Å; S482-L486 WeakPolarHBondContact O-CB 3.27Å; S482-L486 PolarHBondContact O-N 3.21Å
483	F	58.7	Low	56	Low	83 Å²	83	94.8 Å²	94.8	36%	0.364	49%	0.487	S	S	.	.	H	α-helix	trans	-63.3	-42.1	172.2	-86.2	-69.3	0	0	0	112.2	T401 L405 T479 D480 I481 N485 L486 C487	T401-F483 HydrophobicContact CG2-CD1 4.07Å; T401-F483 HydrophobicContact CG2-CD2 4.23Å; T401-F483 HydrophobicContact CG2-CE1 3.91Å; T401-F483 HydrophobicContact CG2-CE2 4.06Å; T401-F483 HydrophobicContact CG2-CG 4.23Å; T401-F483 HydrophobicContact CG2-CZ 3.91Å; L405-F483 HydrophobicContact CD1-CE2 4.36Å; L405-F483 HydrophobicContact CD1-CZ 4.02Å; L405-F483 HydrophobicContact CD2-CE2 4.08Å; L405-F483 HydrophobicContact CD2-CZ 4.39Å; L405-F483 HydrophobicContact CG-CE2 4.32Å; L405-F483 HydrophobicContact CG-CZ 4.48Å; T479-F483 HydrophobicContact CG2-CD2 3.76Å; T479-F483 HydrophobicContact CG2-CE2 3.61Å; T479-F483 VanDerWaalsContact O-CD2 3.29Å; T479-F483 WeakPolarHBondContact O-CD2 3.4Å; T479-F483 PolarHBondContact O-N 2.9Å; D480-F483 PolarHBondContact O-N 3Å; I481-F483 PolarHBondContact O-N 3.42Å; F483-N485 VanDerWaalsContact C-N 3.31Å; F483-N485 PolarHBondContact O-N 2.87Å; F483-L486 WeakPolarHBondContact O-CB 3.44Å; F483-L486 PolarHBondContact O-N 3.22Å; F483-C487 PolarHBondContact O-N 2.97Å; F483-C487 PolarHBondContact O-SG 2.83Å
484	K	59.2	Low	53.9	Low	137 Å²	137	100.4 Å²	100.4	60%	0.596	51%	0.506	S	S	*	.	H	α-helix	trans	-60.9	-41.2	176.6	-165.5	178.2	-179.6	-177.8	0	111.6	D480 I481 C487 F488	D480-K484 WeakPolarHBondContact O-CB 3.43Å; D480-K484 PolarHBondContact O-N 3.1Å; I481-K484 WeakPolarHBondContact O-CB 3.41Å; I481-K484 PolarHBondContact O-N 3.33Å; K484-C487 PolarHBondContact O-N 2.84Å; K484-F488 HydrophobicContact CG-CD2 3.8Å; K484-F488 HydrophobicContact CG-CE2 4.22Å; K484-F488 WeakPolarHBondContact O-CB 3.34Å; K484-F488 WeakPolarHBondContact O-CD2 3.47Å; K484-F488 PolarHBondContact O-N 2.96Å
485	N	54.8	Low	51.8	Low	95 Å²	95	107.8 Å²	107.8	51%	0.508	54%	0.54	S	S	.	.	H	α-helix	trans	-68.9	-34.1	176.7	-69.9	-15.2	0	0	0	112.7	I481 S482 F483 C487 V489	I481-N485 PolarHBondContact O-N 3.37Å; S482-N485 PolarHBondContact O-N 2.99Å; F483-N485 VanDerWaalsContact C-N 3.31Å; F483-N485 PolarHBondContact O-N 2.87Å; N485-C487 VanDerWaalsContact C-N 3.32Å; N485-V489 WeakPolarHBondContact O-CG2 3.18Å
486	L	53.2	Low	50.8	Low	64 Å²	64	111.5 Å²	111.5	34%	0.335	56%	0.558	S	S	.	*	H	α-helix	trans	-63.6	-38.9	171.5	-166.1	88.8	0	0	0	111.4	I398 S482 F483	I398-L486 HydrophobicContact CG1-CD1 3.76Å; S482-L486 WeakPolarHBondContact O-CB 3.27Å; S482-L486 PolarHBondContact O-N 3.21Å; F483-L486 WeakPolarHBondContact O-CB 3.44Å; F483-L486 PolarHBondContact O-N 3.22Å
487	C	44.2	Very low	49.6	Very low	96 Å²	96	110.1 Å²	110.1	65%	0.649	56%	0.56	S	S	*	*	H	α-helix	trans	-81.4	-32	-178.6	-66.9	0	0	0	0	114.4	F483 K484 N485	F483-C487 PolarHBondContact O-N 2.97Å; F483-C487 PolarHBondContact O-SG 2.83Å; K484-C487 PolarHBondContact O-N 2.84Å; N485-C487 VanDerWaalsContact C-N 3.32Å
488	F	36.2	Very low	48.3	Very low	138 Å²	138	110.3 Å²	110.3	61%	0.605	56%	0.56	S	S	*	*			trans	-110	43.6	-177.4	-71.4	-83.5	0	0	0	112.6	K484 N490	K484-F488 HydrophobicContact CG-CD2 3.8Å; K484-F488 HydrophobicContact CG-CE2 4.22Å; K484-F488 WeakPolarHBondContact O-CB 3.34Å; K484-F488 WeakPolarHBondContact O-CD2 3.47Å; K484-F488 PolarHBondContact O-N 2.96Å; F488-N490 PolarHBondContact O-N 2.97Å
489	V	41.7	Very low	46.8	Very low	76 Å²	76	109.1 Å²	109.1	46%	0.461	56%	0.56	S	S	.	*			trans	-62.1	92.9	158.7	-179.8	0	0	0	0	106.7	N485	N485-V489 WeakPolarHBondContact O-CG2 3.18Å
490	N	29.8	Very low	45.4	Very low	120 Å²	120	115.6 Å²	115.6	64%	0.642	59%	0.593	S	S	*	*			trans	-55.9	134.7	-172.5	-92.4	-18.8	0	0	0	111.3	F488 S492	F488-N490 PolarHBondContact O-N 2.97Å; N490-S492 PolarHBondContact O-N 2.87Å
491	I	33.6	Very low	43.7	Very low	176 Å²	176	117.3 Å²	117.3	90%	0.903	60%	0.601	S	S	*	*			trans	-72.6	4.3	170.3	-68.5	166.6	0	0	0	111.4	D493	I491-D493 PolarHBondContact O-N 3.36Å
492	S	25.5	Very low	41.9	Very low	74 Å²	74	119.5 Å²	119.5	52%	0.517	61%	0.612	S	S	.	*			trans	-92.1	104.7	177.4	60	0	0	0	0	111.4	N490	N490-S492 PolarHBondContact O-N 2.87Å
493	D	27	Very low	40.3	Very low	153 Å²	153	127.8 Å²	127.8	82%	0.818	65%	0.653	S	S	*	*				168.3	82	129.2	-81.2	-12.6	0	0	0	108.1	I491	I491-D493 PolarHBondContact O-N 3.36Å
494	E	28.4	Very low	38.7	Very low	184 Å²	184	131.6 Å²	131.6	86%	0.86	68%	0.677	S	S	*	*			trans	-169.6	83.2	154.5	-105.1	167.2	-153.1	0	0	108.7
495	H	31.5	Very low	36.9	Very low	266 Å²	266	131.1 Å²	131.1	100%	1.231	68%	0.684	S	S	*	*			trans	56.9	0	163.1	-62.3	-52.4	0	0	0	121.3

Retrieved 495 of 495 residues in 526.6 ms (Link to these results)

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