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DNA replication licensing factor MCM7

Acts as component of the MCM2-7 complex (MCM complex) which is the replicative helicase essential for 'once per cell cycle' DNA replication initiation and elongation in eukaryotic cells. The active ATPase sites in the MCM2-7 ring are formed through the interaction surfaces of two neighboring subunits such that a critical structure of a conserved arginine finger motif is provided in trans relative to the ATP-binding site of the Walker A box of the adjacent subunit. The six ATPase active sites, however, are likely to contribute differentially to the complex helicase activity.

AlphaFold DB , UniProt , Accession A0A3Q0KE52, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene MCM7, Length 771 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	34.4	Very low	62.8	Low	255 Å²	255	122.1 Å²	122.1	100%	1.256	67%	0.674	S	S	*	*				0	49.8	0	-95.5	-179.1	173.1	0	0	111.5
2	A	37	Very low	64.7	Low	94 Å²	94	113.8 Å²	113.8	78%	0.777	63%	0.628	S	S	*	*			trans	-163.1	35.3	169.1	0	0	0	0	0	114.1
3	L	43.6	Very low	66.4	Low	145 Å²	145	109.8 Å²	109.8	76%	0.759	60%	0.6	S	S	*	*			trans	-127.4	32.8	-172.7	-89.1	160.9	0	0	0	114.6
4	S	46.6	Very low	67.9	Low	121 Å²	121	112.1 Å²	112.1	85%	0.846	60%	0.601	S	S	*	*			trans	-120.6	29	178.7	68.4	0	0	0	0	114.3
5	T	54.6	Low	69.2	Low	112 Å²	112	106.5 Å²	106.5	69%	0.687	58%	0.577	S	S	*	*	S	Bend	trans	-99.2	117.2	162.4	47.5	0	0	0	0	108	R7	T5-R7 PolarHBondContact O-N 3.44Å
6	V	64.1	Low	70.2	Confident	151 Å²	151	99.9 Å²	99.9	92%	0.915	54%	0.541	S	S	*	.			trans	-61.1	103.8	171.9	178.4	0	0	0	0	106.8
7	R	71	Confident	71.2	Confident	75 Å²	75	96.8 Å²	96.8	28%	0.283	52%	0.524	S	S	.	.			trans	-70.3	141.1	-179.6	-70.6	-171.2	174.7	-162.4	1.7	110.5	T5 D64	T5-R7 PolarHBondContact O-N 3.44Å; R7-D64 PolarHBondContact NH1-O 3.26Å; R7-D64 PolarHBondContact NH2-O 3.28Å; R7-D64 VanDerWaalsContact NH2-O 3.14Å
8	N	83.3	Confident	72	Confident	74 Å²	74	96.9 Å²	96.9	40%	0.396	52%	0.521	S	S	.	.			trans	-89.9	109.3	179.1	-170.6	3.1	0	0	0	109.9	D10 E11 D12	N8-D10 PolarHBondContact O-N 3.4Å; N8-D10 PolarHBondContact OD1-N 3.5Å; N8-E11 HydrophobicContact CB-CB 4.42Å; N8-E11 HydrophobicContact CB-CG 4.31Å; N8-E11 PolarHBondContact ND2-OE1 2.76Å; N8-E11 PolarHBondContact O-N 2.83Å; N8-D12 PolarHBondContact O-N 2.92Å
9	Y	85	Confident	72.8	Confident	78 Å²	78	91.8 Å²	91.8	31%	0.306	49%	0.494	S	S	.	.	H	α-helix	trans	-64	-23	-176.5	-64.2	-66.4	0	0	0	113.8	D12 K13 R75 I79	Y9-D12 PolarHBondContact O-N 2.96Å; Y9-K13 WeakPolarHBondContact O-CB 3.35Å; Y9-K13 PolarHBondContact O-N 3.42Å; Y9-R75 HydrophobicContact CE1-CG 4.43Å; Y9-R75 PolarHBondContact OH-NH1 3Å; Y9-I79 HydrophobicContact CD1-CD1 3.72Å; Y9-I79 HydrophobicContact CE1-CD1 4.48Å; Y9-I79 HydrophobicContact CG-CD1 4.36Å
10	D	85.5	Confident	73.4	Confident	114 Å²	114	87.3 Å²	87.3	61%	0.61	47%	0.469	S	S	*	.	H	α-helix	trans	-72.3	-33.4	178	-67.9	-21.7	0	0	0	112	N8 K14	N8-D10 PolarHBondContact O-N 3.4Å; N8-D10 PolarHBondContact OD1-N 3.5Å; D10-K14 WeakPolarHBondContact O-CG 3.22Å; D10-K14 PolarHBondContact O-N 2.89Å
11	E	85.4	Confident	73.8	Confident	124 Å²	124	87.6 Å²	87.6	58%	0.579	46%	0.464	S	S	*	.	H	α-helix	trans	-71.8	-44	173.5	-71.7	167.1	-147.3	0	0	110.2	N8 K13 K14 A15	N8-E11 HydrophobicContact CB-CB 4.42Å; N8-E11 HydrophobicContact CB-CG 4.31Å; N8-E11 PolarHBondContact ND2-OE1 2.76Å; N8-E11 PolarHBondContact O-N 2.83Å; E11-K13 VanDerWaalsContact C-N 3.29Å; E11-K13 PolarHBondContact O-N 3.16Å; E11-K14 PolarHBondContact O-N 3.15Å; E11-A15 PolarHBondContact O-N 2.75Å
12	D	85.8	Confident	76	Confident	23 Å²	23	82.1 Å²	82.1	12%	0.123	43%	0.433	C	S	.	.	H	α-helix	trans	-59.2	-40.2	173.7	-73.4	-7.1	0	0	0	111.2	N8 Y9 K14 A15 C16 Y76	N8-D12 PolarHBondContact O-N 2.92Å; Y9-D12 PolarHBondContact O-N 2.96Å; D12-K14 VanDerWaalsContact C-N 3.33Å; D12-K14 PolarHBondContact O-N 3.37Å; D12-A15 PolarHBondContact O-N 3.14Å; D12-C16 PolarHBondContact O-N 3.31Å; D12-C16 PolarHBondContact O-SG 3.2Å; D12-Y76 HydrophobicContact CB-CE1 4.19Å; D12-Y76 WeakPolarHBondContact OD2-CE1 3.34Å; D12-Y76 PolarHBondContact OD2-OH 3.28Å
13	K	87.5	Confident	78.2	Confident	61 Å²	61	78.5 Å²	78.5	27%	0.265	40%	0.399	S	S	.	.	H	α-helix	trans	-59.2	-43.2	176.7	-169.9	178	176.4	176.3	0	111.6	Y9 E11 C16 D17 I79 V83 D86	Y9-K13 WeakPolarHBondContact O-CB 3.35Å; Y9-K13 PolarHBondContact O-N 3.42Å; E11-K13 VanDerWaalsContact C-N 3.29Å; E11-K13 PolarHBondContact O-N 3.16Å; K13-C16 PolarHBondContact O-N 3.45Å; K13-D17 PolarHBondContact O-N 3.06Å; K13-I79 HydrophobicContact CB-CG2 4.24Å; K13-I79 HydrophobicContact CG-CG2 4.31Å; K13-V83 HydrophobicContact CD-CG2 4.25Å; K13-V83 HydrophobicContact CG-CG2 3.43Å; K13-V83 VanDerWaalsContact CG-CG2 3.43Å; K13-D86 WeakPolarHBondContact CE-OD2 3.3Å; K13-D86 IonicContact NZ-OD2 3.67Å; K13-D86 PolarHBondContact NZ-OD2 3.34Å
14	K	87.6	Confident	79.9	Confident	142 Å²	142	73.7 Å²	73.7	62%	0.617	38%	0.378	S	S	*	.	H	α-helix	trans	-68.2	-37.6	176.1	-69.1	174.1	-175.9	173.6	0	112.2	D10 E11 D12 D17 Q18	D10-K14 WeakPolarHBondContact O-CG 3.22Å; D10-K14 PolarHBondContact O-N 2.89Å; E11-K14 PolarHBondContact O-N 3.15Å; D12-K14 VanDerWaalsContact C-N 3.33Å; D12-K14 PolarHBondContact O-N 3.37Å; K14-D17 PolarHBondContact O-N 3.4Å; K14-Q18 WeakPolarHBondContact O-CG 3.33Å; K14-Q18 PolarHBondContact O-N 2.95Å
15	A	86.4	Confident	81.4	Confident	29 Å²	29	71.6 Å²	71.6	24%	0.24	35%	0.354	C	S	.	.	H	α-helix	trans	-64.8	-42.1	175.6	0	0	0	0	0	111.4	E11 D12 Q18 F19	E11-A15 PolarHBondContact O-N 2.75Å; D12-A15 PolarHBondContact O-N 3.14Å; A15-Q18 PolarHBondContact O-N 2.94Å; A15-F19 WeakPolarHBondContact O-CB 3.29Å; A15-F19 PolarHBondContact O-N 3.27Å
16	C	85.2	Confident	82.5	Confident	0 Å²	0	72.5 Å²	72.5	0%	0	35%	0.351	C	S	.	.	H	α-helix	trans	-61.8	-42	173.9	-66.4	0	0	0	0	112.2	D12 K13 F19 L20 F80 V83	D12-C16 PolarHBondContact O-N 3.31Å; D12-C16 PolarHBondContact O-SG 3.2Å; K13-C16 PolarHBondContact O-N 3.45Å; C16-F19 PolarHBondContact O-N 3.36Å; C16-L20 WeakPolarHBondContact O-CG 3.39Å; C16-L20 PolarHBondContact O-N 2.94Å; C16-F80 HydrophobicContact CB-CE1 4.28Å; C16-F80 HydrophobicContact CB-CE2 4.43Å; C16-F80 HydrophobicContact CB-CZ 4.18Å; C16-F80 WeakPolarHBondContact SG-CE2 3.32Å; C16-V83 HydrophobicContact CB-CG2 4.26Å
17	D	87.2	Confident	82.8	Confident	47 Å²	47	68.7 Å²	68.7	25%	0.251	33%	0.326	S	S	.	.	H	α-helix	trans	-60.6	-47.7	175.2	177.3	38.9	0	0	0	111.8	K13 K14 F19 L20 R21 V83 L87	K13-D17 PolarHBondContact O-N 3.06Å; K14-D17 PolarHBondContact O-N 3.4Å; D17-F19 VanDerWaalsContact C-N 3.34Å; D17-F19 PolarHBondContact O-N 3.46Å; D17-L20 PolarHBondContact O-N 2.83Å; D17-R21 WeakPolarHBondContact O-CG 3.47Å; D17-R21 PolarHBondContact O-N 3.19Å; D17-R21 VanDerWaalsContact O-N 3.12Å; D17-R21 IonicContact OD1-CZ 3.06Å; D17-R21 IonicContact OD1-NE 2.63Å; D17-R21 PolarHBondContact OD1-NE 3.38Å; D17-R21 VanDerWaalsContact OD1-NE 3.17Å; D17-V83 HydrophobicContact CB-CG1 3.93Å; D17-L87 VanDerWaalsContact OD1-CD2 3.32Å; D17-L87 WeakPolarHBondContact OD1-CD2 3.5Å
18	Q	85.6	Confident	82.9	Confident	99 Å²	99	70.6 Å²	70.6	46%	0.463	35%	0.351	S	S	.	.	H	α-helix	trans	-60.7	-43.3	175.9	-72.4	176.2	3.8	0	0	112.1	K14 A15 R21 F22	K14-Q18 WeakPolarHBondContact O-CG 3.33Å; K14-Q18 PolarHBondContact O-N 2.95Å; A15-Q18 PolarHBondContact O-N 2.94Å; Q18-R21 PolarHBondContact O-N 3.45Å; Q18-F22 HydrophobicContact CB-CD2 4.22Å; Q18-F22 HydrophobicContact CG-CE2 4.46Å; Q18-F22 WeakPolarHBondContact O-CB 3.28Å; Q18-F22 VanDerWaalsContact O-CD2 3.25Å; Q18-F22 WeakPolarHBondContact O-CD2 3.36Å; Q18-F22 PolarHBondContact O-N 2.98Å
19	F	87.3	Confident	82.3	Confident	1 Å²	1	76.5 Å²	76.5	0%	0.004	37%	0.369	C	S	.	.	H	α-helix	trans	-58.4	-50.6	176.8	172	-105.2	0	0	0	111.6	A15 C16 D17 R21 Y23 Y36 V53 D57 V58 H61 F80	A15-F19 WeakPolarHBondContact O-CB 3.29Å; A15-F19 PolarHBondContact O-N 3.27Å; C16-F19 PolarHBondContact O-N 3.36Å; D17-F19 VanDerWaalsContact C-N 3.34Å; D17-F19 PolarHBondContact O-N 3.46Å; F19-R21 VanDerWaalsContact C-N 3.28Å; F19-R21 PolarHBondContact O-N 2.83Å; F19-Y23 HydrophobicContact CD2-CD2 4.2Å; F19-Y23 HydrophobicContact CD2-CG 4.34Å; F19-Y23 AromaticContact CE2-CD2 3.66Å; F19-Y23 HydrophobicContact CE2-CD2 3.66Å; F19-Y23 HydrophobicContact CE2-CE2 4.28Å; F19-Y23 AromaticContact CE2-CG 3.8Å; F19-Y23 HydrophobicContact CE2-CG 3.8Å; F19-Y23 HydrophobicContact CZ-CG 4.4Å; F19-Y23 WeakPolarHBondContact O-CB 3.36Å; F19-Y23 PolarHBondContact O-N 3.25Å; F19-Y23 VanDerWaalsContact O-N 3.13Å; F19-Y36 HydrophobicContact CE1-CD2 4.1Å; F19-Y36 AromaticContact CE1-CE2 3.8Å; F19-Y36 HydrophobicContact CE1-CE2 3.8Å; F19-Y36 HydrophobicContact CE2-CE2 4.25Å; F19-Y36 HydrophobicContact CZ-CD2 4.03Å; F19-Y36 AromaticContact CZ-CE2 3.4Å; F19-Y36 HydrophobicContact CZ-CE2 3.4Å; F19-Y36 VanDerWaalsContact CZ-CE2 3.4Å; F19-Y36 AromaticContact CZ-CZ 3.94Å; F19-V53 HydrophobicContact CE1-CG1 4.16Å; F19-D57 HydrophobicContact CE2-CB 4.22Å; F19-D57 WeakPolarHBondContact CE2-O 3.28Å; F19-D57 HydrophobicContact CZ-CB 3.94Å; F19-V58 HydrophobicContact CD1-CG2 4.39Å; F19-V58 HydrophobicContact CE1-CG2 3.69Å; F19-V58 HydrophobicContact CE2-CG2 4.17Å; F19-V58 HydrophobicContact CZ-CB 4.35Å; F19-V58 HydrophobicContact CZ-CG2 3.55Å; F19-H61 HydrophobicContact CD2-CB 3.69Å; F19-H61 AromaticContact CD2-CD2 3.97Å; F19-H61 AromaticContact CD2-CG 3.91Å; F19-H61 HydrophobicContact CE2-CB 4.15Å; F19-F80 HydrophobicContact CD1-CE1 4.31Å
20	L	84.7	Confident	81.8	Confident	1 Å²	1	75.2 Å²	75.2	1%	0.005	38%	0.379	C	S	.	.	H	α-helix	trans	-64	-31.4	-178	-71.7	173.2	0	0	0	113.1	C16 D17 Y36 L40 F80 V83 I84 L87	C16-L20 WeakPolarHBondContact O-CG 3.39Å; C16-L20 PolarHBondContact O-N 2.94Å; D17-L20 PolarHBondContact O-N 2.83Å; L20-Y36 HydrophobicContact CD2-CG 4.37Å; L20-L40 HydrophobicContact CB-CD1 4.33Å; L20-F80 HydrophobicContact CD1-CD1 4.3Å; L20-F80 HydrophobicContact CD2-CE1 4.45Å; L20-F80 HydrophobicContact CG-CE1 4.47Å; L20-V83 HydrophobicContact CD1-CG1 3.83Å; L20-I84 HydrophobicContact CD1-CG1 3.85Å; L20-L87 HydrophobicContact CB-CD1 4.03Å; L20-L87 HydrophobicContact CD1-CD1 4.05Å
21	R	82.3	Confident	81.4	Confident	93 Å²	93	75 Å²	75	35%	0.351	38%	0.378	S	S	.	.	H	α-helix	trans	-83.6	-40.7	-180	-71.7	179.3	174.7	-152.8	-10.5	114	D17 Q18 F19 L87 D90	D17-R21 WeakPolarHBondContact O-CG 3.47Å; D17-R21 PolarHBondContact O-N 3.19Å; D17-R21 VanDerWaalsContact O-N 3.12Å; D17-R21 IonicContact OD1-CZ 3.06Å; D17-R21 IonicContact OD1-NE 2.63Å; D17-R21 PolarHBondContact OD1-NE 3.38Å; D17-R21 VanDerWaalsContact OD1-NE 3.17Å; Q18-R21 PolarHBondContact O-N 3.45Å; F19-R21 VanDerWaalsContact C-N 3.28Å; F19-R21 PolarHBondContact O-N 2.83Å; R21-L87 HydrophobicContact CG-CD2 4.47Å; R21-D90 IonicContact NH2-OD2 3.03Å; R21-D90 PolarHBondContact NH2-OD2 2.82Å
22	F	80.4	Confident	81.1	Confident	140 Å²	140	75.6 Å²	75.6	61%	0.614	38%	0.379	S	S	*	.	H	α-helix	trans	-107.1	-8.6	-165.5	-62.9	-64.6	0	0	0	114.7	Q18 S24	Q18-F22 HydrophobicContact CB-CD2 4.22Å; Q18-F22 HydrophobicContact CG-CE2 4.46Å; Q18-F22 WeakPolarHBondContact O-CB 3.28Å; Q18-F22 VanDerWaalsContact O-CD2 3.25Å; Q18-F22 WeakPolarHBondContact O-CD2 3.36Å; Q18-F22 PolarHBondContact O-N 2.98Å; F22-S24 PolarHBondContact O-N 2.94Å
23	Y	82.9	Confident	80.7	Confident	18 Å²	18	77 Å²	77	7%	0.071	38%	0.384	C	S	.	.			trans	-69.3	118.4	-179	-173.9	-97	0	0	0	111.6	F19 K25 F34 Y36 D57 E60	F19-Y23 HydrophobicContact CD2-CD2 4.2Å; F19-Y23 HydrophobicContact CD2-CG 4.34Å; F19-Y23 AromaticContact CE2-CD2 3.66Å; F19-Y23 HydrophobicContact CE2-CD2 3.66Å; F19-Y23 HydrophobicContact CE2-CE2 4.28Å; F19-Y23 AromaticContact CE2-CG 3.8Å; F19-Y23 HydrophobicContact CE2-CG 3.8Å; F19-Y23 HydrophobicContact CZ-CG 4.4Å; F19-Y23 WeakPolarHBondContact O-CB 3.36Å; F19-Y23 PolarHBondContact O-N 3.25Å; F19-Y23 VanDerWaalsContact O-N 3.13Å; Y23-K25 HydrophobicContact CE1-CD 4.21Å; Y23-K25 HydrophobicContact CE1-CG 3.71Å; Y23-K25 WeakPolarHBondContact OH-CE 3.45Å; Y23-F34 WeakPolarHBondContact O-CD1 3.2Å; Y23-Y36 AromaticContact CD1-CD2 3.62Å; Y23-Y36 HydrophobicContact CD1-CD2 3.62Å; Y23-Y36 AromaticContact CD1-CE2 3.43Å; Y23-Y36 HydrophobicContact CD1-CE2 3.43Å; Y23-Y36 VanDerWaalsContact CD1-CE2 3.43Å; Y23-Y36 HydrophobicContact CE1-CD2 4.47Å; Y23-Y36 AromaticContact CE1-CE2 3.88Å; Y23-Y36 HydrophobicContact CE1-CE2 3.88Å; Y23-Y36 HydrophobicContact CG-CD2 4.17Å; Y23-Y36 HydrophobicContact CG-CE2 4.11Å; Y23-D57 HydrophobicContact CD1-CB 4.42Å; Y23-D57 HydrophobicContact CE1-CB 3.67Å; Y23-D57 WeakPolarHBondContact CE1-OD2 3.39Å; Y23-D57 HydrophobicContact CE2-CB 3.96Å; Y23-D57 WeakPolarHBondContact CE2-O 3.45Å; Y23-D57 VanDerWaalsContact CZ-CB 3.43Å; Y23-D57 WeakPolarHBondContact OH-CB 3.29Å; Y23-D57 VanDerWaalsContact OH-CG 3.23Å; Y23-E60 HydrophobicContact CE2-CB 4.44Å; Y23-E60 PolarHBondContact OH-OE2 2.84Å
24	S	80.6	Confident	80.4	Confident	44 Å²	44	78.3 Å²	78.3	31%	0.308	39%	0.39	S	S	.	.			trans	-123.5	130.8	178.6	68.2	0	0	0	0	110.4	F22 H33	F22-S24 PolarHBondContact O-N 2.94Å; S24-H33 WeakPolarHBondContact CA-O 3.3Å
25	K	77.7	Confident	80.1	Confident	78 Å²	78	73 Å²	73	34%	0.339	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	150.3	164.7	-73.5	-173.4	173.6	167.2	0	109.4	Y23 K32 H33 V35 D57	Y23-K25 HydrophobicContact CE1-CD 4.21Å; Y23-K25 HydrophobicContact CE1-CG 3.71Å; Y23-K25 WeakPolarHBondContact OH-CE 3.45Å; K25-K32 WeakPolarHBondContact O-CA 3.25Å; K25-H33 PolarHBondContact N-O 3.26Å; K25-H33 PolarHBondContact O-N 2.95Å; K25-V35 HydrophobicContact CB-CG2 4.05Å; K25-V35 HydrophobicContact CD-CG2 4.1Å; K25-V35 HydrophobicContact CG-CG2 4.11Å; K25-D57 VanDerWaalsContact CE-CG 3.46Å; K25-D57 VanDerWaalsContact CE-OD1 3.29Å; K25-D57 WeakPolarHBondContact CE-OD1 3.31Å; K25-D57 VanDerWaalsContact CE-OD2 3.28Å; K25-D57 WeakPolarHBondContact CE-OD2 3.5Å; K25-D57 IonicContact NZ-OD1 2.65Å; K25-D57 PolarHBondContact NZ-OD1 2.7Å; K25-D57 IonicContact NZ-OD2 3.29Å; K25-D57 PolarHBondContact NZ-OD2 3.29Å
26	M	76.8	Confident	80.1	Confident	130 Å²	130	71.8 Å²	71.8	64%	0.64	36%	0.359	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90	121.9	168.2	-68.4	-162.6	178.2	0	0	108.4	N31 K32	M26-N31 WeakPolarHBondContact CA-O 3.4Å; M26-K32 HydrophobicContact CE-CG 4.2Å; M26-K32 HydrophobicContact CG-CG 4.33Å
27	D	70.7	Confident	80	Confident	72 Å²	72	72.8 Å²	72.8	39%	0.385	37%	0.366	S	S	.	.	P	Polyproline II helix	trans	-66.2	165.6	170.5	-72.5	-18.6	0	0	0	110.3	Y29 G30 N31	D27-Y29 PolarHBondContact O-N 3.25Å; D27-G30 PolarHBondContact O-N 2.86Å; D27-N31 PolarHBondContact N-O 2.9Å
28	S	73.3	Confident	79.8	Confident	114 Å²	114	74.1 Å²	74.1	80%	0.797	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54	-20.2	172.7	50.5	0	0	0	0	113.9
29	Y	71.4	Confident	79.8	Confident	199 Å²	199	71.3 Å²	71.3	78%	0.78	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93	5.6	176.3	-58.2	-75.5	0	0	0	114.4	D27 N31	D27-Y29 PolarHBondContact O-N 3.25Å; Y29-N31 VanDerWaalsContact C-N 3.27Å; Y29-N31 PolarHBondContact O-N 2.77Å
30	G	73.5	Confident	79.7	Confident	50 Å²	50	71.3 Å²	71.3	52%	0.515	36%	0.357	S	S	.	.	S	Bend	trans	77.7	4.6	178.5	0	0	0	0	0	115.1	D27	D27-G30 PolarHBondContact O-N 2.86Å
31	N	77	Confident	79.7	Confident	109 Å²	109	72.9 Å²	72.9	58%	0.583	37%	0.367	S	S	*	.			trans	-78.4	134.1	174.9	-69.2	-23.2	0	0	0	110	M26 D27 Y29 H33	M26-N31 WeakPolarHBondContact CA-O 3.4Å; D27-N31 PolarHBondContact N-O 2.9Å; Y29-N31 VanDerWaalsContact C-N 3.27Å; Y29-N31 PolarHBondContact O-N 2.77Å; N31-H33 PolarHBondContact O-N 3.09Å
32	K	79.2	Confident	79.9	Confident	138 Å²	138	74 Å²	74	60%	0.6	37%	0.371	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.2	112.7	171.7	-68.8	-175.2	179.9	-175.3	0	108.8	K25 M26	K25-K32 WeakPolarHBondContact O-CA 3.25Å; M26-K32 HydrophobicContact CE-CG 4.2Å; M26-K32 HydrophobicContact CG-CG 4.33Å
33	H	76.7	Confident	80.1	Confident	52 Å²	52	67.9 Å²	67.9	24%	0.241	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	128.3	175.9	-178	-70.2	0	0	0	109.8	S24 K25 N31 V35 E38	S24-H33 WeakPolarHBondContact CA-O 3.3Å; K25-H33 PolarHBondContact N-O 3.26Å; K25-H33 PolarHBondContact O-N 2.95Å; N31-H33 PolarHBondContact O-N 3.09Å; H33-V35 PolarHBondContact ND1-N 3.32Å; H33-V35 PolarHBondContact O-N 3.05Å; H33-E38 IonicContact CD2-OE1 3.18Å; H33-E38 PolarHBondContact CD2-OE1 3.43Å; H33-E38 IonicContact CE1-OE1 3.13Å; H33-E38 IonicContact CE1-OE2 2.91Å; H33-E38 PolarHBondContact CE1-OE2 3.04Å; H33-E38 VanDerWaalsContact CE1-OE2 3.28Å; H33-E38 IonicContact NE2-OE1 3.36Å; H33-E38 PolarHBondContact NE2-OE1 2.91Å; H33-E38 IonicContact NE2-OE2 3.3Å; H33-E38 PolarHBondContact NE2-OE2 3.08Å
34	F	81.3	Confident	80.1	Confident	88 Å²	88	67.5 Å²	67.5	39%	0.386	35%	0.346	S	S	.	.			trans	-86.1	89.9	176.5	-64.5	-81.7	0	0	0	109.6	Y23 Y36 S37 E38	Y23-F34 WeakPolarHBondContact O-CD1 3.2Å; F34-Y36 PolarHBondContact O-N 3.48Å; F34-S37 WeakPolarHBondContact CB-OG 3.23Å; F34-S37 PolarHBondContact O-N 3.13Å; F34-S37 PolarHBondContact O-OG 3Å; F34-S37 VanDerWaalsContact O-OG 3.13Å; F34-E38 PolarHBondContact O-N 3.4Å; F34-E38 VanDerWaalsContact O-N 3.15Å
35	V	82.6	Confident	80.1	Confident	32 Å²	32	66.9 Å²	66.9	19%	0.194	34%	0.339	C	S	.	.	H	α-helix	trans	-55.3	-48.8	-172.6	-178.5	0	0	0	0	111.8	K25 H33 Q39	K25-V35 HydrophobicContact CB-CG2 4.05Å; K25-V35 HydrophobicContact CD-CG2 4.1Å; K25-V35 HydrophobicContact CG-CG2 4.11Å; H33-V35 PolarHBondContact ND1-N 3.32Å; H33-V35 PolarHBondContact O-N 3.05Å; V35-Q39 WeakPolarHBondContact O-CG 3.27Å; V35-Q39 PolarHBondContact O-N 3.13Å
36	Y	85.4	Confident	80	Confident	2 Å²	2	67.8 Å²	67.8	1%	0.008	34%	0.34	C	S	.	.	H	α-helix	trans	-74.8	-35.5	-176.5	-63.9	-66.3	0	0	0	113	F19 L20 Y23 F34 E38 Q39 L40 L51 V53 S54 D57	F19-Y36 HydrophobicContact CE1-CD2 4.1Å; F19-Y36 AromaticContact CE1-CE2 3.8Å; F19-Y36 HydrophobicContact CE1-CE2 3.8Å; F19-Y36 HydrophobicContact CE2-CE2 4.25Å; F19-Y36 HydrophobicContact CZ-CD2 4.03Å; F19-Y36 AromaticContact CZ-CE2 3.4Å; F19-Y36 HydrophobicContact CZ-CE2 3.4Å; F19-Y36 VanDerWaalsContact CZ-CE2 3.4Å; F19-Y36 AromaticContact CZ-CZ 3.94Å; L20-Y36 HydrophobicContact CD2-CG 4.37Å; Y23-Y36 AromaticContact CD1-CD2 3.62Å; Y23-Y36 HydrophobicContact CD1-CD2 3.62Å; Y23-Y36 AromaticContact CD1-CE2 3.43Å; Y23-Y36 HydrophobicContact CD1-CE2 3.43Å; Y23-Y36 VanDerWaalsContact CD1-CE2 3.43Å; Y23-Y36 HydrophobicContact CE1-CD2 4.47Å; Y23-Y36 AromaticContact CE1-CE2 3.88Å; Y23-Y36 HydrophobicContact CE1-CE2 3.88Å; Y23-Y36 HydrophobicContact CG-CD2 4.17Å; Y23-Y36 HydrophobicContact CG-CE2 4.11Å; F34-Y36 PolarHBondContact O-N 3.48Å; Y36-E38 VanDerWaalsContact C-N 3.32Å; Y36-E38 PolarHBondContact O-N 3.14Å; Y36-Q39 PolarHBondContact O-N 3.46Å; Y36-L40 WeakPolarHBondContact O-CB 3.43Å; Y36-L40 WeakPolarHBondContact O-CG 3.14Å; Y36-L40 PolarHBondContact O-N 3.11Å; Y36-L51 HydrophobicContact CD1-CD1 4.46Å; Y36-V53 HydrophobicContact CE1-CG1 4.45Å; Y36-V53 HydrophobicContact CE1-CG2 4.37Å; Y36-S54 PolarHBondContact OH-N 2.85Å; Y36-S54 PolarHBondContact OH-OG 2.95Å; Y36-S54 VanDerWaalsContact OH-OG 3.07Å; Y36-D57 HydrophobicContact CE2-CB 4.09Å; Y36-D57 WeakPolarHBondContact OH-CB 3.41Å; Y36-D57 PolarHBondContact OH-OD2 3.28Å
37	S	82.6	Confident	80.4	Confident	21 Å²	21	68.7 Å²	68.7	15%	0.147	34%	0.343	C	S	.	.	H	α-helix	trans	-67.1	-35.9	178	70.3	0	0	0	0	111.9	F34 L40 T41	F34-S37 WeakPolarHBondContact CB-OG 3.23Å; F34-S37 PolarHBondContact O-N 3.13Å; F34-S37 PolarHBondContact O-OG 3Å; F34-S37 VanDerWaalsContact O-OG 3.13Å; S37-L40 PolarHBondContact O-N 3.01Å; S37-T41 WeakPolarHBondContact O-CB 3.34Å; S37-T41 PolarHBondContact O-N 3.47Å; S37-T41 PolarHBondContact O-OG1 3.17Å
38	E	84.1	Confident	81	Confident	76 Å²	76	67.5 Å²	67.5	36%	0.355	34%	0.335	S	S	.	.	H	α-helix	trans	-65.2	-44.9	172.7	-73.1	-151	178.9	0	0	111.9	H33 F34 Y36 L40 T41 R42	H33-E38 IonicContact CD2-OE1 3.18Å; H33-E38 PolarHBondContact CD2-OE1 3.43Å; H33-E38 IonicContact CE1-OE1 3.13Å; H33-E38 IonicContact CE1-OE2 2.91Å; H33-E38 PolarHBondContact CE1-OE2 3.04Å; H33-E38 VanDerWaalsContact CE1-OE2 3.28Å; H33-E38 IonicContact NE2-OE1 3.36Å; H33-E38 PolarHBondContact NE2-OE1 2.91Å; H33-E38 IonicContact NE2-OE2 3.3Å; H33-E38 PolarHBondContact NE2-OE2 3.08Å; F34-E38 PolarHBondContact O-N 3.4Å; F34-E38 VanDerWaalsContact O-N 3.15Å; Y36-E38 VanDerWaalsContact C-N 3.32Å; Y36-E38 PolarHBondContact O-N 3.14Å; E38-L40 VanDerWaalsContact C-N 3.33Å; E38-L40 PolarHBondContact O-N 3.32Å; E38-T41 WeakPolarHBondContact O-CB 3.38Å; E38-T41 PolarHBondContact O-N 2.92Å; E38-T41 VanDerWaalsContact O-N 3.16Å; E38-R42 WeakPolarHBondContact O-CG 3.43Å; E38-R42 PolarHBondContact O-N 3.36Å; E38-R42 IonicContact OE2-NH2 3.68Å
39	Q	85	Confident	81.5	Confident	39 Å²	39	64.6 Å²	64.6	18%	0.182	31%	0.314	C	S	.	.	H	α-helix	trans	-61.9	-41.6	175.3	-71.2	178.3	-1.1	0	0	111.7	V35 Y36 T41 R42 I43 L51	V35-Q39 WeakPolarHBondContact O-CG 3.27Å; V35-Q39 PolarHBondContact O-N 3.13Å; Y36-Q39 PolarHBondContact O-N 3.46Å; Q39-T41 VanDerWaalsContact C-N 3.29Å; Q39-T41 PolarHBondContact O-N 2.9Å; Q39-R42 PolarHBondContact O-N 3.18Å; Q39-I43 VanDerWaalsContact O-CG1 3.24Å; Q39-I43 WeakPolarHBondContact O-CG1 3.24Å; Q39-I43 PolarHBondContact O-N 3.29Å; Q39-L51 HydrophobicContact CB-CD1 3.69Å; Q39-L51 HydrophobicContact CG-CD1 4.49Å
40	L	85.9	Confident	82.3	Confident	1 Å²	1	55.5 Å²	55.5	1%	0.005	28%	0.28	C	S	.	.	H	α-helix	trans	-62.4	-37.7	174.3	-72.4	175.2	0	0	0	111.6	L20 Y36 S37 E38 I43 A44 I84 L87 F91	L20-L40 HydrophobicContact CB-CD1 4.33Å; Y36-L40 WeakPolarHBondContact O-CB 3.43Å; Y36-L40 WeakPolarHBondContact O-CG 3.14Å; Y36-L40 PolarHBondContact O-N 3.11Å; S37-L40 PolarHBondContact O-N 3.01Å; E38-L40 VanDerWaalsContact C-N 3.33Å; E38-L40 PolarHBondContact O-N 3.32Å; L40-I43 PolarHBondContact O-N 3.45Å; L40-A44 VanDerWaalsContact O-CB 3.26Å; L40-A44 WeakPolarHBondContact O-CB 3.16Å; L40-A44 PolarHBondContact O-N 2.92Å; L40-I84 HydrophobicContact CD2-CG1 4.14Å; L40-I84 HydrophobicContact CD2-CG2 3.76Å; L40-L87 HydrophobicContact CD1-CD1 4.34Å; L40-F91 HydrophobicContact CB-CD2 4.44Å; L40-F91 HydrophobicContact CD1-CD2 4.49Å; L40-F91 HydrophobicContact CD1-CE2 4.25Å
41	T	85.3	Confident	83	Confident	35 Å²	35	53.1 Å²	53.1	22%	0.215	26%	0.255	C	S	.	.	H	α-helix	trans	-64.9	-42.4	173.9	-54.8	0	0	0	0	111	S37 E38 Q39 A44 N45 T93	S37-T41 WeakPolarHBondContact O-CB 3.34Å; S37-T41 PolarHBondContact O-N 3.47Å; S37-T41 PolarHBondContact O-OG1 3.17Å; E38-T41 WeakPolarHBondContact O-CB 3.38Å; E38-T41 PolarHBondContact O-N 2.92Å; E38-T41 VanDerWaalsContact O-N 3.16Å; Q39-T41 VanDerWaalsContact C-N 3.29Å; Q39-T41 PolarHBondContact O-N 2.9Å; T41-A44 PolarHBondContact O-N 2.84Å; T41-N45 VanDerWaalsContact O-CB 3.31Å; T41-N45 WeakPolarHBondContact O-CB 3.49Å; T41-N45 VanDerWaalsContact O-CG 3.25Å; T41-N45 PolarHBondContact O-N 2.87Å; T41-T93 HydrophobicContact CG2-CG2 4.2Å
42	R	85.2	Confident	83.5	Confident	115 Å²	115	52 Å²	52	43%	0.434	24%	0.243	S	C	.	.	H	α-helix	trans	-64.4	-38.5	174.8	-68.6	178.1	-166.5	178.6	6.5	112.4	E38 Q39 N45 R46 E47 Q48	E38-R42 WeakPolarHBondContact O-CG 3.43Å; E38-R42 PolarHBondContact O-N 3.36Å; E38-R42 IonicContact OE2-NH2 3.68Å; Q39-R42 PolarHBondContact O-N 3.18Å; R42-N45 CarbonylContact O-C 3.49Å; R42-N45 PolarHBondContact O-N 3.22Å; R42-R46 PolarHBondContact O-N 3.22Å; R42-E47 HydrophobicContact CB-CB 4.47Å; R42-E47 PolarHBondContact O-N 3.49Å; R42-Q48 HydrophobicContact CB-CB 4.09Å; R42-Q48 PolarHBondContact O-N 3.46Å
43	I	85.6	Confident	83.9	Confident	13 Å²	13	45.4 Å²	45.4	7%	0.067	22%	0.215	C	C	.	.	H	α-helix	trans	-67.3	-43.9	174.7	-67.1	164.6	0	0	0	110.4	Q39 L40 N45 R46 Q48 L51 L88 F152	Q39-I43 VanDerWaalsContact O-CG1 3.24Å; Q39-I43 WeakPolarHBondContact O-CG1 3.24Å; Q39-I43 PolarHBondContact O-N 3.29Å; L40-I43 PolarHBondContact O-N 3.45Å; I43-N45 VanDerWaalsContact C-N 3.28Å; I43-N45 PolarHBondContact O-N 3.15Å; I43-R46 WeakPolarHBondContact O-CA 3.31Å; I43-R46 PolarHBondContact O-N 3.45Å; I43-Q48 WeakPolarHBondContact CA-O 3.3Å; I43-Q48 HydrophobicContact CG1-CB 4.12Å; I43-Q48 HydrophobicContact CG1-CG 4.27Å; I43-Q48 WeakPolarHBondContact CG1-O 3.45Å; I43-L51 HydrophobicContact CD1-CB 3.79Å; I43-L51 HydrophobicContact CD1-CD1 3.78Å; I43-L51 HydrophobicContact CD1-CG 4.31Å; I43-L88 HydrophobicContact CG2-CD2 3.93Å; I43-F152 HydrophobicContact CG2-CB 3.67Å; I43-F152 HydrophobicContact CG2-CD1 4.23Å; I43-F152 HydrophobicContact CG2-CG 4.06Å
44	A	82.1	Confident	84.4	Confident	9 Å²	9	44.2 Å²	44.2	7%	0.074	21%	0.212	C	C	.	.	H	α-helix	trans	-62.2	-36.9	176	0	0	0	0	0	111.8	L40 T41 R46 L88	L40-A44 VanDerWaalsContact O-CB 3.26Å; L40-A44 WeakPolarHBondContact O-CB 3.16Å; L40-A44 PolarHBondContact O-N 2.92Å; T41-A44 PolarHBondContact O-N 2.84Å; A44-R46 PolarHBondContact O-N 3.07Å; A44-L88 HydrophobicContact CB-CD2 4.09Å
45	N	81.5	Confident	84.6	Confident	32 Å²	32	40 Å²	40	17%	0.171	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.5	-4.1	174.5	-70.6	-10.8	0	0	0	113.8	T41 R42 I43 E47 T93	T41-N45 VanDerWaalsContact O-CB 3.31Å; T41-N45 WeakPolarHBondContact O-CB 3.49Å; T41-N45 VanDerWaalsContact O-CG 3.25Å; T41-N45 PolarHBondContact O-N 2.87Å; R42-N45 CarbonylContact O-C 3.49Å; R42-N45 PolarHBondContact O-N 3.22Å; I43-N45 VanDerWaalsContact C-N 3.28Å; I43-N45 PolarHBondContact O-N 3.15Å; N45-E47 VanDerWaalsContact C-N 3.31Å; N45-E47 HydrophobicContact CB-CG 4.41Å; N45-E47 PolarHBondContact O-N 2.69Å; N45-T93 PolarHBondContact ND2-OG1 3.49Å; N45-T93 VanDerWaalsContact ND2-OG1 3.09Å; N45-T93 PolarHBondContact OD1-OG1 2.77Å; N45-T93 VanDerWaalsContact OD1-OG1 3.12Å
46	R	75.6	Confident	84.7	Confident	97 Å²	97	40.1 Å²	40.1	37%	0.366	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	65.1	25.1	-179.4	-53.1	179.8	178.3	-178	-18.9	115.4	R42 I43 A44 L96 D103	R42-R46 PolarHBondContact O-N 3.22Å; I43-R46 WeakPolarHBondContact O-CA 3.31Å; I43-R46 PolarHBondContact O-N 3.45Å; A44-R46 PolarHBondContact O-N 3.07Å; R46-L96 HydrophobicContact CB-CD2 4.35Å; R46-L96 HydrophobicContact CG-CD1 4.35Å; R46-L96 HydrophobicContact CG-CD2 3.67Å; R46-D103 IonicContact CZ-OD1 3.17Å; R46-D103 IonicContact CZ-OD2 3.01Å; R46-D103 IonicContact NH1-OD1 3.25Å; R46-D103 IonicContact NH1-OD2 3.66Å; R46-D103 PolarHBondContact NH1-OD2 2.76Å; R46-D103 IonicContact NH2-OD1 3.05Å; R46-D103 PolarHBondContact NH2-OD1 3.33Å; R46-D103 IonicContact NH2-OD2 2.82Å; R46-D103 PolarHBondContact NH2-OD2 2.94Å; R46-D103 VanDerWaalsContact NH2-OD2 3.13Å
47	E	83.6	Confident	84.8	Confident	148 Å²	148	40.3 Å²	40.3	69%	0.692	20%	0.195	S	C	*	.	S	Bend	trans	-82.8	-30.3	173	-64.6	177.7	174.1	0	0	111.5	R42 N45	R42-E47 HydrophobicContact CB-CB 4.47Å; R42-E47 PolarHBondContact O-N 3.49Å; N45-E47 VanDerWaalsContact C-N 3.31Å; N45-E47 HydrophobicContact CB-CG 4.41Å; N45-E47 PolarHBondContact O-N 2.69Å
48	Q	84.1	Confident	84.9	Confident	48 Å²	48	39.3 Å²	39.3	22%	0.224	19%	0.188	C	C	.	.			trans	-124.2	132.5	-176.6	-175.5	169.9	-7.7	0	0	110.4	R42 I43 V50	R42-Q48 HydrophobicContact CB-CB 4.09Å; R42-Q48 PolarHBondContact O-N 3.46Å; I43-Q48 WeakPolarHBondContact CA-O 3.3Å; I43-Q48 HydrophobicContact CG1-CB 4.12Å; I43-Q48 HydrophobicContact CG1-CG 4.27Å; I43-Q48 WeakPolarHBondContact CG1-O 3.45Å; Q48-V50 WeakPolarHBondContact CG-O 3.47Å; Q48-V50 PolarHBondContact NE2-O 3.07Å
49	S	84.3	Confident	84.9	Confident	52 Å²	52	37 Å²	37	36%	0.364	18%	0.181	S	C	.	.			trans	-101.7	-12.9	178.7	54.4	0	0	0	0	113.6	F152 E153	S49-F152 CarbonylContact O-C 3.53Å; S49-F152 WeakPolarHBondContact O-CA 3.42Å; S49-E153 PolarHBondContact O-N 2.68Å
50	V	87	Confident	84.9	Confident	8 Å²	8	41.9 Å²	41.9	5%	0.048	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	127.8	-174	177.4	0	0	0	0	110.2	Q48 Y52 E153 Y155 E280	Q48-V50 WeakPolarHBondContact CG-O 3.47Å; Q48-V50 PolarHBondContact NE2-O 3.07Å; V50-Y52 HydrophobicContact CB-CE2 4.26Å; V50-Y52 HydrophobicContact CG1-CD1 4.36Å; V50-Y52 HydrophobicContact CG1-CD2 3.94Å; V50-Y52 HydrophobicContact CG1-CE1 4.02Å; V50-Y52 HydrophobicContact CG1-CE2 3.57Å; V50-Y52 HydrophobicContact CG1-CG 4.33Å; V50-E153 WeakPolarHBondContact CA-O 3.46Å; V50-Y155 HydrophobicContact CG1-CD2 3.25Å; V50-Y155 HydrophobicContact CG1-CE2 3.62Å; V50-Y155 HydrophobicContact CG1-CG 4.33Å; V50-Y155 HydrophobicContact CG2-CE2 4.06Å; V50-E280 HydrophobicContact CG2-CB 3.71Å; V50-E280 HydrophobicContact CG2-CG 3.76Å
51	L	89.5	Confident	84.7	Confident	0 Å²	0	46 Å²	46	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	114.7	169.5	-171.4	73.1	0	0	0	109.5	Y36 Q39 I43 V53 I84 E153 Y155	Y36-L51 HydrophobicContact CD1-CD1 4.46Å; Q39-L51 HydrophobicContact CB-CD1 3.69Å; Q39-L51 HydrophobicContact CG-CD1 4.49Å; I43-L51 HydrophobicContact CD1-CB 3.79Å; I43-L51 HydrophobicContact CD1-CD1 3.78Å; I43-L51 HydrophobicContact CD1-CG 4.31Å; L51-V53 HydrophobicContact CD2-CG2 3.83Å; L51-V53 HydrophobicContact CG-CG2 4Å; L51-I84 HydrophobicContact CD2-CD1 3.51Å; L51-I84 HydrophobicContact CD2-CG1 4.46Å; L51-E153 PolarHBondContact N-O 3.04Å; L51-Y155 PolarHBondContact O-N 3.42Å
52	Y	87.1	Confident	84.5	Confident	85 Å²	85	46.1 Å²	46.1	33%	0.333	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	115	170.2	-67.3	-76.4	0	0	0	109.1	V50 Y155 N281	V50-Y52 HydrophobicContact CB-CE2 4.26Å; V50-Y52 HydrophobicContact CG1-CD1 4.36Å; V50-Y52 HydrophobicContact CG1-CD2 3.94Å; V50-Y52 HydrophobicContact CG1-CE1 4.02Å; V50-Y52 HydrophobicContact CG1-CE2 3.57Å; V50-Y52 HydrophobicContact CG1-CG 4.33Å; Y52-Y155 WeakPolarHBondContact CA-O 3.4Å; Y52-Y155 HydrophobicContact CD1-CD2 4.41Å; Y52-Y155 AromaticContact CE1-CD2 3.83Å; Y52-Y155 HydrophobicContact CE1-CD2 3.83Å; Y52-Y155 HydrophobicContact CE1-CG 4.37Å; Y52-N281 PolarHBondContact OH-OD1 3.27Å
53	V	88.4	Confident	84.4	Confident	0 Å²	0	44 Å²	44	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	113.5	177.1	-178.6	0	0	0	0	108.3	F19 Y36 L51 V58 V154 Y155 F156 C157	F19-V53 HydrophobicContact CE1-CG1 4.16Å; Y36-V53 HydrophobicContact CE1-CG1 4.45Å; Y36-V53 HydrophobicContact CE1-CG2 4.37Å; L51-V53 HydrophobicContact CD2-CG2 3.83Å; L51-V53 HydrophobicContact CG-CG2 4Å; V53-V58 HydrophobicContact CG1-CG2 3.86Å; V53-V154 HydrophobicContact CG2-CG1 4.09Å; V53-Y155 PolarHBondContact N-O 2.93Å; V53-F156 HydrophobicContact CB-CD1 3.97Å; V53-F156 HydrophobicContact CB-CE1 4.21Å; V53-F156 HydrophobicContact CG1-CD1 4.24Å; V53-F156 HydrophobicContact CG1-CE1 4.27Å; V53-F156 WeakPolarHBondContact O-CA 3.26Å; V53-C157 PolarHBondContact O-N 3.32Å
54	S	86.3	Confident	84.4	Confident	27 Å²	27	48.1 Å²	48.1	19%	0.189	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	130.1	174	41	0	0	0	0	110.4	Y36 D56 D57 V58	Y36-S54 PolarHBondContact OH-N 2.85Å; Y36-S54 PolarHBondContact OH-OG 2.95Å; Y36-S54 VanDerWaalsContact OH-OG 3.07Å; S54-D56 PolarHBondContact O-N 2.92Å; S54-D57 PolarHBondContact O-N 2.9Å; S54-D57 PolarHBondContact OG-OD1 3.4Å; S54-D57 PolarHBondContact OG-OD2 3.38Å; S54-V58 PolarHBondContact O-N 3.13Å
55	I	86.4	Confident	84.5	Confident	1 Å²	1	47.9 Å²	47.9	1%	0.005	25%	0.248	C	C	.	.	H	α-helix	trans	-68.1	-25.3	176.5	-67.4	174.2	0	0	0	111.2	D57 V58 A59 A66 I69 E70 F156 C157 R159 L178	I55-D57 VanDerWaalsContact C-N 3.35Å; I55-D57 PolarHBondContact O-N 2.89Å; I55-V58 CarbonylContact O-C 3.53Å; I55-V58 PolarHBondContact O-N 3.12Å; I55-A59 VanDerWaalsContact O-CB 3.31Å; I55-A59 WeakPolarHBondContact O-CB 3.4Å; I55-A59 PolarHBondContact O-N 3.24Å; I55-A66 HydrophobicContact CG2-CB 3.94Å; I55-I69 HydrophobicContact CD1-CG2 4.31Å; I55-E70 HydrophobicContact CD1-CG 4.31Å; I55-F156 HydrophobicContact CD1-CB 4.38Å; I55-C157 VanDerWaalsContact CG1-O 3.32Å; I55-C157 WeakPolarHBondContact CG1-O 3.49Å; I55-C157 PolarHBondContact N-O 2.92Å; I55-C157 VanDerWaalsContact N-O 3.09Å; I55-R159 HydrophobicContact CB-CG 3.88Å; I55-R159 HydrophobicContact CG2-CG 3.48Å; I55-R159 VanDerWaalsContact CG2-CG 3.48Å; I55-L178 HydrophobicContact CD1-CD2 3.21Å
56	D	84.6	Confident	84.7	Confident	33 Å²	33	46.4 Å²	46.4	18%	0.176	24%	0.24	C	C	.	.	H	α-helix	trans	-59.8	-45.9	174.8	-63.2	-32.3	0	0	0	111.2	S54 V58 A59 E60 R159 S160	S54-D56 PolarHBondContact O-N 2.92Å; D56-V58 VanDerWaalsContact C-N 3.31Å; D56-V58 PolarHBondContact O-N 2.9Å; D56-A59 WeakPolarHBondContact O-CB 3.35Å; D56-A59 PolarHBondContact O-N 3.04Å; D56-A59 VanDerWaalsContact O-N 3.13Å; D56-E60 WeakPolarHBondContact O-CG 3.26Å; D56-E60 PolarHBondContact O-N 3.35Å; D56-R159 WeakPolarHBondContact OD1-CA 3.32Å; D56-R159 VanDerWaalsContact OD1-CB 3.26Å; D56-R159 WeakPolarHBondContact OD1-CB 3.33Å; D56-R159 WeakPolarHBondContact OD1-CG 3.39Å; D56-R159 IonicContact OD1-NE 2.85Å; D56-S160 PolarHBondContact OD1-N 3.05Å; D56-S160 VanDerWaalsContact OD2-CB 3.27Å; D56-S160 WeakPolarHBondContact OD2-CB 3.47Å; D56-S160 PolarHBondContact OD2-N 3.43Å; D56-S160 PolarHBondContact OD2-OG 3.09Å
57	D	86.2	Confident	85.2	Confident	7 Å²	7	45.2 Å²	45.2	4%	0.037	24%	0.241	C	C	.	.	H	α-helix	trans	-62.4	-40.4	176	-62.8	25.3	0	0	0	111.3	F19 Y23 K25 Y36 S54 I55 A59 E60 H61	F19-D57 HydrophobicContact CE2-CB 4.22Å; F19-D57 WeakPolarHBondContact CE2-O 3.28Å; F19-D57 HydrophobicContact CZ-CB 3.94Å; Y23-D57 HydrophobicContact CD1-CB 4.42Å; Y23-D57 HydrophobicContact CE1-CB 3.67Å; Y23-D57 WeakPolarHBondContact CE1-OD2 3.39Å; Y23-D57 HydrophobicContact CE2-CB 3.96Å; Y23-D57 WeakPolarHBondContact CE2-O 3.45Å; Y23-D57 VanDerWaalsContact CZ-CB 3.43Å; Y23-D57 WeakPolarHBondContact OH-CB 3.29Å; Y23-D57 VanDerWaalsContact OH-CG 3.23Å; K25-D57 VanDerWaalsContact CE-CG 3.46Å; K25-D57 VanDerWaalsContact CE-OD1 3.29Å; K25-D57 WeakPolarHBondContact CE-OD1 3.31Å; K25-D57 VanDerWaalsContact CE-OD2 3.28Å; K25-D57 WeakPolarHBondContact CE-OD2 3.5Å; K25-D57 IonicContact NZ-OD1 2.65Å; K25-D57 PolarHBondContact NZ-OD1 2.7Å; K25-D57 IonicContact NZ-OD2 3.29Å; K25-D57 PolarHBondContact NZ-OD2 3.29Å; Y36-D57 HydrophobicContact CE2-CB 4.09Å; Y36-D57 WeakPolarHBondContact OH-CB 3.41Å; Y36-D57 PolarHBondContact OH-OD2 3.28Å; S54-D57 PolarHBondContact O-N 2.9Å; S54-D57 PolarHBondContact OG-OD1 3.4Å; S54-D57 PolarHBondContact OG-OD2 3.38Å; I55-D57 VanDerWaalsContact C-N 3.35Å; I55-D57 PolarHBondContact O-N 2.89Å; D57-A59 VanDerWaalsContact C-N 3.33Å; D57-E60 PolarHBondContact O-N 2.89Å; D57-H61 PolarHBondContact O-N 2.85Å
58	V	85.1	Confident	85.4	Confident	0 Å²	0	38.6 Å²	38.6	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-66	-38.8	176.3	-178.9	0	0	0	0	110.7	F19 V53 S54 I55 D56 H61 S62 L65 A66 I69	F19-V58 HydrophobicContact CD1-CG2 4.39Å; F19-V58 HydrophobicContact CE1-CG2 3.69Å; F19-V58 HydrophobicContact CE2-CG2 4.17Å; F19-V58 HydrophobicContact CZ-CB 4.35Å; F19-V58 HydrophobicContact CZ-CG2 3.55Å; V53-V58 HydrophobicContact CG1-CG2 3.86Å; S54-V58 PolarHBondContact O-N 3.13Å; I55-V58 CarbonylContact O-C 3.53Å; I55-V58 PolarHBondContact O-N 3.12Å; D56-V58 VanDerWaalsContact C-N 3.31Å; D56-V58 PolarHBondContact O-N 2.9Å; V58-H61 PolarHBondContact O-N 2.82Å; V58-S62 CarbonylContact O-C 3.57Å; V58-S62 PolarHBondContact O-N 3.02Å; V58-S62 VanDerWaalsContact O-O 3.09Å; V58-L65 HydrophobicContact CG1-CB 4.2Å; V58-L65 HydrophobicContact CG1-CD2 3.87Å; V58-L65 HydrophobicContact CG1-CG 3.95Å; V58-A66 HydrophobicContact CG1-CB 4.26Å; V58-I69 HydrophobicContact CG1-CD1 3.9Å
59	A	84.9	Confident	85.5	Confident	27 Å²	27	36.3 Å²	36.3	22%	0.223	20%	0.201	C	C	.	.	H	α-helix	trans	-68.5	-35.1	179.8	0	0	0	0	0	112.2	I55 D56 D57 H61 S63 A66	I55-A59 VanDerWaalsContact O-CB 3.31Å; I55-A59 WeakPolarHBondContact O-CB 3.4Å; I55-A59 PolarHBondContact O-N 3.24Å; D56-A59 WeakPolarHBondContact O-CB 3.35Å; D56-A59 PolarHBondContact O-N 3.04Å; D56-A59 VanDerWaalsContact O-N 3.13Å; D57-A59 VanDerWaalsContact C-N 3.33Å; A59-H61 VanDerWaalsContact C-N 3.32Å; A59-S63 PolarHBondContact O-N 2.95Å; A59-A66 HydrophobicContact CB-CB 3.82Å
60	E	84.3	Confident	85.6	Confident	141 Å²	141	36.2 Å²	36.2	66%	0.659	19%	0.194	S	C	*	.	H	α-helix	trans	-61.8	-39.3	172.1	-73.9	179.3	170.7	0	0	112	Y23 D56 D57	Y23-E60 HydrophobicContact CE2-CB 4.44Å; Y23-E60 PolarHBondContact OH-OE2 2.84Å; D56-E60 WeakPolarHBondContact O-CG 3.26Å; D56-E60 PolarHBondContact O-N 3.35Å; D57-E60 PolarHBondContact O-N 2.89Å
61	H	80.6	Confident	85.6	Confident	88 Å²	88	37.9 Å²	37.9	41%	0.407	21%	0.206	S	C	.	.	H	α-helix	trans	-78.9	-47.4	178.6	-170.9	62.6	0	0	0	112.5	F19 D57 V58 A59	F19-H61 HydrophobicContact CD2-CB 3.69Å; F19-H61 AromaticContact CD2-CD2 3.97Å; F19-H61 AromaticContact CD2-CG 3.91Å; F19-H61 HydrophobicContact CE2-CB 4.15Å; D57-H61 PolarHBondContact O-N 2.85Å; V58-H61 PolarHBondContact O-N 2.82Å; A59-H61 VanDerWaalsContact C-N 3.32Å
62	S	82.5	Confident	85.5	Confident	37 Å²	37	40.8 Å²	40.8	26%	0.259	22%	0.222	S	C	.	.			trans	-152.7	103.5	-179.9	179.9	0	0	0	0	111.1	V58 D64 L65 A66	V58-S62 CarbonylContact O-C 3.57Å; V58-S62 PolarHBondContact O-N 3.02Å; V58-S62 VanDerWaalsContact O-O 3.09Å; S62-D64 PolarHBondContact O-N 3.17Å; S62-L65 PolarHBondContact O-N 3.1Å; S62-L65 PolarHBondContact OG-N 3.18Å; S62-A66 PolarHBondContact O-N 3.29Å; S62-A66 VanDerWaalsContact O-N 3.13Å
63	S	82.8	Confident	85.4	Confident	71 Å²	71	36.8 Å²	36.8	50%	0.497	21%	0.206	S	C	.	.	H	α-helix	trans	-57.6	-33.7	173.6	61.1	0	0	0	0	113	A59 A66 N67	A59-S63 PolarHBondContact O-N 2.95Å; S63-A66 PolarHBondContact O-N 3.25Å; S63-N67 VanDerWaalsContact O-CG 3.3Å; S63-N67 PolarHBondContact O-N 3.25Å; S63-N67 VanDerWaalsContact O-N 3.08Å; S63-N67 PolarHBondContact O-ND2 3.02Å; S63-N67 VanDerWaalsContact O-ND2 3.16Å
64	D	85.1	Confident	85.3	Confident	100 Å²	100	39.1 Å²	39.1	54%	0.535	22%	0.22	S	C	.	.	H	α-helix	trans	-66.6	-41.1	178.1	-77.7	-34.7	0	0	0	112.1	R7 S62 A68	R7-D64 PolarHBondContact NH1-O 3.26Å; R7-D64 PolarHBondContact NH2-O 3.28Å; R7-D64 VanDerWaalsContact NH2-O 3.14Å; S62-D64 PolarHBondContact O-N 3.17Å; D64-A68 PolarHBondContact O-N 3.13Å
65	L	85	Confident	85.4	Confident	4 Å²	4	43.6 Å²	43.6	2%	0.021	23%	0.233	C	C	.	.	H	α-helix	trans	-67.1	-42.3	177.4	-176.6	63.2	0	0	0	110.7	V58 S62 N67 A68 I69 Y76	V58-L65 HydrophobicContact CG1-CB 4.2Å; V58-L65 HydrophobicContact CG1-CD2 3.87Å; V58-L65 HydrophobicContact CG1-CG 3.95Å; S62-L65 PolarHBondContact O-N 3.1Å; S62-L65 PolarHBondContact OG-N 3.18Å; L65-N67 PolarHBondContact O-N 2.76Å; L65-A68 WeakPolarHBondContact O-CB 3.4Å; L65-A68 PolarHBondContact O-N 3.48Å; L65-A68 VanDerWaalsContact O-N 3.12Å; L65-I69 HydrophobicContact CD1-CD1 4.49Å; L65-I69 HydrophobicContact CG-CD1 4.04Å; L65-I69 WeakPolarHBondContact O-CG1 3.31Å; L65-I69 PolarHBondContact O-N 3.18Å; L65-Y76 HydrophobicContact CD1-CD1 4.31Å; L65-Y76 HydrophobicContact CD1-CE1 3.86Å
66	A	84.7	Confident	85.6	Confident	1 Å²	1	43.9 Å²	43.9	1%	0.008	23%	0.234	C	C	.	.	H	α-helix	trans	-57.2	-50.1	175.9	0	0	0	0	0	112	I55 V58 A59 S62 S63 A68 I69 E70	I55-A66 HydrophobicContact CG2-CB 3.94Å; V58-A66 HydrophobicContact CG1-CB 4.26Å; A59-A66 HydrophobicContact CB-CB 3.82Å; S62-A66 PolarHBondContact O-N 3.29Å; S62-A66 VanDerWaalsContact O-N 3.13Å; S63-A66 PolarHBondContact O-N 3.25Å; A66-A68 PolarHBondContact O-N 3.21Å; A66-I69 PolarHBondContact O-N 3.41Å; A66-I69 VanDerWaalsContact O-N 3.17Å; A66-E70 WeakPolarHBondContact O-CG 3.41Å; A66-E70 PolarHBondContact O-N 2.87Å
67	N	86.4	Confident	85.7	Confident	72 Å²	72	43.7 Å²	43.7	39%	0.385	23%	0.234	S	C	.	.	H	α-helix	trans	-60.1	-32.8	176.8	-69.4	-31.4	0	0	0	112.6	S63 L65 C71	S63-N67 VanDerWaalsContact O-CG 3.3Å; S63-N67 PolarHBondContact O-N 3.25Å; S63-N67 VanDerWaalsContact O-N 3.08Å; S63-N67 PolarHBondContact O-ND2 3.02Å; S63-N67 VanDerWaalsContact O-ND2 3.16Å; L65-N67 PolarHBondContact O-N 2.76Å; N67-C71 PolarHBondContact O-N 3.3Å; N67-C71 VanDerWaalsContact O-N 3.15Å; N67-C71 PolarHBondContact O-SG 2.91Å
68	A	86.9	Confident	85.8	Confident	8 Å²	8	47.9 Å²	47.9	7%	0.066	25%	0.252	C	S	.	.	H	α-helix	trans	-66.2	-47.9	176.2	0	0	0	0	0	112.2	D64 L65 A66 E70 C71 N72 Y76	D64-A68 PolarHBondContact O-N 3.13Å; L65-A68 WeakPolarHBondContact O-CB 3.4Å; L65-A68 PolarHBondContact O-N 3.48Å; L65-A68 VanDerWaalsContact O-N 3.12Å; A66-A68 PolarHBondContact O-N 3.21Å; A68-E70 VanDerWaalsContact C-N 3.27Å; A68-E70 PolarHBondContact O-N 3.45Å; A68-C71 PolarHBondContact O-N 2.91Å; A68-C71 VanDerWaalsContact O-N 3.16Å; A68-N72 PolarHBondContact O-N 3.44Å; A68-Y76 VanDerWaalsContact C-CE2 3.4Å; A68-Y76 HydrophobicContact CB-CD2 4.43Å; A68-Y76 HydrophobicContact CB-CE1 4.27Å; A68-Y76 HydrophobicContact CB-CE2 3.46Å; A68-Y76 VanDerWaalsContact CB-CE2 3.46Å; A68-Y76 WeakPolarHBondContact CB-OH 3.43Å; A68-Y76 VanDerWaalsContact O-CE2 3.28Å; A68-Y76 WeakPolarHBondContact O-CE2 3.3Å
69	I	87.6	Confident	86	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-61.5	-42.4	178.9	-65.4	165.7	0	0	0	109.2	I55 V58 L65 A66 C71 N72 A73 Y76 F80 F156	I55-I69 HydrophobicContact CD1-CG2 4.31Å; V58-I69 HydrophobicContact CG1-CD1 3.9Å; L65-I69 HydrophobicContact CD1-CD1 4.49Å; L65-I69 HydrophobicContact CG-CD1 4.04Å; L65-I69 WeakPolarHBondContact O-CG1 3.31Å; L65-I69 PolarHBondContact O-N 3.18Å; A66-I69 PolarHBondContact O-N 3.41Å; A66-I69 VanDerWaalsContact O-N 3.17Å; I69-C71 VanDerWaalsContact C-N 3.3Å; I69-C71 PolarHBondContact O-N 3.36Å; I69-N72 CarbonylContact O-C 3.46Å; I69-N72 PolarHBondContact O-N 3.07Å; I69-A73 WeakPolarHBondContact O-CA 3.38Å; I69-A73 WeakPolarHBondContact O-CB 3.36Å; I69-A73 PolarHBondContact O-N 3.31Å; I69-Y76 HydrophobicContact CB-CD2 4.38Å; I69-Y76 HydrophobicContact CB-CG 4.42Å; I69-Y76 HydrophobicContact CG1-CD1 3.97Å; I69-Y76 HydrophobicContact CG1-CD2 4.01Å; I69-Y76 HydrophobicContact CG1-CG 3.65Å; I69-F80 HydrophobicContact CD1-CE2 3.8Å; I69-F80 HydrophobicContact CD1-CZ 4.22Å; I69-F80 HydrophobicContact CG1-CE2 4.46Å; I69-F156 HydrophobicContact CD1-CE1 4.45Å; I69-F156 HydrophobicContact CG2-CD1 4.17Å; I69-F156 HydrophobicContact CG2-CD2 3.92Å; I69-F156 HydrophobicContact CG2-CE1 4.08Å; I69-F156 HydrophobicContact CG2-CE2 3.78Å; I69-F156 HydrophobicContact CG2-CG 4.11Å; I69-F156 HydrophobicContact CG2-CZ 3.9Å
70	E	86.1	Confident	86.1	Confident	50 Å²	50	47.3 Å²	47.3	23%	0.234	25%	0.245	C	C	.	.	H	α-helix	trans	-62	-35.1	175.9	-72.5	-179.8	177.5	0	0	113	I55 A66 A68 R159 H177 L178	I55-E70 HydrophobicContact CD1-CG 4.31Å; A66-E70 WeakPolarHBondContact O-CG 3.41Å; A66-E70 PolarHBondContact O-N 2.87Å; A68-E70 VanDerWaalsContact C-N 3.27Å; A68-E70 PolarHBondContact O-N 3.45Å; E70-R159 WeakPolarHBondContact OE1-CD 3.2Å; E70-H177 CarbonylContact O-C 3.57Å; E70-H177 WeakPolarHBondContact O-CA 3.42Å; E70-H177 VanDerWaalsContact O-CB 3.32Å; E70-H177 WeakPolarHBondContact O-CB 3.41Å; E70-L178 PolarHBondContact O-N 3.01Å
71	C	86.4	Confident	86.3	Confident	43 Å²	43	41.1 Å²	41.1	29%	0.291	22%	0.218	S	C	.	.	H	α-helix	trans	-80	-33.8	178.9	-67.1	0	0	0	0	113.9	N67 A68 I69 G176	N67-C71 PolarHBondContact O-N 3.3Å; N67-C71 VanDerWaalsContact O-N 3.15Å; N67-C71 PolarHBondContact O-SG 2.91Å; A68-C71 PolarHBondContact O-N 2.91Å; A68-C71 VanDerWaalsContact O-N 3.16Å; I69-C71 VanDerWaalsContact C-N 3.3Å; I69-C71 PolarHBondContact O-N 3.36Å; C71-G176 CarbonylContact O-C 3.56Å
72	N	87.1	Confident	86.6	Confident	62 Å²	62	41 Å²	41	33%	0.332	22%	0.218	S	C	.	.			trans	-143.7	63.4	-175.4	-169	-9.5	0	0	0	112.4	A68 I69 V74 R75 Y76	A68-N72 PolarHBondContact O-N 3.44Å; I69-N72 CarbonylContact O-C 3.46Å; I69-N72 PolarHBondContact O-N 3.07Å; N72-V74 VanDerWaalsContact C-N 3.27Å; N72-V74 PolarHBondContact O-N 3.05Å; N72-R75 PolarHBondContact O-N 3.32Å; N72-R75 PolarHBondContact OD1-N 3.15Å; N72-Y76 VanDerWaalsContact O-CD2 3.23Å; N72-Y76 WeakPolarHBondContact O-CD2 3.39Å; N72-Y76 PolarHBondContact O-N 3.43Å
73	A	85.6	Confident	86.7	Confident	0 Å²	0	39.4 Å²	39.4	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-59.2	-35.4	-175.1	0	0	0	0	0	113.1	I69 R75 Y76 T77 F156 L178 V296	I69-A73 WeakPolarHBondContact O-CA 3.38Å; I69-A73 WeakPolarHBondContact O-CB 3.36Å; I69-A73 PolarHBondContact O-N 3.31Å; A73-R75 VanDerWaalsContact C-N 3.3Å; A73-R75 PolarHBondContact O-N 2.86Å; A73-Y76 PolarHBondContact O-N 2.89Å; A73-T77 WeakPolarHBondContact O-CG2 3.35Å; A73-T77 PolarHBondContact O-N 3.21Å; A73-T77 PolarHBondContact O-OG1 2.73Å; A73-F156 HydrophobicContact CB-CD2 4.48Å; A73-L178 HydrophobicContact CB-CB 4.19Å; A73-L178 HydrophobicContact CB-CD1 4.21Å; A73-V296 HydrophobicContact CB-CG2 3.49Å; A73-V296 VanDerWaalsContact CB-CG2 3.49Å
74	V	86.9	Confident	86.9	Confident	50 Å²	50	36 Å²	36	30%	0.303	18%	0.183	S	C	.	.	H	α-helix	trans	-62.2	-36.9	-177.5	-176.1	0	0	0	0	112.5	N72 T77 V296 L298	N72-V74 VanDerWaalsContact C-N 3.27Å; N72-V74 PolarHBondContact O-N 3.05Å; V74-T77 PolarHBondContact O-OG1 3.37Å; V74-V296 HydrophobicContact CG2-CG1 3.91Å; V74-L298 HydrophobicContact CG2-CD1 4.24Å; V74-L298 HydrophobicContact CG2-CD2 4.03Å
75	R	88.3	Confident	86.8	Confident	120 Å²	120	33.3 Å²	33.3	45%	0.453	17%	0.168	S	C	.	.	H	α-helix	trans	-76.2	-41.2	178.7	-162.8	171.4	-157.6	161.2	10.9	110.9	Y9 N72 A73 K78 I79	Y9-R75 HydrophobicContact CE1-CG 4.43Å; Y9-R75 PolarHBondContact OH-NH1 3Å; N72-R75 PolarHBondContact O-N 3.32Å; N72-R75 PolarHBondContact OD1-N 3.15Å; A73-R75 VanDerWaalsContact C-N 3.3Å; A73-R75 PolarHBondContact O-N 2.86Å; R75-K78 PolarHBondContact O-N 3.18Å; R75-I79 HydrophobicContact CG-CD1 4.23Å; R75-I79 WeakPolarHBondContact O-CG1 3.3Å; R75-I79 PolarHBondContact O-N 3.23Å
76	Y	89.4	Confident	86.8	Confident	8 Å²	8	37.9 Å²	37.9	3%	0.031	19%	0.192	C	C	.	.	H	α-helix	trans	-66.5	-36	177.8	-74.3	-75.5	0	0	0	112.2	D12 L65 A68 I69 N72 A73 K78 I79 F80	D12-Y76 HydrophobicContact CB-CE1 4.19Å; D12-Y76 WeakPolarHBondContact OD2-CE1 3.34Å; D12-Y76 PolarHBondContact OD2-OH 3.28Å; L65-Y76 HydrophobicContact CD1-CD1 4.31Å; L65-Y76 HydrophobicContact CD1-CE1 3.86Å; A68-Y76 VanDerWaalsContact C-CE2 3.4Å; A68-Y76 HydrophobicContact CB-CD2 4.43Å; A68-Y76 HydrophobicContact CB-CE1 4.27Å; A68-Y76 HydrophobicContact CB-CE2 3.46Å; A68-Y76 VanDerWaalsContact CB-CE2 3.46Å; A68-Y76 WeakPolarHBondContact CB-OH 3.43Å; A68-Y76 VanDerWaalsContact O-CE2 3.28Å; A68-Y76 WeakPolarHBondContact O-CE2 3.3Å; I69-Y76 HydrophobicContact CB-CD2 4.38Å; I69-Y76 HydrophobicContact CB-CG 4.42Å; I69-Y76 HydrophobicContact CG1-CD1 3.97Å; I69-Y76 HydrophobicContact CG1-CD2 4.01Å; I69-Y76 HydrophobicContact CG1-CG 3.65Å; N72-Y76 VanDerWaalsContact O-CD2 3.23Å; N72-Y76 WeakPolarHBondContact O-CD2 3.39Å; N72-Y76 PolarHBondContact O-N 3.43Å; A73-Y76 PolarHBondContact O-N 2.89Å; Y76-K78 VanDerWaalsContact C-N 3.27Å; Y76-K78 PolarHBondContact O-N 2.93Å; Y76-I79 HydrophobicContact CD1-CD1 4.33Å; Y76-I79 HydrophobicContact CE1-CD1 4.49Å; Y76-I79 PolarHBondContact O-N 2.92Å; Y76-F80 WeakPolarHBondContact O-CB 3.31Å; Y76-F80 VanDerWaalsContact O-CD2 3.29Å; Y76-F80 WeakPolarHBondContact O-CD2 3.15Å; Y76-F80 PolarHBondContact O-N 3.31Å
77	T	88	Confident	86.6	Confident	28 Å²	28	38 Å²	38	17%	0.172	19%	0.193	C	C	.	.	H	α-helix	trans	-58	-40.6	172.9	52.5	0	0	0	0	111.7	A73 V74 A81 F156	A73-T77 WeakPolarHBondContact O-CG2 3.35Å; A73-T77 PolarHBondContact O-N 3.21Å; A73-T77 PolarHBondContact O-OG1 2.73Å; V74-T77 PolarHBondContact O-OG1 3.37Å; T77-A81 WeakPolarHBondContact O-CB 3.44Å; T77-A81 PolarHBondContact O-N 3.33Å; T77-F156 HydrophobicContact CG2-CD2 3.69Å; T77-F156 HydrophobicContact CG2-CE2 3.31Å; T77-F156 HydrophobicContact CG2-CZ 4.26Å
78	K	87.4	Confident	86.2	Confident	95 Å²	95	36.3 Å²	36.3	41%	0.413	18%	0.184	S	C	.	.	H	α-helix	trans	-66	-44.9	175.4	-67.9	-173.8	178.6	-163.1	0	112.4	R75 Y76 A81 E82	R75-K78 PolarHBondContact O-N 3.18Å; Y76-K78 VanDerWaalsContact C-N 3.27Å; Y76-K78 PolarHBondContact O-N 2.93Å; K78-A81 PolarHBondContact O-N 3.42Å; K78-E82 WeakPolarHBondContact O-CG 3.21Å; K78-E82 PolarHBondContact O-N 2.91Å
79	I	89.4	Confident	85.5	Confident	15 Å²	15	39.8 Å²	39.8	8%	0.077	21%	0.206	C	C	.	.	H	α-helix	trans	-63	-47.1	178.4	-66	167.1	0	0	0	110.4	Y9 K13 R75 Y76 A81 E82 V83	Y9-I79 HydrophobicContact CD1-CD1 3.72Å; Y9-I79 HydrophobicContact CE1-CD1 4.48Å; Y9-I79 HydrophobicContact CG-CD1 4.36Å; K13-I79 HydrophobicContact CB-CG2 4.24Å; K13-I79 HydrophobicContact CG-CG2 4.31Å; R75-I79 HydrophobicContact CG-CD1 4.23Å; R75-I79 WeakPolarHBondContact O-CG1 3.3Å; R75-I79 PolarHBondContact O-N 3.23Å; Y76-I79 HydrophobicContact CD1-CD1 4.33Å; Y76-I79 HydrophobicContact CE1-CD1 4.49Å; Y76-I79 PolarHBondContact O-N 2.92Å; I79-A81 VanDerWaalsContact C-N 3.3Å; I79-A81 PolarHBondContact O-N 2.82Å; I79-E82 PolarHBondContact O-N 2.79Å; I79-V83 HydrophobicContact CG2-CG2 4.38Å; I79-V83 WeakPolarHBondContact O-CG2 3.43Å; I79-V83 PolarHBondContact O-N 2.94Å
80	F	88.5	Confident	84.9	Confident	0 Å²	0	45.1 Å²	45.1	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-59.2	-42.5	175.4	-91.1	-91.4	0	0	0	111.3	C16 F19 L20 I69 Y76 E82 V83 I84 V154 F156	C16-F80 HydrophobicContact CB-CE1 4.28Å; C16-F80 HydrophobicContact CB-CE2 4.43Å; C16-F80 HydrophobicContact CB-CZ 4.18Å; C16-F80 WeakPolarHBondContact SG-CE2 3.32Å; F19-F80 HydrophobicContact CD1-CE1 4.31Å; L20-F80 HydrophobicContact CD1-CD1 4.3Å; L20-F80 HydrophobicContact CD2-CE1 4.45Å; L20-F80 HydrophobicContact CG-CE1 4.47Å; I69-F80 HydrophobicContact CD1-CE2 3.8Å; I69-F80 HydrophobicContact CD1-CZ 4.22Å; I69-F80 HydrophobicContact CG1-CE2 4.46Å; Y76-F80 WeakPolarHBondContact O-CB 3.31Å; Y76-F80 VanDerWaalsContact O-CD2 3.29Å; Y76-F80 WeakPolarHBondContact O-CD2 3.15Å; Y76-F80 PolarHBondContact O-N 3.31Å; F80-E82 PolarHBondContact O-N 3.4Å; F80-V83 PolarHBondContact O-N 3.39Å; F80-I84 WeakPolarHBondContact O-CB 3.43Å; F80-I84 WeakPolarHBondContact O-CD1 3.31Å; F80-I84 WeakPolarHBondContact O-CG1 3.39Å; F80-I84 PolarHBondContact O-N 3.33Å; F80-V154 HydrophobicContact CB-CG1 4.33Å; F80-F156 HydrophobicContact CD2-CE1 4.09Å; F80-F156 AromaticContact CD2-CZ 3.74Å; F80-F156 HydrophobicContact CD2-CZ 3.74Å; F80-F156 HydrophobicContact CE2-CE1 4.1Å; F80-F156 HydrophobicContact CE2-CZ 4.06Å; F80-F156 HydrophobicContact CG-CE1 4.45Å; F80-F156 HydrophobicContact CG-CZ 4.28Å; F80-F156 HydrophobicContact CZ-CE1 4.49Å
81	A	86.9	Confident	84	Confident	11 Å²	11	45 Å²	45	9%	0.091	23%	0.233	C	C	.	.	H	α-helix	trans	-62.4	-41	176.1	0	0	0	0	0	112.5	T77 K78 I79 I84 D85	T77-A81 WeakPolarHBondContact O-CB 3.44Å; T77-A81 PolarHBondContact O-N 3.33Å; K78-A81 PolarHBondContact O-N 3.42Å; I79-A81 VanDerWaalsContact C-N 3.3Å; I79-A81 PolarHBondContact O-N 2.82Å; A81-I84 PolarHBondContact O-N 3.46Å; A81-D85 PolarHBondContact O-N 3.04Å
82	E	86.6	Confident	83.2	Confident	86 Å²	86	49 Å²	49	40%	0.402	24%	0.242	S	C	.	.	H	α-helix	trans	-65.2	-42.5	174.7	-72	174.5	-164.9	0	0	112.7	K78 I79 F80 I84 D85 D86 R150	K78-E82 WeakPolarHBondContact O-CG 3.21Å; K78-E82 PolarHBondContact O-N 2.91Å; I79-E82 PolarHBondContact O-N 2.79Å; F80-E82 PolarHBondContact O-N 3.4Å; E82-I84 VanDerWaalsContact C-N 3.32Å; E82-I84 PolarHBondContact O-N 3.22Å; E82-D85 WeakPolarHBondContact O-CB 3.27Å; E82-D85 PolarHBondContact O-N 3.43Å; E82-D86 PolarHBondContact O-N 2.96Å; E82-D86 VanDerWaalsContact O-N 3.09Å; E82-R150 VanDerWaalsContact CG-NH2 3.3Å
83	V	86.6	Confident	82.2	Confident	4 Å²	4	50.9 Å²	50.9	2%	0.024	26%	0.256	C	S	.	.	H	α-helix	trans	-62.4	-42.8	176	174.4	0	0	0	0	110.5	K13 C16 D17 L20 I79 F80 D86 L87	K13-V83 HydrophobicContact CD-CG2 4.25Å; K13-V83 HydrophobicContact CG-CG2 3.43Å; K13-V83 VanDerWaalsContact CG-CG2 3.43Å; C16-V83 HydrophobicContact CB-CG2 4.26Å; D17-V83 HydrophobicContact CB-CG1 3.93Å; L20-V83 HydrophobicContact CD1-CG1 3.83Å; I79-V83 HydrophobicContact CG2-CG2 4.38Å; I79-V83 WeakPolarHBondContact O-CG2 3.43Å; I79-V83 PolarHBondContact O-N 2.94Å; F80-V83 PolarHBondContact O-N 3.39Å; V83-D86 PolarHBondContact O-N 3.26Å; V83-L87 HydrophobicContact CG1-CD1 3.97Å; V83-L87 HydrophobicContact CG1-CG 4.36Å; V83-L87 VanDerWaalsContact O-CG 3.3Å; V83-L87 WeakPolarHBondContact O-CG 3.19Å; V83-L87 PolarHBondContact O-N 3.1Å
84	I	86.3	Confident	81.3	Confident	0 Å²	0	54.7 Å²	54.7	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-65.7	-41.5	178	-65.4	160.8	0	0	0	110.4	L20 L40 L51 F80 A81 E82 D86 L87 L88 F152 V154	L20-I84 HydrophobicContact CD1-CG1 3.85Å; L40-I84 HydrophobicContact CD2-CG1 4.14Å; L40-I84 HydrophobicContact CD2-CG2 3.76Å; L51-I84 HydrophobicContact CD2-CD1 3.51Å; L51-I84 HydrophobicContact CD2-CG1 4.46Å; F80-I84 WeakPolarHBondContact O-CB 3.43Å; F80-I84 WeakPolarHBondContact O-CD1 3.31Å; F80-I84 WeakPolarHBondContact O-CG1 3.39Å; F80-I84 PolarHBondContact O-N 3.33Å; A81-I84 PolarHBondContact O-N 3.46Å; E82-I84 VanDerWaalsContact C-N 3.32Å; E82-I84 PolarHBondContact O-N 3.22Å; I84-D86 PolarHBondContact O-N 3.14Å; I84-L87 PolarHBondContact O-N 3.41Å; I84-L88 HydrophobicContact CG2-CD1 4.27Å; I84-L88 HydrophobicContact CG2-CD2 4.34Å; I84-L88 HydrophobicContact CG2-CG 4Å; I84-L88 VanDerWaalsContact O-CG 3.27Å; I84-L88 WeakPolarHBondContact O-CG 3.44Å; I84-L88 PolarHBondContact O-N 2.89Å; I84-F152 HydrophobicContact CB-CE2 3.66Å; I84-F152 HydrophobicContact CB-CZ 3.61Å; I84-F152 HydrophobicContact CD1-CD2 4.46Å; I84-F152 HydrophobicContact CD1-CE2 3.86Å; I84-F152 HydrophobicContact CG1-CE2 4.39Å; I84-F152 HydrophobicContact CG2-CD1 4.39Å; I84-F152 HydrophobicContact CG2-CD2 4.04Å; I84-F152 HydrophobicContact CG2-CE1 3.84Å; I84-F152 HydrophobicContact CG2-CE2 3.41Å; I84-F152 VanDerWaalsContact CG2-CE2 3.41Å; I84-F152 HydrophobicContact CG2-CG 4.5Å; I84-F152 HydrophobicContact CG2-CZ 3.3Å; I84-V154 HydrophobicContact CD1-CG2 3.51Å
85	D	83.1	Confident	80.1	Confident	43 Å²	43	60.7 Å²	60.7	23%	0.23	30%	0.303	C	S	.	.	H	α-helix	trans	-55.5	-39.9	174.6	-71.1	-32.8	0	0	0	111.8	A81 E82 R150 F152	A81-D85 PolarHBondContact O-N 3.04Å; E82-D85 WeakPolarHBondContact O-CB 3.27Å; E82-D85 PolarHBondContact O-N 3.43Å; D85-R150 WeakPolarHBondContact OD1-CG 3.25Å; D85-R150 IonicContact OD1-NE 2.71Å; D85-R150 IonicContact OD2-CZ 3.46Å; D85-R150 VanDerWaalsContact OD2-CZ 3.26Å; D85-R150 IonicContact OD2-NE 2.61Å; D85-R150 PolarHBondContact OD2-NE 3.25Å; D85-R150 IonicContact OD2-NH2 3.75Å; D85-R150 PolarHBondContact OD2-NH2 3.1Å; D85-F152 VanDerWaalsContact OD1-CE1 3.28Å; D85-F152 WeakPolarHBondContact OD1-CE1 3.35Å; D85-F152 WeakPolarHBondContact OD1-CZ 3.48Å
86	D	84.2	Confident	79	Confident	99 Å²	99	57 Å²	57	53%	0.529	29%	0.293	S	S	.	.	H	α-helix	trans	-70.4	-31.3	176.7	-67.3	-27.9	0	0	0	112.3	K13 E82 V83 I84 P89	K13-D86 WeakPolarHBondContact CE-OD2 3.3Å; K13-D86 IonicContact NZ-OD2 3.67Å; K13-D86 PolarHBondContact NZ-OD2 3.34Å; E82-D86 PolarHBondContact O-N 2.96Å; E82-D86 VanDerWaalsContact O-N 3.09Å; V83-D86 PolarHBondContact O-N 3.26Å; I84-D86 PolarHBondContact O-N 3.14Å; D86-P89 WeakPolarHBondContact O-CD 3.44Å
87	L	81.7	Confident	77.7	Confident	3 Å²	3	61.6 Å²	61.6	2%	0.016	32%	0.321	C	S	.	.	H	α-helix	trans	-86.3	-29.3	-177.8	-71.8	-178	0	0	0	115.4	D17 L20 R21 L40 V83 I84 P89 D90 F91	D17-L87 VanDerWaalsContact OD1-CD2 3.32Å; D17-L87 WeakPolarHBondContact OD1-CD2 3.5Å; L20-L87 HydrophobicContact CB-CD1 4.03Å; L20-L87 HydrophobicContact CD1-CD1 4.05Å; R21-L87 HydrophobicContact CG-CD2 4.47Å; L40-L87 HydrophobicContact CD1-CD1 4.34Å; V83-L87 HydrophobicContact CG1-CD1 3.97Å; V83-L87 HydrophobicContact CG1-CG 4.36Å; V83-L87 VanDerWaalsContact O-CG 3.3Å; V83-L87 WeakPolarHBondContact O-CG 3.19Å; V83-L87 PolarHBondContact O-N 3.1Å; I84-L87 PolarHBondContact O-N 3.41Å; L87-P89 VanDerWaalsContact C-N 3.29Å; L87-D90 PolarHBondContact O-N 3.31Å; L87-F91 HydrophobicContact CB-CD2 4.43Å; L87-F91 HydrophobicContact CB-CE2 4.29Å; L87-F91 HydrophobicContact CD2-CE2 4.44Å; L87-F91 WeakPolarHBondContact O-CD2 2.9Å
88	L	77.7	Confident	76.5	Confident	38 Å²	38	63 Å²	63	20%	0.199	33%	0.331	C	S	.	.	T	Hydrogen-bonded Turn	trans	-52.6	-36.5	-176.9	-79	173.1	0	0	0	115.1	I43 A44 I84 D90 F152	I43-L88 HydrophobicContact CG2-CD2 3.93Å; A44-L88 HydrophobicContact CB-CD2 4.09Å; I84-L88 HydrophobicContact CG2-CD1 4.27Å; I84-L88 HydrophobicContact CG2-CD2 4.34Å; I84-L88 HydrophobicContact CG2-CG 4Å; I84-L88 VanDerWaalsContact O-CG 3.27Å; I84-L88 WeakPolarHBondContact O-CG 3.44Å; I84-L88 PolarHBondContact O-N 2.89Å; L88-D90 VanDerWaalsContact C-N 3.28Å; L88-D90 PolarHBondContact O-N 3.2Å; L88-F152 HydrophobicContact CD1-CD1 3.83Å; L88-F152 HydrophobicContact CD1-CE1 3.46Å; L88-F152 VanDerWaalsContact CD1-CE1 3.46Å; L88-F152 HydrophobicContact CD1-CZ 4.39Å
89	P	72.6	Confident	75.5	Confident	81 Å²	81	66.8 Å²	66.8	53%	0.526	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-33.7	176.6	-24.4	35.5	0	0	0	113.9	D86 L87	D86-P89 WeakPolarHBondContact O-CD 3.44Å; L87-P89 VanDerWaalsContact C-N 3.29Å
90	D	73.7	Confident	74.4	Confident	111 Å²	111	69.7 Å²	69.7	59%	0.594	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.6	-28.8	-173.2	-67.2	-12.8	0	0	0	112.4	R21 L87 L88	R21-D90 IonicContact NH2-OD2 3.03Å; R21-D90 PolarHBondContact NH2-OD2 2.82Å; L87-D90 PolarHBondContact O-N 3.31Å; L88-D90 VanDerWaalsContact C-N 3.28Å; L88-D90 PolarHBondContact O-N 3.2Å
91	F	67.6	Low	73.6	Confident	48 Å²	48	73.9 Å²	73.9	21%	0.211	39%	0.391	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.3	3.8	-174.6	-67.7	-76.4	0	0	0	114.3	L40 L87 T93	L40-F91 HydrophobicContact CB-CD2 4.44Å; L40-F91 HydrophobicContact CD1-CD2 4.49Å; L40-F91 HydrophobicContact CD1-CE2 4.25Å; L87-F91 HydrophobicContact CB-CD2 4.43Å; L87-F91 HydrophobicContact CB-CE2 4.29Å; L87-F91 HydrophobicContact CD2-CE2 4.44Å; L87-F91 WeakPolarHBondContact O-CD2 2.9Å; F91-T93 PolarHBondContact O-N 2.83Å; F91-T93 VanDerWaalsContact O-N 3.15Å
92	R	68.6	Low	72.8	Confident	128 Å²	128	76.6 Å²	76.6	48%	0.483	40%	0.404	S	S	.	.			trans	-73.6	108.6	-178.7	-173.4	177.9	177	-178.1	-0.1	110.6	V94 L96	R92-V94 WeakPolarHBondContact CG-O 3.31Å; R92-V94 PolarHBondContact NE-O 3.08Å; R92-V94 VanDerWaalsContact NE-O 3.1Å; R92-L96 VanDerWaalsContact NH2-N 3.11Å
93	T	66.7	Low	72	Confident	100 Å²	100	73.3 Å²	73.3	61%	0.613	39%	0.389	S	S	*	.			trans	-94.1	-24.7	178.8	49.7	0	0	0	0	113.2	T41 N45 F91	T41-T93 HydrophobicContact CG2-CG2 4.2Å; N45-T93 PolarHBondContact ND2-OG1 3.49Å; N45-T93 VanDerWaalsContact ND2-OG1 3.09Å; N45-T93 PolarHBondContact OD1-OG1 2.77Å; N45-T93 VanDerWaalsContact OD1-OG1 3.12Å; F91-T93 PolarHBondContact O-N 2.83Å; F91-T93 VanDerWaalsContact O-N 3.15Å
94	V	67.3	Low	71.4	Confident	81 Å²	81	77.1 Å²	77.1	49%	0.491	41%	0.408	S	S	.	.	S	Bend	trans	-117.7	138.6	-176.7	-176.2	0	0	0	0	111.8	R92 L96	R92-V94 WeakPolarHBondContact CG-O 3.31Å; R92-V94 PolarHBondContact NE-O 3.08Å; R92-V94 VanDerWaalsContact NE-O 3.1Å; V94-L96 PolarHBondContact O-N 3Å
95	E	62.5	Low	70.8	Confident	175 Å²	175	80.5 Å²	80.5	82%	0.818	42%	0.423	S	S	*	.			trans	-69.4	96.6	166.6	-73.4	-170.9	176.9	0	0	110.2	V97	E95-V97 PolarHBondContact O-N 3.36Å
96	L	63.6	Low	70.4	Confident	44 Å²	44	79.7 Å²	79.7	23%	0.23	42%	0.419	C	S	.	.			trans	-53.9	118.4	174.8	-57.7	161	0	0	0	112.4	R46 R92 V94	R46-L96 HydrophobicContact CB-CD2 4.35Å; R46-L96 HydrophobicContact CG-CD1 4.35Å; R46-L96 HydrophobicContact CG-CD2 3.67Å; R92-L96 VanDerWaalsContact NH2-N 3.11Å; V94-L96 PolarHBondContact O-N 3Å
97	V	63.3	Low	69.9	Low	104 Å²	104	77.1 Å²	77.1	63%	0.63	41%	0.405	S	S	*	.			trans	-74.2	133.1	159.6	-179.4	0	0	0	0	107.4	E95 Q99	E95-V97 PolarHBondContact O-N 3.36Å; V97-Q99 PolarHBondContact O-N 3.03Å
98	P	63.1	Low	69.6	Low	57 Å²	57	82.4 Å²	82.4	37%	0.37	43%	0.429	S	S	.	.			trans	-67.1	96.5	175.2	28.7	-34.3	0	0	0	109.1	D103 I104	P98-D103 HydrophobicContact CB-CB 4.13Å; P98-I104 HydrophobicContact CB-CG1 3.83Å; P98-I104 HydrophobicContact CG-CG1 4.39Å
99	Q	65.2	Low	69.3	Low	175 Å²	175	82.1 Å²	82.1	82%	0.818	43%	0.425	S	S	*	.			trans	-83.5	-33.1	-179.9	-68	-178.1	4.3	0	0	112.2	V97	V97-Q99 PolarHBondContact O-N 3.03Å
100	D	65.9	Low	69.3	Low	75 Å²	75	79.3 Å²	79.3	40%	0.401	41%	0.406	S	S	.	.	S	Bend	trans	-102	146.6	-169.3	-170.7	21.7	0	0	0	112.3	L102 D103 I104 R151	D100-L102 VanDerWaalsContact C-N 3.27Å; D100-L102 PolarHBondContact O-N 2.77Å; D100-D103 WeakPolarHBondContact O-CB 2.94Å; D100-D103 PolarHBondContact O-N 3.44Å; D100-I104 WeakPolarHBondContact O-CG1 3.43Å; D100-I104 PolarHBondContact O-N 2.99Å; D100-I104 VanDerWaalsContact O-N 3.17Å; D100-R151 IonicContact OD2-NH2 2.87Å
101	V	71.8	Confident	69.4	Low	89 Å²	89	80.1 Å²	80.1	54%	0.539	40%	0.4	S	S	.	.	H	α-helix	trans	-58.7	-41.1	-173	176.1	0	0	0	0	111.1	D103 I104 F105	V101-D103 PolarHBondContact O-N 3.24Å; V101-I104 PolarHBondContact O-N 3.48Å; V101-F105 HydrophobicContact CG1-CD2 3.64Å; V101-F105 HydrophobicContact CG1-CE2 3.29Å; V101-F105 HydrophobicContact CG1-CZ 4.41Å; V101-F105 WeakPolarHBondContact O-CD2 3.46Å; V101-F105 PolarHBondContact O-N 3.35Å; V101-F105 VanDerWaalsContact O-N 3.08Å
102	L	71.5	Confident	69.7	Low	68 Å²	68	82.7 Å²	82.7	36%	0.356	41%	0.414	S	S	.	.	H	α-helix	trans	-64.4	-37.6	178	-72.6	169.3	0	0	0	112.4	D100 F105 I106	D100-L102 VanDerWaalsContact C-N 3.27Å; D100-L102 PolarHBondContact O-N 2.77Å; L102-F105 PolarHBondContact O-N 3.27Å; L102-I106 WeakPolarHBondContact O-CB 3.23Å; L102-I106 WeakPolarHBondContact O-CD1 3.33Å; L102-I106 WeakPolarHBondContact O-CG1 3.33Å; L102-I106 PolarHBondContact O-N 3.28Å
103	D	69.8	Low	69.8	Low	16 Å²	16	78 Å²	78	9%	0.086	40%	0.398	C	S	.	.	H	α-helix	trans	-64.2	-47	176.3	-85.6	-43.7	0	0	0	111.2	R46 P98 D100 V101 F105 I106 D107 R151	R46-D103 IonicContact CZ-OD1 3.17Å; R46-D103 IonicContact CZ-OD2 3.01Å; R46-D103 IonicContact NH1-OD1 3.25Å; R46-D103 IonicContact NH1-OD2 3.66Å; R46-D103 PolarHBondContact NH1-OD2 2.76Å; R46-D103 IonicContact NH2-OD1 3.05Å; R46-D103 PolarHBondContact NH2-OD1 3.33Å; R46-D103 IonicContact NH2-OD2 2.82Å; R46-D103 PolarHBondContact NH2-OD2 2.94Å; R46-D103 VanDerWaalsContact NH2-OD2 3.13Å; P98-D103 HydrophobicContact CB-CB 4.13Å; D100-D103 WeakPolarHBondContact O-CB 2.94Å; D100-D103 PolarHBondContact O-N 3.44Å; V101-D103 PolarHBondContact O-N 3.24Å; D103-F105 PolarHBondContact O-N 2.75Å; D103-I106 PolarHBondContact O-N 3.11Å; D103-I106 VanDerWaalsContact O-N 3.16Å; D103-D107 VanDerWaalsContact O-CB 3.24Å; D103-D107 WeakPolarHBondContact O-CB 3.47Å; D103-D107 PolarHBondContact O-N 3.35Å; D103-R151 VanDerWaalsContact N-NH2 3.11Å; D103-R151 IonicContact OD1-CZ 3.64Å; D103-R151 IonicContact OD1-NE 3.6Å; D103-R151 PolarHBondContact OD1-NE 2.97Å; D103-R151 IonicContact OD1-NH1 2.82Å; D103-R151 PolarHBondContact OD1-NH1 3.33Å; D103-R151 IonicContact OD1-NH2 3.21Å; D103-R151 PolarHBondContact OD1-NH2 2.81Å; D103-R151 IonicContact OD2-CZ 3.9Å; D103-R151 IonicContact OD2-NE 3.48Å; D103-R151 IonicContact OD2-NH1 2.77Å; D103-R151 PolarHBondContact OD2-NH1 2.76Å; D103-R151 IonicContact OD2-NH2 2.72Å; D103-R151 PolarHBondContact OD2-NH2 3.33Å; D103-R151 VanDerWaalsContact OD2-NH2 3.07Å
104	I	74	Confident	70	Confident	84 Å²	84	76.2 Å²	76.2	43%	0.431	38%	0.382	S	S	.	.	H	α-helix	trans	-59.8	-40.9	-178.3	-62.6	167	0	0	0	108.8	P98 D100 V101 H108	P98-I104 HydrophobicContact CB-CG1 3.83Å; P98-I104 HydrophobicContact CG-CG1 4.39Å; D100-I104 WeakPolarHBondContact O-CG1 3.43Å; D100-I104 PolarHBondContact O-N 2.99Å; D100-I104 VanDerWaalsContact O-N 3.17Å; V101-I104 PolarHBondContact O-N 3.48Å; I104-H108 WeakPolarHBondContact O-CB 3.44Å; I104-H108 PolarHBondContact O-N 2.87Å
105	F	73.9	Confident	70.4	Confident	72 Å²	72	81 Å²	81	32%	0.316	39%	0.392	S	S	.	.	H	α-helix	trans	-66.9	-43.6	175.3	-77.3	-57.5	0	0	0	113.3	V101 L102 D103 H108 R109	V101-F105 HydrophobicContact CG1-CD2 3.64Å; V101-F105 HydrophobicContact CG1-CE2 3.29Å; V101-F105 HydrophobicContact CG1-CZ 4.41Å; V101-F105 WeakPolarHBondContact O-CD2 3.46Å; V101-F105 PolarHBondContact O-N 3.35Å; V101-F105 VanDerWaalsContact O-N 3.08Å; L102-F105 PolarHBondContact O-N 3.27Å; D103-F105 PolarHBondContact O-N 2.75Å; F105-H108 PolarHBondContact O-N 2.74Å; F105-R109 WeakPolarHBondContact O-CB 3.22Å; F105-R109 WeakPolarHBondContact O-CD 3.47Å; F105-R109 WeakPolarHBondContact O-CG 3.34Å; F105-R109 PolarHBondContact O-N 3.11Å
106	I	73.6	Confident	70.9	Confident	26 Å²	26	76.7 Å²	76.7	13%	0.133	37%	0.374	C	S	.	.	H	α-helix	trans	-64	-47	177.6	-69.6	164.3	0	0	0	110.2	L102 D103 R109 I110 L148 L149	L102-I106 WeakPolarHBondContact O-CB 3.23Å; L102-I106 WeakPolarHBondContact O-CD1 3.33Å; L102-I106 WeakPolarHBondContact O-CG1 3.33Å; L102-I106 PolarHBondContact O-N 3.28Å; D103-I106 PolarHBondContact O-N 3.11Å; D103-I106 VanDerWaalsContact O-N 3.16Å; I106-R109 WeakPolarHBondContact O-CB 3.26Å; I106-R109 PolarHBondContact O-N 3.08Å; I106-I110 HydrophobicContact CG2-CD1 3.7Å; I106-I110 HydrophobicContact CG2-CG1 4.35Å; I106-I110 VanDerWaalsContact O-CG1 3.27Å; I106-I110 WeakPolarHBondContact O-CG1 3.34Å; I106-I110 PolarHBondContact O-N 3.04Å; I106-L148 HydrophobicContact CD1-CD2 3.91Å; I106-L148 HydrophobicContact CG1-CD2 3.94Å; I106-L149 HydrophobicContact CD1-CD2 4.44Å; I106-L149 HydrophobicContact CG2-CD2 3.6Å
107	D	73.6	Confident	71.1	Confident	45 Å²	45	77.1 Å²	77.1	24%	0.241	37%	0.372	C	S	.	.	H	α-helix	trans	-63.9	-43.4	178.1	-173.1	27.3	0	0	0	111.1	D103 R109 I110 R111	D103-D107 VanDerWaalsContact O-CB 3.24Å; D103-D107 WeakPolarHBondContact O-CB 3.47Å; D103-D107 PolarHBondContact O-N 3.35Å; D107-R109 VanDerWaalsContact C-N 3.29Å; D107-R109 PolarHBondContact O-N 3.19Å; D107-I110 PolarHBondContact O-N 3.23Å; D107-R111 VanDerWaalsContact CG-CZ 3.49Å; D107-R111 WeakPolarHBondContact O-CB 3.47Å; D107-R111 WeakPolarHBondContact O-CG 3.32Å; D107-R111 PolarHBondContact O-N 3.31Å; D107-R111 IonicContact OD1-CZ 3Å; D107-R111 IonicContact OD1-NE 3.66Å; D107-R111 IonicContact OD1-NH1 2.73Å; D107-R111 IonicContact OD1-NH2 2.79Å; D107-R111 PolarHBondContact OD1-NH2 3.31Å; D107-R111 IonicContact OD2-CZ 3.9Å; D107-R111 IonicContact OD2-NH1 2.99Å; D107-R111 PolarHBondContact OD2-NH1 3.22Å; D107-R111 IonicContact OD2-NH2 3.7Å; D107-R111 PolarHBondContact OD2-NH2 3.45Å
108	H	75	Confident	71.5	Confident	113 Å²	113	74.3 Å²	74.3	52%	0.523	36%	0.359	S	S	.	.	H	α-helix	trans	-59.7	-40.2	173.2	-175.4	-85.9	0	0	0	111.9	I104 F105 M112	I104-H108 WeakPolarHBondContact O-CB 3.44Å; I104-H108 PolarHBondContact O-N 2.87Å; F105-H108 PolarHBondContact O-N 2.74Å; H108-M112 VanDerWaalsContact O-CB 3.23Å; H108-M112 WeakPolarHBondContact O-CB 3.35Å; H108-M112 PolarHBondContact O-N 2.9Å
109	R	71.6	Confident	71.8	Confident	33 Å²	33	73.7 Å²	73.7	13%	0.125	36%	0.359	C	S	.	.	H	α-helix	trans	-68.4	-45.4	176.9	-79	169.4	167.2	179.8	-8.8	112.6	F105 I106 D107 R111 M112 E113 E208 G246	F105-R109 WeakPolarHBondContact O-CB 3.22Å; F105-R109 WeakPolarHBondContact O-CD 3.47Å; F105-R109 WeakPolarHBondContact O-CG 3.34Å; F105-R109 PolarHBondContact O-N 3.11Å; I106-R109 WeakPolarHBondContact O-CB 3.26Å; I106-R109 PolarHBondContact O-N 3.08Å; D107-R109 VanDerWaalsContact C-N 3.29Å; D107-R109 PolarHBondContact O-N 3.19Å; R109-R111 VanDerWaalsContact C-N 3.3Å; R109-R111 PolarHBondContact O-N 2.83Å; R109-M112 PolarHBondContact O-N 2.83Å; R109-M112 VanDerWaalsContact O-N 3.15Å; R109-E113 PolarHBondContact O-N 3.2Å; R109-E208 IonicContact CZ-OE1 3.74Å; R109-E208 VanDerWaalsContact CZ-OE1 3.25Å; R109-E208 IonicContact CZ-OE2 3.52Å; R109-E208 IonicContact NE-OE1 3.33Å; R109-E208 PolarHBondContact NE-OE1 2.85Å; R109-E208 IonicContact NE-OE2 3.53Å; R109-E208 PolarHBondContact NE-OE2 2.78Å; R109-E208 IonicContact NH1-OE2 3.81Å; R109-E208 VanDerWaalsContact NH2-CD 3.33Å; R109-E208 IonicContact NH2-OE1 3.36Å; R109-E208 PolarHBondContact NH2-OE1 3.47Å; R109-E208 IonicContact NH2-OE2 3.72Å; R109-E208 PolarHBondContact NH2-OE2 3.06Å; R109-E208 VanDerWaalsContact NH2-OE2 3.17Å; R109-G246 PolarHBondContact NH1-O 2.88Å; R109-G246 VanDerWaalsContact NH2-CA 3.3Å
110	I	73.2	Confident	71.8	Confident	21 Å²	21	70.2 Å²	70.2	11%	0.108	35%	0.346	C	S	.	.	H	α-helix	trans	-58.6	-46.8	175.8	-69.2	167.5	0	0	0	109.3	I106 D107 M112 E113 Q114 M137 V140 F144	I106-I110 HydrophobicContact CG2-CD1 3.7Å; I106-I110 HydrophobicContact CG2-CG1 4.35Å; I106-I110 VanDerWaalsContact O-CG1 3.27Å; I106-I110 WeakPolarHBondContact O-CG1 3.34Å; I106-I110 PolarHBondContact O-N 3.04Å; D107-I110 PolarHBondContact O-N 3.23Å; I110-M112 PolarHBondContact O-N 3.36Å; I110-E113 PolarHBondContact O-N 3.5Å; I110-Q114 WeakPolarHBondContact O-CB 3.26Å; I110-Q114 WeakPolarHBondContact O-CG 2.93Å; I110-Q114 PolarHBondContact O-N 3.13Å; I110-M137 HydrophobicContact CG2-CE 3.91Å; I110-V140 HydrophobicContact CG2-CG1 4.45Å; I110-F144 HydrophobicContact CG1-CE2 4.24Å
111	R	75.1	Confident	71.8	Confident	129 Å²	129	70.1 Å²	70.1	49%	0.487	36%	0.356	S	S	.	.	H	α-helix	trans	-63.7	-37.8	175.5	-73.1	-170.6	-175.5	114.7	13.1	113	D107 R109 R115	D107-R111 VanDerWaalsContact CG-CZ 3.49Å; D107-R111 WeakPolarHBondContact O-CB 3.47Å; D107-R111 WeakPolarHBondContact O-CG 3.32Å; D107-R111 PolarHBondContact O-N 3.31Å; D107-R111 IonicContact OD1-CZ 3Å; D107-R111 IonicContact OD1-NE 3.66Å; D107-R111 IonicContact OD1-NH1 2.73Å; D107-R111 IonicContact OD1-NH2 2.79Å; D107-R111 PolarHBondContact OD1-NH2 3.31Å; D107-R111 IonicContact OD2-CZ 3.9Å; D107-R111 IonicContact OD2-NH1 2.99Å; D107-R111 PolarHBondContact OD2-NH1 3.22Å; D107-R111 IonicContact OD2-NH2 3.7Å; D107-R111 PolarHBondContact OD2-NH2 3.45Å; R109-R111 VanDerWaalsContact C-N 3.3Å; R109-R111 PolarHBondContact O-N 2.83Å; R111-R115 WeakPolarHBondContact O-CG 3.25Å; R111-R115 PolarHBondContact O-N 2.77Å; R111-R115 VanDerWaalsContact O-N 3.11Å
112	M	74	Confident	71.4	Confident	102 Å²	102	73.8 Å²	73.8	50%	0.502	37%	0.367	S	S	.	.	H	α-helix	trans	-68.6	-43.2	178.1	-172.6	177.1	178.8	0	0	111.3	H108 R109 I110 R115 I116	H108-M112 VanDerWaalsContact O-CB 3.23Å; H108-M112 WeakPolarHBondContact O-CB 3.35Å; H108-M112 PolarHBondContact O-N 2.9Å; R109-M112 PolarHBondContact O-N 2.83Å; R109-M112 VanDerWaalsContact O-N 3.15Å; I110-M112 PolarHBondContact O-N 3.36Å; M112-R115 WeakPolarHBondContact O-CB 3.41Å; M112-R115 PolarHBondContact O-N 3.09Å; M112-I116 HydrophobicContact CE-CD1 4.37Å; M112-I116 HydrophobicContact CG-CD1 4.18Å; M112-I116 WeakPolarHBondContact O-CG1 3.36Å; M112-I116 PolarHBondContact O-N 3.08Å
113	E	71.2	Confident	70.8	Confident	30 Å²	30	76.1 Å²	76.1	14%	0.14	38%	0.384	C	S	.	.	H	α-helix	trans	-66.2	-38.4	176.6	-168.9	178.3	177.1	0	0	111.5	R109 I110 R115 I116 R117 R143 F144	R109-E113 PolarHBondContact O-N 3.2Å; I110-E113 PolarHBondContact O-N 3.5Å; E113-R115 VanDerWaalsContact C-N 3.31Å; E113-R115 PolarHBondContact O-N 3.01Å; E113-I116 PolarHBondContact O-N 3.23Å; E113-R117 PolarHBondContact O-N 3.37Å; E113-R117 IonicContact OE1-NE 3.66Å; E113-R117 IonicContact OE1-NH2 2.77Å; E113-R143 VanDerWaalsContact OE1-CD 3.26Å; E113-R143 WeakPolarHBondContact OE1-CD 3.2Å; E113-R143 IonicContact OE1-CZ 2.68Å; E113-R143 IonicContact OE1-NE 3.7Å; E113-R143 IonicContact OE1-NH1 3.16Å; E113-R143 PolarHBondContact OE1-NH1 2.77Å; E113-F144 WeakPolarHBondContact OE2-CE2 3.39Å; E113-F144 VanDerWaalsContact OE2-CZ 3.26Å; E113-F144 WeakPolarHBondContact OE2-CZ 3.19Å
114	Q	72	Confident	70.2	Confident	61 Å²	61	78 Å²	78	29%	0.285	40%	0.402	S	S	.	.	H	α-helix	trans	-56.6	-44.8	171.2	-76.5	170.9	-6.2	0	0	111.7	I110 A118 M137	I110-Q114 WeakPolarHBondContact O-CB 3.26Å; I110-Q114 WeakPolarHBondContact O-CG 2.93Å; I110-Q114 PolarHBondContact O-N 3.13Å; Q114-A118 WeakPolarHBondContact O-CB 3.49Å; Q114-A118 PolarHBondContact O-N 3.1Å; Q114-M137 PolarHBondContact NE2-SD 3.31Å
115	R	75.2	Confident	69	Low	182 Å²	182	79.8 Å²	79.8	69%	0.687	42%	0.419	S	S	*	.	H	α-helix	trans	-64.8	-42.3	177	-73.5	177.7	-174.1	171.2	2.4	112.4	R111 M112 E113 A118 A119	R111-R115 WeakPolarHBondContact O-CG 3.25Å; R111-R115 PolarHBondContact O-N 2.77Å; R111-R115 VanDerWaalsContact O-N 3.11Å; M112-R115 WeakPolarHBondContact O-CB 3.41Å; M112-R115 PolarHBondContact O-N 3.09Å; E113-R115 VanDerWaalsContact C-N 3.31Å; E113-R115 PolarHBondContact O-N 3.01Å; R115-A118 PolarHBondContact O-N 2.78Å; R115-A119 WeakPolarHBondContact O-CB 3.48Å; R115-A119 PolarHBondContact O-N 2.97Å
116	I	71.7	Confident	67.7	Low	85 Å²	85	88.7 Å²	88.7	44%	0.436	45%	0.45	S	S	.	.	H	α-helix	trans	-63.6	-47.4	178.6	-66.9	166.1	0	0	0	110.1	M112 E113 A118 A119 D120	M112-I116 HydrophobicContact CE-CD1 4.37Å; M112-I116 HydrophobicContact CG-CD1 4.18Å; M112-I116 WeakPolarHBondContact O-CG1 3.36Å; M112-I116 PolarHBondContact O-N 3.08Å; E113-I116 PolarHBondContact O-N 3.23Å; I116-A118 VanDerWaalsContact C-N 3.34Å; I116-A118 PolarHBondContact O-N 3.31Å; I116-A119 PolarHBondContact O-N 2.98Å; I116-D120 PolarHBondContact O-N 2.64Å
117	R	69	Low	66.1	Low	53 Å²	53	91.3 Å²	91.3	20%	0.2	48%	0.476	C	S	.	.	H	α-helix	trans	-64	-37.5	177.1	-75.3	-162.6	-168.4	-174.6	9.5	112.8	E113 A119 D120 A121 E139 R143	E113-R117 PolarHBondContact O-N 3.37Å; E113-R117 IonicContact OE1-NE 3.66Å; E113-R117 IonicContact OE1-NH2 2.77Å; R117-A119 VanDerWaalsContact C-N 3.35Å; R117-D120 PolarHBondContact O-N 3.12Å; R117-A121 WeakPolarHBondContact O-CB 3.33Å; R117-A121 PolarHBondContact O-N 2.68Å; R117-E139 IonicContact NH1-OE2 3.41Å; R117-E139 PolarHBondContact NH2-O 3.5Å; R117-E139 VanDerWaalsContact NH2-O 3.11Å; R117-R143 VanDerWaalsContact NH2-CZ 3.28Å; R117-R143 VanDerWaalsContact NH2-NE 3.12Å
118	A	70.8	Confident	64.6	Low	44 Å²	44	95 Å²	95	36%	0.364	50%	0.5	S	S	.	.	H	α-helix	trans	-62.8	-43.6	175.3	0	0	0	0	0	111.1	Q114 R115 I116 A121 E122	Q114-A118 WeakPolarHBondContact O-CB 3.49Å; Q114-A118 PolarHBondContact O-N 3.1Å; R115-A118 PolarHBondContact O-N 2.78Å; I116-A118 VanDerWaalsContact C-N 3.34Å; I116-A118 PolarHBondContact O-N 3.31Å; A118-A121 PolarHBondContact O-N 2.75Å; A118-E122 WeakPolarHBondContact O-CG 3.23Å; A118-E122 PolarHBondContact O-N 3.29Å
119	A	69	Low	62.9	Low	44 Å²	44	95.5 Å²	95.5	36%	0.364	52%	0.516	S	S	.	.	H	α-helix	trans	-65	-40	175.7	0	0	0	0	0	112.5	R115 I116 R117 A121 E122 T123	R115-A119 WeakPolarHBondContact O-CB 3.48Å; R115-A119 PolarHBondContact O-N 2.97Å; I116-A119 PolarHBondContact O-N 2.98Å; R117-A119 VanDerWaalsContact C-N 3.35Å; A119-A121 VanDerWaalsContact C-N 3.33Å; A119-E122 PolarHBondContact O-N 3.02Å; A119-T123 WeakPolarHBondContact O-CB 3.38Å; A119-T123 PolarHBondContact O-N 2.93Å; A119-T123 PolarHBondContact O-OG1 2.96Å
120	D	66	Low	61.5	Low	103 Å²	103	103.3 Å²	103.3	55%	0.551	55%	0.546	S	S	*	.	H	α-helix	trans	-64.9	-38.4	175.6	-72.6	-21.5	0	0	0	111.5	I116 R117 T123 A124	I116-D120 PolarHBondContact O-N 2.64Å; R117-D120 PolarHBondContact O-N 3.12Å; D120-T123 PolarHBondContact O-N 3.33Å; D120-A124 PolarHBondContact O-N 3.1Å; D120-A124 VanDerWaalsContact O-N 3.11Å
121	A	65.5	Low	60	Low	72 Å²	72	109.3 Å²	109.3	60%	0.595	58%	0.578	S	S	*	*	H	α-helix	trans	-66.7	-36.4	175.2	0	0	0	0	0	112.3	R117 A118 A119	R117-A121 WeakPolarHBondContact O-CB 3.33Å; R117-A121 PolarHBondContact O-N 2.68Å; A118-A121 PolarHBondContact O-N 2.75Å; A119-A121 VanDerWaalsContact C-N 3.33Å
122	E	63.7	Low	58.6	Low	167 Å²	167	109.1 Å²	109.1	78%	0.78	59%	0.594	S	S	*	*	H	α-helix	trans	-70.8	-29.7	174.9	-74	178.9	-179.2	0	0	113	A118 A119	A118-E122 WeakPolarHBondContact O-CG 3.23Å; A118-E122 PolarHBondContact O-N 3.29Å; A119-E122 PolarHBondContact O-N 3.02Å
123	T	59	Low	57.3	Low	117 Å²	117	111.5 Å²	111.5	72%	0.718	60%	0.604	S	S	*	*	H	α-helix	trans	-87.8	-16.9	-176.9	-47.7	0	0	0	0	112.7	A119 D120	A119-T123 WeakPolarHBondContact O-CB 3.38Å; A119-T123 PolarHBondContact O-N 2.93Å; A119-T123 PolarHBondContact O-OG1 2.96Å; D120-T123 PolarHBondContact O-N 3.33Å
124	A	56.4	Low	56.2	Low	56 Å²	56	115.6 Å²	115.6	46%	0.463	63%	0.633	S	S	.	*	S	Bend	trans	-64.4	134.9	175.3	0	0	0	0	0	111.2	D120 R126	D120-A124 PolarHBondContact O-N 3.1Å; D120-A124 VanDerWaalsContact O-N 3.11Å; A124-R126 PolarHBondContact O-N 3.08Å
125	P	49.2	Very low	55.1	Low	120 Å²	120	116.3 Å²	116.3	78%	0.779	64%	0.641	S	S	*	*			trans	-59	128.8	-176.8	22.7	-31.4	0	0	0	110.6	A127	P125-A127 PolarHBondContact O-N 2.79Å
126	R	47.1	Very low	53.9	Low	259 Å²	259	112.5 Å²	112.5	98%	0.977	63%	0.634	S	S	*	*			trans	-58.4	54	-177	-69	-180	167.7	174	-4	115.3	A124	A124-R126 PolarHBondContact O-N 3.08Å
127	A	40.1	Very low	53	Low	82 Å²	82	111.6 Å²	111.6	68%	0.678	63%	0.629	S	S	*	*			trans	-106.5	116.2	171.8	0	0	0	0	0	108.6	P125	P125-A127 PolarHBondContact O-N 2.79Å
128	V	42.7	Very low	52.2	Low	121 Å²	121	112.2 Å²	112.2	73%	0.733	65%	0.645	S	S	*	*	S	Bend	trans	90	98.5	-179.8	-165	0	0	0	0	114.1	R130	V128-R130 VanDerWaalsContact C-N 3.29Å; V128-R130 HydrophobicContact CG1-CG 4.32Å; V128-R130 PolarHBondContact O-N 2.92Å
129	S	37.6	Very low	51.5	Low	125 Å²	125	115.2 Å²	115.2	87%	0.874	65%	0.652	S	S	*	*			trans	-55	87.3	158.3	49.4	0	0	0	0	110.7
130	R	42.6	Very low	50.9	Low	197 Å²	197	113.1 Å²	113.1	74%	0.743	64%	0.635	S	S	*	*			trans	-115.9	130.5	153.7	-85.5	-177.7	174.1	-177.2	-2.7	106.3	V128	V128-R130 VanDerWaalsContact C-N 3.29Å; V128-R130 HydrophobicContact CG1-CG 4.32Å; V128-R130 PolarHBondContact O-N 2.92Å
131	D	42.4	Very low	50.6	Low	146 Å²	146	114.8 Å²	114.8	78%	0.781	63%	0.633	S	S	*	*			trans	-45	142.8	173.2	-61.6	-56	0	0	0	109.7	E133	D131-E133 PolarHBondContact O-N 3.02Å
132	P	44.8	Very low	50.3	Low	126 Å²	126	115.7 Å²	115.7	82%	0.818	64%	0.635	S	S	*	*			trans	-60	102	177.2	24.2	-30.9	0	0	0	108
133	E	46.3	Very low	50.4	Low	152 Å²	152	115 Å²	115	71%	0.71	63%	0.626	S	S	*	*			trans	-56.2	129.7	175	-73.2	-179.5	176.4	0	0	107.3	D131 V135	D131-E133 PolarHBondContact O-N 3.02Å; E133-V135 PolarHBondContact O-N 2.96Å; E133-V135 VanDerWaalsContact O-N 3.14Å
134	P	48.9	Very low	51	Low	116 Å²	116	110.1 Å²	110.1	75%	0.753	60%	0.595	S	S	*	*			trans	-54.8	127.3	-179.4	22.6	-32	0	0	0	107.9	N136	P134-N136 PolarHBondContact O-N 3.31Å
135	V	49	Very low	51.8	Low	76 Å²	76	108.3 Å²	108.3	46%	0.461	58%	0.578	S	S	.	*			trans	-45.3	107.4	-179.5	178.9	0	0	0	0	108	E133 M137 V140	E133-V135 PolarHBondContact O-N 2.96Å; E133-V135 VanDerWaalsContact O-N 3.14Å; V135-M137 VanDerWaalsContact C-N 3.34Å; V135-M137 PolarHBondContact O-N 3.16Å; V135-V140 HydrophobicContact CG1-CG2 4.01Å
136	N	49.6	Very low	53	Low	102 Å²	102	105.6 Å²	105.6	55%	0.545	56%	0.56	S	S	.	*			trans	-70.2	100.5	-173.7	-135	-9.4	0	0	0	106	P134 A138 E139	P134-N136 PolarHBondContact O-N 3.31Å; N136-A138 PolarHBondContact O-N 3.39Å; N136-E139 HydrophobicContact CB-CG 4.22Å; N136-E139 PolarHBondContact O-N 2.74Å
137	M	52.3	Low	54.3	Low	65 Å²	65	95 Å²	95	32%	0.32	52%	0.522	S	S	.	.	H	α-helix	trans	-52.8	-26.8	-177.9	-86.1	-58.1	-46.9	0	0	111.9	I110 Q114 V135 V140 R141	I110-M137 HydrophobicContact CG2-CE 3.91Å; Q114-M137 PolarHBondContact NE2-SD 3.31Å; V135-M137 VanDerWaalsContact C-N 3.34Å; V135-M137 PolarHBondContact O-N 3.16Å; M137-V140 PolarHBondContact O-N 2.74Å; M137-R141 HydrophobicContact CE-CG 4.28Å; M137-R141 WeakPolarHBondContact O-CB 3.39Å; M137-R141 VanDerWaalsContact O-CG 3.27Å; M137-R141 WeakPolarHBondContact O-CG 3.32Å; M137-R141 PolarHBondContact O-N 3.4Å
138	A	54.2	Low	56.1	Low	66 Å²	66	91.6 Å²	91.6	55%	0.545	49%	0.492	S	S	.	.	H	α-helix	trans	-59.9	-41.2	172.4	0	0	0	0	0	113.5	N136 R141 S142	N136-A138 PolarHBondContact O-N 3.39Å; A138-R141 PolarHBondContact O-N 2.86Å; A138-S142 VanDerWaalsContact O-CB 3.28Å; A138-S142 WeakPolarHBondContact O-CB 3.43Å; A138-S142 PolarHBondContact O-N 3.36Å; A138-S142 PolarHBondContact O-OG 2.97Å
139	E	55.3	Low	57.6	Low	108 Å²	108	88.6 Å²	88.6	51%	0.505	47%	0.472	S	S	.	.	H	α-helix	trans	-77.3	-24.9	-179.3	-70.5	-174.8	-178.9	0	0	113.9	R117 N136 S142	R117-E139 IonicContact NH1-OE2 3.41Å; R117-E139 PolarHBondContact NH2-O 3.5Å; R117-E139 VanDerWaalsContact NH2-O 3.11Å; N136-E139 HydrophobicContact CB-CG 4.22Å; N136-E139 PolarHBondContact O-N 2.74Å; E139-S142 WeakPolarHBondContact CA-OG 3.3Å; E139-S142 PolarHBondContact O-OG 3.09Å; E139-S142 VanDerWaalsContact O-OG 3.05Å
140	V	56.1	Low	59.4	Low	0 Å²	0	84 Å²	84	0%	0	44%	0.435	C	S	.	.	H	α-helix	trans	-76	-44.5	171.7	177.8	0	0	0	0	108.3	I110 V135 M137 S142 R143 F144	I110-V140 HydrophobicContact CG2-CG1 4.45Å; V135-V140 HydrophobicContact CG1-CG2 4.01Å; M137-V140 PolarHBondContact O-N 2.74Å; V140-S142 VanDerWaalsContact C-N 3.33Å; V140-S142 PolarHBondContact O-N 3.37Å; V140-R143 PolarHBondContact O-N 3.23Å; V140-F144 HydrophobicContact CG1-CE2 4.11Å; V140-F144 WeakPolarHBondContact O-CD2 3.45Å; V140-F144 VanDerWaalsContact O-CE2 3.27Å; V140-F144 WeakPolarHBondContact O-CE2 3.44Å
141	R	59.2	Low	61	Low	137 Å²	137	79 Å²	79	52%	0.517	42%	0.416	S	S	.	.	H	α-helix	trans	-63	-36.2	175.1	-75.5	178.5	177.6	-175	0.7	113.1	M137 A138 R143 F144	M137-R141 HydrophobicContact CE-CG 4.28Å; M137-R141 WeakPolarHBondContact O-CB 3.39Å; M137-R141 VanDerWaalsContact O-CG 3.27Å; M137-R141 WeakPolarHBondContact O-CG 3.32Å; M137-R141 PolarHBondContact O-N 3.4Å; A138-R141 PolarHBondContact O-N 2.86Å; R141-R143 PolarHBondContact O-N 2.91Å; R141-R143 VanDerWaalsContact O-N 3.17Å; R141-F144 PolarHBondContact O-N 2.79Å; R141-F144 VanDerWaalsContact O-O 3.13Å
142	S	60	Low	63.1	Low	92 Å²	92	72.7 Å²	72.7	64%	0.643	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.8	-15.7	-177.8	69.8	0	0	0	0	114.4	A138 E139 V140	A138-S142 VanDerWaalsContact O-CB 3.28Å; A138-S142 WeakPolarHBondContact O-CB 3.43Å; A138-S142 PolarHBondContact O-N 3.36Å; A138-S142 PolarHBondContact O-OG 2.97Å; E139-S142 WeakPolarHBondContact CA-OG 3.3Å; E139-S142 PolarHBondContact O-OG 3.09Å; E139-S142 VanDerWaalsContact O-OG 3.05Å; V140-S142 VanDerWaalsContact C-N 3.33Å; V140-S142 PolarHBondContact O-N 3.37Å
143	R	65.3	Low	65.1	Low	153 Å²	153	68.5 Å²	68.5	58%	0.577	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.1	-23.5	172.9	-75	-174.5	177.5	179.3	-3.4	112.9	E113 R117 V140 R141	E113-R143 VanDerWaalsContact OE1-CD 3.26Å; E113-R143 WeakPolarHBondContact OE1-CD 3.2Å; E113-R143 IonicContact OE1-CZ 2.68Å; E113-R143 IonicContact OE1-NE 3.7Å; E113-R143 IonicContact OE1-NH1 3.16Å; E113-R143 PolarHBondContact OE1-NH1 2.77Å; R117-R143 VanDerWaalsContact NH2-CZ 3.28Å; R117-R143 VanDerWaalsContact NH2-NE 3.12Å; V140-R143 PolarHBondContact O-N 3.23Å; R141-R143 PolarHBondContact O-N 2.91Å; R141-R143 VanDerWaalsContact O-N 3.17Å
144	F	71.7	Confident	67.1	Low	14 Å²	14	62 Å²	62	6%	0.061	32%	0.322	C	S	.	.	S	Bend	trans	-89	129.2	176.9	-58	-77.8	0	0	0	108.7	I110 E113 V140 R141 L149 Y210	I110-F144 HydrophobicContact CG1-CE2 4.24Å; E113-F144 WeakPolarHBondContact OE2-CE2 3.39Å; E113-F144 VanDerWaalsContact OE2-CZ 3.26Å; E113-F144 WeakPolarHBondContact OE2-CZ 3.19Å; V140-F144 HydrophobicContact CG1-CE2 4.11Å; V140-F144 WeakPolarHBondContact O-CD2 3.45Å; V140-F144 VanDerWaalsContact O-CE2 3.27Å; V140-F144 WeakPolarHBondContact O-CE2 3.44Å; R141-F144 PolarHBondContact O-N 2.79Å; R141-F144 VanDerWaalsContact O-O 3.13Å; F144-L149 HydrophobicContact CB-CD1 4.33Å; F144-L149 HydrophobicContact CB-CG 4.48Å; F144-Y210 HydrophobicContact CD1-CE1 4.37Å; F144-Y210 AromaticContact CD1-CE2 3.85Å; F144-Y210 HydrophobicContact CD1-CE2 3.85Å; F144-Y210 AromaticContact CD1-CZ 3.71Å; F144-Y210 HydrophobicContact CE1-CE2 4.08Å; F144-Y210 AromaticContact CE1-CZ 3.79Å; F144-Y210 VanDerWaalsContact CE1-OH 3.23Å; F144-Y210 WeakPolarHBondContact CE1-OH 3.49Å
145	P	72.5	Confident	69	Low	17 Å²	17	57.1 Å²	57.1	11%	0.11	29%	0.289	C	S	.	.			trans	-59.6	135.5	173.2	23.3	-30.7	0	0	0	109.2	E147 L148 T197 Y210 E212	P145-E147 PolarHBondContact O-N 3.28Å; P145-E147 VanDerWaalsContact O-N 3.11Å; P145-L148 HydrophobicContact CG-CB 4.15Å; P145-L148 WeakPolarHBondContact O-CB 3.4Å; P145-L148 PolarHBondContact O-N 3.21Å; P145-T197 HydrophobicContact CG-CG2 4.47Å; P145-Y210 HydrophobicContact CG-CG 4.25Å; P145-E212 HydrophobicContact CB-CG 4.39Å; P145-E212 WeakPolarHBondContact CB-OE1 3.35Å
146	P	74.6	Confident	71	Confident	63 Å²	63	53.5 Å²	53.5	41%	0.409	27%	0.267	S	S	.	.	H	α-helix	trans	-58.4	-30.7	-177.1	23.9	-33.4	0	0	0	111.1	L148 L149 R150	P146-L148 PolarHBondContact O-N 2.9Å; P146-L148 VanDerWaalsContact O-N 3.15Å; P146-L149 PolarHBondContact O-N 3.31Å; P146-R150 VanDerWaalsContact O-CG 3.29Å; P146-R150 WeakPolarHBondContact O-CG 3.35Å; P146-R150 PolarHBondContact O-N 3.47Å
147	E	74.6	Confident	72.6	Confident	36 Å²	36	49.8 Å²	49.8	17%	0.168	25%	0.248	C	C	.	.	H	α-helix	trans	-57.2	-29.3	175.4	-64.8	-170.6	171.5	0	0	114.2	P145 T197 K248	P145-E147 PolarHBondContact O-N 3.28Å; P145-E147 VanDerWaalsContact O-N 3.11Å; E147-T197 HydrophobicContact CB-CG2 4.04Å; E147-K248 WeakPolarHBondContact O-CD 3.46Å; E147-K248 PolarHBondContact O-NZ 3.13Å
148	L	77.5	Confident	73.9	Confident	12 Å²	12	47.3 Å²	47.3	6%	0.063	24%	0.239	C	C	.	.	H	α-helix	trans	-75.3	-34.2	176.3	-172.2	146.6	0	0	0	111.7	I106 P145 P146 T199 Y210	I106-L148 HydrophobicContact CD1-CD2 3.91Å; I106-L148 HydrophobicContact CG1-CD2 3.94Å; P145-L148 HydrophobicContact CG-CB 4.15Å; P145-L148 WeakPolarHBondContact O-CB 3.4Å; P145-L148 PolarHBondContact O-N 3.21Å; P146-L148 PolarHBondContact O-N 2.9Å; P146-L148 VanDerWaalsContact O-N 3.15Å; L148-T199 HydrophobicContact CD1-CG2 4.12Å; L148-Y210 HydrophobicContact CD1-CD1 3.66Å; L148-Y210 HydrophobicContact CD1-CE1 3.75Å
149	L	75.5	Confident	75.1	Confident	57 Å²	57	47.8 Å²	47.8	30%	0.298	23%	0.227	S	C	.	.	H	α-helix	trans	-84.1	-26.5	179.6	-63.1	176.4	0	0	0	112.6	I106 F144 P146 R151	I106-L149 HydrophobicContact CD1-CD2 4.44Å; I106-L149 HydrophobicContact CG2-CD2 3.6Å; F144-L149 HydrophobicContact CB-CD1 4.33Å; F144-L149 HydrophobicContact CB-CG 4.48Å; P146-L149 PolarHBondContact O-N 3.31Å; L149-R151 PolarHBondContact O-N 2.86Å
150	R	75.8	Confident	76.1	Confident	29 Å²	29	47.5 Å²	47.5	11%	0.109	24%	0.237	C	C	.	.			trans	-59.9	121.4	177.7	-79.7	173.3	-171.7	175.2	1	110.6	E82 D85 P146 F152 K248	E82-R150 VanDerWaalsContact CG-NH2 3.3Å; D85-R150 WeakPolarHBondContact OD1-CG 3.25Å; D85-R150 IonicContact OD1-NE 2.71Å; D85-R150 IonicContact OD2-CZ 3.46Å; D85-R150 VanDerWaalsContact OD2-CZ 3.26Å; D85-R150 IonicContact OD2-NE 2.61Å; D85-R150 PolarHBondContact OD2-NE 3.25Å; D85-R150 IonicContact OD2-NH2 3.75Å; D85-R150 PolarHBondContact OD2-NH2 3.1Å; P146-R150 VanDerWaalsContact O-CG 3.29Å; P146-R150 WeakPolarHBondContact O-CG 3.35Å; P146-R150 PolarHBondContact O-N 3.47Å; R150-F152 HydrophobicContact CG-CE1 4.42Å; R150-K248 PolarHBondContact O-NZ 2.86Å
151	R	76	Confident	76.9	Confident	91 Å²	91	53.6 Å²	53.6	34%	0.343	27%	0.27	S	S	.	.			trans	-112.5	-10.2	175.6	-76.1	167.7	158.1	-108.7	-18.2	113.4	D100 D103 L149	D100-R151 IonicContact OD2-NH2 2.87Å; D103-R151 VanDerWaalsContact N-NH2 3.11Å; D103-R151 IonicContact OD1-CZ 3.64Å; D103-R151 IonicContact OD1-NE 3.6Å; D103-R151 PolarHBondContact OD1-NE 2.97Å; D103-R151 IonicContact OD1-NH1 2.82Å; D103-R151 PolarHBondContact OD1-NH1 3.33Å; D103-R151 IonicContact OD1-NH2 3.21Å; D103-R151 PolarHBondContact OD1-NH2 2.81Å; D103-R151 IonicContact OD2-CZ 3.9Å; D103-R151 IonicContact OD2-NE 3.48Å; D103-R151 IonicContact OD2-NH1 2.77Å; D103-R151 PolarHBondContact OD2-NH1 2.76Å; D103-R151 IonicContact OD2-NH2 2.72Å; D103-R151 PolarHBondContact OD2-NH2 3.33Å; D103-R151 VanDerWaalsContact OD2-NH2 3.07Å; L149-R151 PolarHBondContact O-N 2.86Å
152	F	85.7	Confident	77.8	Confident	14 Å²	14	49.1 Å²	49.1	6%	0.061	26%	0.262	C	S	.	.			trans	-103.9	153.7	175.1	66.7	-83.9	0	0	0	110	I43 S49 I84 D85 L88 R150 V154	I43-F152 HydrophobicContact CG2-CB 3.67Å; I43-F152 HydrophobicContact CG2-CD1 4.23Å; I43-F152 HydrophobicContact CG2-CG 4.06Å; S49-F152 CarbonylContact O-C 3.53Å; S49-F152 WeakPolarHBondContact O-CA 3.42Å; I84-F152 HydrophobicContact CB-CE2 3.66Å; I84-F152 HydrophobicContact CB-CZ 3.61Å; I84-F152 HydrophobicContact CD1-CD2 4.46Å; I84-F152 HydrophobicContact CD1-CE2 3.86Å; I84-F152 HydrophobicContact CG1-CE2 4.39Å; I84-F152 HydrophobicContact CG2-CD1 4.39Å; I84-F152 HydrophobicContact CG2-CD2 4.04Å; I84-F152 HydrophobicContact CG2-CE1 3.84Å; I84-F152 HydrophobicContact CG2-CE2 3.41Å; I84-F152 VanDerWaalsContact CG2-CE2 3.41Å; I84-F152 HydrophobicContact CG2-CG 4.5Å; I84-F152 HydrophobicContact CG2-CZ 3.3Å; D85-F152 VanDerWaalsContact OD1-CE1 3.28Å; D85-F152 WeakPolarHBondContact OD1-CE1 3.35Å; D85-F152 WeakPolarHBondContact OD1-CZ 3.48Å; L88-F152 HydrophobicContact CD1-CD1 3.83Å; L88-F152 HydrophobicContact CD1-CE1 3.46Å; L88-F152 VanDerWaalsContact CD1-CE1 3.46Å; L88-F152 HydrophobicContact CD1-CZ 4.39Å; R150-F152 HydrophobicContact CG-CE1 4.42Å; F152-V154 HydrophobicContact CD2-CG2 3.89Å; F152-V154 HydrophobicContact CE2-CG2 3.78Å
153	E	86.7	Confident	78.9	Confident	38 Å²	38	53.7 Å²	53.7	18%	0.178	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	147.7	171.1	-62.9	175	161.1	0	0	108.2	S49 V50 L51 Y155 G279 E280	S49-E153 PolarHBondContact O-N 2.68Å; V50-E153 WeakPolarHBondContact CA-O 3.46Å; L51-E153 PolarHBondContact N-O 3.04Å; E153-Y155 HydrophobicContact CB-CE2 4.15Å; E153-Y155 VanDerWaalsContact CD-OH 3.29Å; E153-Y155 PolarHBondContact OE2-OH 2.81Å; E153-G279 VanDerWaalsContact OE1-CA 3.25Å; E153-G279 WeakPolarHBondContact OE1-CA 3.35Å; E153-G279 VanDerWaalsContact OE2-CA 3.3Å; E153-G279 WeakPolarHBondContact OE2-CA 3.49Å; E153-E280 PolarHBondContact OE2-N 2.92Å
154	V	88.4	Confident	79.8	Confident	15 Å²	15	49.2 Å²	49.2	9%	0.091	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	123.2	177.2	-176.5	0	0	0	0	107.8	V53 F80 I84 F152	V53-V154 HydrophobicContact CG2-CG1 4.09Å; F80-V154 HydrophobicContact CB-CG1 4.33Å; I84-V154 HydrophobicContact CD1-CG2 3.51Å; F152-V154 HydrophobicContact CD2-CG2 3.89Å; F152-V154 HydrophobicContact CE2-CG2 3.78Å
155	Y	90.2	Very high	80.5	Confident	15 Å²	15	51.4 Å²	51.4	6%	0.059	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	138.1	176.2	-66.4	-46.1	0	0	0	110.4	V50 L51 Y52 V53 E153 R278 H335	V50-Y155 HydrophobicContact CG1-CD2 3.25Å; V50-Y155 HydrophobicContact CG1-CE2 3.62Å; V50-Y155 HydrophobicContact CG1-CG 4.33Å; V50-Y155 HydrophobicContact CG2-CE2 4.06Å; L51-Y155 PolarHBondContact O-N 3.42Å; Y52-Y155 WeakPolarHBondContact CA-O 3.4Å; Y52-Y155 HydrophobicContact CD1-CD2 4.41Å; Y52-Y155 AromaticContact CE1-CD2 3.83Å; Y52-Y155 HydrophobicContact CE1-CD2 3.83Å; Y52-Y155 HydrophobicContact CE1-CG 4.37Å; V53-Y155 PolarHBondContact N-O 2.93Å; E153-Y155 HydrophobicContact CB-CE2 4.15Å; E153-Y155 VanDerWaalsContact CD-OH 3.29Å; E153-Y155 PolarHBondContact OE2-OH 2.81Å; Y155-R278 PolarHBondContact OH-O 3.15Å; Y155-H335 WeakPolarHBondContact CB-O 3.31Å; Y155-H335 HydrophobicContact CD1-CB 3.99Å; Y155-H335 WeakPolarHBondContact CD2-O 3.19Å; Y155-H335 HydrophobicContact CG-CB 4.34Å
156	F	89.6	Confident	81.2	Confident	0 Å²	0	51.7 Å²	51.7	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	127.1	172.3	-65.1	-59	0	0	0	110.2	V53 I55 I69 A73 T77 F80 L178 H335	V53-F156 HydrophobicContact CB-CD1 3.97Å; V53-F156 HydrophobicContact CB-CE1 4.21Å; V53-F156 HydrophobicContact CG1-CD1 4.24Å; V53-F156 HydrophobicContact CG1-CE1 4.27Å; V53-F156 WeakPolarHBondContact O-CA 3.26Å; I55-F156 HydrophobicContact CD1-CB 4.38Å; I69-F156 HydrophobicContact CD1-CE1 4.45Å; I69-F156 HydrophobicContact CG2-CD1 4.17Å; I69-F156 HydrophobicContact CG2-CD2 3.92Å; I69-F156 HydrophobicContact CG2-CE1 4.08Å; I69-F156 HydrophobicContact CG2-CE2 3.78Å; I69-F156 HydrophobicContact CG2-CG 4.11Å; I69-F156 HydrophobicContact CG2-CZ 3.9Å; A73-F156 HydrophobicContact CB-CD2 4.48Å; T77-F156 HydrophobicContact CG2-CD2 3.69Å; T77-F156 HydrophobicContact CG2-CE2 3.31Å; T77-F156 HydrophobicContact CG2-CZ 4.26Å; F80-F156 HydrophobicContact CD2-CE1 4.09Å; F80-F156 AromaticContact CD2-CZ 3.74Å; F80-F156 HydrophobicContact CD2-CZ 3.74Å; F80-F156 HydrophobicContact CE2-CE1 4.1Å; F80-F156 HydrophobicContact CE2-CZ 4.06Å; F80-F156 HydrophobicContact CG-CE1 4.45Å; F80-F156 HydrophobicContact CG-CZ 4.28Å; F80-F156 HydrophobicContact CZ-CE1 4.49Å; F156-L178 HydrophobicContact CB-CD2 3.9Å; F156-H335 AromaticContact CD2-CE1 3.94Å; F156-H335 AromaticContact CD2-ND1 3.86Å; F156-H335 WeakPolarHBondContact O-CB 3.42Å
157	C	84	Confident	81.9	Confident	23 Å²	23	49.2 Å²	49.2	16%	0.155	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	128.8	165.1	-65.4	0	0	0	0	108.2	V53 I55	V53-C157 PolarHBondContact O-N 3.32Å; I55-C157 VanDerWaalsContact CG1-O 3.32Å; I55-C157 WeakPolarHBondContact CG1-O 3.49Å; I55-C157 PolarHBondContact N-O 2.92Å; I55-C157 VanDerWaalsContact N-O 3.09Å
158	G	79.5	Confident	82.6	Confident	13 Å²	13	49.4 Å²	49.4	13%	0.134	26%	0.258	C	S	.	.	P	Polyproline II helix	trans	-64.3	165.3	178.1	0	0	0	0	0	111.1	Q180	G158-Q180 VanDerWaalsContact C-NE2 3.28Å; G158-Q180 VanDerWaalsContact CA-NE2 3.29Å
159	R	79.9	Confident	83.2	Confident	76 Å²	76	53 Å²	53	29%	0.287	28%	0.278	S	S	.	.	P	Polyproline II helix	trans	-63.7	143.4	178.8	-67.3	-178.5	61.6	-175.6	-4.5	111.6	I55 D56 E70 D161 A162 Q180	I55-R159 HydrophobicContact CB-CG 3.88Å; I55-R159 HydrophobicContact CG2-CG 3.48Å; I55-R159 VanDerWaalsContact CG2-CG 3.48Å; D56-R159 WeakPolarHBondContact OD1-CA 3.32Å; D56-R159 VanDerWaalsContact OD1-CB 3.26Å; D56-R159 WeakPolarHBondContact OD1-CB 3.33Å; D56-R159 WeakPolarHBondContact OD1-CG 3.39Å; D56-R159 IonicContact OD1-NE 2.85Å; E70-R159 WeakPolarHBondContact OE1-CD 3.2Å; R159-D161 VanDerWaalsContact C-N 3.31Å; R159-D161 IonicContact NH2-OD2 3.65Å; R159-A162 HydrophobicContact CB-CB 4.04Å; R159-A162 PolarHBondContact O-N 3.36Å; R159-Q180 PolarHBondContact O-NE2 3.44Å; R159-Q180 VanDerWaalsContact O-NE2 3.09Å
160	S	75.1	Confident	83.8	Confident	102 Å²	102	51.3 Å²	51.3	71%	0.713	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.6	-32.8	176.5	-53.8	0	0	0	0	111.8	D56 A162	D56-S160 PolarHBondContact OD1-N 3.05Å; D56-S160 VanDerWaalsContact OD2-CB 3.27Å; D56-S160 WeakPolarHBondContact OD2-CB 3.47Å; D56-S160 PolarHBondContact OD2-N 3.43Å; D56-S160 PolarHBondContact OD2-OG 3.09Å; S160-A162 VanDerWaalsContact C-N 3.29Å; S160-A162 PolarHBondContact O-N 2.88Å
161	D	74.2	Confident	84.4	Confident	129 Å²	129	55.1 Å²	55.1	69%	0.69	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.7	-15.7	178	-64.2	-27.4	0	0	0	113.7	R159 K163	R159-D161 VanDerWaalsContact C-N 3.31Å; R159-D161 IonicContact NH2-OD2 3.65Å; D161-K163 PolarHBondContact O-N 2.69Å
162	A	77.9	Confident	84.8	Confident	43 Å²	43	54.5 Å²	54.5	36%	0.355	31%	0.306	S	S	.	.	S	Bend	trans	-71.7	125.4	-174.1	0	0	0	0	0	110.2	R159 S160 Q180	R159-A162 HydrophobicContact CB-CB 4.04Å; R159-A162 PolarHBondContact O-N 3.36Å; S160-A162 VanDerWaalsContact C-N 3.29Å; S160-A162 PolarHBondContact O-N 2.88Å; A162-Q180 PolarHBondContact O-OE1 3.23Å
163	K	82	Confident	84.9	Confident	187 Å²	187	58 Å²	58	81%	0.813	33%	0.332	S	S	*	.	P	Polyproline II helix	trans	-68	126	174.9	-69.6	-178.1	-179.9	179.2	0	109.1	D161 L165	D161-K163 PolarHBondContact O-N 2.69Å; K163-L165 PolarHBondContact O-N 3.21Å
164	P	84.8	Confident	84.9	Confident	60 Å²	60	57 Å²	57	39%	0.39	33%	0.33	S	S	.	.	P	Polyproline II helix	trans	-63	132.7	177.1	26.2	-34.3	0	0	0	110.1	R182 L292	P164-R182 HydrophobicContact CB-CB 4.23Å; P164-L292 HydrophobicContact CB-CD1 3.68Å
165	L	87.1	Confident	84.9	Confident	60 Å²	60	59.9 Å²	59.9	31%	0.314	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	142.8	178.7	-64.2	172.5	0	0	0	110.5	K163 I179 Q180 V181 R182	K163-L165 PolarHBondContact O-N 3.21Å; L165-I179 HydrophobicContact CD1-CB 4.24Å; L165-I179 HydrophobicContact CD1-CG2 4.08Å; L165-Q180 WeakPolarHBondContact CB-O 3.28Å; L165-Q180 PolarHBondContact N-O 2.91Å; L165-V181 WeakPolarHBondContact O-CA 3.35Å; L165-R182 PolarHBondContact O-N 2.85Å
166	C	86.9	Confident	84.8	Confident	23 Å²	23	59.9 Å²	59.9	16%	0.155	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	147.2	163.6	-50.6	0	0	0	0	109.3	R168 N169 Q263	C166-R168 PolarHBondContact O-N 3.31Å; C166-R168 VanDerWaalsContact O-N 3.1Å; C166-N169 HydrophobicContact CB-CB 4.48Å; C166-N169 PolarHBondContact O-N 3.17Å; C166-Q263 PolarHBondContact SG-OE1 3.41Å
167	V	89.2	Confident	84.7	Confident	11 Å²	11	63 Å²	63	7%	0.067	36%	0.363	C	S	.	.	G	3₁₀ helix	trans	-52.5	-36.8	175	-179.1	0	0	0	0	111.3	N169 V170 V181 E259 R271 L273	V167-N169 VanDerWaalsContact C-N 3.31Å; V167-N169 PolarHBondContact O-N 3.06Å; V167-V170 WeakPolarHBondContact O-CB 3.31Å; V167-V170 WeakPolarHBondContact O-CG2 3.45Å; V167-V170 PolarHBondContact O-N 2.88Å; V167-V181 HydrophobicContact CB-CG1 4.45Å; V167-V181 HydrophobicContact CG2-CG1 3.59Å; V167-E259 HydrophobicContact CB-CG 3.58Å; V167-E259 HydrophobicContact CG1-CG 4.48Å; V167-E259 HydrophobicContact CG2-CG 3.93Å; V167-R271 HydrophobicContact CG1-CB 4.44Å; V167-L273 HydrophobicContact CG1-CB 3.81Å; V167-L273 HydrophobicContact CG1-CD1 4.35Å
168	R	88.5	Confident	85	Confident	39 Å²	39	62.9 Å²	62.9	15%	0.147	36%	0.36	C	S	.	.	G	3₁₀ helix	trans	-60.5	-36.3	176.6	-167.2	166.1	-64.1	-114.3	-6.2	114.6	C166 V170 E259 H268 I269	C166-R168 PolarHBondContact O-N 3.31Å; C166-R168 VanDerWaalsContact O-N 3.1Å; R168-V170 PolarHBondContact O-N 3.21Å; R168-E259 VanDerWaalsContact CA-OE1 3.3Å; R168-E259 WeakPolarHBondContact CA-OE1 3.37Å; R168-E259 VanDerWaalsContact CB-OE1 3.23Å; R168-E259 WeakPolarHBondContact CB-OE1 3.33Å; R168-E259 IonicContact CZ-OE2 2.79Å; R168-E259 PolarHBondContact N-OE1 2.97Å; R168-E259 IonicContact NE-OE1 3.46Å; R168-E259 IonicContact NE-OE2 3.71Å; R168-E259 IonicContact NH2-OE2 3.77Å; R168-E259 PolarHBondContact NH2-OE2 3.38Å; R168-E259 VanDerWaalsContact NH2-OE2 3.13Å; R168-H268 PolarHBondContact NH1-ND1 3.16Å; R168-I269 PolarHBondContact NH2-O 2.96Å; R168-I269 VanDerWaalsContact NH2-O 3.16Å
169	N	89.3	Confident	85.6	Confident	89 Å²	89	62.8 Å²	62.8	48%	0.476	36%	0.357	S	S	.	.	G	3₁₀ helix	trans	-83.3	-2	-174.8	-66.6	-11.7	0	0	0	111.8	C166 V167 L171	C166-N169 HydrophobicContact CB-CB 4.48Å; C166-N169 PolarHBondContact O-N 3.17Å; V167-N169 VanDerWaalsContact C-N 3.31Å; V167-N169 PolarHBondContact O-N 3.06Å; N169-L171 PolarHBondContact O-N 2.87Å
170	V	88.6	Confident	86.2	Confident	20 Å²	20	60.2 Å²	60.2	12%	0.121	35%	0.348	C	S	.	.			trans	-72.1	100.1	169.8	-175.2	0	0	0	0	108.2	V167 R168 I179 V181 F297	V167-V170 WeakPolarHBondContact O-CB 3.31Å; V167-V170 WeakPolarHBondContact O-CG2 3.45Å; V167-V170 PolarHBondContact O-N 2.88Å; R168-V170 PolarHBondContact O-N 3.21Å; V170-I179 HydrophobicContact CB-CD1 4.48Å; V170-I179 HydrophobicContact CG1-CD1 3.82Å; V170-I179 HydrophobicContact CG2-CD1 3.8Å; V170-V181 HydrophobicContact CG2-CG2 4.04Å; V170-F297 HydrophobicContact CG1-CD1 3.89Å; V170-F297 HydrophobicContact CG1-CD2 3.91Å; V170-F297 HydrophobicContact CG1-CE1 3.87Å; V170-F297 HydrophobicContact CG1-CE2 3.89Å; V170-F297 HydrophobicContact CG1-CG 3.9Å; V170-F297 HydrophobicContact CG1-CZ 3.85Å
171	L	87.9	Confident	86.9	Confident	109 Å²	109	55.4 Å²	55.4	57%	0.571	31%	0.314	S	S	*	.			trans	-98.3	169.6	-179.9	-63.1	177.6	0	0	0	110.9	N169 S173 S174	N169-L171 PolarHBondContact O-N 2.87Å; L171-S173 PolarHBondContact O-N 2.82Å; L171-S173 VanDerWaalsContact O-N 3.13Å; L171-S174 WeakPolarHBondContact O-CB 3.33Å; L171-S174 PolarHBondContact O-N 3.13Å
172	A	86.2	Confident	87.6	Confident	79 Å²	79	52.4 Å²	52.4	65%	0.653	29%	0.293	S	S	*	.	G	3₁₀ helix	trans	-59.4	-23.4	176.1	0	0	0	0	0	113.5	S174 I175	A172-S174 PolarHBondContact O-N 3.21Å; A172-I175 HydrophobicContact CB-CD1 4.38Å; A172-I175 WeakPolarHBondContact O-CD1 3.38Å; A172-I175 VanDerWaalsContact O-CG1 3.28Å; A172-I175 WeakPolarHBondContact O-CG1 3.35Å; A172-I175 PolarHBondContact O-N 3.28Å
173	S	87.8	Confident	88.1	Confident	86 Å²	86	50.4 Å²	50.4	60%	0.601	28%	0.276	S	S	*	.	G	3₁₀ helix	trans	-65.2	-24.2	174.2	52.2	0	0	0	0	113.3	L171 I175 H177	L171-S173 PolarHBondContact O-N 2.82Å; L171-S173 VanDerWaalsContact O-N 3.13Å; S173-I175 VanDerWaalsContact C-N 3.29Å; S173-I175 PolarHBondContact O-N 2.73Å; S173-H177 PolarHBondContact O-CE1 2.79Å; S173-H177 VanDerWaalsContact O-CE1 3.28Å; S173-H177 PolarHBondContact O-ND1 3.49Å
174	S	86.5	Confident	88.3	Confident	19 Å²	19	42.1 Å²	42.1	13%	0.133	24%	0.241	C	C	.	.	G	3₁₀ helix	trans	-86.3	3.1	-177.5	-54.8	0	0	0	0	113.2	L171 A172 G176 H177	L171-S174 WeakPolarHBondContact O-CB 3.33Å; L171-S174 PolarHBondContact O-N 3.13Å; A172-S174 PolarHBondContact O-N 3.21Å; S174-G176 PolarHBondContact O-N 3.4Å; S174-H177 WeakPolarHBondContact O-CB 3.43Å; S174-H177 PolarHBondContact O-N 3.21Å; S174-H177 VanDerWaalsContact O-N 3.12Å
175	I	88.4	Confident	88.5	Confident	74 Å²	74	39.2 Å²	39.2	38%	0.379	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.6	131.2	176.2	-65.6	169.4	0	0	0	109.3	A172 S173 H177 F297	A172-I175 HydrophobicContact CB-CD1 4.38Å; A172-I175 WeakPolarHBondContact O-CD1 3.38Å; A172-I175 VanDerWaalsContact O-CG1 3.28Å; A172-I175 WeakPolarHBondContact O-CG1 3.35Å; A172-I175 PolarHBondContact O-N 3.28Å; S173-I175 VanDerWaalsContact C-N 3.29Å; S173-I175 PolarHBondContact O-N 2.73Å; I175-H177 PolarHBondContact O-N 3.28Å; I175-H177 PolarHBondContact O-ND1 2.94Å; I175-F297 HydrophobicContact CG1-CD1 3.94Å; I175-F297 HydrophobicContact CG1-CE1 4.05Å
176	G	86.7	Confident	88.3	Confident	15 Å²	15	37 Å²	37	16%	0.155	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	76.6	-7.4	-178.1	0	0	0	0	0	115.1	C71 S174 F297	C71-G176 CarbonylContact O-C 3.56Å; S174-G176 PolarHBondContact O-N 3.4Å; G176-F297 PolarHBondContact N-O 3.01Å
177	H	88.9	Confident	88.2	Confident	66 Å²	66	38.8 Å²	38.8	31%	0.306	22%	0.215	S	C	.	.	S	Bend	trans	-83.5	150.1	178.3	-65.8	63.1	0	0	0	111.1	E70 S173 S174 I175 I179 F297	E70-H177 CarbonylContact O-C 3.57Å; E70-H177 WeakPolarHBondContact O-CA 3.42Å; E70-H177 VanDerWaalsContact O-CB 3.32Å; E70-H177 WeakPolarHBondContact O-CB 3.41Å; S173-H177 PolarHBondContact O-CE1 2.79Å; S173-H177 VanDerWaalsContact O-CE1 3.28Å; S173-H177 PolarHBondContact O-ND1 3.49Å; S174-H177 WeakPolarHBondContact O-CB 3.43Å; S174-H177 PolarHBondContact O-N 3.21Å; S174-H177 VanDerWaalsContact O-N 3.12Å; I175-H177 PolarHBondContact O-N 3.28Å; I175-H177 PolarHBondContact O-ND1 2.94Å; H177-I179 HydrophobicContact CB-CG2 4.35Å; H177-I179 PolarHBondContact O-N 3.16Å; H177-F297 PolarHBondContact O-N 3.4Å
178	L	90.4	Very high	88	Confident	21 Å²	21	39.5 Å²	39.5	11%	0.11	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	115.5	167.6	-165.4	78.3	0	0	0	108.8	I55 E70 A73 F156 T294 V296	I55-L178 HydrophobicContact CD1-CD2 3.21Å; E70-L178 PolarHBondContact O-N 3.01Å; A73-L178 HydrophobicContact CB-CB 4.19Å; A73-L178 HydrophobicContact CB-CD1 4.21Å; F156-L178 HydrophobicContact CB-CD2 3.9Å; L178-T294 HydrophobicContact CD1-CG2 4.03Å; L178-T294 HydrophobicContact CD2-CG2 3.83Å; L178-T294 HydrophobicContact CG-CG2 3.81Å; L178-V296 HydrophobicContact CD1-CG2 3.83Å
179	I	91.7	Very high	87.9	Confident	10 Å²	10	38.6 Å²	38.6	5%	0.051	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	148.5	-179.5	60.1	170.9	0	0	0	110.8	L165 V170 H177 V181 T294 G295 F297 L332	L165-I179 HydrophobicContact CD1-CB 4.24Å; L165-I179 HydrophobicContact CD1-CG2 4.08Å; V170-I179 HydrophobicContact CB-CD1 4.48Å; V170-I179 HydrophobicContact CG1-CD1 3.82Å; V170-I179 HydrophobicContact CG2-CD1 3.8Å; H177-I179 HydrophobicContact CB-CG2 4.35Å; H177-I179 PolarHBondContact O-N 3.16Å; I179-V181 HydrophobicContact CD1-CG2 3.7Å; I179-V181 HydrophobicContact CG1-CG2 4.07Å; I179-T294 WeakPolarHBondContact O-CA 3.43Å; I179-G295 PolarHBondContact N-O 2.99Å; I179-G295 PolarHBondContact O-N 2.98Å; I179-F297 HydrophobicContact CD1-CB 3.88Å; I179-F297 HydrophobicContact CD1-CG 4.41Å; I179-F297 HydrophobicContact CG1-CB 4.39Å; I179-L332 HydrophobicContact CD1-CD1 3.87Å; I179-L332 HydrophobicContact CG1-CD1 3.73Å
180	Q	91.5	Very high	87.7	Confident	23 Å²	23	41.9 Å²	41.9	11%	0.107	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	123.8	168.1	-76.9	175	-13.4	0	0	108.8	G158 R159 A162 L165 L292 V293 T294	G158-Q180 VanDerWaalsContact C-NE2 3.28Å; G158-Q180 VanDerWaalsContact CA-NE2 3.29Å; R159-Q180 PolarHBondContact O-NE2 3.44Å; R159-Q180 VanDerWaalsContact O-NE2 3.09Å; A162-Q180 PolarHBondContact O-OE1 3.23Å; L165-Q180 WeakPolarHBondContact CB-O 3.28Å; L165-Q180 PolarHBondContact N-O 2.91Å; Q180-L292 HydrophobicContact CB-CD1 4.21Å; Q180-V293 CarbonylContact C-O 3.55Å; Q180-V293 WeakPolarHBondContact CA-O 3.49Å; Q180-T294 HydrophobicContact CG-CG2 4.12Å; Q180-T294 WeakPolarHBondContact CG-OG1 3.47Å
181	V	91.1	Very high	87.7	Confident	0 Å²	0	42.9 Å²	42.9	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	129.8	179.3	-178.5	0	0	0	0	109.3	L165 V167 V170 I179 L273 V293 L332	L165-V181 WeakPolarHBondContact O-CA 3.35Å; V167-V181 HydrophobicContact CB-CG1 4.45Å; V167-V181 HydrophobicContact CG2-CG1 3.59Å; V170-V181 HydrophobicContact CG2-CG2 4.04Å; I179-V181 HydrophobicContact CD1-CG2 3.7Å; I179-V181 HydrophobicContact CG1-CG2 4.07Å; V181-L273 HydrophobicContact CG1-CD2 4.45Å; V181-V293 PolarHBondContact N-O 3.29Å; V181-V293 PolarHBondContact O-N 3.49Å; V181-L332 HydrophobicContact CG2-CD2 4.39Å
182	R	89.2	Confident	87.8	Confident	67 Å²	67	39.9 Å²	39.9	25%	0.253	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	135.4	173.8	-175.9	175.1	177.2	142	4.3	109.9	P164 L165 L260 L292 L340 D345	P164-R182 HydrophobicContact CB-CB 4.23Å; L165-R182 PolarHBondContact O-N 2.85Å; R182-L260 HydrophobicContact CG-CD1 3.99Å; R182-L260 HydrophobicContact CG-CD2 4.49Å; R182-L292 HydrophobicContact CB-CD1 4.41Å; R182-L340 HydrophobicContact CG-CD1 3.74Å; R182-D345 IonicContact CZ-OD2 3.8Å; R182-D345 IonicContact NH1-OD2 3.51Å; R182-D345 PolarHBondContact NH1-OD2 3.33Å; R182-D345 IonicContact NH2-OD2 3.92Å
183	G	87.8	Confident	88	Confident	0 Å²	0	41 Å²	41	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-170.7	179	175.7	0	0	0	0	0	114.1	I257 Q258 L260 H290 I291	G183-I257 VanDerWaalsContact CA-CG2 3.4Å; G183-Q258 CarbonylContact C-O 3.55Å; G183-Q258 VanDerWaalsContact CA-O 3.24Å; G183-Q258 WeakPolarHBondContact CA-O 3.28Å; G183-L260 VanDerWaalsContact CA-CD1 3.43Å; G183-H290 WeakPolarHBondContact O-CA 3.45Å; G183-I291 PolarHBondContact N-O 3.28Å; G183-I291 VanDerWaalsContact N-O 3.1Å; G183-I291 PolarHBondContact O-N 3.24Å
184	V	86.7	Confident	88.1	Confident	13 Å²	13	39.3 Å²	39.3	8%	0.079	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	133	176.8	-175	0	0	0	0	110	T186 I257 Q258 L260 D289 H290 L470	V184-T186 PolarHBondContact O-N 3.18Å; V184-I257 CarbonylContact O-C 3.57Å; V184-I257 VanDerWaalsContact O-CA 3.32Å; V184-I257 WeakPolarHBondContact O-CA 3.49Å; V184-Q258 PolarHBondContact N-O 2.64Å; V184-Q258 PolarHBondContact O-N 3.12Å; V184-L260 HydrophobicContact CG2-CD1 4.14Å; V184-L260 HydrophobicContact CG2-CG 4.47Å; V184-D289 WeakPolarHBondContact CA-O 3.48Å; V184-H290 WeakPolarHBondContact CG2-CE1 3.39Å; V184-H290 WeakPolarHBondContact CG2-ND1 3.49Å; V184-L470 HydrophobicContact CG1-CD2 3.81Å
185	V	87.7	Confident	88.3	Confident	0 Å²	0	39.3 Å²	39.3	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	122	174	-179.2	0	0	0	0	110.1	I255 I257 A285 Q286 G288 D289 I291	V185-I255 HydrophobicContact CB-CG2 4.23Å; V185-I255 HydrophobicContact CG1-CG2 3.39Å; V185-I255 HydrophobicContact CG2-CG2 3.88Å; V185-I257 HydrophobicContact CG2-CG1 4.45Å; V185-A285 HydrophobicContact CG2-CB 4.02Å; V185-Q286 WeakPolarHBondContact CB-O 3.44Å; V185-G288 PolarHBondContact O-N 3.04Å; V185-D289 PolarHBondContact N-O 2.95Å; V185-I291 HydrophobicContact CG2-CD1 3.27Å; V185-I291 HydrophobicContact CG2-CG1 3.8Å; V185-I291 HydrophobicContact CG2-CG2 4.37Å
186	T	84.2	Confident	88.2	Confident	12 Å²	12	36.8 Å²	36.8	7%	0.074	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	-39.4	177.4	52.7	0	0	0	0	112	V184 R256 Q258	V184-T186 PolarHBondContact O-N 3.18Å; T186-R256 PolarHBondContact N-O 3Å; T186-R256 PolarHBondContact OG1-O 3.15Å; T186-Q258 HydrophobicContact CG2-CB 3.6Å
187	R	84.4	Confident	88.3	Confident	62 Å²	62	36.1 Å²	36.1	23%	0.234	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	137.1	-176.2	-53.1	-176.8	-165.5	-179.2	0.6	109.6	I255 R256 E464	R187-I255 WeakPolarHBondContact O-CA 3.39Å; R187-R256 HydrophobicContact CB-CB 4.3Å; R187-R256 PolarHBondContact O-N 3.19Å; R187-E464 HydrophobicContact CG-CB 4.21Å; R187-E464 HydrophobicContact CG-CG 4.33Å; R187-E464 IonicContact CZ-OE1 2.89Å; R187-E464 IonicContact NE-OE1 2.97Å; R187-E464 PolarHBondContact NE-OE1 2.69Å; R187-E464 IonicContact NH2-OE1 2.8Å; R187-E464 PolarHBondContact NH2-OE1 3.39Å; R187-E464 IonicContact NH2-OE2 3.71Å
188	A	84.2	Confident	88.3	Confident	25 Å²	25	33 Å²	33	21%	0.207	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	133.1	172	0	0	0	0	0	108.9	I255	A188-I255 HydrophobicContact CB-CD1 4.32Å; A188-I255 HydrophobicContact CB-CG1 4.12Å
189	T	86	Confident	88.2	Confident	21 Å²	21	32 Å²	32	13%	0.129	17%	0.166	C	C	.	.	P	Polyproline II helix	trans	-82.5	166.7	172.6	69	0	0	0	0	110.7	Q253 E254	T189-Q253 VanDerWaalsContact O-CG 3.29Å; T189-Q253 WeakPolarHBondContact O-CG 3.42Å; T189-Q253 PolarHBondContact O-NE2 2.65Å; T189-E254 HydrophobicContact CG2-CB 3.98Å; T189-E254 PolarHBondContact N-O 3.24Å; T189-E254 PolarHBondContact OG1-N 3.13Å; T189-E254 PolarHBondContact OG1-O 3.11Å
190	E	85.7	Confident	88.1	Confident	157 Å²	157	31.6 Å²	31.6	73%	0.734	16%	0.163	S	C	*	.	P	Polyproline II helix	trans	-69.8	165.1	165	-62.9	-170.9	173.8	0	0	111.4
191	V	89.4	Confident	87.9	Confident	41 Å²	41	32.1 Å²	32.1	25%	0.248	17%	0.168	C	C	.	.	P	Polyproline II helix	trans	-78.9	126	-179.1	-178.2	0	0	0	0	110	K251 F252 T282 R283	V191-K251 HydrophobicContact CG1-CB 3.78Å; V191-K251 HydrophobicContact CG1-CG 4.17Å; V191-F252 CarbonylContact C-O 3.53Å; V191-F252 WeakPolarHBondContact CA-O 3.38Å; V191-T282 HydrophobicContact CG1-CG2 4.4Å; V191-R283 HydrophobicContact CG2-CG 3.59Å
192	K	89.3	Confident	87.6	Confident	47 Å²	47	32.2 Å²	32.2	20%	0.204	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	147.9	179.8	-55.7	-172.8	-171.2	-159.4	0	110.5	L194 F252 E460	K192-L194 PolarHBondContact O-N 3.33Å; K192-F252 PolarHBondContact N-O 3.04Å; K192-F252 WeakPolarHBondContact O-CA 3.47Å; K192-F252 WeakPolarHBondContact O-CB 3.44Å; K192-F252 PolarHBondContact O-N 3.36Å; K192-E460 VanDerWaalsContact CE-OE2 3.24Å; K192-E460 WeakPolarHBondContact CE-OE2 3.49Å; K192-E460 IonicContact NZ-OE1 2.92Å; K192-E460 PolarHBondContact NZ-OE1 3.01Å; K192-E460 IonicContact NZ-OE2 2.91Å; K192-E460 PolarHBondContact NZ-OE2 2.64Å
193	P	91.1	Very high	87.4	Confident	103 Å²	103	34 Å²	34	67%	0.669	18%	0.184	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-79.1	117.4	172.2	30.4	-31.6	0	0	0	110.4	F249 L250	P193-F249 HydrophobicContact CB-CB 4.24Å; P193-F249 HydrophobicContact CB-CD1 4.23Å; P193-F249 HydrophobicContact CB-CG 4.47Å; P193-L250 CarbonylContact C-O 3.6Å; P193-L250 WeakPolarHBondContact CA-O 3.5Å
194	L	89.8	Confident	87	Confident	50 Å²	50	41.8 Å²	41.8	26%	0.262	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	125.6	171	-178	72	0	0	0	109.4	K192 F249 L250 F252	K192-L194 PolarHBondContact O-N 3.33Å; L194-F249 CarbonylContact O-C 3.56Å; L194-F249 WeakPolarHBondContact O-CA 3.29Å; L194-L250 PolarHBondContact N-O 2.87Å; L194-L250 PolarHBondContact O-N 2.86Å; L194-F252 HydrophobicContact CB-CB 3.65Å; L194-F252 HydrophobicContact CB-CG 4.29Å; L194-F252 HydrophobicContact CD2-CB 4.49Å; L194-F252 HydrophobicContact CD2-CD2 4.1Å
195	I	89.3	Confident	86.5	Confident	19 Å²	19	43.2 Å²	43.2	10%	0.097	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	131.5	175.8	-169	165.2	0	0	0	110.6	A198 I213 F218 M242 F249	I195-A198 HydrophobicContact CD1-CB 3.75Å; I195-I213 HydrophobicContact CB-CD1 4.43Å; I195-I213 HydrophobicContact CD1-CD1 4.15Å; I195-I213 HydrophobicContact CG1-CD1 4.09Å; I195-I213 HydrophobicContact CG2-CD1 3.58Å; I195-I213 HydrophobicContact CG2-CG2 4.47Å; I195-F218 HydrophobicContact CG2-CE1 3.98Å; I195-F218 HydrophobicContact CG2-CZ 4.31Å; I195-M242 HydrophobicContact CD1-CE 3.14Å; I195-F249 HydrophobicContact CB-CD1 3.94Å; I195-F249 HydrophobicContact CB-CE1 3.88Å; I195-F249 HydrophobicContact CD1-CE1 4Å; I195-F249 HydrophobicContact CD1-CZ 4.32Å; I195-F249 HydrophobicContact CG1-CD1 4.3Å; I195-F249 HydrophobicContact CG1-CE1 4.06Å
196	T	86.7	Confident	86	Confident	21 Å²	21	46 Å²	46	13%	0.129	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	-45.1	173.8	53.2	0	0	0	0	111.6	I213 K248 L250	T196-I213 PolarHBondContact O-N 3.07Å; T196-K248 PolarHBondContact N-O 3.17Å; T196-K248 PolarHBondContact OG1-O 2.94Å; T196-L250 HydrophobicContact CG2-CB 4.43Å; T196-L250 HydrophobicContact CG2-CD1 3.41Å; T196-L250 VanDerWaalsContact CG2-CD1 3.41Å; T196-L250 HydrophobicContact CG2-CG 3.71Å
197	T	88.6	Confident	85.6	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	118.9	176.1	57.9	0	0	0	0	110.3	P145 E147 Q211 E212 S247 K248	P145-T197 HydrophobicContact CG-CG2 4.47Å; E147-T197 HydrophobicContact CB-CG2 4.04Å; T197-Q211 WeakPolarHBondContact CA-O 3.38Å; T197-E212 HydrophobicContact CG2-CG 4.22Å; T197-S247 CarbonylContact O-C 3.46Å; T197-S247 VanDerWaalsContact O-CA 3.23Å; T197-S247 WeakPolarHBondContact O-CA 3.34Å; T197-S247 VanDerWaalsContact O-CB 3.25Å; T197-S247 WeakPolarHBondContact O-CB 3.5Å; T197-K248 PolarHBondContact O-N 3.16Å; T197-K248 VanDerWaalsContact OG1-CB 3.26Å; T197-K248 WeakPolarHBondContact OG1-CB 3.22Å
198	A	90	Very high	85.4	Confident	0 Å²	0	46.8 Å²	46.8	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	129.3	173.4	0	0	0	0	0	110.2	I195 Y200 Y210 Q211 I213 M242	I195-A198 HydrophobicContact CD1-CB 3.75Å; A198-Y200 HydrophobicContact CB-CE2 3.94Å; A198-Y210 WeakPolarHBondContact O-CA 3.4Å; A198-Q211 PolarHBondContact N-O 3.03Å; A198-Q211 PolarHBondContact O-N 2.87Å; A198-I213 HydrophobicContact CB-CD1 3.69Å; A198-M242 HydrophobicContact CB-CE 4.35Å
199	T	88.4	Confident	85.4	Confident	0 Å²	0	46.9 Å²	46.9	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	126.7	172.5	62.3	0	0	0	0	110.4	L148 T209 Y210 Q243 G246 S247	L148-T199 HydrophobicContact CD1-CG2 4.12Å; T199-T209 WeakPolarHBondContact CA-O 3.42Å; T199-Y210 HydrophobicContact CG2-CD1 3.48Å; T199-Y210 VanDerWaalsContact CG2-CD1 3.48Å; T199-Y210 HydrophobicContact CG2-CE1 3.43Å; T199-Y210 VanDerWaalsContact CG2-CE1 3.43Å; T199-Q243 PolarHBondContact O-N 2.78Å; T199-Q243 PolarHBondContact OG1-O 3.41Å; T199-G246 WeakPolarHBondContact CG2-O 3.5Å; T199-G246 VanDerWaalsContact OG1-C 3.22Å; T199-G246 WeakPolarHBondContact OG1-CA 3.11Å; T199-S247 PolarHBondContact N-OG 2.84Å; T199-S247 VanDerWaalsContact N-OG 3.08Å; T199-S247 PolarHBondContact OG1-N 3.33Å; T199-S247 PolarHBondContact OG1-OG 2.89Å
200	Y	89.4	Confident	85.4	Confident	2 Å²	2	48.6 Å²	48.6	1%	0.008	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	136.2	172.4	-52.8	-92.8	0	0	0	110.8	A198 E208 T209 Q211 P220 L221 L240 H241 M242	A198-Y200 HydrophobicContact CB-CE2 3.94Å; Y200-E208 CarbonylContact O-C 3.5Å; Y200-E208 VanDerWaalsContact O-CA 3.31Å; Y200-E208 WeakPolarHBondContact O-CA 3.33Å; Y200-T209 WeakPolarHBondContact CB-OG1 3.26Å; Y200-T209 PolarHBondContact N-O 3.47Å; Y200-T209 PolarHBondContact O-N 3.34Å; Y200-T209 PolarHBondContact O-OG1 3.3Å; Y200-Q211 HydrophobicContact CE2-CB 3.84Å; Y200-Q211 VanDerWaalsContact CE2-OE1 3.26Å; Y200-Q211 PolarHBondContact OH-OE1 3.4Å; Y200-P220 HydrophobicContact CE1-CB 4Å; Y200-P220 VanDerWaalsContact OH-CA 3.3Å; Y200-P220 WeakPolarHBondContact OH-CA 3.44Å; Y200-L221 HydrophobicContact CD2-CB 4.31Å; Y200-L221 HydrophobicContact CD2-CD1 4.37Å; Y200-L221 HydrophobicContact CE2-CB 4.17Å; Y200-L221 HydrophobicContact CE2-CD1 4.24Å; Y200-L221 HydrophobicContact CE2-CG 4.31Å; Y200-L240 HydrophobicContact CD1-CB 4.44Å; Y200-L240 HydrophobicContact CG-CB 4.45Å; Y200-H241 CarbonylContact C-O 3.52Å; Y200-H241 VanDerWaalsContact CA-O 3.26Å; Y200-H241 WeakPolarHBondContact CA-O 3.17Å; Y200-M242 HydrophobicContact CD1-CB 3.81Å; Y200-M242 HydrophobicContact CD1-CG 4.41Å; Y200-M242 HydrophobicContact CE1-CB 3.76Å; Y200-M242 HydrophobicContact CE1-CG 4.15Å
201	T	87.3	Confident	85.4	Confident	34 Å²	34	43.1 Å²	43.1	21%	0.209	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	133	175.2	57.8	0	0	0	0	109.7	E208 H241 Q243	T201-E208 HydrophobicContact CG2-CG 4.11Å; T201-H241 PolarHBondContact N-O 3.37Å; T201-H241 PolarHBondContact O-N 2.82Å; T201-H241 PolarHBondContact OG1-O 2.93Å; T201-Q243 HydrophobicContact CG2-CB 4.23Å
202	C	84.9	Confident	85.2	Confident	3 Å²	3	45.6 Å²	45.6	2%	0.02	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	128.6	174.6	-176.4	0	0	0	0	111.3	R204 C205 G206 A207 C224 C229 L240	C202-R204 VanDerWaalsContact C-N 3.27Å; C202-R204 PolarHBondContact O-N 3.31Å; C202-C205 WeakPolarHBondContact CB-SG 3.43Å; C202-C205 PolarHBondContact SG-SG 2.9Å; C202-G206 VanDerWaalsContact O-CA 3.27Å; C202-G206 WeakPolarHBondContact O-CA 3.31Å; C202-G206 PolarHBondContact O-N 3.16Å; C202-A207 PolarHBondContact N-O 3.47Å; C202-C224 HydrophobicContact CB-CB 4.21Å; C202-C229 VanDerWaalsContact SG-SG 3.66Å; C202-L240 HydrophobicContact CB-CD2 3.8Å
203	D	84.1	Confident	85.1	Confident	105 Å²	105	44.2 Å²	44.2	56%	0.561	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.3	-30	-179.4	-61.9	-26.7	0	0	0	113.7	R239 H241	D203-R239 PolarHBondContact N-O 3.41Å; D203-H241 IonicContact OD1-CD2 3.62Å; D203-H241 PolarHBondContact OD1-CD2 3.03Å; D203-H241 VanDerWaalsContact OD1-CD2 3.3Å; D203-H241 IonicContact OD2-CD2 3.21Å; D203-H241 PolarHBondContact OD2-CD2 3.05Å; D203-H241 IonicContact OD2-NE2 3.31Å; D203-H241 PolarHBondContact OD2-NE2 3.16Å
204	R	79.8	Confident	84.6	Confident	162 Å²	162	44.2 Å²	44.2	61%	0.611	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-90.3	-46.8	-173.5	-68.9	-172.3	179.4	173.6	-0.8	113.1	C202 G235 G236	C202-R204 VanDerWaalsContact C-N 3.27Å; C202-R204 PolarHBondContact O-N 3.31Å; R204-G235 PolarHBondContact NH1-O 3.48Å; R204-G236 PolarHBondContact NH1-O 3.48Å
205	C	75.9	Confident	84.1	Confident	44 Å²	44	46 Å²	46	30%	0.297	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.6	-5.3	-176.6	69.7	0	0	0	0	113.7	C202 A207 A228	C202-C205 WeakPolarHBondContact CB-SG 3.43Å; C202-C205 PolarHBondContact SG-SG 2.9Å; C205-A207 PolarHBondContact O-N 3.03Å; C205-A207 VanDerWaalsContact SG-CB 3.51Å; C205-A228 HydrophobicContact CB-CB 4.4Å
206	G	78.4	Confident	83.4	Confident	58 Å²	58	49.5 Å²	49.5	60%	0.598	27%	0.271	S	S	*	.			trans	64	5.3	-178.3	0	0	0	0	0	114.7	C202	C202-G206 VanDerWaalsContact O-CA 3.27Å; C202-G206 WeakPolarHBondContact O-CA 3.31Å; C202-G206 PolarHBondContact O-N 3.16Å
207	A	76	Confident	83.2	Confident	25 Å²	25	52.2 Å²	52.2	21%	0.207	29%	0.287	C	S	.	.			trans	-73.6	133.2	-178.1	0	0	0	0	0	110.2	C202 C205 T226	C202-A207 PolarHBondContact N-O 3.47Å; C205-A207 PolarHBondContact O-N 3.03Å; C205-A207 VanDerWaalsContact SG-CB 3.51Å; A207-T226 HydrophobicContact CB-CG2 4.33Å
208	E	79.3	Confident	83	Confident	65 Å²	65	56.2 Å²	56.2	30%	0.304	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	137.8	169.1	-54.5	-161.4	156.1	0	0	109.7	R109 Y200 T201 Y210	R109-E208 IonicContact CZ-OE1 3.74Å; R109-E208 VanDerWaalsContact CZ-OE1 3.25Å; R109-E208 IonicContact CZ-OE2 3.52Å; R109-E208 IonicContact NE-OE1 3.33Å; R109-E208 PolarHBondContact NE-OE1 2.85Å; R109-E208 IonicContact NE-OE2 3.53Å; R109-E208 PolarHBondContact NE-OE2 2.78Å; R109-E208 IonicContact NH1-OE2 3.81Å; R109-E208 VanDerWaalsContact NH2-CD 3.33Å; R109-E208 IonicContact NH2-OE1 3.36Å; R109-E208 PolarHBondContact NH2-OE1 3.47Å; R109-E208 IonicContact NH2-OE2 3.72Å; R109-E208 PolarHBondContact NH2-OE2 3.06Å; R109-E208 VanDerWaalsContact NH2-OE2 3.17Å; Y200-E208 CarbonylContact O-C 3.5Å; Y200-E208 VanDerWaalsContact O-CA 3.31Å; Y200-E208 WeakPolarHBondContact O-CA 3.33Å; T201-E208 HydrophobicContact CG2-CG 4.11Å; E208-Y210 HydrophobicContact CB-CE2 4.47Å; E208-Y210 PolarHBondContact OE2-OH 3.04Å
209	T	83.7	Confident	82.8	Confident	27 Å²	27	63.7 Å²	63.7	17%	0.166	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	138.1	174.4	52.8	0	0	0	0	109	T199 Y200	T199-T209 WeakPolarHBondContact CA-O 3.42Å; Y200-T209 WeakPolarHBondContact CB-OG1 3.26Å; Y200-T209 PolarHBondContact N-O 3.47Å; Y200-T209 PolarHBondContact O-N 3.34Å; Y200-T209 PolarHBondContact O-OG1 3.3Å
210	Y	85.5	Confident	82.7	Confident	58 Å²	58	67 Å²	67	23%	0.227	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	134.9	-176.5	-53.7	-81.9	0	0	0	109.4	F144 P145 L148 A198 T199 E208	F144-Y210 HydrophobicContact CD1-CE1 4.37Å; F144-Y210 AromaticContact CD1-CE2 3.85Å; F144-Y210 HydrophobicContact CD1-CE2 3.85Å; F144-Y210 AromaticContact CD1-CZ 3.71Å; F144-Y210 HydrophobicContact CE1-CE2 4.08Å; F144-Y210 AromaticContact CE1-CZ 3.79Å; F144-Y210 VanDerWaalsContact CE1-OH 3.23Å; F144-Y210 WeakPolarHBondContact CE1-OH 3.49Å; P145-Y210 HydrophobicContact CG-CG 4.25Å; L148-Y210 HydrophobicContact CD1-CD1 3.66Å; L148-Y210 HydrophobicContact CD1-CE1 3.75Å; A198-Y210 WeakPolarHBondContact O-CA 3.4Å; T199-Y210 HydrophobicContact CG2-CD1 3.48Å; T199-Y210 VanDerWaalsContact CG2-CD1 3.48Å; T199-Y210 HydrophobicContact CG2-CE1 3.43Å; T199-Y210 VanDerWaalsContact CG2-CE1 3.43Å; E208-Y210 HydrophobicContact CB-CE2 4.47Å; E208-Y210 PolarHBondContact OE2-OH 3.04Å
211	Q	86.2	Confident	82.4	Confident	42 Å²	42	70.4 Å²	70.4	20%	0.196	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	122.6	173.1	-175.9	-177.8	16	0	0	109.1	T197 A198 Y200 M219 L221	T197-Q211 WeakPolarHBondContact CA-O 3.38Å; A198-Q211 PolarHBondContact N-O 3.03Å; A198-Q211 PolarHBondContact O-N 2.87Å; Y200-Q211 HydrophobicContact CE2-CB 3.84Å; Y200-Q211 VanDerWaalsContact CE2-OE1 3.26Å; Y200-Q211 PolarHBondContact OH-OE1 3.4Å; Q211-M219 PolarHBondContact NE2-O 2.86Å; Q211-L221 HydrophobicContact CB-CD1 4.17Å; Q211-L221 HydrophobicContact CG-CD1 4.43Å
212	E	86.4	Confident	82.1	Confident	92 Å²	92	73.3 Å²	73.3	43%	0.43	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	131.8	171.9	-66.8	175	-179.5	0	0	110	P145 T197	P145-E212 HydrophobicContact CB-CG 4.39Å; P145-E212 WeakPolarHBondContact CB-OE1 3.35Å; T197-E212 HydrophobicContact CG2-CG 4.22Å
213	I	85.5	Confident	82	Confident	18 Å²	18	78.3 Å²	78.3	9%	0.092	43%	0.429	C	S	.	.			trans	-115.9	102	-175.8	-61.3	165.7	0	0	0	107.9	I195 T196 A198 N215 F218	I195-I213 HydrophobicContact CB-CD1 4.43Å; I195-I213 HydrophobicContact CD1-CD1 4.15Å; I195-I213 HydrophobicContact CG1-CD1 4.09Å; I195-I213 HydrophobicContact CG2-CD1 3.58Å; I195-I213 HydrophobicContact CG2-CG2 4.47Å; T196-I213 PolarHBondContact O-N 3.07Å; A198-I213 HydrophobicContact CB-CD1 3.69Å; I213-N215 WeakPolarHBondContact CG2-O 3.37Å; I213-F218 HydrophobicContact CD1-CD1 3.85Å; I213-F218 HydrophobicContact CD1-CD2 3.77Å; I213-F218 HydrophobicContact CD1-CE1 3.69Å; I213-F218 HydrophobicContact CD1-CE2 3.6Å; I213-F218 HydrophobicContact CD1-CG 3.9Å; I213-F218 HydrophobicContact CD1-CZ 3.56Å; I213-F218 HydrophobicContact CG1-CB 4.43Å; I213-F218 HydrophobicContact CG1-CD1 4.2Å; I213-F218 HydrophobicContact CG1-CD2 4.1Å; I213-F218 HydrophobicContact CG1-CE2 4.43Å; I213-F218 HydrophobicContact CG1-CG 3.99Å; I213-F218 HydrophobicContact CG2-CB 4.15Å; I213-F218 HydrophobicContact CG2-CD1 3.63Å; I213-F218 HydrophobicContact CG2-CE1 4.27Å; I213-F218 HydrophobicContact CG2-CG 3.99Å
214	N	80.5	Confident	81.6	Confident	103 Å²	103	73.5 Å²	73.5	55%	0.551	40%	0.403	S	S	*	.			trans	-96.3	-25.3	176.1	-68.5	-41.1	0	0	0	112.6
215	N	80.3	Confident	81.5	Confident	88 Å²	88	67.9 Å²	67.9	47%	0.471	40%	0.396	S	S	.	.	S	Bend	trans	-98.8	147.2	-175.8	-68.7	-22.6	0	0	0	111	I213 T217	I213-N215 WeakPolarHBondContact CG2-O 3.37Å; N215-T217 PolarHBondContact O-N 3.23Å; N215-T217 VanDerWaalsContact O-N 3.17Å
216	P	75.5	Confident	81.3	Confident	93 Å²	93	68 Å²	68	60%	0.604	40%	0.395	S	S	*	.	S	Bend	trans	-61.7	-25.8	177.9	25.6	-34.8	0	0	0	112.6
217	T	82.2	Confident	81	Confident	77 Å²	77	68.2 Å²	68.2	47%	0.472	39%	0.392	S	S	.	.	S	Bend	trans	-113	127.1	174.4	58.8	0	0	0	0	109.7	N215	N215-T217 PolarHBondContact O-N 3.23Å; N215-T217 VanDerWaalsContact O-N 3.17Å
218	F	84.1	Confident	80.7	Confident	84 Å²	84	70.2 Å²	70.2	37%	0.368	41%	0.408	S	S	.	.			trans	-136.5	154.8	173.7	70.4	-81.2	0	0	0	110.5	I195 I213	I195-F218 HydrophobicContact CG2-CE1 3.98Å; I195-F218 HydrophobicContact CG2-CZ 4.31Å; I213-F218 HydrophobicContact CD1-CD1 3.85Å; I213-F218 HydrophobicContact CD1-CD2 3.77Å; I213-F218 HydrophobicContact CD1-CE1 3.69Å; I213-F218 HydrophobicContact CD1-CE2 3.6Å; I213-F218 HydrophobicContact CD1-CG 3.9Å; I213-F218 HydrophobicContact CD1-CZ 3.56Å; I213-F218 HydrophobicContact CG1-CB 4.43Å; I213-F218 HydrophobicContact CG1-CD1 4.2Å; I213-F218 HydrophobicContact CG1-CD2 4.1Å; I213-F218 HydrophobicContact CG1-CE2 4.43Å; I213-F218 HydrophobicContact CG1-CG 3.99Å; I213-F218 HydrophobicContact CG2-CB 4.15Å; I213-F218 HydrophobicContact CG2-CD1 3.63Å; I213-F218 HydrophobicContact CG2-CE1 4.27Å; I213-F218 HydrophobicContact CG2-CG 3.99Å
219	M	86	Confident	80.3	Confident	157 Å²	157	67.4 Å²	67.4	77%	0.773	40%	0.396	S	S	*	.	P	Polyproline II helix	trans	-99.3	129.3	172.7	-171.6	172.3	68.8	0	0	108.8	Q211	Q211-M219 PolarHBondContact NE2-O 2.86Å
220	P	85	Confident	79.7	Confident	71 Å²	71	73.1 Å²	73.1	46%	0.461	42%	0.418	S	S	.	.	P	Polyproline II helix	trans	-69.6	145.5	178.8	28.3	-34.2	0	0	0	111.5	Y200 T222	Y200-P220 HydrophobicContact CE1-CB 4Å; Y200-P220 VanDerWaalsContact OH-CA 3.3Å; Y200-P220 WeakPolarHBondContact OH-CA 3.44Å; P220-T222 PolarHBondContact O-N 3.42Å
221	L	84	Confident	79.1	Confident	73 Å²	73	77 Å²	77	38%	0.382	44%	0.443	S	S	.	.	P	Polyproline II helix	trans	-75.6	123.6	174.4	-64.9	173.6	0	0	0	109.7	Y200 Q211 L240	Y200-L221 HydrophobicContact CD2-CB 4.31Å; Y200-L221 HydrophobicContact CD2-CD1 4.37Å; Y200-L221 HydrophobicContact CE2-CB 4.17Å; Y200-L221 HydrophobicContact CE2-CD1 4.24Å; Y200-L221 HydrophobicContact CE2-CG 4.31Å; Q211-L221 HydrophobicContact CB-CD1 4.17Å; Q211-L221 HydrophobicContact CG-CD1 4.43Å; L221-L240 HydrophobicContact CB-CD1 3.8Å; L221-L240 VanDerWaalsContact O-CB 3.29Å; L221-L240 WeakPolarHBondContact O-CB 3.41Å
222	T	81.4	Confident	78.2	Confident	95 Å²	95	77.9 Å²	77.9	58%	0.583	46%	0.457	S	S	*	.			trans	-103.6	-22.1	178.6	51.9	0	0	0	0	113.2	P220 L240	P220-T222 PolarHBondContact O-N 3.42Å; T222-L240 PolarHBondContact O-N 3.37Å
223	V	81.2	Confident	77.1	Confident	108 Å²	108	75.2 Å²	75.2	66%	0.655	45%	0.454	S	S	*	.	B	Isolated β-bridge	trans	-108.4	125.7	-174.5	-175.2	0	0	0	0	110.3	G225 L240	V223-G225 PolarHBondContact O-N 3.11Å; V223-L240 VanDerWaalsContact O-CD1 3.25Å; V223-L240 WeakPolarHBondContact O-CD1 3.5Å
224	C	76.8	Confident	75.8	Confident	3 Å²	3	81.4 Å²	81.4	2%	0.02	50%	0.495	C	S	.	.			trans	-68.7	125.5	176.3	-173.4	0	0	0	0	111.7	C202 T226 C229 L240	C202-C224 HydrophobicContact CB-CB 4.21Å; C224-T226 PolarHBondContact SG-OG1 3.43Å; C224-C229 HydrophobicContact CB-CB 3.93Å; C224-L240 HydrophobicContact CB-CD2 4.04Å; C224-L240 HydrophobicContact CB-CG 4.23Å
225	G	76.7	Confident	74.8	Confident	44 Å²	44	79.9 Å²	79.9	45%	0.454	50%	0.504	S	S	.	.			trans	-80.7	-9.7	-179.8	0	0	0	0	0	115.5	V223 K230	V223-G225 PolarHBondContact O-N 3.11Å; G225-K230 WeakPolarHBondContact O-CE 3.42Å; G225-K230 PolarHBondContact O-NZ 3.31Å
226	T	72.1	Confident	73.9	Confident	47 Å²	47	76.2 Å²	76.2	29%	0.288	49%	0.487	S	S	.	.	S	Bend	trans	-67.3	139.1	-172.9	-44	0	0	0	0	111.7	A207 C224 A228 C229 K230	A207-T226 HydrophobicContact CB-CG2 4.33Å; C224-T226 PolarHBondContact SG-OG1 3.43Å; T226-A228 HydrophobicContact CG2-CB 4.36Å; T226-A228 PolarHBondContact O-N 2.96Å; T226-A228 VanDerWaalsContact O-N 3.15Å; T226-C229 PolarHBondContact O-N 3.15Å; T226-K230 PolarHBondContact O-N 2.88Å
227	A	72.3	Confident	73.5	Confident	63 Å²	63	73.4 Å²	73.4	52%	0.521	48%	0.475	S	S	.	.	H	α-helix	trans	-53.5	-36.8	179.7	0	0	0	0	0	112.8	C229 K230 N231	A227-C229 VanDerWaalsContact C-N 3.32Å; A227-C229 PolarHBondContact O-N 3.38Å; A227-K230 PolarHBondContact O-N 3.22Å; A227-N231 WeakPolarHBondContact O-CB 3.48Å; A227-N231 PolarHBondContact O-N 2.7Å; A227-N231 PolarHBondContact O-ND2 3.15Å; A227-N231 PolarHBondContact O-OD1 3.26Å
228	A	70.4	Confident	73.1	Confident	66 Å²	66	70 Å²	70	55%	0.545	46%	0.455	S	S	.	.	H	α-helix	trans	-57.8	-40	175.4	0	0	0	0	0	113.2	C205 T226	C205-A228 HydrophobicContact CB-CB 4.4Å; T226-A228 HydrophobicContact CG2-CB 4.36Å; T226-A228 PolarHBondContact O-N 2.96Å; T226-A228 VanDerWaalsContact O-N 3.15Å
229	C	70.4	Confident	73	Confident	7 Å²	7	75.1 Å²	75.1	5%	0.047	47%	0.472	C	S	.	.	H	α-helix	trans	-83.3	-32.8	177.7	-79.3	0	0	0	0	112.7	C202 C224 T226 A227 N231 A232	C202-C229 VanDerWaalsContact SG-SG 3.66Å; C224-C229 HydrophobicContact CB-CB 3.93Å; T226-C229 PolarHBondContact O-N 3.15Å; A227-C229 VanDerWaalsContact C-N 3.32Å; A227-C229 PolarHBondContact O-N 3.38Å; C229-N231 VanDerWaalsContact C-N 3.32Å; C229-A232 PolarHBondContact O-N 3.1Å
230	K	72.2	Confident	73	Confident	147 Å²	147	68.4 Å²	68.4	64%	0.639	44%	0.439	S	S	*	.	H	α-helix	trans	-64.4	-37.7	175.6	-75.8	-179.4	174.4	169	0	112	G225 T226 A227 A232	G225-K230 WeakPolarHBondContact O-CE 3.42Å; G225-K230 PolarHBondContact O-NZ 3.31Å; T226-K230 PolarHBondContact O-N 2.88Å; A227-K230 PolarHBondContact O-N 3.22Å; K230-A232 VanDerWaalsContact C-N 3.28Å; K230-A232 PolarHBondContact O-N 3.45Å
231	N	72.3	Confident	73.1	Confident	140 Å²	140	69.7 Å²	69.7	75%	0.749	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.3	-14.3	-178	-66	-7	0	0	0	113.3	A227 C229 G233	A227-N231 WeakPolarHBondContact O-CB 3.48Å; A227-N231 PolarHBondContact O-N 2.7Å; A227-N231 PolarHBondContact O-ND2 3.15Å; A227-N231 PolarHBondContact O-OD1 3.26Å; C229-N231 VanDerWaalsContact C-N 3.32Å; N231-G233 PolarHBondContact O-N 3.45Å
232	A	66.5	Low	73.3	Confident	60 Å²	60	70 Å²	70	50%	0.496	44%	0.439	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.5	6.2	-178.1	0	0	0	0	0	114.7	C229 K230 G236	C229-A232 PolarHBondContact O-N 3.1Å; K230-A232 VanDerWaalsContact C-N 3.28Å; K230-A232 PolarHBondContact O-N 3.45Å; A232-G236 WeakPolarHBondContact O-CA 3.36Å
233	G	64.2	Low	73.5	Confident	35 Å²	35	68.8 Å²	68.8	36%	0.361	43%	0.427	S	S	.	.			trans	85.3	170.3	174.3	0	0	0	0	0	115.5	N231 G235 G236	N231-G233 PolarHBondContact O-N 3.45Å; G233-G235 PolarHBondContact O-N 3.1Å; G233-G236 PolarHBondContact O-N 3.25Å
234	P	57.7	Low	73.8	Confident	148 Å²	148	67.7 Å²	67.7	96%	0.961	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.4	100.4	-178.8	28.5	-30.7	0	0	0	109.8
235	G	60.3	Low	74.1	Confident	71 Å²	71	75.5 Å²	75.5	73%	0.732	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	118.6	-12.6	-170.1	0	0	0	0	0	113.8	R204 G233	R204-G235 PolarHBondContact NH1-O 3.48Å; G233-G235 PolarHBondContact O-N 3.1Å
236	G	60.7	Low	74.3	Confident	11 Å²	11	73.6 Å²	73.6	11%	0.113	43%	0.43	C	S	.	.			trans	-81.8	-13	176.4	0	0	0	0	0	115.3	R204 A232 G233 G238	R204-G236 PolarHBondContact NH1-O 3.48Å; A232-G236 WeakPolarHBondContact O-CA 3.36Å; G233-G236 PolarHBondContact O-N 3.25Å; G236-G238 PolarHBondContact O-N 3.03Å
237	G	66.7	Low	74.9	Confident	35 Å²	35	71.5 Å²	71.5	36%	0.361	42%	0.418	S	S	.	.	P	Polyproline II helix	trans	-63.7	120.5	-179.6	0	0	0	0	0	112.3
238	G	73.1	Confident	75.6	Confident	4 Å²	4	70.3 Å²	70.3	4%	0.041	40%	0.401	C	S	.	.	P	Polyproline II helix	trans	-64.5	146.2	169.1	0	0	0	0	0	110.8	G236	G236-G238 PolarHBondContact O-N 3.03Å
239	R	83	Confident	76.4	Confident	192 Å²	192	71.6 Å²	71.6	73%	0.725	39%	0.394	S	S	*	.	B	Isolated β-bridge	trans	-76.6	140.6	173.3	-68.3	-176.8	178.9	-174	-0.3	108.9	D203	D203-R239 PolarHBondContact N-O 3.41Å
240	L	85.3	Confident	77.3	Confident	16 Å²	16	73.2 Å²	73.2	8%	0.084	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	123.8	173	-73.5	-179.6	0	0	0	109.2	Y200 C202 L221 T222 V223 C224	Y200-L240 HydrophobicContact CD1-CB 4.44Å; Y200-L240 HydrophobicContact CG-CB 4.45Å; C202-L240 HydrophobicContact CB-CD2 3.8Å; L221-L240 HydrophobicContact CB-CD1 3.8Å; L221-L240 VanDerWaalsContact O-CB 3.29Å; L221-L240 WeakPolarHBondContact O-CB 3.41Å; T222-L240 PolarHBondContact O-N 3.37Å; V223-L240 VanDerWaalsContact O-CD1 3.25Å; V223-L240 WeakPolarHBondContact O-CD1 3.5Å; C224-L240 HydrophobicContact CB-CD2 4.04Å; C224-L240 HydrophobicContact CB-CG 4.23Å
241	H	87.6	Confident	78.2	Confident	98 Å²	98	70.4 Å²	70.4	45%	0.454	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	130.8	171.7	-77.6	-75.4	0	0	0	109.8	Y200 T201 D203 Q243	Y200-H241 CarbonylContact C-O 3.52Å; Y200-H241 VanDerWaalsContact CA-O 3.26Å; Y200-H241 WeakPolarHBondContact CA-O 3.17Å; T201-H241 PolarHBondContact N-O 3.37Å; T201-H241 PolarHBondContact O-N 2.82Å; T201-H241 PolarHBondContact OG1-O 2.93Å; D203-H241 IonicContact OD1-CD2 3.62Å; D203-H241 PolarHBondContact OD1-CD2 3.03Å; D203-H241 VanDerWaalsContact OD1-CD2 3.3Å; D203-H241 IonicContact OD2-CD2 3.21Å; D203-H241 PolarHBondContact OD2-CD2 3.05Å; D203-H241 IonicContact OD2-NE2 3.31Å; D203-H241 PolarHBondContact OD2-NE2 3.16Å; H241-Q243 PolarHBondContact O-N 3.16Å
242	M	87.8	Confident	79.1	Confident	79 Å²	79	65.4 Å²	65.4	39%	0.389	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	125.7	176.6	-175.5	-170.8	169.2	0	0	110	I195 A198 Y200	I195-M242 HydrophobicContact CD1-CE 3.14Å; A198-M242 HydrophobicContact CB-CE 4.35Å; Y200-M242 HydrophobicContact CD1-CB 3.81Å; Y200-M242 HydrophobicContact CD1-CG 4.41Å; Y200-M242 HydrophobicContact CE1-CB 3.76Å; Y200-M242 HydrophobicContact CE1-CG 4.15Å
243	Q	86.1	Confident	80.3	Confident	71 Å²	71	63.1 Å²	63.1	33%	0.332	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	115.5	177.8	-173.8	65.1	11.8	0	0	109.9	T199 T201 H241 R245 G246 S247	T199-Q243 PolarHBondContact O-N 2.78Å; T199-Q243 PolarHBondContact OG1-O 3.41Å; T201-Q243 HydrophobicContact CG2-CB 4.23Å; H241-Q243 PolarHBondContact O-N 3.16Å; Q243-R245 HydrophobicContact CG-CB 4.42Å; Q243-G246 PolarHBondContact O-N 3.39Å; Q243-S247 PolarHBondContact O-N 3Å; Q243-S247 PolarHBondContact O-OG 3.44Å
244	T	87.4	Confident	81.5	Confident	85 Å²	85	62.5 Å²	62.5	52%	0.521	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	-37.9	-179.8	54	0	0	0	0	112.6	G246 S247 F249	T244-G246 PolarHBondContact O-N 3.2Å; T244-S247 PolarHBondContact O-N 2.76Å; T244-F249 HydrophobicContact CG2-CZ 4.44Å
245	R	83.4	Confident	83	Confident	166 Å²	166	55.7 Å²	55.7	63%	0.626	28%	0.284	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-62	-28	-178.7	-62.3	-172.6	-178.5	-178.1	-0.7	114	Q243	Q243-R245 HydrophobicContact CG-CB 4.42Å
246	G	79.8	Confident	84.5	Confident	5 Å²	5	55.7 Å²	55.7	5%	0.052	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	-15.8	178.1	0	0	0	0	0	113.9	R109 T199 Q243 T244	R109-G246 PolarHBondContact NH1-O 2.88Å; R109-G246 VanDerWaalsContact NH2-CA 3.3Å; T199-G246 WeakPolarHBondContact CG2-O 3.5Å; T199-G246 VanDerWaalsContact OG1-C 3.22Å; T199-G246 WeakPolarHBondContact OG1-CA 3.11Å; Q243-G246 PolarHBondContact O-N 3.39Å; T244-G246 PolarHBondContact O-N 3.2Å
247	S	85.9	Confident	85.9	Confident	3 Å²	3	55.2 Å²	55.2	2%	0.021	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	148	-175	-59.2	0	0	0	0	110.2	T197 T199 Q243 T244	T197-S247 CarbonylContact O-C 3.46Å; T197-S247 VanDerWaalsContact O-CA 3.23Å; T197-S247 WeakPolarHBondContact O-CA 3.34Å; T197-S247 VanDerWaalsContact O-CB 3.25Å; T197-S247 WeakPolarHBondContact O-CB 3.5Å; T199-S247 PolarHBondContact N-OG 2.84Å; T199-S247 VanDerWaalsContact N-OG 3.08Å; T199-S247 PolarHBondContact OG1-N 3.33Å; T199-S247 PolarHBondContact OG1-OG 2.89Å; Q243-S247 PolarHBondContact O-N 3Å; Q243-S247 PolarHBondContact O-OG 3.44Å; T244-S247 PolarHBondContact O-N 2.76Å
248	K	85.8	Confident	87	Confident	38 Å²	38	56.3 Å²	56.3	17%	0.165	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	129	175.9	-173.9	175.1	167.3	-177	0	110.1	E147 R150 T196 T197	E147-K248 WeakPolarHBondContact O-CD 3.46Å; E147-K248 PolarHBondContact O-NZ 3.13Å; R150-K248 PolarHBondContact O-NZ 2.86Å; T196-K248 PolarHBondContact N-O 3.17Å; T196-K248 PolarHBondContact OG1-O 2.94Å; T197-K248 PolarHBondContact O-N 3.16Å; T197-K248 VanDerWaalsContact OG1-CB 3.26Å; T197-K248 WeakPolarHBondContact OG1-CB 3.22Å
249	F	89	Confident	87.6	Confident	92 Å²	92	56.4 Å²	56.4	40%	0.404	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	139.1	173.4	-59.2	-82.6	0	0	0	109.5	P193 L194 I195 T244	P193-F249 HydrophobicContact CB-CB 4.24Å; P193-F249 HydrophobicContact CB-CD1 4.23Å; P193-F249 HydrophobicContact CB-CG 4.47Å; L194-F249 CarbonylContact O-C 3.56Å; L194-F249 WeakPolarHBondContact O-CA 3.29Å; I195-F249 HydrophobicContact CB-CD1 3.94Å; I195-F249 HydrophobicContact CB-CE1 3.88Å; I195-F249 HydrophobicContact CD1-CE1 4Å; I195-F249 HydrophobicContact CD1-CZ 4.32Å; I195-F249 HydrophobicContact CG1-CD1 4.3Å; I195-F249 HydrophobicContact CG1-CE1 4.06Å; T244-F249 HydrophobicContact CG2-CZ 4.44Å
250	L	88.5	Confident	87.5	Confident	41 Å²	41	48 Å²	48	22%	0.215	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	151.5	169.4	-66.8	-177.9	0	0	0	109.6	P193 L194 T196	P193-L250 CarbonylContact C-O 3.6Å; P193-L250 WeakPolarHBondContact CA-O 3.5Å; L194-L250 PolarHBondContact N-O 2.87Å; L194-L250 PolarHBondContact O-N 2.86Å; T196-L250 HydrophobicContact CG2-CB 4.43Å; T196-L250 HydrophobicContact CG2-CD1 3.41Å; T196-L250 VanDerWaalsContact CG2-CD1 3.41Å; T196-L250 HydrophobicContact CG2-CG 3.71Å
251	K	91.8	Very high	87.1	Confident	89 Å²	89	50.8 Å²	50.8	39%	0.387	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.8	135.8	168.9	-61	168	-173.6	157.9	0	108.3	V191 R278 G279 E280 T282	V191-K251 HydrophobicContact CG1-CB 3.78Å; V191-K251 HydrophobicContact CG1-CG 4.17Å; K251-R278 CarbonylContact O-C 3.54Å; K251-R278 WeakPolarHBondContact O-CA 3.45Å; K251-G279 WeakPolarHBondContact CB-O 3.28Å; K251-G279 PolarHBondContact O-N 2.92Å; K251-E280 IonicContact NZ-OE1 3.45Å; K251-E280 PolarHBondContact NZ-OE1 2.92Å; K251-E280 IonicContact NZ-OE2 3.65Å; K251-E280 PolarHBondContact NZ-OE2 3.09Å; K251-T282 HydrophobicContact CB-CG2 3.82Å; K251-T282 WeakPolarHBondContact CD-OG1 3.32Å
252	F	91.4	Very high	86.5	Confident	35 Å²	35	51 Å²	51	15%	0.154	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	135.4	178	173.8	-95.3	0	0	0	109.7	V191 K192 L194 Y276 L277 R278	V191-F252 CarbonylContact C-O 3.53Å; V191-F252 WeakPolarHBondContact CA-O 3.38Å; K192-F252 PolarHBondContact N-O 3.04Å; K192-F252 WeakPolarHBondContact O-CA 3.47Å; K192-F252 WeakPolarHBondContact O-CB 3.44Å; K192-F252 PolarHBondContact O-N 3.36Å; L194-F252 HydrophobicContact CB-CB 3.65Å; L194-F252 HydrophobicContact CB-CG 4.29Å; L194-F252 HydrophobicContact CD2-CB 4.49Å; L194-F252 HydrophobicContact CD2-CD2 4.1Å; F252-Y276 AromaticContact CE2-CD1 3.86Å; F252-Y276 HydrophobicContact CE2-CD1 3.86Å; F252-Y276 HydrophobicContact CE2-CD2 4.14Å; F252-Y276 HydrophobicContact CE2-CE1 4.49Å; F252-Y276 AromaticContact CE2-CG 3.67Å; F252-Y276 HydrophobicContact CE2-CG 3.67Å; F252-Y276 AromaticContact CZ-CD1 3.54Å; F252-Y276 HydrophobicContact CZ-CD1 3.54Å; F252-Y276 HydrophobicContact CZ-CD2 4.34Å; F252-Y276 AromaticContact CZ-CE1 3.82Å; F252-Y276 HydrophobicContact CZ-CE1 3.82Å; F252-Y276 AromaticContact CZ-CG 3.84Å; F252-Y276 HydrophobicContact CZ-CG 3.84Å; F252-L277 WeakPolarHBondContact CA-O 3.25Å; F252-R278 HydrophobicContact CD2-CG 4.26Å
253	Q	89.8	Confident	86.1	Confident	11 Å²	11	50.5 Å²	50.5	5%	0.051	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	138	176.3	-170.4	-176.3	13.1	0	0	109.4	T189 I255 L277 T282	T189-Q253 VanDerWaalsContact O-CG 3.29Å; T189-Q253 WeakPolarHBondContact O-CG 3.42Å; T189-Q253 PolarHBondContact O-NE2 2.65Å; Q253-I255 HydrophobicContact CG-CG1 4.39Å; Q253-L277 HydrophobicContact CB-CB 4.27Å; Q253-L277 PolarHBondContact N-O 2.97Å; Q253-L277 PolarHBondContact O-N 3.49Å; Q253-T282 HydrophobicContact CB-CG2 3.82Å
254	E	89.9	Confident	86	Confident	23 Å²	23	48.6 Å²	48.6	11%	0.107	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	130.9	172.7	-178	177.5	157.3	0	0	109.4	T189 R256 T274 Y276	T189-E254 HydrophobicContact CG2-CB 3.98Å; T189-E254 PolarHBondContact N-O 3.24Å; T189-E254 PolarHBondContact OG1-N 3.13Å; T189-E254 PolarHBondContact OG1-O 3.11Å; E254-R256 IonicContact OE1-NE 2.92Å; E254-R256 IonicContact OE1-NH2 3.18Å; E254-T274 HydrophobicContact CG-CG2 3.64Å; E254-T274 VanDerWaalsContact OE1-CG2 3.25Å; E254-T274 WeakPolarHBondContact OE1-CG2 3.5Å; E254-Y276 HydrophobicContact CB-CD1 4.24Å; E254-Y276 HydrophobicContact CB-CE1 4.26Å; E254-Y276 HydrophobicContact CG-CD1 4.07Å; E254-Y276 HydrophobicContact CG-CE1 3.84Å
255	I	90.2	Very high	85.9	Confident	4 Å²	4	47.5 Å²	47.5	2%	0.021	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	141.8	173.9	-60.5	-165.5	0	0	0	108.8	V185 R187 A188 Q253 I275 L277 A285	V185-I255 HydrophobicContact CB-CG2 4.23Å; V185-I255 HydrophobicContact CG1-CG2 3.39Å; V185-I255 HydrophobicContact CG2-CG2 3.88Å; R187-I255 WeakPolarHBondContact O-CA 3.39Å; A188-I255 HydrophobicContact CB-CD1 4.32Å; A188-I255 HydrophobicContact CB-CG1 4.12Å; Q253-I255 HydrophobicContact CG-CG1 4.39Å; I255-I275 PolarHBondContact N-O 3.12Å; I255-I275 PolarHBondContact O-N 3.17Å; I255-L277 HydrophobicContact CD1-CD1 3.28Å; I255-L277 HydrophobicContact CD1-CG 4.44Å; I255-L277 HydrophobicContact CG1-CD1 3.76Å; I255-A285 HydrophobicContact CD1-CB 4.04Å
256	R	90.6	Very high	85.9	Confident	72 Å²	72	46.6 Å²	46.6	27%	0.272	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	125	171.3	-64.6	-168.7	-177.9	-177.4	3.1	110.6	T186 R187 E254 L273	T186-R256 PolarHBondContact N-O 3Å; T186-R256 PolarHBondContact OG1-O 3.15Å; R187-R256 HydrophobicContact CB-CB 4.3Å; R187-R256 PolarHBondContact O-N 3.19Å; E254-R256 IonicContact OE1-NE 2.92Å; E254-R256 IonicContact OE1-NH2 3.18Å; R256-L273 WeakPolarHBondContact CA-O 3.38Å
257	I	90.9	Very high	86.2	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	146.4	175.5	-65.8	-163.6	0	0	0	110.1	G183 V184 V185 A272 L273 I275 I291 V293	G183-I257 VanDerWaalsContact CA-CG2 3.4Å; V184-I257 CarbonylContact O-C 3.57Å; V184-I257 VanDerWaalsContact O-CA 3.32Å; V184-I257 WeakPolarHBondContact O-CA 3.49Å; V185-I257 HydrophobicContact CG2-CG1 4.45Å; I257-A272 CarbonylContact O-C 3.59Å; I257-A272 WeakPolarHBondContact O-CA 3.29Å; I257-L273 PolarHBondContact N-O 2.94Å; I257-L273 PolarHBondContact O-N 3.29Å; I257-I275 HydrophobicContact CB-CD1 4.23Å; I257-I275 HydrophobicContact CD1-CD1 3.15Å; I257-I275 HydrophobicContact CD1-CG1 4.33Å; I257-I275 HydrophobicContact CG1-CD1 3.52Å; I257-I275 HydrophobicContact CG1-CG1 4.24Å; I257-I291 HydrophobicContact CD1-CD1 3.39Å; I257-I291 HydrophobicContact CD1-CG1 3.49Å; I257-I291 VanDerWaalsContact CD1-CG1 3.49Å; I257-I291 HydrophobicContact CG1-CD1 4.07Å; I257-I291 HydrophobicContact CG1-CG1 4.4Å; I257-V293 HydrophobicContact CD1-CG2 3.69Å
258	Q	88.8	Confident	86.3	Confident	59 Å²	59	55.9 Å²	55.9	28%	0.276	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	152	168.6	-169.3	170.4	29.7	0	0	111.4	G183 V184 T186 P270	G183-Q258 CarbonylContact C-O 3.55Å; G183-Q258 VanDerWaalsContact CA-O 3.24Å; G183-Q258 WeakPolarHBondContact CA-O 3.28Å; V184-Q258 PolarHBondContact N-O 2.64Å; V184-Q258 PolarHBondContact O-N 3.12Å; T186-Q258 HydrophobicContact CG2-CB 3.6Å; Q258-P270 HydrophobicContact CG-CB 3.8Å; Q258-P270 HydrophobicContact CG-CG 4.34Å
259	E	87.7	Confident	86.3	Confident	6 Å²	6	61 Å²	61	3%	0.028	34%	0.336	C	S	.	.			trans	-54.7	146.4	171	-69.6	171.3	-178.3	0	0	111.7	V167 R168 V264 P270 R271	V167-E259 HydrophobicContact CB-CG 3.58Å; V167-E259 HydrophobicContact CG1-CG 4.48Å; V167-E259 HydrophobicContact CG2-CG 3.93Å; R168-E259 VanDerWaalsContact CA-OE1 3.3Å; R168-E259 WeakPolarHBondContact CA-OE1 3.37Å; R168-E259 VanDerWaalsContact CB-OE1 3.23Å; R168-E259 WeakPolarHBondContact CB-OE1 3.33Å; R168-E259 IonicContact CZ-OE2 2.79Å; R168-E259 PolarHBondContact N-OE1 2.97Å; R168-E259 IonicContact NE-OE1 3.46Å; R168-E259 IonicContact NE-OE2 3.71Å; R168-E259 IonicContact NH2-OE2 3.77Å; R168-E259 PolarHBondContact NH2-OE2 3.38Å; R168-E259 VanDerWaalsContact NH2-OE2 3.13Å; E259-V264 HydrophobicContact CB-CG2 4.01Å; E259-P270 HydrophobicContact CB-CB 4.41Å; E259-R271 PolarHBondContact N-O 2.96Å; E259-R271 WeakPolarHBondContact OE1-CB 3.36Å; E259-R271 PolarHBondContact OE2-N 3.35Å
260	L	80.7	Confident	86.2	Confident	16 Å²	16	58.8 Å²	58.8	8%	0.084	33%	0.33	C	S	.	.			trans	-66.3	137.6	167.2	-88.1	67.3	0	0	0	109.2	R182 G183 V184 D262 Q263	R182-L260 HydrophobicContact CG-CD1 3.99Å; R182-L260 HydrophobicContact CG-CD2 4.49Å; G183-L260 VanDerWaalsContact CA-CD1 3.43Å; V184-L260 HydrophobicContact CG2-CD1 4.14Å; V184-L260 HydrophobicContact CG2-CG 4.47Å; L260-D262 PolarHBondContact O-N 3.39Å; L260-D262 VanDerWaalsContact O-N 3.15Å; L260-Q263 HydrophobicContact CB-CG 4.42Å; L260-Q263 PolarHBondContact O-N 3.48Å
261	S	76.2	Confident	86.2	Confident	73 Å²	73	63.4 Å²	63.4	51%	0.51	35%	0.345	S	S	.	.	G	3₁₀ helix	trans	-52.3	-38.6	-179	-54.7	0	0	0	0	113	Q263 V264	S261-Q263 PolarHBondContact O-N 2.86Å; S261-V264 PolarHBondContact O-N 3.37Å; S261-V264 VanDerWaalsContact O-N 3.17Å
262	D	75.1	Confident	86.1	Confident	104 Å²	104	62.5 Å²	62.5	56%	0.556	35%	0.354	S	S	*	.	G	3₁₀ helix	trans	-60.7	-27.3	-180	-64.6	-10.9	0	0	0	114.1	L260	L260-D262 PolarHBondContact O-N 3.39Å; L260-D262 VanDerWaalsContact O-N 3.15Å
263	Q	79.2	Confident	86	Confident	68 Å²	68	61.4 Å²	61.4	32%	0.318	35%	0.35	S	S	.	.	G	3₁₀ helix	trans	-93.9	-5.6	-175.3	-61.6	178.1	-11.1	0	0	112.2	C166 L260 S261 P265	C166-Q263 PolarHBondContact SG-OE1 3.41Å; L260-Q263 HydrophobicContact CB-CG 4.42Å; L260-Q263 PolarHBondContact O-N 3.48Å; S261-Q263 PolarHBondContact O-N 2.86Å; Q263-P265 WeakPolarHBondContact O-CD 3.43Å
264	V	83.3	Confident	86.1	Confident	31 Å²	31	62.3 Å²	62.3	19%	0.188	36%	0.356	C	S	.	.	S	Bend	trans	-85	121.3	-177.9	-175.7	0	0	0	0	109	E259 S261 V266 H268 P270	E259-V264 HydrophobicContact CB-CG2 4.01Å; S261-V264 PolarHBondContact O-N 3.37Å; S261-V264 VanDerWaalsContact O-N 3.17Å; V264-V266 PolarHBondContact O-N 2.97Å; V264-H268 HydrophobicContact CG1-CB 4.47Å; V264-H268 VanDerWaalsContact CG1-O 3.26Å; V264-H268 WeakPolarHBondContact CG1-O 3.5Å; V264-P270 HydrophobicContact CG2-CB 3.99Å
265	P	85.6	Confident	86.2	Confident	61 Å²	61	61.4 Å²	61.4	40%	0.396	35%	0.352	S	S	.	.	P	Polyproline II helix	trans	-61.4	139.5	173.1	-21.2	33	0	0	0	111	Q263 G267 H268	Q263-P265 WeakPolarHBondContact O-CD 3.43Å; P265-G267 PolarHBondContact O-N 2.98Å; P265-H268 PolarHBondContact O-N 2.88Å
266	V	84.7	Confident	86.3	Confident	148 Å²	148	62.9 Å²	62.9	90%	0.897	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.1	128.7	178.5	-66.3	0	0	0	0	111	V264	V264-V266 PolarHBondContact O-N 2.97Å
267	G	84.4	Confident	86.4	Confident	88 Å²	88	59.6 Å²	59.6	91%	0.907	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	89.5	-9.3	-179.3	0	0	0	0	0	115.9	P265	P265-G267 PolarHBondContact O-N 2.98Å
268	H	88	Confident	86.4	Confident	115 Å²	115	62.6 Å²	62.6	53%	0.532	36%	0.357	S	S	.	.	P	Polyproline II helix	trans	-94.1	147.1	172.3	-75	-92	0	0	0	112.2	R168 V264 P265	R168-H268 PolarHBondContact NH1-ND1 3.16Å; V264-H268 HydrophobicContact CG1-CB 4.47Å; V264-H268 VanDerWaalsContact CG1-O 3.26Å; V264-H268 WeakPolarHBondContact CG1-O 3.5Å; P265-H268 PolarHBondContact O-N 2.88Å
269	I	86.8	Confident	86.3	Confident	146 Å²	146	59.9 Å²	59.9	75%	0.749	35%	0.345	S	S	*	.	P	Polyproline II helix	trans	-77.5	136.3	171.2	-56.3	173.1	0	0	0	108.4	R168 R271	R168-I269 PolarHBondContact NH2-O 2.96Å; R168-I269 VanDerWaalsContact NH2-O 3.16Å; I269-R271 PolarHBondContact O-N 3.03Å
270	P	85.9	Confident	86.2	Confident	45 Å²	45	63.9 Å²	63.9	29%	0.292	36%	0.363	S	S	.	.	P	Polyproline II helix	trans	-58.8	132.5	172.3	22.8	-34.7	0	0	0	111.1	Q258 E259 V264	Q258-P270 HydrophobicContact CG-CB 3.8Å; Q258-P270 HydrophobicContact CG-CG 4.34Å; E259-P270 HydrophobicContact CB-CB 4.41Å; V264-P270 HydrophobicContact CG2-CB 3.99Å
271	R	89	Confident	86.5	Confident	137 Å²	137	63.4 Å²	63.4	52%	0.517	36%	0.361	S	S	.	.	P	Polyproline II helix	trans	-82.9	149.6	177	-62.2	-179.4	172.9	-178.3	-1.5	110.5	V167 E259 I269	V167-R271 HydrophobicContact CG1-CB 4.44Å; E259-R271 PolarHBondContact N-O 2.96Å; E259-R271 WeakPolarHBondContact OE1-CB 3.36Å; E259-R271 PolarHBondContact OE2-N 3.35Å; I269-R271 PolarHBondContact O-N 3.03Å
272	A	89.5	Confident	87.1	Confident	71 Å²	71	60.6 Å²	60.6	59%	0.587	34%	0.34	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107.9	145.7	173.2	0	0	0	0	0	110.4	I257	I257-A272 CarbonylContact O-C 3.59Å; I257-A272 WeakPolarHBondContact O-CA 3.29Å
273	L	90.3	Very high	87.7	Confident	11 Å²	11	64.3 Å²	64.3	6%	0.058	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	132.3	175.5	-169.8	80.4	0	0	0	109.1	V167 V181 R256 I257 I275 F297 L332	V167-L273 HydrophobicContact CG1-CB 3.81Å; V167-L273 HydrophobicContact CG1-CD1 4.35Å; V181-L273 HydrophobicContact CG1-CD2 4.45Å; R256-L273 WeakPolarHBondContact CA-O 3.38Å; I257-L273 PolarHBondContact N-O 2.94Å; I257-L273 PolarHBondContact O-N 3.29Å; L273-I275 HydrophobicContact CD2-CD1 4.36Å; L273-I275 HydrophobicContact CD2-CG1 4.24Å; L273-F297 HydrophobicContact CD1-CD2 4.5Å; L273-F297 HydrophobicContact CD1-CE2 3.92Å; L273-L332 HydrophobicContact CD2-CB 3.9Å; L273-L332 HydrophobicContact CD2-CD2 3.98Å; L273-L332 HydrophobicContact CD2-CG 4.48Å
274	T	91.4	Very high	88	Confident	31 Å²	31	62.9 Å²	62.9	19%	0.19	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	131.8	172.1	-61	0	0	0	0	110	E254 Y276 Y331 L332	E254-T274 HydrophobicContact CG-CG2 3.64Å; E254-T274 VanDerWaalsContact OE1-CG2 3.25Å; E254-T274 WeakPolarHBondContact OE1-CG2 3.5Å; T274-Y276 HydrophobicContact CG2-CD1 4.19Å; T274-Y276 HydrophobicContact CG2-CE1 3.71Å; T274-Y331 WeakPolarHBondContact O-CA 3.48Å; T274-L332 PolarHBondContact O-N 3.21Å
275	I	92.3	Very high	88	Confident	3 Å²	3	61.4 Å²	61.4	2%	0.015	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	131.5	-179	-53.4	-166.9	0	0	0	109.1	I255 I257 L273 V293 L332 A334	I255-I275 PolarHBondContact N-O 3.12Å; I255-I275 PolarHBondContact O-N 3.17Å; I257-I275 HydrophobicContact CB-CD1 4.23Å; I257-I275 HydrophobicContact CD1-CD1 3.15Å; I257-I275 HydrophobicContact CD1-CG1 4.33Å; I257-I275 HydrophobicContact CG1-CD1 3.52Å; I257-I275 HydrophobicContact CG1-CG1 4.24Å; L273-I275 HydrophobicContact CD2-CD1 4.36Å; L273-I275 HydrophobicContact CD2-CG1 4.24Å; I275-V293 HydrophobicContact CD1-CB 4.12Å; I275-V293 HydrophobicContact CD1-CG1 4.08Å; I275-V293 HydrophobicContact CD1-CG2 3.87Å; I275-V293 HydrophobicContact CG2-CG1 4.26Å; I275-L332 CarbonylContact C-O 3.46Å; I275-L332 WeakPolarHBondContact CA-O 3.44Å; I275-L332 HydrophobicContact CD1-CD2 4.03Å; I275-L332 HydrophobicContact CG1-CB 4.14Å; I275-L332 HydrophobicContact CG1-CD2 4.43Å; I275-A334 HydrophobicContact CG2-CB 3.6Å
276	Y	92.7	Very high	87.8	Confident	36 Å²	36	63.9 Å²	63.9	14%	0.141	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	117	172.6	-67.8	-20.5	0	0	0	109.4	F252 E254 T274 Y331 L332 A334	F252-Y276 AromaticContact CE2-CD1 3.86Å; F252-Y276 HydrophobicContact CE2-CD1 3.86Å; F252-Y276 HydrophobicContact CE2-CD2 4.14Å; F252-Y276 HydrophobicContact CE2-CE1 4.49Å; F252-Y276 AromaticContact CE2-CG 3.67Å; F252-Y276 HydrophobicContact CE2-CG 3.67Å; F252-Y276 AromaticContact CZ-CD1 3.54Å; F252-Y276 HydrophobicContact CZ-CD1 3.54Å; F252-Y276 HydrophobicContact CZ-CD2 4.34Å; F252-Y276 AromaticContact CZ-CE1 3.82Å; F252-Y276 HydrophobicContact CZ-CE1 3.82Å; F252-Y276 AromaticContact CZ-CG 3.84Å; F252-Y276 HydrophobicContact CZ-CG 3.84Å; E254-Y276 HydrophobicContact CB-CD1 4.24Å; E254-Y276 HydrophobicContact CB-CE1 4.26Å; E254-Y276 HydrophobicContact CG-CD1 4.07Å; E254-Y276 HydrophobicContact CG-CE1 3.84Å; T274-Y276 HydrophobicContact CG2-CD1 4.19Å; T274-Y276 HydrophobicContact CG2-CE1 3.71Å; Y276-Y331 HydrophobicContact CD2-CD1 4.33Å; Y276-Y331 AromaticContact CD2-CD2 3.2Å; Y276-Y331 HydrophobicContact CD2-CD2 3.2Å; Y276-Y331 AromaticContact CD2-CE2 3.61Å; Y276-Y331 HydrophobicContact CD2-CE2 3.61Å; Y276-Y331 AromaticContact CD2-CG 3.6Å; Y276-Y331 HydrophobicContact CD2-CG 3.6Å; Y276-Y331 AromaticContact CE2-CD1 3.97Å; Y276-Y331 HydrophobicContact CE2-CD1 3.97Å; Y276-Y331 AromaticContact CE2-CD2 3.7Å; Y276-Y331 HydrophobicContact CE2-CD2 3.7Å; Y276-Y331 HydrophobicContact CE2-CE1 4.41Å; Y276-Y331 HydrophobicContact CE2-CE2 4.17Å; Y276-Y331 AromaticContact CE2-CG 3.57Å; Y276-Y331 HydrophobicContact CE2-CG 3.57Å; Y276-Y331 AromaticContact CG-CD2 3.97Å; Y276-Y331 HydrophobicContact CG-CD2 3.97Å; Y276-Y331 HydrophobicContact CG-CG 4.46Å; Y276-L332 PolarHBondContact N-O 3.34Å; Y276-A334 PolarHBondContact O-N 3.39Å; Y276-A334 VanDerWaalsContact O-N 3.07Å
277	L	91.8	Very high	87.7	Confident	2 Å²	2	58.1 Å²	58.1	1%	0.01	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	123.3	169.6	-63.2	170	0	0	0	108	F252 Q253 I255 N281 T282 A334 V337	F252-L277 WeakPolarHBondContact CA-O 3.25Å; Q253-L277 HydrophobicContact CB-CB 4.27Å; Q253-L277 PolarHBondContact N-O 2.97Å; Q253-L277 PolarHBondContact O-N 3.49Å; I255-L277 HydrophobicContact CD1-CD1 3.28Å; I255-L277 HydrophobicContact CD1-CG 4.44Å; I255-L277 HydrophobicContact CG1-CD1 3.76Å; L277-N281 HydrophobicContact CD2-CB 4.04Å; L277-T282 HydrophobicContact CB-CG2 4.28Å; L277-A334 HydrophobicContact CD2-CB 3.52Å; L277-V337 HydrophobicContact CD2-CG2 3.41Å; L277-V337 VanDerWaalsContact CD2-CG2 3.41Å
278	R	90	Very high	87.3	Confident	64 Å²	64	54 Å²	54	24%	0.242	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	152	172.5	-68.3	176.2	174.8	175.1	-6	108.8	Y155 K251 F252 E333	Y155-R278 PolarHBondContact OH-O 3.15Å; K251-R278 CarbonylContact O-C 3.54Å; K251-R278 WeakPolarHBondContact O-CA 3.45Å; F252-R278 HydrophobicContact CD2-CG 4.26Å; R278-E333 WeakPolarHBondContact CD-OE1 3.39Å; R278-E333 IonicContact CZ-OE1 2.81Å; R278-E333 IonicContact NE-OE1 2.97Å; R278-E333 VanDerWaalsContact NH1-CD 3.34Å; R278-E333 IonicContact NH1-OE1 3.84Å; R278-E333 PolarHBondContact NH1-OE1 3.27Å; R278-E333 IonicContact NH1-OE2 3.88Å; R278-E333 PolarHBondContact NH1-OE2 3.4Å
279	G	87	Confident	87	Confident	2 Å²	2	50.4 Å²	50.4	2%	0.021	25%	0.252	C	S	.	.	G	3₁₀ helix	trans	68.5	-138.2	169.7	0	0	0	0	0	114.5	E153 K251 N281 T282	E153-G279 VanDerWaalsContact OE1-CA 3.25Å; E153-G279 WeakPolarHBondContact OE1-CA 3.35Å; E153-G279 VanDerWaalsContact OE2-CA 3.3Å; E153-G279 WeakPolarHBondContact OE2-CA 3.49Å; K251-G279 WeakPolarHBondContact CB-O 3.28Å; K251-G279 PolarHBondContact O-N 2.92Å; G279-N281 VanDerWaalsContact C-N 3.28Å; G279-N281 PolarHBondContact O-N 3.36Å; G279-T282 WeakPolarHBondContact O-CG2 3.4Å; G279-T282 PolarHBondContact O-N 3.25Å; G279-T282 PolarHBondContact O-OG1 2.97Å
280	E	86.4	Confident	86.8	Confident	89 Å²	89	44.5 Å²	44.5	42%	0.416	22%	0.221	S	C	.	.	G	3₁₀ helix	trans	-75.3	-12	-175.1	-64.2	-56.7	143.8	0	0	114.5	V50 E153 K251 T282	V50-E280 HydrophobicContact CG2-CB 3.71Å; V50-E280 HydrophobicContact CG2-CG 3.76Å; E153-E280 PolarHBondContact OE2-N 2.92Å; K251-E280 IonicContact NZ-OE1 3.45Å; K251-E280 PolarHBondContact NZ-OE1 2.92Å; K251-E280 IonicContact NZ-OE2 3.65Å; K251-E280 PolarHBondContact NZ-OE2 3.09Å; E280-T282 PolarHBondContact O-N 3.01Å; E280-T282 VanDerWaalsContact O-N 3.15Å
281	N	87.4	Confident	87	Confident	6 Å²	6	42.5 Å²	42.5	3%	0.032	21%	0.208	C	C	.	.	G	3₁₀ helix	trans	-70.7	-4.8	172.8	-69.4	-24.9	0	0	0	113.2	Y52 L277 G279 A284 H335	Y52-N281 PolarHBondContact OH-OD1 3.27Å; L277-N281 HydrophobicContact CD2-CB 4.04Å; G279-N281 VanDerWaalsContact C-N 3.28Å; G279-N281 PolarHBondContact O-N 3.36Å; N281-A284 VanDerWaalsContact O-CB 3.3Å; N281-A284 WeakPolarHBondContact O-CB 3.43Å; N281-A284 PolarHBondContact O-N 3.39Å; N281-H335 PolarHBondContact ND2-O 3.11Å
282	T	88.6	Confident	87	Confident	14 Å²	14	36.9 Å²	36.9	9%	0.086	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.7	142.1	175.3	55.6	0	0	0	0	111.2	V191 K251 Q253 L277 G279 E280 A284	V191-T282 HydrophobicContact CG1-CG2 4.4Å; K251-T282 HydrophobicContact CB-CG2 3.82Å; K251-T282 WeakPolarHBondContact CD-OG1 3.32Å; Q253-T282 HydrophobicContact CB-CG2 3.82Å; L277-T282 HydrophobicContact CB-CG2 4.28Å; G279-T282 WeakPolarHBondContact O-CG2 3.4Å; G279-T282 PolarHBondContact O-N 3.25Å; G279-T282 PolarHBondContact O-OG1 2.97Å; E280-T282 PolarHBondContact O-N 3.01Å; E280-T282 VanDerWaalsContact O-N 3.15Å; T282-A284 PolarHBondContact O-N 3.15Å
283	R	87	Confident	87.1	Confident	183 Å²	183	33.6 Å²	33.6	69%	0.691	16%	0.161	S	C	*	.	T	Hydrogen-bonded Turn	trans	67.4	10.3	-175	-50.7	178.6	176.1	177.8	-2.8	115.7	V191 A285	V191-R283 HydrophobicContact CG2-CG 3.59Å; R283-A285 VanDerWaalsContact C-N 3.3Å; R283-A285 PolarHBondContact O-N 3.37Å
284	A	85.5	Confident	87.2	Confident	37 Å²	37	33.2 Å²	33.2	31%	0.306	16%	0.159	S	C	.	.			trans	-68.3	-24.8	178.5	0	0	0	0	0	114.1	N281 T282 V337	N281-A284 VanDerWaalsContact O-CB 3.3Å; N281-A284 WeakPolarHBondContact O-CB 3.43Å; N281-A284 PolarHBondContact O-N 3.39Å; T282-A284 PolarHBondContact O-N 3.15Å; A284-V337 HydrophobicContact CB-CB 4.27Å; A284-V337 HydrophobicContact CB-CG1 4.36Å
285	A	84	Confident	87.2	Confident	1 Å²	1	31.7 Å²	31.7	1%	0.008	15%	0.15	C	C	.	.			trans	-128.4	144	-176.5	0	0	0	0	0	112.7	V185 I255 R283 I291 V337	V185-A285 HydrophobicContact CG2-CB 4.02Å; I255-A285 HydrophobicContact CD1-CB 4.04Å; R283-A285 VanDerWaalsContact C-N 3.3Å; R283-A285 PolarHBondContact O-N 3.37Å; A285-I291 HydrophobicContact CB-CD1 4.06Å; A285-I291 HydrophobicContact CB-CG2 3.99Å; A285-V337 HydrophobicContact CB-CG1 4.34Å
286	Q	81.4	Confident	87.2	Confident	113 Å²	113	31.6 Å²	31.6	53%	0.528	15%	0.149	S	C	.	.			trans	-109.2	156.5	174.7	-62	-62.2	-33.5	0	0	110.9	V185 G288 D289	V185-Q286 WeakPolarHBondContact CB-O 3.44Å; Q286-G288 PolarHBondContact O-N 3.37Å; Q286-D289 WeakPolarHBondContact CB-OD2 3.32Å; Q286-D289 PolarHBondContact N-OD2 2.94Å; Q286-D289 VanDerWaalsContact N-OD2 3.13Å; Q286-D289 WeakPolarHBondContact O-CB 3.31Å; Q286-D289 PolarHBondContact O-N 2.83Å
287	P	81.7	Confident	87.2	Confident	26 Å²	26	30.6 Å²	30.6	17%	0.169	15%	0.145	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.4	130.7	173.1	26.5	-34.5	0	0	0	111
288	G	77.4	Confident	87.1	Confident	3 Å²	3	31.8 Å²	31.8	3%	0.031	15%	0.152	C	C	.	.	T	Hydrogen-bonded Turn	trans	99.1	-10.8	-175.3	0	0	0	0	0	114.4	V185 Q286 R434	V185-G288 PolarHBondContact O-N 3.04Å; Q286-G288 PolarHBondContact O-N 3.37Å; G288-R434 PolarHBondContact O-NH2 3.32Å
289	D	82	Confident	87	Confident	39 Å²	39	31 Å²	31	21%	0.209	16%	0.155	C	C	.	.			trans	-79.5	140.7	178.9	-67.1	-25.8	0	0	0	111.7	V184 V185 Q286 I291 L339	V184-D289 WeakPolarHBondContact CA-O 3.48Å; V185-D289 PolarHBondContact N-O 2.95Å; Q286-D289 WeakPolarHBondContact CB-OD2 3.32Å; Q286-D289 PolarHBondContact N-OD2 2.94Å; Q286-D289 VanDerWaalsContact N-OD2 3.13Å; Q286-D289 WeakPolarHBondContact O-CB 3.31Å; Q286-D289 PolarHBondContact O-N 2.83Å; D289-I291 HydrophobicContact CB-CG2 4.24Å; D289-L339 HydrophobicContact CB-CD2 3.87Å
290	H	82.6	Confident	86.6	Confident	22 Å²	22	31.7 Å²	31.7	10%	0.102	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82	124.6	166	-65.8	-101.3	0	0	0	107.6	G183 V184 L340 R434	G183-H290 WeakPolarHBondContact O-CA 3.45Å; V184-H290 WeakPolarHBondContact CG2-CE1 3.39Å; V184-H290 WeakPolarHBondContact CG2-ND1 3.49Å; H290-L340 HydrophobicContact CB-CB 4.09Å; H290-L340 WeakPolarHBondContact O-CB 3.4Å; H290-L340 PolarHBondContact O-N 3.11Å; H290-R434 VanDerWaalsContact CD2-CZ 3.47Å; H290-R434 PolarHBondContact CD2-NE 3.06Å; H290-R434 WeakPolarHBondContact NE2-CG 3.39Å; H290-R434 PolarHBondContact NE2-NE 3.44Å
291	I	88.4	Confident	85.9	Confident	3 Å²	3	31.8 Å²	31.8	2%	0.015	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	144.6	-179.5	58.6	176.1	0	0	0	111	G183 V185 I257 A285 D289 V293 V337 Q338 L339	G183-I291 PolarHBondContact N-O 3.28Å; G183-I291 VanDerWaalsContact N-O 3.1Å; G183-I291 PolarHBondContact O-N 3.24Å; V185-I291 HydrophobicContact CG2-CD1 3.27Å; V185-I291 HydrophobicContact CG2-CG1 3.8Å; V185-I291 HydrophobicContact CG2-CG2 4.37Å; I257-I291 HydrophobicContact CD1-CD1 3.39Å; I257-I291 HydrophobicContact CD1-CG1 3.49Å; I257-I291 VanDerWaalsContact CD1-CG1 3.49Å; I257-I291 HydrophobicContact CG1-CD1 4.07Å; I257-I291 HydrophobicContact CG1-CG1 4.4Å; A285-I291 HydrophobicContact CB-CD1 4.06Å; A285-I291 HydrophobicContact CB-CG2 3.99Å; D289-I291 HydrophobicContact CB-CG2 4.24Å; I291-V293 HydrophobicContact CB-CG2 4.38Å; I291-V293 HydrophobicContact CD1-CG2 3.56Å; I291-V293 HydrophobicContact CG1-CG2 3.85Å; I291-V337 HydrophobicContact CB-CG1 4.19Å; I291-V337 HydrophobicContact CD1-CG1 4.11Å; I291-V337 HydrophobicContact CG2-CG1 4.18Å; I291-Q338 WeakPolarHBondContact CA-O 3.38Å; I291-L339 HydrophobicContact CG2-CD2 3.84Å
292	L	90.6	Very high	84.5	Confident	19 Å²	19	38.6 Å²	38.6	10%	0.099	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	111.8	164	-179.3	66.3	0	0	0	107	P164 Q180 R182 Q338 L340	P164-L292 HydrophobicContact CB-CD1 3.68Å; Q180-L292 HydrophobicContact CB-CD1 4.21Å; R182-L292 HydrophobicContact CB-CD1 4.41Å; L292-Q338 HydrophobicContact CB-CB 4.34Å; L292-Q338 PolarHBondContact N-O 2.97Å; L292-Q338 PolarHBondContact O-N 2.88Å; L292-L340 HydrophobicContact CB-CD1 4.02Å; L292-L340 HydrophobicContact CB-CD2 4.15Å; L292-L340 HydrophobicContact CB-CG 4.06Å
293	V	91.5	Very high	82.6	Confident	1 Å²	1	40 Å²	40	1%	0.006	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	121	177.9	-177.3	0	0	0	0	109.1	Q180 V181 I257 I275 I291 L332 A334 S336 V337	Q180-V293 CarbonylContact C-O 3.55Å; Q180-V293 WeakPolarHBondContact CA-O 3.49Å; V181-V293 PolarHBondContact N-O 3.29Å; V181-V293 PolarHBondContact O-N 3.49Å; I257-V293 HydrophobicContact CD1-CG2 3.69Å; I275-V293 HydrophobicContact CD1-CB 4.12Å; I275-V293 HydrophobicContact CD1-CG1 4.08Å; I275-V293 HydrophobicContact CD1-CG2 3.87Å; I275-V293 HydrophobicContact CG2-CG1 4.26Å; I291-V293 HydrophobicContact CB-CG2 4.38Å; I291-V293 HydrophobicContact CD1-CG2 3.56Å; I291-V293 HydrophobicContact CG1-CG2 3.85Å; V293-L332 HydrophobicContact CB-CD2 4.29Å; V293-L332 HydrophobicContact CG1-CD2 3.79Å; V293-A334 HydrophobicContact CG1-CB 3.55Å; V293-S336 WeakPolarHBondContact CA-O 3.48Å; V293-V337 HydrophobicContact CG1-CG2 4.48Å; V293-V337 HydrophobicContact CG2-CG1 4.46Å; V293-V337 HydrophobicContact CG2-CG2 4.31Å
294	T	92	Very high	80.4	Confident	3 Å²	3	35.4 Å²	35.4	2%	0.018	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	125.9	164.7	-52.6	0	0	0	0	108.4	L178 I179 Q180 H335 S336	L178-T294 HydrophobicContact CD1-CG2 4.03Å; L178-T294 HydrophobicContact CD2-CG2 3.83Å; L178-T294 HydrophobicContact CG-CG2 3.81Å; I179-T294 WeakPolarHBondContact O-CA 3.43Å; Q180-T294 HydrophobicContact CG-CG2 4.12Å; Q180-T294 WeakPolarHBondContact CG-OG1 3.47Å; T294-H335 PolarHBondContact O-N 3.48Å; T294-S336 PolarHBondContact N-O 3.11Å; T294-S336 PolarHBondContact O-N 3.47Å; T294-S336 VanDerWaalsContact O-N 3.15Å
295	G	91.5	Very high	78.3	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-165.5	173.6	-179.1	0	0	0	0	0	114	I179 E333	I179-G295 PolarHBondContact N-O 2.99Å; I179-G295 PolarHBondContact O-N 2.98Å; G295-E333 CarbonylContact C-O 3.51Å; G295-E333 WeakPolarHBondContact CA-O 3.35Å
296	V	92.1	Very high	76.1	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	127.4	178.6	-169.3	0	0	0	0	109.5	A73 V74 L178 L298 E333	A73-V296 HydrophobicContact CB-CG2 3.49Å; A73-V296 VanDerWaalsContact CB-CG2 3.49Å; V74-V296 HydrophobicContact CG2-CG1 3.91Å; L178-V296 HydrophobicContact CD1-CG2 3.83Å; V296-L298 HydrophobicContact CB-CG 4.45Å; V296-L298 HydrophobicContact CG1-CD2 3.94Å; V296-L298 HydrophobicContact CG1-CG 4.03Å; V296-L298 PolarHBondContact O-N 2.88Å; V296-E333 PolarHBondContact N-O 3.43Å; V296-E333 PolarHBondContact O-N 2.96Å
297	F	92.2	Very high	74	Confident	15 Å²	15	48.7 Å²	48.7	7%	0.066	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	114.8	179.1	-172.8	-113.3	0	0	0	110.7	V170 I175 G176 H177 I179 L273 T330 L332	V170-F297 HydrophobicContact CG1-CD1 3.89Å; V170-F297 HydrophobicContact CG1-CD2 3.91Å; V170-F297 HydrophobicContact CG1-CE1 3.87Å; V170-F297 HydrophobicContact CG1-CE2 3.89Å; V170-F297 HydrophobicContact CG1-CG 3.9Å; V170-F297 HydrophobicContact CG1-CZ 3.85Å; I175-F297 HydrophobicContact CG1-CD1 3.94Å; I175-F297 HydrophobicContact CG1-CE1 4.05Å; G176-F297 PolarHBondContact N-O 3.01Å; H177-F297 PolarHBondContact O-N 3.4Å; I179-F297 HydrophobicContact CD1-CB 3.88Å; I179-F297 HydrophobicContact CD1-CG 4.41Å; I179-F297 HydrophobicContact CG1-CB 4.39Å; L273-F297 HydrophobicContact CD1-CD2 4.5Å; L273-F297 HydrophobicContact CD1-CE2 3.92Å; F297-T330 HydrophobicContact CE1-CG2 4Å; F297-T330 HydrophobicContact CE2-CG2 4.25Å; F297-T330 HydrophobicContact CZ-CG2 3.52Å; F297-T330 WeakPolarHBondContact CZ-OG1 3.43Å; F297-L332 HydrophobicContact CB-CD1 4.07Å; F297-L332 HydrophobicContact CD2-CD1 4.39Å
298	L	90	Very high	71.7	Confident	28 Å²	28	50.3 Å²	50.3	15%	0.147	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	142	-172.1	-64.8	174.7	0	0	0	112.1	V74 V296 Y331 E333	V74-L298 HydrophobicContact CG2-CD1 4.24Å; V74-L298 HydrophobicContact CG2-CD2 4.03Å; V296-L298 HydrophobicContact CB-CG 4.45Å; V296-L298 HydrophobicContact CG1-CD2 3.94Å; V296-L298 HydrophobicContact CG1-CG 4.03Å; V296-L298 PolarHBondContact O-N 2.88Å; L298-Y331 HydrophobicContact CB-CE1 4Å; L298-Y331 HydrophobicContact CB-CE2 4.08Å; L298-Y331 HydrophobicContact CD1-CE2 4.22Å; L298-Y331 PolarHBondContact N-O 3.29Å; L298-Y331 WeakPolarHBondContact O-CD1 3.36Å; L298-Y331 PolarHBondContact O-N 3.28Å; L298-Y331 VanDerWaalsContact O-O 3.04Å; L298-E333 HydrophobicContact CD1-CB 4.36Å; L298-E333 WeakPolarHBondContact CD1-OE2 3.38Å
299	P	88.3	Confident	69.8	Low	47 Å²	47	56.4 Å²	56.4	31%	0.305	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	132.2	167.4	30.6	-31.3	0	0	0	110.3	T328	P299-T328 HydrophobicContact CB-CG2 3.84Å
300	S	78.6	Confident	67.4	Low	16 Å²	16	58 Å²	58	11%	0.112	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	121.2	167.9	-165.5	0	0	0	0	109.9	R302 D329	S300-R302 PolarHBondContact O-N 3.43Å; S300-D329 WeakPolarHBondContact CA-O 3.43Å; S300-D329 WeakPolarHBondContact CB-O 3.47Å; S300-D329 PolarHBondContact N-O 3.22Å
301	V	70.7	Confident	65	Low	92 Å²	92	68 Å²	68	56%	0.558	41%	0.412	S	S	*	.			trans	-83.2	87.5	164.7	-72.1	0	0	0	0	108.5	G303	V301-G303 VanDerWaalsContact C-N 3.26Å; V301-G303 PolarHBondContact O-N 3.46Å
302	R	58.5	Low	62.4	Low	149 Å²	149	73.3 Å²	73.3	56%	0.562	45%	0.445	S	S	*	.			trans	-69.4	93.4	162.8	-79.8	-176.2	172.8	166	-6.8	107.8	S300 A304 D329	S300-R302 PolarHBondContact O-N 3.43Å; R302-A304 PolarHBondContact O-N 3.14Å; R302-D329 IonicContact CZ-OD2 2.85Å; R302-D329 IonicContact NE-OD2 3.86Å; R302-D329 IonicContact NH1-OD2 3.63Å; R302-D329 PolarHBondContact NH1-OD2 3.11Å
303	G	50	Low	59.7	Low	43 Å²	43	79.4 Å²	79.4	44%	0.443	48%	0.477	S	S	.	.			trans	-54.7	121.8	170.8	0	0	0	0	0	108.9	V301 S305	V301-G303 VanDerWaalsContact C-N 3.26Å; V301-G303 PolarHBondContact O-N 3.46Å; G303-S305 PolarHBondContact O-N 3.2Å
304	A	40.7	Very low	57.1	Low	87 Å²	87	87.4 Å²	87.4	72%	0.719	52%	0.515	S	S	*	.			trans	-64.2	76.9	177.3	0	0	0	0	0	110.7	R302	R302-A304 PolarHBondContact O-N 3.14Å
305	S	40.2	Very low	54.1	Low	96 Å²	96	92.2 Å²	92.2	67%	0.671	56%	0.555	S	S	*	*			trans	-106.5	50.3	171.5	-62.5	0	0	0	0	109.4	G303 S307	G303-S305 PolarHBondContact O-N 3.2Å; S305-S307 PolarHBondContact O-N 3.41Å
306	F	37.6	Very low	51.4	Low	213 Å²	213	97.1 Å²	97.1	93%	0.934	59%	0.589	S	S	*	*			trans	-75.3	72.9	164.1	-105.7	-85	0	0	0	108.9
307	S	37.3	Very low	48.4	Very low	121 Å²	121	102.9 Å²	102.9	85%	0.846	62%	0.624	S	S	*	*			trans	-98.8	67.5	163.4	161.5	0	0	0	0	107.5	S305	S305-S307 PolarHBondContact O-N 3.41Å
308	G	34.8	Very low	45.7	Very low	60 Å²	60	106.9 Å²	106.9	62%	0.619	65%	0.654	S	S	*	*			trans	-118.2	118.2	174.4	0	0	0	0	0	110
309	S	37.3	Very low	43.2	Very low	131 Å²	131	113.7 Å²	113.7	92%	0.916	69%	0.689	S	S	*	*	S	Bend	trans	89.6	113.5	177.8	-154.1	0	0	0	0	116
310	G	30.5	Very low	40.4	Very low	71 Å²	71	118 Å²	118	73%	0.732	71%	0.71	S	S	*	*			trans	-58.6	134.9	-169.4	0	0	0	0	0	115.5
311	R	32.4	Very low	38.3	Very low	233 Å²	233	122.9 Å²	122.9	88%	0.879	74%	0.739	S	S	*	*			trans	-165.1	103.1	134	-111	170.5	159.4	149.5	-3.9	110.6
312	T	33.5	Very low	36.9	Very low	115 Å²	115	126 Å²	126	71%	0.706	76%	0.758	S	S	*	*			trans	27	115.4	139.1	56.5	0	0	0	0	118.5
313	N	33.8	Very low	36.2	Very low	146 Å²	146	123.5 Å²	123.5	78%	0.781	76%	0.763	S	S	*	*			trans	65.1	129.8	133.5	-76.2	-9.8	0	0	0	120.1
314	Q	36.6	Very low	36.1	Very low	170 Å²	170	125 Å²	125	79%	0.794	78%	0.779	S	S	*	*			trans	90.4	89.3	152.6	-63.9	166.5	27.3	0	0	117	S316	Q314-S316 PolarHBondContact O-N 3.19Å
315	A	30.8	Very low	36.8	Very low	104 Å²	104	123 Å²	123	86%	0.86	77%	0.767	S	S	*	*				34.3	75.2	113.6	0	0	0	0	0	116
316	S	33.5	Very low	38	Very low	102 Å²	102	126.7 Å²	126.7	71%	0.713	78%	0.778	S	S	*	*			trans	179.5	140.7	141.2	48	0	0	0	0	108.9	Q314	Q314-S316 PolarHBondContact O-N 3.19Å
317	V	30.5	Very low	39.3	Very low	122 Å²	122	124.3 Å²	124.3	74%	0.739	77%	0.774	S	S	*	*			trans	46.9	105.2	143	-174.3	0	0	0	0	116.2
318	S	33.5	Very low	40.8	Very low	99 Å²	99	121.9 Å²	121.9	69%	0.692	75%	0.754	S	S	*	*				-163	108.2	124.5	-88.1	0	0	0	0	110.6	N320	S318-N320 PolarHBondContact O-N 2.64Å
319	L	37.4	Very low	42.9	Very low	171 Å²	171	122.9 Å²	122.9	90%	0.895	75%	0.746	S	S	*	*			trans	-61.8	30.2	163.2	-74.8	102.4	0	0	0	113
320	N	29.8	Very low	45.2	Very low	138 Å²	138	119.4 Å²	119.4	74%	0.738	72%	0.719	S	S	*	*			trans	-130.2	73.9	-176.3	-83	-7.5	0	0	0	110	S318	S318-N320 PolarHBondContact O-N 2.64Å
321	T	36	Very low	48.1	Very low	118 Å²	118	117.6 Å²	117.6	72%	0.724	69%	0.69	S	S	*	*			trans	-135.2	122.7	139.3	57.9	0	0	0	0	106.4	S323	T321-S323 PolarHBondContact O-N 3.42Å
322	V	40.2	Very low	50.9	Low	158 Å²	158	106.5 Å²	106.5	96%	0.958	65%	0.648	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.4	15.5	-172.2	167.5	0	0	0	0	114.1
323	S	44.7	Very low	53.7	Low	96 Å²	96	102.7 Å²	102.7	67%	0.671	62%	0.622	S	S	*	*	T	Hydrogen-bonded Turn	trans	-137.1	22.7	-157.8	-149	0	0	0	0	115.2	T321 G325	T321-S323 PolarHBondContact O-N 3.42Å; S323-G325 PolarHBondContact O-N 2.85Å
324	G	47.7	Very low	56.5	Low	74 Å²	74	95.8 Å²	95.8	76%	0.763	59%	0.586	S	S	*	*			trans	-85.4	32.7	156.7	0	0	0	0	0	111.8
325	G	54.8	Low	59	Low	46 Å²	46	88.2 Å²	88.2	47%	0.474	55%	0.55	S	S	.	*			trans	-63.7	142.5	-172.3	0	0	0	0	0	111.7	S323 L327	S323-G325 PolarHBondContact O-N 2.85Å; G325-L327 PolarHBondContact O-N 2.85Å
326	L	64.7	Low	61.6	Low	173 Å²	173	83.7 Å²	83.7	91%	0.906	51%	0.512	S	S	*	.	S	Bend	trans	-62.9	6.2	167	-67.7	161.1	0	0	0	112.9	T328	L326-T328 PolarHBondContact O-N 2.69Å
327	L	65.7	Low	64.2	Low	162 Å²	162	79.9 Å²	79.9	85%	0.848	49%	0.485	S	S	*	.			trans	-72.1	95.9	170.1	-74.9	91.8	0	0	0	107.9	G325	G325-L327 PolarHBondContact O-N 2.85Å
328	T	68	Low	66.8	Low	71 Å²	71	78.6 Å²	78.6	44%	0.436	47%	0.471	S	S	.	.	P	Polyproline II helix	trans	-82.1	119.8	173	53.6	0	0	0	0	109.1	P299 L326 T330	P299-T328 HydrophobicContact CB-CG2 3.84Å; L326-T328 PolarHBondContact O-N 2.69Å; T328-T330 PolarHBondContact O-N 3.04Å
329	D	79	Confident	69.2	Low	81 Å²	81	77.7 Å²	77.7	43%	0.433	46%	0.458	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.2	128.8	162	-76.2	-19.5	0	0	0	107.5	S300 R302	S300-D329 WeakPolarHBondContact CA-O 3.43Å; S300-D329 WeakPolarHBondContact CB-O 3.47Å; S300-D329 PolarHBondContact N-O 3.22Å; R302-D329 IonicContact CZ-OD2 2.85Å; R302-D329 IonicContact NE-OD2 3.86Å; R302-D329 IonicContact NH1-OD2 3.63Å; R302-D329 PolarHBondContact NH1-OD2 3.11Å
330	T	87	Confident	70.9	Confident	58 Å²	58	70.7 Å²	70.7	36%	0.356	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	144.1	-178.7	58	0	0	0	0	111	F297 T328	F297-T330 HydrophobicContact CE1-CG2 4Å; F297-T330 HydrophobicContact CE2-CG2 4.25Å; F297-T330 HydrophobicContact CZ-CG2 3.52Å; F297-T330 WeakPolarHBondContact CZ-OG1 3.43Å; T328-T330 PolarHBondContact O-N 3.04Å
331	Y	91	Very high	72.3	Confident	33 Å²	33	66.7 Å²	66.7	13%	0.129	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	156.5	171.5	68	-83.9	0	0	0	110.1	T274 Y276 L298 E333	T274-Y331 WeakPolarHBondContact O-CA 3.48Å; Y276-Y331 HydrophobicContact CD2-CD1 4.33Å; Y276-Y331 AromaticContact CD2-CD2 3.2Å; Y276-Y331 HydrophobicContact CD2-CD2 3.2Å; Y276-Y331 AromaticContact CD2-CE2 3.61Å; Y276-Y331 HydrophobicContact CD2-CE2 3.61Å; Y276-Y331 AromaticContact CD2-CG 3.6Å; Y276-Y331 HydrophobicContact CD2-CG 3.6Å; Y276-Y331 AromaticContact CE2-CD1 3.97Å; Y276-Y331 HydrophobicContact CE2-CD1 3.97Å; Y276-Y331 AromaticContact CE2-CD2 3.7Å; Y276-Y331 HydrophobicContact CE2-CD2 3.7Å; Y276-Y331 HydrophobicContact CE2-CE1 4.41Å; Y276-Y331 HydrophobicContact CE2-CE2 4.17Å; Y276-Y331 AromaticContact CE2-CG 3.57Å; Y276-Y331 HydrophobicContact CE2-CG 3.57Å; Y276-Y331 AromaticContact CG-CD2 3.97Å; Y276-Y331 HydrophobicContact CG-CD2 3.97Å; Y276-Y331 HydrophobicContact CG-CG 4.46Å; L298-Y331 HydrophobicContact CB-CE1 4Å; L298-Y331 HydrophobicContact CB-CE2 4.08Å; L298-Y331 HydrophobicContact CD1-CE2 4.22Å; L298-Y331 PolarHBondContact N-O 3.29Å; L298-Y331 WeakPolarHBondContact O-CD1 3.36Å; L298-Y331 PolarHBondContact O-N 3.28Å; L298-Y331 VanDerWaalsContact O-O 3.04Å; Y331-E333 HydrophobicContact CE2-CB 4.17Å
332	L	91.7	Very high	73	Confident	0 Å²	0	64.5 Å²	64.5	0%	0	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	122.8	171	-168.4	73.6	0	0	0	108.9	I179 V181 L273 T274 I275 Y276 V293 F297	I179-L332 HydrophobicContact CD1-CD1 3.87Å; I179-L332 HydrophobicContact CG1-CD1 3.73Å; V181-L332 HydrophobicContact CG2-CD2 4.39Å; L273-L332 HydrophobicContact CD2-CB 3.9Å; L273-L332 HydrophobicContact CD2-CD2 3.98Å; L273-L332 HydrophobicContact CD2-CG 4.48Å; T274-L332 PolarHBondContact O-N 3.21Å; I275-L332 CarbonylContact C-O 3.46Å; I275-L332 WeakPolarHBondContact CA-O 3.44Å; I275-L332 HydrophobicContact CD1-CD2 4.03Å; I275-L332 HydrophobicContact CG1-CB 4.14Å; I275-L332 HydrophobicContact CG1-CD2 4.43Å; Y276-L332 PolarHBondContact N-O 3.34Å; V293-L332 HydrophobicContact CB-CD2 4.29Å; V293-L332 HydrophobicContact CG1-CD2 3.79Å; F297-L332 HydrophobicContact CB-CD1 4.07Å; F297-L332 HydrophobicContact CD2-CD1 4.39Å
333	E	92.2	Very high	73.3	Confident	34 Å²	34	60.6 Å²	60.6	16%	0.159	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	110.8	170.1	-174.6	164	-177.2	0	0	108.8	R278 G295 V296 L298 Y331	R278-E333 WeakPolarHBondContact CD-OE1 3.39Å; R278-E333 IonicContact CZ-OE1 2.81Å; R278-E333 IonicContact NE-OE1 2.97Å; R278-E333 VanDerWaalsContact NH1-CD 3.34Å; R278-E333 IonicContact NH1-OE1 3.84Å; R278-E333 PolarHBondContact NH1-OE1 3.27Å; R278-E333 IonicContact NH1-OE2 3.88Å; R278-E333 PolarHBondContact NH1-OE2 3.4Å; G295-E333 CarbonylContact C-O 3.51Å; G295-E333 WeakPolarHBondContact CA-O 3.35Å; V296-E333 PolarHBondContact N-O 3.43Å; V296-E333 PolarHBondContact O-N 2.96Å; L298-E333 HydrophobicContact CD1-CB 4.36Å; L298-E333 WeakPolarHBondContact CD1-OE2 3.38Å; Y331-E333 HydrophobicContact CE2-CB 4.17Å
334	A	92	Very high	73.3	Confident	2 Å²	2	59.9 Å²	59.9	2%	0.017	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	125.8	-173.6	0	0	0	0	0	111.8	I275 Y276 L277 V293 V337	I275-A334 HydrophobicContact CG2-CB 3.6Å; Y276-A334 PolarHBondContact O-N 3.39Å; Y276-A334 VanDerWaalsContact O-N 3.07Å; L277-A334 HydrophobicContact CD2-CB 3.52Å; V293-A334 HydrophobicContact CG1-CB 3.55Å; A334-V337 HydrophobicContact CB-CG2 4.25Å
335	H	88.1	Confident	73.1	Confident	10 Å²	10	60.8 Å²	60.8	5%	0.046	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	-38.1	172.5	-72.2	-175.2	0	0	0	111.7	Y155 F156 N281 T294	Y155-H335 WeakPolarHBondContact CB-O 3.31Å; Y155-H335 HydrophobicContact CD1-CB 3.99Å; Y155-H335 WeakPolarHBondContact CD2-O 3.19Å; Y155-H335 HydrophobicContact CG-CB 4.34Å; F156-H335 AromaticContact CD2-CE1 3.94Å; F156-H335 AromaticContact CD2-ND1 3.86Å; F156-H335 WeakPolarHBondContact O-CB 3.42Å; N281-H335 PolarHBondContact ND2-O 3.11Å; T294-H335 PolarHBondContact O-N 3.48Å
336	S	86.9	Confident	72.4	Confident	9 Å²	9	61.2 Å²	61.2	6%	0.063	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	132.2	178.6	-179.5	0	0	0	0	109.9	V293 T294	V293-S336 WeakPolarHBondContact CA-O 3.48Å; T294-S336 PolarHBondContact N-O 3.11Å; T294-S336 PolarHBondContact O-N 3.47Å; T294-S336 VanDerWaalsContact O-N 3.15Å
337	V	87.6	Confident	71.2	Confident	23 Å²	23	56.7 Å²	56.7	14%	0.139	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	113.9	174.4	-179.1	0	0	0	0	107.3	L277 A284 A285 I291 V293 A334	L277-V337 HydrophobicContact CD2-CG2 3.41Å; L277-V337 VanDerWaalsContact CD2-CG2 3.41Å; A284-V337 HydrophobicContact CB-CB 4.27Å; A284-V337 HydrophobicContact CB-CG1 4.36Å; A285-V337 HydrophobicContact CB-CG1 4.34Å; I291-V337 HydrophobicContact CB-CG1 4.19Å; I291-V337 HydrophobicContact CD1-CG1 4.11Å; I291-V337 HydrophobicContact CG2-CG1 4.18Å; V293-V337 HydrophobicContact CG1-CG2 4.48Å; V293-V337 HydrophobicContact CG2-CG1 4.46Å; V293-V337 HydrophobicContact CG2-CG2 4.31Å; A334-V337 HydrophobicContact CB-CG2 4.25Å
338	Q	86.1	Confident	70.1	Confident	95 Å²	95	56.3 Å²	56.3	44%	0.444	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	126.5	173.5	-67.8	174	-9.4	0	0	108.5	I291 L292 L340	I291-Q338 WeakPolarHBondContact CA-O 3.38Å; L292-Q338 HydrophobicContact CB-CB 4.34Å; L292-Q338 PolarHBondContact N-O 2.97Å; L292-Q338 PolarHBondContact O-N 2.88Å; Q338-L340 PolarHBondContact O-N 3.18Å
339	L	82.1	Confident	69	Low	80 Å²	80	56.6 Å²	56.6	42%	0.419	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	118.2	171.8	-70.4	157.3	0	0	0	107.6	D289 I291 S341	D289-L339 HydrophobicContact CB-CD2 3.87Å; I291-L339 HydrophobicContact CG2-CD2 3.84Å; L339-S341 PolarHBondContact O-N 3.41Å
340	L	73.1	Confident	67.4	Low	24 Å²	24	56.2 Å²	56.2	13%	0.126	32%	0.316	C	S	.	.			trans	-80.4	71.4	173.2	-65.2	165.6	0	0	0	108.1	R182 H290 L292 Q338 D345	R182-L340 HydrophobicContact CG-CD1 3.74Å; H290-L340 HydrophobicContact CB-CB 4.09Å; H290-L340 WeakPolarHBondContact O-CB 3.4Å; H290-L340 PolarHBondContact O-N 3.11Å; L292-L340 HydrophobicContact CB-CD1 4.02Å; L292-L340 HydrophobicContact CB-CD2 4.15Å; L292-L340 HydrophobicContact CB-CG 4.06Å; Q338-L340 PolarHBondContact O-N 3.18Å; L340-D345 WeakPolarHBondContact CD2-OD1 3.49Å
341	S	59.1	Low	65.7	Low	53 Å²	53	61.4 Å²	61.4	37%	0.371	34%	0.337	S	S	.	.			trans	-71.3	143.6	160.6	33.3	0	0	0	0	108.8	L339 T343 D344	L339-S341 PolarHBondContact O-N 3.41Å; S341-T343 PolarHBondContact O-N 2.92Å; S341-D344 PolarHBondContact O-N 2.81Å; S341-D344 VanDerWaalsContact O-N 3.09Å
342	K	52.4	Low	64	Low	73 Å²	73	63 Å²	63	32%	0.317	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.9	3.5	-174.2	-66.8	178	179.8	178.7	0	115.4	Q473	K342-Q473 PolarHBondContact NZ-O 3.43Å
343	T	44.6	Very low	62.4	Low	75 Å²	75	64.6 Å²	64.6	46%	0.46	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.9	-40.5	174.3	48	0	0	0	0	111.7	S341 T347	S341-T343 PolarHBondContact O-N 2.92Å; T343-T347 VanDerWaalsContact O-CG2 3.23Å; T343-T347 WeakPolarHBondContact O-CG2 3.35Å; T343-T347 PolarHBondContact O-N 3.33Å; T343-T347 VanDerWaalsContact O-N 3.14Å; T343-T347 PolarHBondContact O-OG1 3.23Å
344	D	44.8	Very low	61.2	Low	82 Å²	82	71 Å²	71	44%	0.439	39%	0.392	S	S	.	.	H	α-helix	trans	-89.5	-28.9	-155.9	-60.9	-0	0	0	0	113.9	S341 V346 T347	S341-D344 PolarHBondContact O-N 2.81Å; S341-D344 VanDerWaalsContact O-N 3.09Å; D344-V346 PolarHBondContact O-N 3.5Å; D344-T347 WeakPolarHBondContact CA-OG1 3.48Å; D344-T347 PolarHBondContact O-OG1 3.29Å
345	D	44.8	Very low	60.2	Low	92 Å²	92	77.2 Å²	77.2	49%	0.492	42%	0.421	S	S	.	.	H	α-helix	trans	-71	-8.8	175.2	-86.6	-3.6	0	0	0	113.1	R182 L340	R182-D345 IonicContact CZ-OD2 3.8Å; R182-D345 IonicContact NH1-OD2 3.51Å; R182-D345 PolarHBondContact NH1-OD2 3.33Å; R182-D345 IonicContact NH2-OD2 3.92Å; L340-D345 WeakPolarHBondContact CD2-OD1 3.49Å
346	V	40.6	Very low	59.2	Low	55 Å²	55	77.5 Å²	77.5	33%	0.333	42%	0.422	S	S	.	.	H	α-helix	trans	-116.4	-28.7	179.3	-170	0	0	0	0	111.8	D344 D348 N350	D344-V346 PolarHBondContact O-N 3.5Å; V346-D348 PolarHBondContact O-N 3.31Å; V346-N350 CarbonylContact O-C 3.58Å; V346-N350 PolarHBondContact O-N 3.27Å
347	T	39.7	Very low	58.5	Low	78 Å²	78	78.7 Å²	78.7	48%	0.479	43%	0.427	S	S	.	.	H	α-helix	trans	-71.6	-29	-176.9	45.1	0	0	0	0	114.5	T343 D344 A349	T343-T347 VanDerWaalsContact O-CG2 3.23Å; T343-T347 WeakPolarHBondContact O-CG2 3.35Å; T343-T347 PolarHBondContact O-N 3.33Å; T343-T347 VanDerWaalsContact O-N 3.14Å; T343-T347 PolarHBondContact O-OG1 3.23Å; D344-T347 WeakPolarHBondContact CA-OG1 3.48Å; D344-T347 PolarHBondContact O-OG1 3.29Å; T347-A349 VanDerWaalsContact C-N 3.34Å
348	D	41.7	Very low	57.8	Low	154 Å²	154	83.8 Å²	83.8	82%	0.824	45%	0.45	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.7	-6.3	-178.2	-70.4	-8	0	0	0	113.6	V346	V346-D348 PolarHBondContact O-N 3.31Å
349	A	45.2	Very low	57.1	Low	77 Å²	77	84.4 Å²	84.4	64%	0.636	45%	0.448	S	S	*	.	T	Hydrogen-bonded Turn	trans	-128.8	-14.5	179.8	0	0	0	0	0	115.5	T347	T347-A349 VanDerWaalsContact C-N 3.34Å
350	N	44.8	Very low	56.6	Low	73 Å²	73	80.9 Å²	80.9	39%	0.39	43%	0.429	S	S	.	.			trans	-156.8	98.4	170	-70.9	-74	0	0	0	109.7	V346 R607	V346-N350 CarbonylContact O-C 3.58Å; V346-N350 PolarHBondContact O-N 3.27Å; N350-R607 VanDerWaalsContact CG-NH2 3.26Å; N350-R607 PolarHBondContact ND2-NH1 2.82Å; N350-R607 PolarHBondContact OD1-NH2 3.39Å
351	E	51.9	Low	56.5	Low	168 Å²	168	87.3 Å²	87.3	79%	0.785	45%	0.452	S	S	*	.			trans	-42.8	137.8	145.8	-68.7	-178.5	161.5	0	0	107.4	S353	E351-S353 PolarHBondContact O-N 2.8Å
352	P	55	Low	57.3	Low	66 Å²	66	89.5 Å²	89.5	43%	0.429	46%	0.459	S	S	.	.			trans	-55.8	106.7	-176.7	26.5	-35.3	0	0	0	107.2	E354 I357 V611	P352-E354 PolarHBondContact O-N 3.43Å; P352-E354 VanDerWaalsContact O-N 3.15Å; P352-I357 HydrophobicContact CB-CD1 3.86Å; P352-I357 HydrophobicContact CB-CG1 4.12Å; P352-I357 HydrophobicContact CG-CD1 3.98Å; P352-V611 HydrophobicContact CB-CG1 3.85Å; P352-V611 HydrophobicContact CB-CG2 4.35Å
353	S	58.9	Low	58.1	Low	34 Å²	34	92.5 Å²	92.5	24%	0.238	48%	0.478	C	S	.	.			trans	-54.6	129.8	-177.2	48	0	0	0	0	106.5	E351 E355 E356 I357	E351-S353 PolarHBondContact O-N 2.8Å; S353-E355 PolarHBondContact O-N 2.8Å; S353-E356 WeakPolarHBondContact O-CB 3.44Å; S353-E356 PolarHBondContact O-N 2.65Å; S353-E356 VanDerWaalsContact OG-CD 3.29Å; S353-E356 WeakPolarHBondContact OG-CG 3.45Å; S353-E356 PolarHBondContact OG-OE2 3.45Å; S353-I357 PolarHBondContact O-N 3.15Å
354	E	66.6	Low	59.4	Low	169 Å²	169	96.7 Å²	96.7	79%	0.79	49%	0.493	S	S	*	.	H	α-helix	trans	-52.1	-30.6	-178.3	-68.1	-174.7	151.2	0	0	111	P352 E356 I357 E358	P352-E354 PolarHBondContact O-N 3.43Å; P352-E354 VanDerWaalsContact O-N 3.15Å; E354-E356 PolarHBondContact O-N 3.39Å; E354-I357 PolarHBondContact O-N 3.26Å; E354-E358 WeakPolarHBondContact O-CB 3.42Å; E354-E358 PolarHBondContact O-N 2.98Å
355	E	69.7	Low	61	Low	131 Å²	131	93.8 Å²	93.8	61%	0.612	48%	0.476	S	S	*	.	H	α-helix	trans	-59.5	-36.6	172.8	-56.9	-177.7	178.2	0	0	114.9	S353 R359	S353-E355 PolarHBondContact O-N 2.8Å; E355-R359 WeakPolarHBondContact O-CG 3.36Å; E355-R359 PolarHBondContact O-N 3.22Å; E355-R359 VanDerWaalsContact O-N 3.1Å; E355-R359 PolarHBondContact O-NE 3.31Å
356	E	68.9	Low	62.9	Low	17 Å²	17	90.6 Å²	90.6	8%	0.079	46%	0.458	C	S	.	.	H	α-helix	trans	-75.8	-37.2	177	-76.9	177.3	166.9	0	0	110.9	S353 E354 E358 R359 L360 R607 L608	S353-E356 WeakPolarHBondContact O-CB 3.44Å; S353-E356 PolarHBondContact O-N 2.65Å; S353-E356 VanDerWaalsContact OG-CD 3.29Å; S353-E356 WeakPolarHBondContact OG-CG 3.45Å; S353-E356 PolarHBondContact OG-OE2 3.45Å; E354-E356 PolarHBondContact O-N 3.39Å; E356-E358 VanDerWaalsContact C-N 3.34Å; E356-R359 PolarHBondContact O-N 3.18Å; E356-L360 WeakPolarHBondContact O-CG 3.29Å; E356-L360 PolarHBondContact O-N 2.87Å; E356-L360 VanDerWaalsContact O-N 3.1Å; E356-R607 VanDerWaalsContact CD-NE 3.26Å; E356-R607 WeakPolarHBondContact OE1-CD 3.38Å; E356-R607 IonicContact OE1-CZ 3.33Å; E356-R607 IonicContact OE1-NE 3.83Å; E356-R607 PolarHBondContact OE1-NE 2.93Å; E356-R607 IonicContact OE1-NH1 2.76Å; E356-R607 IonicContact OE1-NH2 2.69Å; E356-R607 PolarHBondContact OE1-NH2 2.71Å; E356-R607 IonicContact OE2-CZ 2.81Å; E356-R607 IonicContact OE2-NE 3.95Å; E356-R607 PolarHBondContact OE2-NE 3.04Å; E356-R607 IonicContact OE2-NH2 2.88Å; E356-R607 PolarHBondContact OE2-NH2 3.07Å; E356-R607 VanDerWaalsContact OE2-NH2 3.11Å; E356-L608 HydrophobicContact CB-CD2 4.31Å; E356-L608 HydrophobicContact CG-CD2 4.48Å
357	I	70.6	Confident	65	Low	34 Å²	34	89.7 Å²	89.7	17%	0.174	45%	0.454	C	S	.	.	H	α-helix	trans	-66.7	-40.3	173.8	-61.9	173.7	0	0	0	110.1	P352 S353 E354 L360 R361 V611 A668	P352-I357 HydrophobicContact CB-CD1 3.86Å; P352-I357 HydrophobicContact CB-CG1 4.12Å; P352-I357 HydrophobicContact CG-CD1 3.98Å; S353-I357 PolarHBondContact O-N 3.15Å; E354-I357 PolarHBondContact O-N 3.26Å; I357-L360 WeakPolarHBondContact O-CB 3.48Å; I357-L360 PolarHBondContact O-N 3.13Å; I357-L360 VanDerWaalsContact O-N 3.15Å; I357-R361 WeakPolarHBondContact O-CG 3.49Å; I357-R361 PolarHBondContact O-N 2.96Å; I357-V611 HydrophobicContact CG1-CG1 4.38Å; I357-A668 HydrophobicContact CG2-CB 3.89Å
358	E	72.8	Confident	67.1	Low	130 Å²	130	88 Å²	88	61%	0.607	44%	0.441	S	S	*	.	H	α-helix	trans	-63.9	-43.8	177.8	-168.8	164	-155.6	0	0	110.9	E354 E356 L360 R361	E354-E358 WeakPolarHBondContact O-CB 3.42Å; E354-E358 PolarHBondContact O-N 2.98Å; E356-E358 VanDerWaalsContact C-N 3.34Å; E358-L360 PolarHBondContact O-N 3.23Å; E358-R361 WeakPolarHBondContact O-CB 3.49Å; E358-R361 PolarHBondContact O-N 3.14Å
359	R	72.8	Confident	69.2	Low	107 Å²	107	80.9 Å²	80.9	40%	0.404	40%	0.403	S	S	.	.	H	α-helix	trans	-57	-35.9	171.2	-78.6	-178	-97.3	166.9	-10.4	113.2	E355 E356 R361 F365	E355-R359 WeakPolarHBondContact O-CG 3.36Å; E355-R359 PolarHBondContact O-N 3.22Å; E355-R359 VanDerWaalsContact O-N 3.1Å; E355-R359 PolarHBondContact O-NE 3.31Å; E356-R359 PolarHBondContact O-N 3.18Å; R359-R361 VanDerWaalsContact C-N 3.3Å; R359-R361 PolarHBondContact O-N 3.04Å; R359-F365 HydrophobicContact CB-CE2 4.5Å; R359-F365 WeakPolarHBondContact O-CB 3.41Å; R359-F365 WeakPolarHBondContact O-CD1 3.14Å; R359-F365 WeakPolarHBondContact O-CG 3.42Å
360	L	71.1	Confident	71.2	Confident	6 Å²	6	77.3 Å²	77.3	3%	0.031	37%	0.374	C	S	.	.	H	α-helix	trans	-71.2	-21.4	177.7	-75.6	167.1	0	0	0	113.8	E356 I357 E358 D362 F365 M369 L608 V611	E356-L360 WeakPolarHBondContact O-CG 3.29Å; E356-L360 PolarHBondContact O-N 2.87Å; E356-L360 VanDerWaalsContact O-N 3.1Å; I357-L360 WeakPolarHBondContact O-CB 3.48Å; I357-L360 PolarHBondContact O-N 3.13Å; I357-L360 VanDerWaalsContact O-N 3.15Å; E358-L360 PolarHBondContact O-N 3.23Å; L360-D362 VanDerWaalsContact C-N 3.32Å; L360-F365 HydrophobicContact CD2-CD1 3.97Å; L360-F365 HydrophobicContact CD2-CE1 3.61Å; L360-F365 HydrophobicContact CG-CE1 4.29Å; L360-M369 HydrophobicContact CD2-CE 4.34Å; L360-M369 HydrophobicContact CD2-SD 4.28Å; L360-L608 HydrophobicContact CD1-CD2 4.36Å; L360-L608 HydrophobicContact CD2-CD2 4.33Å; L360-L608 HydrophobicContact CG-CD2 4.17Å; L360-V611 HydrophobicContact CD1-CG1 4.04Å
361	R	71	Confident	73	Confident	159 Å²	159	77.6 Å²	77.6	60%	0.6	37%	0.373	S	S	*	.	H	α-helix	trans	-75.8	-22.1	-179.9	-71.8	174.8	178.3	178.1	2.7	112.8	I357 E358 R359 L363	I357-R361 WeakPolarHBondContact O-CG 3.49Å; I357-R361 PolarHBondContact O-N 2.96Å; E358-R361 WeakPolarHBondContact O-CB 3.49Å; E358-R361 PolarHBondContact O-N 3.14Å; R359-R361 VanDerWaalsContact C-N 3.3Å; R359-R361 PolarHBondContact O-N 3.04Å; R361-L363 PolarHBondContact O-N 3.36Å
362	D	76.1	Confident	74.6	Confident	99 Å²	99	70 Å²	70	53%	0.529	34%	0.338	S	S	.	.			trans	-66.8	129.1	-178.4	-71.3	-23.9	0	0	0	111.6	L360 E364 F365	L360-D362 VanDerWaalsContact C-N 3.32Å; D362-E364 VanDerWaalsContact C-N 3.29Å; D362-E364 PolarHBondContact O-N 2.93Å; D362-F365 HydrophobicContact CB-CB 4.05Å; D362-F365 WeakPolarHBondContact O-CB 3.23Å; D362-F365 PolarHBondContact O-N 3.34Å; D362-F365 VanDerWaalsContact O-N 3.09Å
363	L	68.7	Low	76	Confident	136 Å²	136	67 Å²	67	71%	0.712	32%	0.318	S	S	*	.	H	α-helix	trans	-64.7	-34.4	-177.8	-71	169.9	0	0	0	112.4	R361 F365	R361-L363 PolarHBondContact O-N 3.36Å; L363-F365 PolarHBondContact O-N 3.47Å
364	E	72.9	Confident	77.2	Confident	164 Å²	164	65.5 Å²	65.5	77%	0.766	31%	0.308	S	S	*	.	H	α-helix	trans	-69.4	-24.8	177	-62.8	-171.8	164.9	0	0	111.9	D362 Y366 S367 L368	D362-E364 VanDerWaalsContact C-N 3.29Å; D362-E364 PolarHBondContact O-N 2.93Å; E364-Y366 VanDerWaalsContact C-N 3.27Å; E364-Y366 PolarHBondContact O-N 3.01Å; E364-S367 PolarHBondContact O-N 3.23Å; E364-L368 PolarHBondContact O-N 3.29Å
365	F	78.2	Confident	78	Confident	20 Å²	20	59.1 Å²	59.1	9%	0.088	28%	0.282	C	S	.	.	H	α-helix	trans	-63.9	-33.2	-179.2	-163.3	-107.6	0	0	0	112.4	R359 L360 D362 L363 S367 L368 M369 L600 L608	R359-F365 HydrophobicContact CB-CE2 4.5Å; R359-F365 WeakPolarHBondContact O-CB 3.41Å; R359-F365 WeakPolarHBondContact O-CD1 3.14Å; R359-F365 WeakPolarHBondContact O-CG 3.42Å; L360-F365 HydrophobicContact CD2-CD1 3.97Å; L360-F365 HydrophobicContact CD2-CE1 3.61Å; L360-F365 HydrophobicContact CG-CE1 4.29Å; D362-F365 HydrophobicContact CB-CB 4.05Å; D362-F365 WeakPolarHBondContact O-CB 3.23Å; D362-F365 PolarHBondContact O-N 3.34Å; D362-F365 VanDerWaalsContact O-N 3.09Å; L363-F365 PolarHBondContact O-N 3.47Å; F365-S367 VanDerWaalsContact C-N 3.32Å; F365-S367 PolarHBondContact O-N 3.48Å; F365-L368 HydrophobicContact CD2-CD2 4.18Å; F365-L368 HydrophobicContact CE2-CD2 4.42Å; F365-L368 PolarHBondContact O-N 2.82Å; F365-M369 HydrophobicContact CD1-CE 3.63Å; F365-M369 HydrophobicContact CD1-CG 3.77Å; F365-M369 HydrophobicContact CD1-SD 3.73Å; F365-M369 HydrophobicContact CE1-CE 3.9Å; F365-M369 HydrophobicContact CE1-CG 3.51Å; F365-M369 HydrophobicContact CE1-SD 3.34Å; F365-M369 WeakPolarHBondContact CE1-SD 3.11Å; F365-M369 HydrophobicContact CG-CG 4.43Å; F365-M369 HydrophobicContact CZ-CG 3.98Å; F365-M369 HydrophobicContact CZ-SD 4.24Å; F365-M369 WeakPolarHBondContact O-CB 3.3Å; F365-M369 WeakPolarHBondContact O-CG 3.48Å; F365-M369 PolarHBondContact O-N 3.21Å; F365-L600 HydrophobicContact CE2-CD1 4.28Å; F365-L600 HydrophobicContact CE2-CD2 4.05Å; F365-L600 HydrophobicContact CZ-CD2 3.75Å; F365-L608 HydrophobicContact CE1-CD1 4.08Å; F365-L608 HydrophobicContact CZ-CD1 3.59Å; F365-L608 HydrophobicContact CZ-CD2 4.41Å
366	Y	84.6	Confident	78.7	Confident	26 Å²	26	58 Å²	58	10%	0.102	28%	0.276	C	S	.	.	H	α-helix	trans	-60	-42.5	172.7	174.6	-114.3	0	0	0	112.2	E364 A370 K385 L388 L666 E679	E364-Y366 VanDerWaalsContact C-N 3.27Å; E364-Y366 PolarHBondContact O-N 3.01Å; Y366-A370 WeakPolarHBondContact O-CB 3.32Å; Y366-A370 PolarHBondContact O-N 3Å; Y366-A370 VanDerWaalsContact O-N 3.1Å; Y366-K385 HydrophobicContact CE1-CD 3.77Å; Y366-K385 HydrophobicContact CE1-CG 3.89Å; Y366-K385 WeakPolarHBondContact OH-CB 3.28Å; Y366-L388 HydrophobicContact CD2-CD2 4.5Å; Y366-L388 HydrophobicContact CE2-CD2 4.32Å; Y366-L666 HydrophobicContact CD2-CD1 4.11Å; Y366-L666 HydrophobicContact CE2-CD1 4.11Å; Y366-E679 HydrophobicContact CE1-CG 4.44Å
367	S	84.6	Confident	79.4	Confident	36 Å²	36	58.4 Å²	58.4	25%	0.252	28%	0.279	S	S	.	.	H	α-helix	trans	-71.6	-39.6	177.2	-158.9	0	0	0	0	111.3	E364 F365 A370 Q371	E364-S367 PolarHBondContact O-N 3.23Å; F365-S367 VanDerWaalsContact C-N 3.32Å; F365-S367 PolarHBondContact O-N 3.48Å; S367-A370 PolarHBondContact O-N 3.19Å; S367-Q371 WeakPolarHBondContact O-CB 3.46Å; S367-Q371 WeakPolarHBondContact O-CG 3.38Å; S367-Q371 PolarHBondContact O-N 3.06Å
368	L	83.8	Confident	80	Confident	42 Å²	42	60.6 Å²	60.6	22%	0.22	29%	0.285	C	S	.	.	H	α-helix	trans	-64	-44	177.4	-174.5	67.7	0	0	0	112.2	E364 F365 A370 Q371 S372 L600	E364-L368 PolarHBondContact O-N 3.29Å; F365-L368 HydrophobicContact CD2-CD2 4.18Å; F365-L368 HydrophobicContact CE2-CD2 4.42Å; F365-L368 PolarHBondContact O-N 2.82Å; L368-A370 VanDerWaalsContact C-N 3.31Å; L368-A370 PolarHBondContact O-N 3.39Å; L368-Q371 PolarHBondContact O-N 3.44Å; L368-S372 WeakPolarHBondContact O-CB 3.39Å; L368-S372 PolarHBondContact O-N 3.38Å; L368-S372 PolarHBondContact O-OG 2.93Å; L368-L600 HydrophobicContact CD2-CD1 3.62Å; L368-L600 HydrophobicContact CG-CD1 3.78Å
369	M	85.2	Confident	80.5	Confident	4 Å²	4	55.4 Å²	55.4	2%	0.02	27%	0.267	C	S	.	.	H	α-helix	trans	-64.2	-37.8	174	-71.7	-169.2	-65.5	0	0	111.6	L360 F365 S372 L373 L388 L605 L666	L360-M369 HydrophobicContact CD2-CE 4.34Å; L360-M369 HydrophobicContact CD2-SD 4.28Å; F365-M369 HydrophobicContact CD1-CE 3.63Å; F365-M369 HydrophobicContact CD1-CG 3.77Å; F365-M369 HydrophobicContact CD1-SD 3.73Å; F365-M369 HydrophobicContact CE1-CE 3.9Å; F365-M369 HydrophobicContact CE1-CG 3.51Å; F365-M369 HydrophobicContact CE1-SD 3.34Å; F365-M369 WeakPolarHBondContact CE1-SD 3.11Å; F365-M369 HydrophobicContact CG-CG 4.43Å; F365-M369 HydrophobicContact CZ-CG 3.98Å; F365-M369 HydrophobicContact CZ-SD 4.24Å; F365-M369 WeakPolarHBondContact O-CB 3.3Å; F365-M369 WeakPolarHBondContact O-CG 3.48Å; F365-M369 PolarHBondContact O-N 3.21Å; M369-S372 VanDerWaalsContact CA-OG 3.25Å; M369-S372 WeakPolarHBondContact CA-OG 3.49Å; M369-S372 PolarHBondContact O-OG 3.14Å; M369-L373 PolarHBondContact O-N 3.1Å; M369-L388 HydrophobicContact CB-CD1 3.39Å; M369-L388 HydrophobicContact CE-CD1 4.37Å; M369-L605 HydrophobicContact CB-CD1 4.26Å; M369-L605 HydrophobicContact CG-CD1 4.14Å; M369-L605 HydrophobicContact SD-CD1 4.38Å; M369-L666 HydrophobicContact CE-CD2 3.9Å
370	A	86.5	Confident	80.9	Confident	2 Å²	2	53.2 Å²	53.2	2%	0.017	26%	0.261	C	S	.	.	H	α-helix	trans	-66.6	-39.5	175.5	0	0	0	0	0	111.9	Y366 S367 L368 L373 K384 K385 L388	Y366-A370 WeakPolarHBondContact O-CB 3.32Å; Y366-A370 PolarHBondContact O-N 3Å; Y366-A370 VanDerWaalsContact O-N 3.1Å; S367-A370 PolarHBondContact O-N 3.19Å; L368-A370 VanDerWaalsContact C-N 3.31Å; L368-A370 PolarHBondContact O-N 3.39Å; A370-L373 WeakPolarHBondContact O-CB 3.43Å; A370-L373 PolarHBondContact O-N 2.84Å; A370-K384 WeakPolarHBondContact O-CB 3.31Å; A370-K384 WeakPolarHBondContact O-CD 3.03Å; A370-K385 HydrophobicContact CB-CG 3.59Å; A370-L388 HydrophobicContact CB-CD1 4.47Å
371	Q	84.3	Confident	81.6	Confident	79 Å²	79	57.3 Å²	57.3	37%	0.369	28%	0.28	S	S	.	.	H	α-helix	trans	-71.8	-33.9	178	-73.6	173.6	-3.1	0	0	112.7	S367 L368 L373 E381	S367-Q371 WeakPolarHBondContact O-CB 3.46Å; S367-Q371 WeakPolarHBondContact O-CG 3.38Å; S367-Q371 PolarHBondContact O-N 3.06Å; L368-Q371 PolarHBondContact O-N 3.44Å; Q371-L373 PolarHBondContact O-N 3.28Å; Q371-E381 PolarHBondContact NE2-OE1 2.97Å; Q371-E381 VanDerWaalsContact NE2-OE1 3.13Å
372	S	84.7	Confident	82.6	Confident	8 Å²	8	52 Å²	52	6%	0.056	26%	0.264	C	S	.	.	H	α-helix	trans	-72.2	-11.4	172.7	55.6	0	0	0	0	113.6	L368 M369 A374 P375	L368-S372 WeakPolarHBondContact O-CB 3.39Å; L368-S372 PolarHBondContact O-N 3.38Å; L368-S372 PolarHBondContact O-OG 2.93Å; M369-S372 VanDerWaalsContact CA-OG 3.25Å; M369-S372 WeakPolarHBondContact CA-OG 3.49Å; M369-S372 PolarHBondContact O-OG 3.14Å; S372-A374 PolarHBondContact O-N 3.25Å; S372-P375 WeakPolarHBondContact O-CD 3.48Å
373	L	84.6	Confident	83.3	Confident	3 Å²	3	47.6 Å²	47.6	2%	0.016	24%	0.24	C	C	.	.	S	Bend	trans	-74.5	115.4	167.8	-161.7	82.6	0	0	0	109.8	M369 A370 Q371 K384 L387 L391 F427 L431	M369-L373 PolarHBondContact O-N 3.1Å; A370-L373 WeakPolarHBondContact O-CB 3.43Å; A370-L373 PolarHBondContact O-N 2.84Å; Q371-L373 PolarHBondContact O-N 3.28Å; L373-K384 HydrophobicContact CB-CB 4.41Å; L373-K384 HydrophobicContact CD2-CB 4.16Å; L373-K384 HydrophobicContact CD2-CG 4.44Å; L373-K384 VanDerWaalsContact O-CD 3.23Å; L373-K384 WeakPolarHBondContact O-CD 3.31Å; L373-K384 WeakPolarHBondContact O-CE 3.4Å; L373-K384 PolarHBondContact O-NZ 2.85Å; L373-L387 HydrophobicContact CD2-CB 3.55Å; L373-L387 HydrophobicContact CD2-CD1 4Å; L373-L387 HydrophobicContact CD2-CG 4.43Å; L373-L391 HydrophobicContact CD1-CD1 4.11Å; L373-F427 HydrophobicContact CD1-CD1 4.06Å; L373-F427 HydrophobicContact CD1-CE1 3.78Å; L373-F427 HydrophobicContact CG-CD1 4.2Å; L373-F427 HydrophobicContact CG-CE1 4.08Å; L373-L431 HydrophobicContact CD1-CD2 3.34Å
374	A	84.2	Confident	84.4	Confident	4 Å²	4	41.7 Å²	41.7	3%	0.033	21%	0.209	C	C	.	.	S	Bend	trans	48.2	66.7	-177.2	0	0	0	0	0	112.8	S372 E376 I377 K384 L424 F427	S372-A374 PolarHBondContact O-N 3.25Å; A374-E376 PolarHBondContact O-N 2.99Å; A374-I377 HydrophobicContact CB-CD1 4.22Å; A374-I377 PolarHBondContact O-N 2.91Å; A374-I377 VanDerWaalsContact O-N 3.08Å; A374-K384 PolarHBondContact O-NZ 2.76Å; A374-L424 HydrophobicContact CB-CD2 4.04Å; A374-F427 HydrophobicContact CB-CB 4.3Å; A374-F427 HydrophobicContact CB-CD1 4.06Å; A374-F427 HydrophobicContact CB-CD2 4.23Å; A374-F427 HydrophobicContact CB-CE1 4.48Å; A374-F427 HydrophobicContact CB-CG 3.92Å; A374-F427 VanDerWaalsContact N-CZ 3.35Å
375	P	83.1	Confident	85.3	Confident	35 Å²	35	35.1 Å²	35.1	23%	0.227	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-19.7	-177.3	30.3	-35.8	0	0	0	112.2	S372 I377 H570 A580 L599	S372-P375 WeakPolarHBondContact O-CD 3.48Å; P375-I377 PolarHBondContact O-N 2.94Å; P375-H570 PolarHBondContact O-CE1 2.76Å; P375-H570 VanDerWaalsContact O-CE1 3.31Å; P375-H570 PolarHBondContact O-NE2 2.84Å; P375-A580 HydrophobicContact CB-CB 3.78Å; P375-A580 WeakPolarHBondContact O-CB 3.48Å; P375-L599 HydrophobicContact CB-CD1 4.24Å
376	E	83.4	Confident	85.9	Confident	106 Å²	106	34.1 Å²	34.1	50%	0.495	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-25.2	173.4	-62.6	172.9	-166.2	0	0	112.9	A374 H570 V574	A374-E376 PolarHBondContact O-N 2.99Å; E376-H570 PolarHBondContact O-CD2 2.67Å; E376-H570 VanDerWaalsContact O-CD2 3.28Å; E376-H570 PolarHBondContact O-NE2 2.79Å; E376-V574 HydrophobicContact CG-CG1 4.36Å
377	I	85	Confident	86.3	Confident	26 Å²	26	33 Å²	33	13%	0.133	17%	0.169	C	C	.	.	S	Bend	trans	-99.9	118.6	-179.5	-58.6	171.7	0	0	0	109	A374 P375 K384 A420 Q423 L424	A374-I377 HydrophobicContact CB-CD1 4.22Å; A374-I377 PolarHBondContact O-N 2.91Å; A374-I377 VanDerWaalsContact O-N 3.08Å; P375-I377 PolarHBondContact O-N 2.94Å; I377-K384 PolarHBondContact O-NZ 3.11Å; I377-A420 HydrophobicContact CD1-CB 3.84Å; I377-A420 HydrophobicContact CG1-CB 4.28Å; I377-Q423 HydrophobicContact CD1-CB 3.99Å; I377-L424 HydrophobicContact CD1-CD2 3.7Å; I377-L424 HydrophobicContact CD1-CG 3.86Å
378	Y	83.5	Confident	86.7	Confident	81 Å²	81	31.3 Å²	31.3	32%	0.318	16%	0.157	S	C	.	.			trans	-74.4	139.2	173.2	-176.8	-107.7	0	0	0	111.2	R566 L567 H570	Y378-R566 HydrophobicContact CD1-CB 4.37Å; Y378-R566 HydrophobicContact CE1-CB 3.68Å; Y378-R566 VanDerWaalsContact OH-CD 3.28Å; Y378-R566 WeakPolarHBondContact OH-CD 3.37Å; Y378-L567 HydrophobicContact CD1-CB 4.44Å; Y378-H570 HydrophobicContact CD2-CB 4.4Å; Y378-H570 HydrophobicContact CG-CB 4.26Å
379	G	81.8	Confident	87.1	Confident	21 Å²	21	29.4 Å²	29.4	22%	0.216	15%	0.147	C	C	.	.	S	Bend	trans	82.7	-157.5	176.2	0	0	0	0	0	114.8	E381 K384	G379-E381 VanDerWaalsContact C-N 3.29Å; G379-E381 PolarHBondContact O-N 3.01Å; G379-K384 WeakPolarHBondContact O-CE 3.42Å
380	H	82.6	Confident	87.5	Confident	61 Å²	61	29.4 Å²	29.4	28%	0.282	15%	0.147	S	C	.	.			trans	49.3	41	-178.2	-56.1	-48.7	0	0	0	114.9	D382 V383 K384 I555	H380-D382 PolarHBondContact O-N 2.91Å; H380-V383 HydrophobicContact CB-CB 4.07Å; H380-V383 HydrophobicContact CB-CG2 4.1Å; H380-V383 PolarHBondContact O-N 3.39Å; H380-V383 VanDerWaalsContact O-N 3.09Å; H380-K384 WeakPolarHBondContact O-CG 2.8Å; H380-K384 PolarHBondContact O-N 3.4Å; H380-I555 VanDerWaalsContact CE1-CG2 3.43Å; H380-I555 WeakPolarHBondContact CE1-CG2 3.15Å
381	E	85.9	Confident	87.6	Confident	92 Å²	92	29.5 Å²	29.5	43%	0.43	15%	0.147	S	C	.	.	H	α-helix	trans	-56.6	-38.8	-178.6	-61.4	-165.8	150.1	0	0	112.5	Q371 G379 K384 K385	Q371-E381 PolarHBondContact NE2-OE1 2.97Å; Q371-E381 VanDerWaalsContact NE2-OE1 3.13Å; G379-E381 VanDerWaalsContact C-N 3.29Å; G379-E381 PolarHBondContact O-N 3.01Å; E381-K384 PolarHBondContact O-N 3.15Å; E381-K385 WeakPolarHBondContact O-CB 3.39Å; E381-K385 VanDerWaalsContact O-CG 3.3Å; E381-K385 WeakPolarHBondContact O-CG 3.43Å; E381-K385 PolarHBondContact O-N 3.03Å
382	D	90.1	Very high	87.8	Confident	48 Å²	48	25.9 Å²	25.9	26%	0.257	13%	0.13	S	C	.	.	H	α-helix	trans	-67.7	-37	178.5	-67.1	-36.7	0	0	0	112.9	H380 A386 W553 R682 L683	H380-D382 PolarHBondContact O-N 2.91Å; D382-A386 PolarHBondContact O-N 2.71Å; D382-W553 HydrophobicContact CB-CH2 3.68Å; D382-W553 HydrophobicContact CB-CZ2 4.04Å; D382-W553 HydrophobicContact CB-CZ3 4.48Å; D382-R682 IonicContact OD1-CZ 3.17Å; D382-R682 VanDerWaalsContact OD1-CZ 3.24Å; D382-R682 IonicContact OD1-NH1 3.54Å; D382-R682 PolarHBondContact OD1-NH1 2.92Å; D382-R682 IonicContact OD1-NH2 3.57Å; D382-R682 PolarHBondContact OD1-NH2 3.32Å; D382-R682 IonicContact OD2-NH1 3.89Å; D382-L683 HydrophobicContact CB-CD2 4.33Å
383	V	91.2	Very high	87.8	Confident	5 Å²	5	25.8 Å²	25.8	3%	0.03	13%	0.131	C	C	.	.	H	α-helix	trans	-67.8	-43.4	175.1	-177.1	0	0	0	0	109.7	H380 K385 A386 L387 L413 L424 W553 I555	H380-V383 HydrophobicContact CB-CB 4.07Å; H380-V383 HydrophobicContact CB-CG2 4.1Å; H380-V383 PolarHBondContact O-N 3.39Å; H380-V383 VanDerWaalsContact O-N 3.09Å; V383-K385 PolarHBondContact O-N 3.11Å; V383-A386 WeakPolarHBondContact O-CB 3.33Å; V383-A386 PolarHBondContact O-N 3.49Å; V383-A386 VanDerWaalsContact O-N 3.16Å; V383-L387 HydrophobicContact CG1-CD1 4.36Å; V383-L387 HydrophobicContact CG1-CG 4.43Å; V383-L387 WeakPolarHBondContact O-CG 3.49Å; V383-L387 PolarHBondContact O-N 2.9Å; V383-L413 HydrophobicContact CG1-CD2 3.78Å; V383-L424 HydrophobicContact CG1-CD1 4.35Å; V383-W553 HydrophobicContact CG2-CD2 4.05Å; V383-W553 HydrophobicContact CG2-CE3 4.27Å; V383-W553 HydrophobicContact CG2-CG 4.2Å; V383-I555 HydrophobicContact CG2-CD1 4.36Å
384	K	91.7	Very high	87.7	Confident	12 Å²	12	25.8 Å²	25.8	5%	0.052	13%	0.132	C	C	.	.	H	α-helix	trans	-62.4	-41.5	177.5	-67.8	178.1	179.4	-161.5	0	112	A370 L373 A374 I377 G379 H380 E381 A386 L387 L388	A370-K384 WeakPolarHBondContact O-CB 3.31Å; A370-K384 WeakPolarHBondContact O-CD 3.03Å; L373-K384 HydrophobicContact CB-CB 4.41Å; L373-K384 HydrophobicContact CD2-CB 4.16Å; L373-K384 HydrophobicContact CD2-CG 4.44Å; L373-K384 VanDerWaalsContact O-CD 3.23Å; L373-K384 WeakPolarHBondContact O-CD 3.31Å; L373-K384 WeakPolarHBondContact O-CE 3.4Å; L373-K384 PolarHBondContact O-NZ 2.85Å; A374-K384 PolarHBondContact O-NZ 2.76Å; I377-K384 PolarHBondContact O-NZ 3.11Å; G379-K384 WeakPolarHBondContact O-CE 3.42Å; H380-K384 WeakPolarHBondContact O-CG 2.8Å; H380-K384 PolarHBondContact O-N 3.4Å; E381-K384 PolarHBondContact O-N 3.15Å; K384-A386 PolarHBondContact O-N 3.05Å; K384-L387 PolarHBondContact O-N 2.92Å; K384-L388 WeakPolarHBondContact O-CB 3.27Å; K384-L388 PolarHBondContact O-N 3.4Å
385	K	91.4	Very high	87.7	Confident	26 Å²	26	26.3 Å²	26.3	11%	0.113	13%	0.134	C	C	.	.	H	α-helix	trans	-57.4	-45.9	171.3	-79	173.5	-178.2	173.5	0	111.9	Y366 A370 E381 V383 L388 L389 L683	Y366-K385 HydrophobicContact CE1-CD 3.77Å; Y366-K385 HydrophobicContact CE1-CG 3.89Å; Y366-K385 WeakPolarHBondContact OH-CB 3.28Å; A370-K385 HydrophobicContact CB-CG 3.59Å; E381-K385 WeakPolarHBondContact O-CB 3.39Å; E381-K385 VanDerWaalsContact O-CG 3.3Å; E381-K385 WeakPolarHBondContact O-CG 3.43Å; E381-K385 PolarHBondContact O-N 3.03Å; V383-K385 PolarHBondContact O-N 3.11Å; K385-L388 PolarHBondContact O-N 3.17Å; K385-L389 WeakPolarHBondContact O-CG 3.39Å; K385-L389 PolarHBondContact O-N 3.44Å; K385-L683 HydrophobicContact CB-CD2 4.35Å
386	A	92.5	Very high	87.7	Confident	0 Å²	0	28.2 Å²	28.2	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-64.2	-41.8	177.3	0	0	0	0	0	112.8	D382 V383 K384 L388 L389 L390 I411 L551	D382-A386 PolarHBondContact O-N 2.71Å; V383-A386 WeakPolarHBondContact O-CB 3.33Å; V383-A386 PolarHBondContact O-N 3.49Å; V383-A386 VanDerWaalsContact O-N 3.16Å; K384-A386 PolarHBondContact O-N 3.05Å; A386-L388 VanDerWaalsContact C-N 3.32Å; A386-L388 PolarHBondContact O-N 2.94Å; A386-L389 PolarHBondContact O-N 3.45Å; A386-L390 PolarHBondContact O-N 3.08Å; A386-I411 HydrophobicContact CB-CD1 4.04Å; A386-I411 VanDerWaalsContact O-CD1 3.28Å; A386-I411 WeakPolarHBondContact O-CD1 3.04Å; A386-L551 HydrophobicContact CB-CD1 3.75Å
387	L	93.2	Very high	87.3	Confident	1 Å²	1	27 Å²	27	1%	0.005	14%	0.137	C	C	.	.	H	α-helix	trans	-64	-37.2	176.1	-69.3	178.8	0	0	0	112.3	L373 V383 K384 L390 L391 L424 V428 L519	L373-L387 HydrophobicContact CD2-CB 3.55Å; L373-L387 HydrophobicContact CD2-CD1 4Å; L373-L387 HydrophobicContact CD2-CG 4.43Å; V383-L387 HydrophobicContact CG1-CD1 4.36Å; V383-L387 HydrophobicContact CG1-CG 4.43Å; V383-L387 WeakPolarHBondContact O-CG 3.49Å; V383-L387 PolarHBondContact O-N 2.9Å; K384-L387 PolarHBondContact O-N 2.92Å; L387-L390 WeakPolarHBondContact O-CB 3.46Å; L387-L390 PolarHBondContact O-N 3.38Å; L387-L391 PolarHBondContact O-N 3.19Å; L387-L424 HydrophobicContact CD1-CB 4.29Å; L387-L424 HydrophobicContact CD1-CD2 4.25Å; L387-V428 HydrophobicContact CB-CG2 4.46Å; L387-V428 HydrophobicContact CD1-CG2 4.08Å; L387-V428 HydrophobicContact CD2-CG2 4.38Å; L387-L519 HydrophobicContact CD2-CD1 3.51Å; L387-L519 HydrophobicContact CD2-CD2 3.74Å; L387-L519 HydrophobicContact CD2-CG 4.3Å
388	L	91.9	Very high	87	Confident	2 Å²	2	29.7 Å²	29.7	1%	0.01	16%	0.163	C	C	.	.	H	α-helix	trans	-63.4	-44.6	174.4	-174	159.5	0	0	0	111.1	Y366 M369 A370 K384 K385 A386 L390 L391 V392 L666	Y366-L388 HydrophobicContact CD2-CD2 4.5Å; Y366-L388 HydrophobicContact CE2-CD2 4.32Å; M369-L388 HydrophobicContact CB-CD1 3.39Å; M369-L388 HydrophobicContact CE-CD1 4.37Å; A370-L388 HydrophobicContact CB-CD1 4.47Å; K384-L388 WeakPolarHBondContact O-CB 3.27Å; K384-L388 PolarHBondContact O-N 3.4Å; K385-L388 PolarHBondContact O-N 3.17Å; A386-L388 VanDerWaalsContact C-N 3.32Å; A386-L388 PolarHBondContact O-N 2.94Å; L388-L390 VanDerWaalsContact C-N 3.3Å; L388-L390 PolarHBondContact O-N 3.36Å; L388-L391 PolarHBondContact O-N 3.48Å; L388-L391 VanDerWaalsContact O-N 3.15Å; L388-V392 HydrophobicContact CD2-CG2 4.33Å; L388-V392 WeakPolarHBondContact O-CG2 3.48Å; L388-V392 PolarHBondContact O-N 3.15Å; L388-V392 VanDerWaalsContact O-N 3.15Å; L388-L666 HydrophobicContact CD2-CD1 3.15Å; L388-L666 HydrophobicContact CD2-CD2 3.73Å; L388-L666 HydrophobicContact CD2-CG 4.03Å
389	L	92.6	Very high	86	Confident	2 Å²	2	29.8 Å²	29.8	1%	0.01	17%	0.174	C	C	.	.	H	α-helix	trans	-61.3	-38.2	173.9	-66.6	172.4	0	0	0	112	K385 A386 L391 V392 G393 L409 L659 A662 R663 L666 L683	K385-L389 WeakPolarHBondContact O-CG 3.39Å; K385-L389 PolarHBondContact O-N 3.44Å; A386-L389 PolarHBondContact O-N 3.45Å; L389-L391 VanDerWaalsContact C-N 3.33Å; L389-L391 PolarHBondContact O-N 2.99Å; L389-V392 PolarHBondContact O-N 3.49Å; L389-G393 PolarHBondContact O-N 3.41Å; L389-L409 HydrophobicContact CB-CD1 4.02Å; L389-L409 WeakPolarHBondContact O-CD1 3.39Å; L389-L659 HydrophobicContact CB-CD2 4.3Å; L389-L659 HydrophobicContact CD1-CD2 3.81Å; L389-A662 HydrophobicContact CB-CB 4.45Å; L389-A662 HydrophobicContact CD2-CB 4.07Å; L389-R663 HydrophobicContact CD2-CB 3.93Å; L389-L666 HydrophobicContact CD2-CD1 3.69Å; L389-L683 HydrophobicContact CD1-CD1 3.6Å
390	L	92.7	Very high	85.4	Confident	3 Å²	3	36.7 Å²	36.7	2%	0.016	20%	0.198	C	C	.	.	H	α-helix	trans	-60.9	-42	173.6	174.8	151.8	0	0	0	112	A386 L387 L388 V392 G393 I411 V475 A517 L519	A386-L390 PolarHBondContact O-N 3.08Å; L387-L390 WeakPolarHBondContact O-CB 3.46Å; L387-L390 PolarHBondContact O-N 3.38Å; L388-L390 VanDerWaalsContact C-N 3.3Å; L388-L390 PolarHBondContact O-N 3.36Å; L390-V392 VanDerWaalsContact C-N 3.32Å; L390-V392 PolarHBondContact O-N 2.98Å; L390-G393 PolarHBondContact O-N 3.48Å; L390-I411 HydrophobicContact CB-CD1 3.72Å; L390-I411 HydrophobicContact CB-CG1 4.44Å; L390-I411 HydrophobicContact CD1-CB 3.94Å; L390-I411 HydrophobicContact CD1-CD1 3.82Å; L390-I411 HydrophobicContact CD1-CG1 3.76Å; L390-I411 HydrophobicContact CG-CD1 4.43Å; L390-V475 HydrophobicContact CD2-CB 4.42Å; L390-V475 HydrophobicContact CD2-CG1 3.82Å; L390-V475 HydrophobicContact CD2-CG2 3.65Å; L390-A517 HydrophobicContact CD2-CB 4.42Å; L390-A517 HydrophobicContact CG-CB 4.27Å; L390-L519 HydrophobicContact CD1-CB 4.13Å; L390-L519 HydrophobicContact CD1-CD1 4.21Å
391	L	90.1	Very high	84.8	Confident	4 Å²	4	43.8 Å²	43.8	2%	0.021	23%	0.231	C	C	.	.	H	α-helix	trans	-65.6	-34.7	179.6	-78.9	166.5	0	0	0	112.6	L373 L387 L388 L389 V428 L431 V475 I609 K613	L373-L391 HydrophobicContact CD1-CD1 4.11Å; L387-L391 PolarHBondContact O-N 3.19Å; L388-L391 PolarHBondContact O-N 3.48Å; L388-L391 VanDerWaalsContact O-N 3.15Å; L389-L391 VanDerWaalsContact C-N 3.33Å; L389-L391 PolarHBondContact O-N 2.99Å; L391-V428 HydrophobicContact CD2-CG1 4.08Å; L391-V428 HydrophobicContact CG-CG1 4.44Å; L391-L431 HydrophobicContact CD1-CD2 3.43Å; L391-L431 VanDerWaalsContact CD1-CD2 3.43Å; L391-L431 HydrophobicContact CD1-CG 4.1Å; L391-V475 HydrophobicContact CD2-CG2 4.15Å; L391-I609 HydrophobicContact CB-CD1 4.3Å; L391-I609 HydrophobicContact CB-CG2 4.47Å; L391-I609 HydrophobicContact CD1-CD1 4.2Å; L391-K613 WeakPolarHBondContact O-CE 3.36Å; L391-K613 PolarHBondContact O-NZ 2.83Å
392	V	88	Confident	83.9	Confident	3 Å²	3	43.7 Å²	43.7	2%	0.018	26%	0.255	C	S	.	.	H	α-helix	trans	-76.6	-44.4	177.3	179.2	0	0	0	0	110.9	L388 L389 L390 A612 K613 R665 L666	L388-V392 HydrophobicContact CD2-CG2 4.33Å; L388-V392 WeakPolarHBondContact O-CG2 3.48Å; L388-V392 PolarHBondContact O-N 3.15Å; L388-V392 VanDerWaalsContact O-N 3.15Å; L389-V392 PolarHBondContact O-N 3.49Å; L390-V392 VanDerWaalsContact C-N 3.32Å; L390-V392 PolarHBondContact O-N 2.98Å; V392-A612 HydrophobicContact CG1-CB 4.49Å; V392-K613 WeakPolarHBondContact O-CE 3.48Å; V392-K613 WeakPolarHBondContact O-CG 3.49Å; V392-R665 HydrophobicContact CG1-CB 3.9Å; V392-L666 HydrophobicContact CB-CD2 4.49Å; V392-L666 HydrophobicContact CB-CG 4.45Å; V392-L666 HydrophobicContact CG1-CG 4.31Å; V392-L666 HydrophobicContact CG2-CD1 4.15Å; V392-L666 HydrophobicContact CG2-CD2 3.32Å; V392-L666 HydrophobicContact CG2-CG 3.68Å
393	G	85.3	Confident	83.4	Confident	7 Å²	7	46.6 Å²	46.6	7%	0.072	27%	0.269	C	S	.	.			trans	73.6	152.2	-176.2	0	0	0	0	0	113.5	L389 L390 R665	L389-G393 PolarHBondContact O-N 3.41Å; L390-G393 PolarHBondContact O-N 3.48Å; G393-R665 PolarHBondContact O-NH1 2.95Å
394	G	81.2	Confident	82.9	Confident	3 Å²	3	51 Å²	51	3%	0.031	29%	0.286	C	S	.	.			trans	-84.6	-178.8	176.2	0	0	0	0	0	113.1	G407 R665	G394-G407 CarbonylContact C-O 3.5Å; G394-G407 WeakPolarHBondContact CA-O 3.42Å; G394-G407 PolarHBondContact N-O 3.02Å; G394-R665 PolarHBondContact O-NH1 2.84Å
395	V	84.2	Confident	82.6	Confident	14 Å²	14	53 Å²	53	9%	0.085	30%	0.296	C	S	.	.			trans	-77.2	127.9	-179.4	177.7	0	0	0	0	110.8	L397 G407 A617 P618 T661	V395-L397 HydrophobicContact CG1-CD2 3.98Å; V395-L397 HydrophobicContact CG1-CG 4.2Å; V395-G407 VanDerWaalsContact O-CA 3.28Å; V395-G407 WeakPolarHBondContact O-CA 3.49Å; V395-A617 HydrophobicContact CB-CB 4.45Å; V395-A617 HydrophobicContact CG1-CB 3.69Å; V395-A617 HydrophobicContact CG2-CB 3.84Å; V395-P618 HydrophobicContact CG2-CG 3.92Å; V395-T661 HydrophobicContact CG2-CG2 4.37Å
396	E	82.7	Confident	82.4	Confident	76 Å²	76	52.2 Å²	52.2	36%	0.355	29%	0.293	S	S	.	.			trans	-77.7	124	165.9	-62.4	-170.8	166.1	0	0	109	R404	E396-R404 IonicContact OE1-NH2 3.11Å; E396-R404 PolarHBondContact OE1-NH2 2.82Å; E396-R404 VanDerWaalsContact OE1-NH2 3.16Å; E396-R404 IonicContact OE2-CZ 3.38Å; E396-R404 IonicContact OE2-NE 3.87Å; E396-R404 IonicContact OE2-NH2 2.99Å; E396-R404 PolarHBondContact OE2-NH2 2.91Å
397	L	76.8	Confident	82	Confident	80 Å²	80	52.2 Å²	52.2	42%	0.419	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	126.5	179.6	-64.9	162.1	0	0	0	108.8	V395 P399 I405	V395-L397 HydrophobicContact CG1-CD2 3.98Å; V395-L397 HydrophobicContact CG1-CG 4.2Å; L397-P399 WeakPolarHBondContact O-CD 3.44Å; L397-I405 HydrophobicContact CB-CB 4.24Å; L397-I405 HydrophobicContact CB-CD1 4.46Å; L397-I405 PolarHBondContact N-O 2.91Å; L397-I405 PolarHBondContact O-N 2.67Å
398	A	76.7	Confident	81.9	Confident	82 Å²	82	53.2 Å²	53.2	68%	0.678	30%	0.298	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-117.3	67.5	168.7	0	0	0	0	0	109.4	K400	A398-K400 VanDerWaalsContact C-N 3.28Å; A398-K400 PolarHBondContact O-N 3.41Å
399	P	63.3	Low	81.9	Confident	84 Å²	84	53.2 Å²	53.2	55%	0.545	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	-21.6	-169.7	27.7	-36.1	0	0	0	114.1	L397 L403 I405	L397-P399 WeakPolarHBondContact O-CD 3.44Å; P399-L403 WeakPolarHBondContact CD-O 3.22Å; P399-I405 HydrophobicContact CG-CD1 4.45Å
400	K	70.4	Confident	82	Confident	165 Å²	165	53.3 Å²	53.3	72%	0.717	30%	0.298	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-145.4	148.5	178.3	-66	-174.5	179.5	-179.3	0	109.6	A398 G402 L403	A398-K400 VanDerWaalsContact C-N 3.28Å; A398-K400 PolarHBondContact O-N 3.41Å; K400-G402 PolarHBondContact O-N 3.33Å; K400-L403 PolarHBondContact O-N 3.37Å; K400-L403 VanDerWaalsContact O-N 3.16Å
401	E	68.3	Low	82	Confident	210 Å²	210	53.2 Å²	53.2	98%	0.981	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.4	115.8	170.9	-66.9	-171.1	166.5	0	0	109.5
402	G	68.8	Low	82.1	Confident	90 Å²	90	53 Å²	53	93%	0.928	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	102.4	-17.7	176.6	0	0	0	0	0	117.1	K400	K400-G402 PolarHBondContact O-N 3.33Å
403	L	78.4	Confident	82.2	Confident	109 Å²	109	52.9 Å²	52.9	57%	0.571	30%	0.296	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-111	102.5	175	-172.2	73	0	0	0	110.6	P399 K400	P399-L403 WeakPolarHBondContact CD-O 3.22Å; K400-L403 PolarHBondContact O-N 3.37Å; K400-L403 VanDerWaalsContact O-N 3.16Å
404	R	81	Confident	82.4	Confident	99 Å²	99	53 Å²	53	37%	0.374	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	125	172.9	-170.4	176.7	-179.9	-153.3	-6.5	109.9	E396	E396-R404 IonicContact OE1-NH2 3.11Å; E396-R404 PolarHBondContact OE1-NH2 2.82Å; E396-R404 VanDerWaalsContact OE1-NH2 3.16Å; E396-R404 IonicContact OE2-CZ 3.38Å; E396-R404 IonicContact OE2-NE 3.87Å; E396-R404 IonicContact OE2-NH2 2.99Å; E396-R404 PolarHBondContact OE2-NH2 2.91Å
405	I	84.3	Confident	82.6	Confident	53 Å²	53	52.9 Å²	52.9	27%	0.272	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	121.3	174.2	-57.3	173.9	0	0	0	107.6	L397 P399 G407	L397-I405 HydrophobicContact CB-CB 4.24Å; L397-I405 HydrophobicContact CB-CD1 4.46Å; L397-I405 PolarHBondContact N-O 2.91Å; L397-I405 PolarHBondContact O-N 2.67Å; P399-I405 HydrophobicContact CG-CD1 4.45Å; I405-G407 PolarHBondContact O-N 3Å
406	R	88.2	Confident	82.6	Confident	9 Å²	9	52.9 Å²	52.9	3%	0.034	29%	0.293	C	S	.	.	P	Polyproline II helix	trans	-58	136.3	176.6	72.6	176.5	-154.3	-157	0.8	111	N410 M496 Q499 R548 D550 R658	R406-N410 PolarHBondContact NH1-ND2 3.01Å; R406-M496 WeakPolarHBondContact CD-O 3.4Å; R406-M496 PolarHBondContact NH1-O 2.87Å; R406-Q499 VanDerWaalsContact CB-CD 3.49Å; R406-Q499 HydrophobicContact CB-CG 4.03Å; R406-R548 PolarHBondContact NH1-O 3.08Å; R406-R548 PolarHBondContact NH2-O 3.48Å; R406-D550 IonicContact CZ-OD2 3.26Å; R406-D550 VanDerWaalsContact NH2-CG 3.26Å; R406-D550 IonicContact NH2-OD1 2.79Å; R406-D550 PolarHBondContact NH2-OD1 3.19Å; R406-D550 IonicContact NH2-OD2 2.73Å; R406-D550 PolarHBondContact NH2-OD2 2.78Å; R406-R658 VanDerWaalsContact CG-CZ 3.44Å; R406-R658 VanDerWaalsContact NH2-NH1 3.17Å; R406-R658 PolarHBondContact O-NE 2.97Å; R406-R658 PolarHBondContact O-NH2 3.17Å
407	G	85.1	Confident	82.6	Confident	0 Å²	0	53.4 Å²	53.4	0%	0	30%	0.303	C	S	.	.			trans	-96.4	-16.7	172.3	0	0	0	0	0	113.8	G394 V395 I405	G394-G407 CarbonylContact C-O 3.5Å; G394-G407 WeakPolarHBondContact CA-O 3.42Å; G394-G407 PolarHBondContact N-O 3.02Å; V395-G407 VanDerWaalsContact O-CA 3.28Å; V395-G407 WeakPolarHBondContact O-CA 3.49Å; I405-G407 PolarHBondContact O-N 3Å
408	N	90.7	Very high	82.8	Confident	23 Å²	23	53.2 Å²	53.2	12%	0.123	32%	0.32	C	S	.	.			trans	-73.3	146.3	-177.3	-63.4	-7.9	0	0	0	111.8	Q499 R515 V516 A517	N408-Q499 PolarHBondContact ND2-NE2 3.29Å; N408-R515 PolarHBondContact ND2-O 2.92Å; N408-V516 PolarHBondContact ND2-O 2.93Å; N408-A517 HydrophobicContact CB-CB 4.21Å
409	L	92.1	Very high	83.1	Confident	1 Å²	1	50 Å²	50	1%	0.005	29%	0.292	C	S	.	.			trans	-96	135	175.1	-68.1	167.5	0	0	0	109.7	L389 D550 R658 L659 A662	L389-L409 HydrophobicContact CB-CD1 4.02Å; L389-L409 WeakPolarHBondContact O-CD1 3.39Å; L409-D550 WeakPolarHBondContact CA-OD2 3.34Å; L409-D550 HydrophobicContact CD2-CB 4.11Å; L409-R658 HydrophobicContact CD2-CB 3.59Å; L409-R658 HydrophobicContact CG-CB 4.45Å; L409-L659 HydrophobicContact CD1-CD2 3.68Å; L409-L659 HydrophobicContact CD2-CD2 3.87Å; L409-L659 HydrophobicContact CD2-CG 3.99Å; L409-L659 HydrophobicContact CG-CD2 4.44Å; L409-A662 HydrophobicContact CD1-CB 4.27Å
410	N	93.4	Very high	84.2	Confident	4 Å²	4	47.7 Å²	47.7	2%	0.021	28%	0.28	C	S	.	.			trans	-110.8	124.9	172	-60.6	-42.1	0	0	0	109.5	R406 M496 I518 F549 D550 L551	R406-N410 PolarHBondContact NH1-ND2 3.01Å; N410-M496 HydrophobicContact CB-CE 3.7Å; N410-I518 WeakPolarHBondContact CA-O 3.41Å; N410-I518 PolarHBondContact OD1-N 3.2Å; N410-F549 HydrophobicContact CB-CD1 3.76Å; N410-F549 HydrophobicContact CB-CE1 4.3Å; N410-D550 PolarHBondContact N-OD2 3.48Å; N410-D550 PolarHBondContact O-N 3.19Å; N410-L551 PolarHBondContact O-N 2.91Å
411	I	93	Very high	85.1	Confident	1 Å²	1	40.3 Å²	40.3	1%	0.005	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	137.8	-177.6	-59.5	-178.6	0	0	0	109.1	A386 L390 L413 I518 L519 A520 L551	A386-I411 HydrophobicContact CB-CD1 4.04Å; A386-I411 VanDerWaalsContact O-CD1 3.28Å; A386-I411 WeakPolarHBondContact O-CD1 3.04Å; L390-I411 HydrophobicContact CB-CD1 3.72Å; L390-I411 HydrophobicContact CB-CG1 4.44Å; L390-I411 HydrophobicContact CD1-CB 3.94Å; L390-I411 HydrophobicContact CD1-CD1 3.82Å; L390-I411 HydrophobicContact CD1-CG1 3.76Å; L390-I411 HydrophobicContact CG-CD1 4.43Å; I411-L413 HydrophobicContact CG2-CD2 4.09Å; I411-I518 PolarHBondContact N-O 3.36Å; I411-L519 HydrophobicContact CB-CD1 3.91Å; I411-L519 HydrophobicContact CG2-CD1 4.05Å; I411-L519 WeakPolarHBondContact O-CA 3.21Å; I411-A520 PolarHBondContact O-N 2.87Å; I411-L551 WeakPolarHBondContact CA-O 3.46Å; I411-L551 HydrophobicContact CD1-CD1 4.25Å; I411-L551 HydrophobicContact CG1-CB 4.22Å; I411-L551 HydrophobicContact CG1-CD1 4.5Å; I411-L551 HydrophobicContact CG2-CB 4.47Å
412	C	91.5	Very high	86	Confident	0 Å²	0	32.9 Å²	32.9	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	127.5	171.2	179.8	0	0	0	0	110.6	A520 F549 L551 L552 W553	C412-A520 CarbonylContact C-O 3.59Å; C412-A520 VanDerWaalsContact CA-O 3.31Å; C412-A520 WeakPolarHBondContact CA-O 3.48Å; C412-A520 HydrophobicContact CB-CB 4.21Å; C412-F549 HydrophobicContact CB-CD1 3.9Å; C412-F549 HydrophobicContact CB-CD2 3.87Å; C412-F549 HydrophobicContact CB-CE1 3.91Å; C412-F549 HydrophobicContact CB-CE2 3.8Å; C412-F549 HydrophobicContact CB-CG 3.91Å; C412-F549 HydrophobicContact CB-CZ 3.87Å; C412-L551 PolarHBondContact N-O 2.95Å; C412-L551 VanDerWaalsContact N-O 3.09Å; C412-L552 HydrophobicContact CB-CD2 3.95Å; C412-W553 PolarHBondContact O-N 2.91Å
413	L	91.5	Very high	87	Confident	0 Å²	0	34.2 Å²	34.2	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	106.9	177.3	-55.1	-178.5	0	0	0	109.3	V383 I411 K421 L424 L519 A520 A521 A522 W553	V383-L413 HydrophobicContact CG1-CD2 3.78Å; I411-L413 HydrophobicContact CG2-CD2 4.09Å; L413-K421 HydrophobicContact CB-CD 4.14Å; L413-L424 HydrophobicContact CD1-CD1 4.28Å; L413-L519 HydrophobicContact CG-CD1 4.39Å; L413-A520 PolarHBondContact N-O 2.77Å; L413-A521 CarbonylContact O-C 3.34Å; L413-A521 WeakPolarHBondContact O-CA 3.49Å; L413-A522 PolarHBondContact O-N 3.21Å; L413-W553 HydrophobicContact CD2-CB 3.88Å; L413-W553 HydrophobicContact CD2-CG 4.35Å
414	M	88.2	Confident	87.6	Confident	11 Å²	11	29.1 Å²	29.1	5%	0.054	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	153.7	173.8	-61.6	178.4	177.9	0	0	109.8	A522 V539 L541 L546 L552 W553 L554 I555	M414-A522 WeakPolarHBondContact CA-O 3.43Å; M414-A522 HydrophobicContact CG-CB 4.37Å; M414-V539 HydrophobicContact CE-CG1 3.73Å; M414-V539 HydrophobicContact SD-CG1 4.07Å; M414-V539 HydrophobicContact SD-CG2 3.79Å; M414-L541 HydrophobicContact CE-CD1 3.89Å; M414-L546 HydrophobicContact CE-CD2 3.54Å; M414-L552 HydrophobicContact CE-CD2 3.76Å; M414-W553 WeakPolarHBondContact CA-O 3.46Å; M414-W553 PolarHBondContact N-O 3.37Å; M414-L554 HydrophobicContact CB-CD1 3.81Å; M414-I555 PolarHBondContact O-N 3.31Å
415	G	85.2	Confident	88.2	Confident	0 Å²	0	24.4 Å²	24.4	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	153.4	178.6	179.2	0	0	0	0	0	115.1	K421 P524 I555	G415-K421 VanDerWaalsContact CA-CE 3.42Å; G415-K421 VanDerWaalsContact CA-NZ 3.3Å; G415-K421 PolarHBondContact O-NZ 3.34Å; G415-P524 WeakPolarHBondContact O-CD 3.25Å; G415-I555 WeakPolarHBondContact CA-O 3.44Å
416	D	84.9	Confident	88.4	Confident	13 Å²	13	22.9 Å²	22.9	7%	0.07	15%	0.154	C	C	.	.			trans	-75.1	156.2	-176.6	-61	-21.9	0	0	0	111.6	G418 V419 R528 Y529 I555 D557	D416-G418 PolarHBondContact O-N 2.92Å; D416-V419 WeakPolarHBondContact O-CG2 3.34Å; D416-R528 VanDerWaalsContact OD1-CA 3.31Å; D416-R528 WeakPolarHBondContact OD1-CA 3.42Å; D416-Y529 PolarHBondContact OD1-N 3.44Å; D416-I555 PolarHBondContact N-O 2.63Å; D416-D557 HydrophobicContact CB-CB 4.46Å
417	P	82.6	Confident	88.5	Confident	88 Å²	88	23.2 Å²	23.2	57%	0.571	16%	0.156	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.9	130.8	170.6	28.3	-33.4	0	0	0	109.3	G527	P417-G527 WeakPolarHBondContact CD-O 3.47Å
418	G	81	Confident	88.8	Confident	75 Å²	75	23.2 Å²	23.2	77%	0.773	16%	0.156	S	C	*	.	T	Hydrogen-bonded Turn	trans	119.6	-19.8	-179.5	0	0	0	0	0	114.5	D416 A420	D416-G418 PolarHBondContact O-N 2.92Å; G418-A420 PolarHBondContact O-N 2.91Å
419	V	84.3	Confident	88.8	Confident	16 Å²	16	24 Å²	24	10%	0.097	16%	0.16	C	C	.	.	S	Bend	trans	-79.1	27.3	-177.6	-53.6	0	0	0	0	114.4	D416 K421 I555 D557	D416-V419 WeakPolarHBondContact O-CG2 3.34Å; V419-K421 HydrophobicContact CG2-CD 4.08Å; V419-K421 VanDerWaalsContact CG2-CE 3.47Å; V419-K421 HydrophobicContact CG2-CG 3.47Å; V419-K421 VanDerWaalsContact CG2-CG 3.47Å; V419-K421 PolarHBondContact O-N 3.28Å; V419-I555 HydrophobicContact CB-CB 4.48Å; V419-I555 HydrophobicContact CB-CG2 3.79Å; V419-I555 HydrophobicContact CG1-CG2 3.92Å; V419-I555 HydrophobicContact CG2-CB 4.08Å; V419-I555 HydrophobicContact CG2-CG2 3.93Å; V419-D557 HydrophobicContact CG1-CB 4.17Å
420	A	85.6	Confident	88.5	Confident	34 Å²	34	29.7 Å²	29.7	28%	0.281	18%	0.181	S	C	.	.			trans	52.5	23.3	176.6	0	0	0	0	0	116.9	I377 G418 S422 Q423 L424	I377-A420 HydrophobicContact CD1-CB 3.84Å; I377-A420 HydrophobicContact CG1-CB 4.28Å; G418-A420 PolarHBondContact O-N 2.91Å; A420-S422 PolarHBondContact O-N 3.06Å; A420-Q423 HydrophobicContact CB-CB 4.29Å; A420-Q423 HydrophobicContact CB-CG 4.43Å; A420-Q423 WeakPolarHBondContact O-CA 3.12Å; A420-Q423 WeakPolarHBondContact O-CB 3.19Å; A420-Q423 PolarHBondContact O-N 3.5Å; A420-L424 PolarHBondContact O-N 3.42Å; A420-L424 VanDerWaalsContact O-N 3.08Å
421	K	88.5	Confident	88.2	Confident	11 Å²	11	29.6 Å²	29.6	5%	0.048	18%	0.181	C	C	.	.	H	α-helix	trans	-57	-45.5	-178.5	-52.8	-172.4	-156.8	145	0	113.5	L413 G415 V419 Q423 L424 L425 A521 A522 N523	L413-K421 HydrophobicContact CB-CD 4.14Å; G415-K421 VanDerWaalsContact CA-CE 3.42Å; G415-K421 VanDerWaalsContact CA-NZ 3.3Å; G415-K421 PolarHBondContact O-NZ 3.34Å; V419-K421 HydrophobicContact CG2-CD 4.08Å; V419-K421 VanDerWaalsContact CG2-CE 3.47Å; V419-K421 HydrophobicContact CG2-CG 3.47Å; V419-K421 VanDerWaalsContact CG2-CG 3.47Å; V419-K421 PolarHBondContact O-N 3.28Å; K421-Q423 PolarHBondContact O-N 2.95Å; K421-L424 WeakPolarHBondContact O-CB 3.4Å; K421-L424 PolarHBondContact O-N 3.45Å; K421-L424 VanDerWaalsContact O-N 3.1Å; K421-L425 PolarHBondContact O-N 2.98Å; K421-A521 HydrophobicContact CB-CB 4.27Å; K421-A521 HydrophobicContact CD-CB 4.36Å; K421-A522 PolarHBondContact NZ-O 3.14Å; K421-N523 PolarHBondContact NZ-OD1 2.89Å; K421-N523 VanDerWaalsContact NZ-OD1 3.12Å
422	S	88.7	Confident	87.8	Confident	54 Å²	54	29.7 Å²	29.7	38%	0.378	18%	0.182	S	C	.	.	H	α-helix	trans	-63.7	-28.9	178.8	-50.2	0	0	0	0	112	A420 G426 D479	A420-S422 PolarHBondContact O-N 3.06Å; S422-G426 PolarHBondContact O-N 3.26Å; S422-D479 VanDerWaalsContact CB-OD2 3.26Å; S422-D479 WeakPolarHBondContact CB-OD2 3.48Å; S422-D479 PolarHBondContact OG-OD2 3.5Å
423	Q	89.1	Confident	87	Confident	117 Å²	117	33.3 Å²	33.3	55%	0.547	21%	0.205	S	C	.	.	H	α-helix	trans	-71.7	-38.9	173.6	-61.8	-63.6	-12.1	0	0	111.6	I377 A420 K421 G426 F427	I377-Q423 HydrophobicContact CD1-CB 3.99Å; A420-Q423 HydrophobicContact CB-CB 4.29Å; A420-Q423 HydrophobicContact CB-CG 4.43Å; A420-Q423 WeakPolarHBondContact O-CA 3.12Å; A420-Q423 WeakPolarHBondContact O-CB 3.19Å; A420-Q423 PolarHBondContact O-N 3.5Å; K421-Q423 PolarHBondContact O-N 2.95Å; Q423-G426 PolarHBondContact O-N 3.05Å; Q423-F427 WeakPolarHBondContact O-CB 3.27Å; Q423-F427 PolarHBondContact O-N 3.1Å
424	L	91.8	Very high	86.4	Confident	2 Å²	2	34.3 Å²	34.3	1%	0.01	21%	0.209	C	C	.	.	H	α-helix	trans	-61.4	-45.4	171.8	-68.7	172.2	0	0	0	111.2	A374 I377 V383 L387 L413 A420 K421 F427 V428	A374-L424 HydrophobicContact CB-CD2 4.04Å; I377-L424 HydrophobicContact CD1-CD2 3.7Å; I377-L424 HydrophobicContact CD1-CG 3.86Å; V383-L424 HydrophobicContact CG1-CD1 4.35Å; L387-L424 HydrophobicContact CD1-CB 4.29Å; L387-L424 HydrophobicContact CD1-CD2 4.25Å; L413-L424 HydrophobicContact CD1-CD1 4.28Å; A420-L424 PolarHBondContact O-N 3.42Å; A420-L424 VanDerWaalsContact O-N 3.08Å; K421-L424 WeakPolarHBondContact O-CB 3.4Å; K421-L424 PolarHBondContact O-N 3.45Å; K421-L424 VanDerWaalsContact O-N 3.1Å; L424-F427 PolarHBondContact O-N 3.38Å; L424-V428 WeakPolarHBondContact O-CG2 3.34Å; L424-V428 PolarHBondContact O-N 3.02Å
425	L	92.4	Very high	86.4	Confident	0 Å²	0	34.6 Å²	34.6	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-57.9	-51	174.7	-66.9	-174.7	0	0	0	111.4	K421 F427 V428 D429 Y437 C477 D479 L519 A521	K421-L425 PolarHBondContact O-N 2.98Å; L425-F427 VanDerWaalsContact C-N 3.26Å; L425-F427 PolarHBondContact O-N 3.45Å; L425-V428 PolarHBondContact O-N 3.37Å; L425-D429 WeakPolarHBondContact O-CB 3.39Å; L425-D429 PolarHBondContact O-N 2.9Å; L425-Y437 HydrophobicContact CB-CD2 4.34Å; L425-Y437 HydrophobicContact CB-CE2 3.92Å; L425-Y437 HydrophobicContact CD1-CE2 4.13Å; L425-C477 HydrophobicContact CB-CB 4.34Å; L425-C477 HydrophobicContact CD2-CB 4.27Å; L425-D479 HydrophobicContact CD1-CB 3.83Å; L425-L519 HydrophobicContact CD2-CB 4.3Å; L425-L519 HydrophobicContact CD2-CD1 4.38Å; L425-L519 HydrophobicContact CD2-CD2 3.41Å; L425-L519 VanDerWaalsContact CD2-CD2 3.41Å; L425-L519 HydrophobicContact CD2-CG 3.37Å; L425-A521 HydrophobicContact CD1-CB 3.7Å; L425-A521 HydrophobicContact CG-CB 4.34Å
426	G	89.7	Confident	86.5	Confident	21 Å²	21	36.8 Å²	36.8	22%	0.216	22%	0.222	C	C	.	.	H	α-helix	trans	-64.8	-27.8	179.6	0	0	0	0	0	113.6	S422 Q423 R430	S422-G426 PolarHBondContact O-N 3.26Å; Q423-G426 PolarHBondContact O-N 3.05Å; G426-R430 WeakPolarHBondContact O-CG 3.5Å; G426-R430 PolarHBondContact O-N 3.32Å; G426-R430 PolarHBondContact O-NE 3.36Å
427	F	90.3	Very high	86.8	Confident	16 Å²	16	40.5 Å²	40.5	7%	0.07	24%	0.236	C	C	.	.	H	α-helix	trans	-73.7	-44.5	173	-169.1	-89.6	0	0	0	111.8	L373 A374 Q423 L424 L425 D429 R430 L431 L602	L373-F427 HydrophobicContact CD1-CD1 4.06Å; L373-F427 HydrophobicContact CD1-CE1 3.78Å; L373-F427 HydrophobicContact CG-CD1 4.2Å; L373-F427 HydrophobicContact CG-CE1 4.08Å; A374-F427 HydrophobicContact CB-CB 4.3Å; A374-F427 HydrophobicContact CB-CD1 4.06Å; A374-F427 HydrophobicContact CB-CD2 4.23Å; A374-F427 HydrophobicContact CB-CE1 4.48Å; A374-F427 HydrophobicContact CB-CG 3.92Å; A374-F427 VanDerWaalsContact N-CZ 3.35Å; Q423-F427 WeakPolarHBondContact O-CB 3.27Å; Q423-F427 PolarHBondContact O-N 3.1Å; L424-F427 PolarHBondContact O-N 3.38Å; L425-F427 VanDerWaalsContact C-N 3.26Å; L425-F427 PolarHBondContact O-N 3.45Å; F427-D429 VanDerWaalsContact C-N 3.32Å; F427-D429 PolarHBondContact O-N 3.46Å; F427-R430 PolarHBondContact O-N 3.48Å; F427-L431 HydrophobicContact CE1-CD2 4.28Å; F427-L431 WeakPolarHBondContact O-CB 3.19Å; F427-L431 PolarHBondContact O-N 2.74Å; F427-L602 HydrophobicContact CE1-CD2 4.37Å; F427-L602 HydrophobicContact CE2-CD2 4.09Å; F427-L602 HydrophobicContact CZ-CD2 3.65Å
428	V	91.4	Very high	87.1	Confident	1 Å²	1	36.9 Å²	36.9	1%	0.006	21%	0.212	C	C	.	.	H	α-helix	trans	-64	-39.2	176.4	172.7	0	0	0	0	111.3	L387 L391 L424 L425 L431 S432 V475 L519	L387-V428 HydrophobicContact CB-CG2 4.46Å; L387-V428 HydrophobicContact CD1-CG2 4.08Å; L387-V428 HydrophobicContact CD2-CG2 4.38Å; L391-V428 HydrophobicContact CD2-CG1 4.08Å; L391-V428 HydrophobicContact CG-CG1 4.44Å; L424-V428 WeakPolarHBondContact O-CG2 3.34Å; L424-V428 PolarHBondContact O-N 3.02Å; L425-V428 PolarHBondContact O-N 3.37Å; V428-L431 PolarHBondContact O-N 3.15Å; V428-S432 PolarHBondContact O-N 2.68Å; V428-V475 HydrophobicContact CG1-CG1 4.1Å; V428-L519 HydrophobicContact CB-CD2 4.07Å; V428-L519 HydrophobicContact CG1-CD2 3.94Å; V428-L519 HydrophobicContact CG2-CD2 4.1Å
429	D	89.8	Confident	87.6	Confident	39 Å²	39	35.7 Å²	35.7	21%	0.209	19%	0.19	C	C	.	.	H	α-helix	trans	-57.5	-48.4	174.1	-173	58.2	0	0	0	110.8	L425 F427 L431 S435	L425-D429 WeakPolarHBondContact O-CB 3.39Å; L425-D429 PolarHBondContact O-N 2.9Å; F427-D429 VanDerWaalsContact C-N 3.32Å; F427-D429 PolarHBondContact O-N 3.46Å; D429-L431 PolarHBondContact O-N 3.22Å; D429-S435 WeakPolarHBondContact O-CB 3.18Å; D429-S435 PolarHBondContact O-OG 2.9Å; D429-S435 WeakPolarHBondContact OD1-CB 3.37Å; D429-S435 PolarHBondContact OD1-OG 2.82Å; D429-S435 VanDerWaalsContact OD1-OG 3.12Å
430	R	86.2	Confident	87.5	Confident	120 Å²	120	35.1 Å²	35.1	45%	0.453	19%	0.187	S	C	.	.	H	α-helix	trans	-65.6	-37.5	174.1	-71.6	-177.6	-68.3	173.1	0.3	112.4	G426 F427 R606	G426-R430 WeakPolarHBondContact O-CG 3.5Å; G426-R430 PolarHBondContact O-N 3.32Å; G426-R430 PolarHBondContact O-NE 3.36Å; F427-R430 PolarHBondContact O-N 3.48Å; R430-R606 PolarHBondContact O-NE 3.14Å; R430-R606 PolarHBondContact O-NH2 3.1Å
431	L	87	Confident	87.4	Confident	3 Å²	3	42.3 Å²	42.3	2%	0.016	21%	0.207	C	C	.	.	H	α-helix	trans	-72	-38.9	-175.1	-176.6	58.3	0	0	0	112	L373 L391 F427 V428 D429 L602 L605 R606 I609	L373-L431 HydrophobicContact CD1-CD2 3.34Å; L391-L431 HydrophobicContact CD1-CD2 3.43Å; L391-L431 VanDerWaalsContact CD1-CD2 3.43Å; L391-L431 HydrophobicContact CD1-CG 4.1Å; F427-L431 HydrophobicContact CE1-CD2 4.28Å; F427-L431 WeakPolarHBondContact O-CB 3.19Å; F427-L431 PolarHBondContact O-N 2.74Å; V428-L431 PolarHBondContact O-N 3.15Å; D429-L431 PolarHBondContact O-N 3.22Å; L431-L602 HydrophobicContact CD1-CD2 4.08Å; L431-L605 HydrophobicContact CD1-CB 4.28Å; L431-L605 HydrophobicContact CD1-CD2 3.81Å; L431-L605 HydrophobicContact CD1-CG 4.06Å; L431-L605 HydrophobicContact CD2-CD2 3.56Å; L431-L605 HydrophobicContact CD2-CG 4.24Å; L431-L605 HydrophobicContact CG-CD2 4.38Å; L431-R606 HydrophobicContact CD1-CG 3.63Å; L431-R606 WeakPolarHBondContact O-CD 3.28Å; L431-R606 VanDerWaalsContact O-CG 3.28Å; L431-R606 WeakPolarHBondContact O-CG 3.37Å; L431-R606 PolarHBondContact O-NE 3.49Å; L431-I609 HydrophobicContact CD2-CD1 4.1Å; L431-I609 HydrophobicContact CG-CD1 4.35Å
432	S	83.6	Confident	87	Confident	2 Å²	2	44.7 Å²	44.7	1%	0.014	24%	0.235	C	C	.	.	S	Bend	trans	-72.9	134.2	179.8	-177.4	0	0	0	0	111.7	V428 R434 S435	V428-S432 PolarHBondContact O-N 2.68Å; S432-R434 PolarHBondContact O-N 2.66Å; S432-R434 PolarHBondContact OG-N 3.14Å; S432-R434 PolarHBondContact OG-O 3.39Å; S432-S435 PolarHBondContact O-OG 3.41Å
433	P	74.9	Confident	86.4	Confident	77 Å²	77	43.3 Å²	43.3	50%	0.5	23%	0.225	S	C	.	.	S	Bend	trans	-70.5	-17.4	176.8	29.5	-36.6	0	0	0	113.5
434	R	80.4	Confident	86	Confident	21 Å²	21	41.1 Å²	41.1	8%	0.079	22%	0.223	C	C	.	.	S	Bend	trans	-132.7	108.4	174.3	-66.9	-171.3	67.2	174.1	0.2	107.3	G288 H290 S432 L470 D472 G474 V475	G288-R434 PolarHBondContact O-NH2 3.32Å; H290-R434 VanDerWaalsContact CD2-CZ 3.47Å; H290-R434 PolarHBondContact CD2-NE 3.06Å; H290-R434 WeakPolarHBondContact NE2-CG 3.39Å; H290-R434 PolarHBondContact NE2-NE 3.44Å; S432-R434 PolarHBondContact O-N 2.66Å; S432-R434 PolarHBondContact OG-N 3.14Å; S432-R434 PolarHBondContact OG-O 3.39Å; R434-L470 PolarHBondContact NH2-O 3.14Å; R434-D472 PolarHBondContact NE-O 3.36Å; R434-D472 PolarHBondContact NH1-O 3.04Å; R434-D472 VanDerWaalsContact NH1-O 3.14Å; R434-D472 PolarHBondContact NH2-O 2.74Å; R434-G474 CarbonylContact O-C 3.57Å; R434-G474 WeakPolarHBondContact O-CA 3.11Å; R434-V475 PolarHBondContact O-N 3.31Å
435	S	87	Confident	85.4	Confident	17 Å²	17	41.2 Å²	41.2	12%	0.119	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.3	153.9	-178.8	47.4	0	0	0	0	110.4	D429 S432 V475	D429-S435 WeakPolarHBondContact O-CB 3.18Å; D429-S435 PolarHBondContact O-OG 2.9Å; D429-S435 WeakPolarHBondContact OD1-CB 3.37Å; D429-S435 PolarHBondContact OD1-OG 2.82Å; D429-S435 VanDerWaalsContact OD1-OG 3.12Å; S432-S435 PolarHBondContact O-OG 3.41Å; S435-V475 WeakPolarHBondContact CA-O 3.22Å; S435-V475 WeakPolarHBondContact CB-O 3.28Å
436	Q	87.9	Confident	84.9	Confident	46 Å²	46	44 Å²	44	22%	0.215	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	127.7	171.8	-68.6	-64.9	1.3	0	0	108	L470 A471 V475 C477	Q436-L470 HydrophobicContact CG-CB 4.25Å; Q436-A471 HydrophobicContact CB-CB 4.24Å; Q436-A471 HydrophobicContact CG-CB 3.98Å; Q436-V475 PolarHBondContact N-O 3.08Å; Q436-C477 PolarHBondContact O-N 2.63Å
437	Y	90.8	Very high	84.6	Confident	91 Å²	91	44.7 Å²	44.7	36%	0.357	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	123.8	172.5	-176.5	-92.5	0	0	0	110	L425 T439 C477 D479	L425-Y437 HydrophobicContact CB-CD2 4.34Å; L425-Y437 HydrophobicContact CB-CE2 3.92Å; L425-Y437 HydrophobicContact CD1-CE2 4.13Å; Y437-T439 HydrophobicContact CE1-CG2 4.11Å; Y437-C477 HydrophobicContact CD2-CB 3.91Å; Y437-D479 HydrophobicContact CE2-CB 4.28Å; Y437-D479 WeakPolarHBondContact OH-CB 3.4Å; Y437-D479 PolarHBondContact OH-OD2 2.99Å
438	T	89.8	Confident	84.3	Confident	12 Å²	12	44 Å²	44	7%	0.074	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	154.9	179.7	58.7	0	0	0	0	110.4	L448 A467 C477 I478 D479	T438-L448 HydrophobicContact CG2-CD2 4.4Å; T438-A467 HydrophobicContact CG2-CB 3.64Å; T438-C477 PolarHBondContact N-O 3.31Å; T438-C477 PolarHBondContact OG1-O 3.47Å; T438-C477 VanDerWaalsContact OG1-O 3.13Å; T438-I478 WeakPolarHBondContact O-CA 3.18Å; T438-D479 PolarHBondContact O-N 3.49Å
439	T	90.6	Very high	83.9	Confident	49 Å²	49	44.8 Å²	44.8	30%	0.301	25%	0.25	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	146.6	173	65.3	0	0	0	0	109.1	Y437 R441 G442 S443 D479	Y437-T439 HydrophobicContact CE1-CG2 4.11Å; T439-R441 PolarHBondContact O-N 3.34Å; T439-R441 VanDerWaalsContact O-N 3.16Å; T439-G442 PolarHBondContact O-N 3.28Å; T439-G442 VanDerWaalsContact OG1-CA 3.31Å; T439-G442 WeakPolarHBondContact OG1-CA 3.41Å; T439-G442 PolarHBondContact OG1-N 3.33Å; T439-S443 PolarHBondContact O-N 3.4Å; T439-S443 VanDerWaalsContact O-N 3.16Å; T439-D479 CarbonylContact C-O 3.6Å; T439-D479 WeakPolarHBondContact CA-O 3.42Å; T439-D479 HydrophobicContact CG2-CB 4.48Å
440	G	82	Confident	83.6	Confident	4 Å²	4	43 Å²	43	4%	0.041	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-26.5	-175.7	0	0	0	0	0	114.3	D479 M484	G440-D479 PolarHBondContact N-O 3.45Å; G440-M484 WeakPolarHBondContact O-CG 3.24Å
441	R	84.1	Confident	83.5	Confident	185 Å²	185	38.4 Å²	38.4	70%	0.698	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	-92	-25.7	172.4	-71.5	-171.6	172.7	-176.3	2.9	114.1	T439 K483	T439-R441 PolarHBondContact O-N 3.34Å; T439-R441 VanDerWaalsContact O-N 3.16Å; R441-K483 HydrophobicContact CG-CB 3.8Å; R441-K483 HydrophobicContact CG-CD 4.44Å
442	G	80.5	Confident	83.4	Confident	62 Å²	62	40 Å²	40	64%	0.639	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.5	-22	-176.4	0	0	0	0	0	113.7	T439	T439-G442 PolarHBondContact O-N 3.28Å; T439-G442 VanDerWaalsContact OG1-CA 3.31Å; T439-G442 WeakPolarHBondContact OG1-CA 3.41Å; T439-G442 PolarHBondContact OG1-N 3.33Å
443	S	75.5	Confident	83.4	Confident	24 Å²	24	42.3 Å²	42.3	17%	0.168	25%	0.248	C	C	.	.			trans	-114.5	116.6	-178.9	-61.5	0	0	0	0	110.8	T439	T439-S443 PolarHBondContact O-N 3.4Å; T439-S443 VanDerWaalsContact O-N 3.16Å
444	S	80.5	Confident	83.8	Confident	72 Å²	72	45.2 Å²	45.2	50%	0.503	25%	0.253	S	S	.	.			trans	-72.8	159.6	165.3	65.4	0	0	0	0	110.3	V446 G447 L448	S444-V446 PolarHBondContact O-N 3.29Å; S444-V446 VanDerWaalsContact O-N 3.08Å; S444-G447 CarbonylContact O-C 3.57Å; S444-G447 WeakPolarHBondContact O-CA 3.4Å; S444-G447 PolarHBondContact O-N 2.93Å; S444-G447 PolarHBondContact OG-N 2.84Å; S444-L448 PolarHBondContact O-N 3.48Å
445	G	79.5	Confident	83.6	Confident	3 Å²	3	44.8 Å²	44.8	3%	0.031	25%	0.252	C	S	.	.	H	α-helix	trans	-57.5	-27.8	179.4	0	0	0	0	0	113.5	T449 D488	G445-T449 WeakPolarHBondContact O-CB 3.3Å; G445-T449 WeakPolarHBondContact O-CG2 3.36Å; G445-T449 PolarHBondContact O-N 3.42Å; G445-T449 PolarHBondContact O-OG1 2.98Å; G445-D488 WeakPolarHBondContact CA-OD1 3.37Å; G445-D488 VanDerWaalsContact N-CG 3.26Å; G445-D488 PolarHBondContact N-OD1 3.16Å
446	V	82	Confident	82.9	Confident	59 Å²	59	49.7 Å²	49.7	36%	0.358	28%	0.283	S	S	.	.	H	α-helix	trans	-70.3	-38.6	172.1	-177.3	0	0	0	0	111.5	S444 A450 S451	S444-V446 PolarHBondContact O-N 3.29Å; S444-V446 VanDerWaalsContact O-N 3.08Å; V446-A450 CarbonylContact O-C 3.53Å; V446-A450 PolarHBondContact O-N 3.31Å; V446-S451 VanDerWaalsContact CG1-CB 3.5Å
447	G	82.8	Confident	81.9	Confident	35 Å²	35	53 Å²	53	36%	0.361	30%	0.302	S	S	.	.	H	α-helix	trans	-73.1	-26.4	174.5	0	0	0	0	0	113.7	S444 G466 A467	S444-G447 CarbonylContact O-C 3.57Å; S444-G447 WeakPolarHBondContact O-CA 3.4Å; S444-G447 PolarHBondContact O-N 2.93Å; S444-G447 PolarHBondContact OG-N 2.84Å; G447-G466 CarbonylContact O-C 3.39Å; G447-G466 WeakPolarHBondContact O-CA 3.48Å; G447-A467 PolarHBondContact O-N 2.71Å
448	L	83.7	Confident	81	Confident	2 Å²	2	51.2 Å²	51.2	1%	0.01	30%	0.3	C	S	.	.	H	α-helix	trans	-77	-42.2	172.8	-69.4	175.3	0	0	0	112.2	T438 S444 A467 L468 D488 I492	T438-L448 HydrophobicContact CG2-CD2 4.4Å; S444-L448 PolarHBondContact O-N 3.48Å; L448-A467 HydrophobicContact CD2-CB 4.39Å; L448-A467 PolarHBondContact O-N 3.4Å; L448-L468 HydrophobicContact CB-CD1 4.28Å; L448-L468 VanDerWaalsContact O-CB 3.27Å; L448-L468 WeakPolarHBondContact O-CB 3.23Å; L448-L468 WeakPolarHBondContact O-CG 3.27Å; L448-L468 PolarHBondContact O-N 3.49Å; L448-D488 HydrophobicContact CD1-CB 4.44Å; L448-I492 HydrophobicContact CD1-CD1 4.32Å
449	T	83.6	Confident	80.3	Confident	18 Å²	18	52.2 Å²	52.2	11%	0.11	31%	0.313	C	S	.	.	S	Bend	trans	-88.6	-93.2	-174.1	53.8	0	0	0	0	112.6	G445 G466 V469 A491 I501	G445-T449 WeakPolarHBondContact O-CB 3.3Å; G445-T449 WeakPolarHBondContact O-CG2 3.36Å; G445-T449 PolarHBondContact O-N 3.42Å; G445-T449 PolarHBondContact O-OG1 2.98Å; T449-G466 WeakPolarHBondContact O-CA 3.42Å; T449-G466 PolarHBondContact O-N 2.61Å; T449-V469 VanDerWaalsContact O-CG2 3.22Å; T449-V469 WeakPolarHBondContact O-CG2 3.3Å; T449-A491 HydrophobicContact CG2-CB 3.55Å; T449-I501 HydrophobicContact CG2-CG2 4.08Å
450	A	83.5	Confident	79.9	Confident	1 Å²	1	53.5 Å²	53.5	1%	0.008	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-163.3	153.7	171.6	0	0	0	0	0	109.2	V446 E464 I503 L512	V446-A450 CarbonylContact O-C 3.53Å; V446-A450 PolarHBondContact O-N 3.31Å; A450-E464 CarbonylContact C-O 3.39Å; A450-E464 WeakPolarHBondContact CA-O 3.35Å; A450-E464 WeakPolarHBondContact CB-O 3.23Å; A450-I503 HydrophobicContact CB-CD1 3.32Å; A450-L512 HydrophobicContact CB-CD1 3.72Å
451	S	83.5	Confident	79.9	Confident	23 Å²	23	57.7 Å²	57.7	16%	0.161	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	149.3	178	87.9	0	0	0	0	110.6	V446 E464	V446-S451 VanDerWaalsContact CG1-CB 3.5Å; S451-E464 PolarHBondContact N-O 3.25Å; S451-E464 PolarHBondContact O-N 3.25Å
452	V	85.3	Confident	79.9	Confident	36 Å²	36	49.5 Å²	49.5	22%	0.218	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	119.3	169.9	179.9	0	0	0	0	107.1	M461 T462 L463 I503 K505 A506 I508	V452-M461 HydrophobicContact CG1-CB 3.88Å; V452-M461 HydrophobicContact CG1-CG 4.46Å; V452-M461 HydrophobicContact CG1-SD 4.43Å; V452-T462 WeakPolarHBondContact CA-O 3.3Å; V452-L463 HydrophobicContact CG2-CD2 3.83Å; V452-I503 HydrophobicContact CG2-CG2 4.14Å; V452-K505 HydrophobicContact CG2-CB 4.04Å; V452-A506 HydrophobicContact CG1-CB 3.96Å; V452-I508 HydrophobicContact CG1-CD1 3.75Å; V452-I508 HydrophobicContact CG2-CD1 4.3Å
453	M	84.1	Confident	79.9	Confident	51 Å²	51	48 Å²	48	25%	0.251	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	143	176.9	-73.2	179.3	-65.8	0	0	111.1	D455 T462 E464	M453-D455 PolarHBondContact O-N 2.86Å; M453-T462 PolarHBondContact N-O 3.42Å; M453-T462 PolarHBondContact O-N 3.45Å; M453-T462 PolarHBondContact O-OG1 2.78Å; M453-E464 HydrophobicContact CE-CB 3.41Å; M453-E464 VanDerWaalsContact CE-CB 3.41Å; M453-E464 HydrophobicContact CE-CG 4Å; M453-E464 WeakPolarHBondContact CE-OE2 3.44Å
454	K	82.8	Confident	80.2	Confident	138 Å²	138	49.3 Å²	49.3	60%	0.6	29%	0.287	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.8	122.2	171	-163.9	174	-176.4	179	0	109.4	G459 E460 M461	K454-G459 VanDerWaalsContact CE-CA 3.48Å; K454-G459 WeakPolarHBondContact CE-O 3.47Å; K454-G459 WeakPolarHBondContact CG-O 3.45Å; K454-E460 CarbonylContact C-O 3.52Å; K454-E460 WeakPolarHBondContact CA-O 3.42Å; K454-M461 HydrophobicContact CB-SD 3.8Å; K454-M461 HydrophobicContact CG-SD 4.08Å
455	D	75.4	Confident	80.2	Confident	13 Å²	13	46.5 Å²	46.5	7%	0.07	27%	0.269	C	S	.	.			trans	-65.8	125.5	172.8	173.5	37.1	0	0	0	109.4	M453 L457 T458 G459 E460 T462	M453-D455 PolarHBondContact O-N 2.86Å; D455-L457 PolarHBondContact O-N 2.83Å; D455-T458 WeakPolarHBondContact CB-OG1 3.32Å; D455-T458 WeakPolarHBondContact OD2-CB 3.16Å; D455-T458 VanDerWaalsContact OD2-CG2 3.28Å; D455-T458 WeakPolarHBondContact OD2-CG2 3.28Å; D455-T458 PolarHBondContact OD2-N 3Å; D455-T458 PolarHBondContact OD2-OG1 3.06Å; D455-G459 VanDerWaalsContact O-CA 3.25Å; D455-G459 WeakPolarHBondContact O-CA 3.21Å; D455-G459 PolarHBondContact O-N 3.07Å; D455-E460 PolarHBondContact N-O 3.35Å; D455-T462 HydrophobicContact CB-CG2 4.13Å
456	P	73.6	Confident	80.5	Confident	119 Å²	119	46.7 Å²	46.7	77%	0.773	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.2	-25.4	-176.6	23.6	-36.2	0	0	0	114
457	L	67.2	Low	80.7	Confident	115 Å²	115	44.5 Å²	44.5	60%	0.602	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.1	-48.6	-177.1	-163.9	86.2	0	0	0	111.7	D455	D455-L457 PolarHBondContact O-N 2.83Å
458	T	71.5	Confident	81	Confident	54 Å²	54	42.8 Å²	42.8	33%	0.331	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.7	-21.9	-171.7	61.7	0	0	0	0	112.5	D455 E460	D455-T458 WeakPolarHBondContact CB-OG1 3.32Å; D455-T458 WeakPolarHBondContact OD2-CB 3.16Å; D455-T458 VanDerWaalsContact OD2-CG2 3.28Å; D455-T458 WeakPolarHBondContact OD2-CG2 3.28Å; D455-T458 PolarHBondContact OD2-N 3Å; D455-T458 PolarHBondContact OD2-OG1 3.06Å; T458-E460 PolarHBondContact O-N 3.45Å; T458-E460 PolarHBondContact OG1-N 3.22Å
459	G	75	Confident	81.1	Confident	33 Å²	33	42.9 Å²	42.9	34%	0.34	24%	0.242	S	C	.	.			trans	71	6.5	-171.5	0	0	0	0	0	113.8	K454 D455	K454-G459 VanDerWaalsContact CE-CA 3.48Å; K454-G459 WeakPolarHBondContact CE-O 3.47Å; K454-G459 WeakPolarHBondContact CG-O 3.45Å; D455-G459 VanDerWaalsContact O-CA 3.25Å; D455-G459 WeakPolarHBondContact O-CA 3.21Å; D455-G459 PolarHBondContact O-N 3.07Å
460	E	81	Confident	81.2	Confident	76 Å²	76	43.3 Å²	43.3	36%	0.355	24%	0.244	S	C	.	.			trans	-77	147.6	176	-71.6	164.5	-158.7	0	0	110.5	K192 K454 D455 T458 T462	K192-E460 VanDerWaalsContact CE-OE2 3.24Å; K192-E460 WeakPolarHBondContact CE-OE2 3.49Å; K192-E460 IonicContact NZ-OE1 2.92Å; K192-E460 PolarHBondContact NZ-OE1 3.01Å; K192-E460 IonicContact NZ-OE2 2.91Å; K192-E460 PolarHBondContact NZ-OE2 2.64Å; K454-E460 CarbonylContact C-O 3.52Å; K454-E460 WeakPolarHBondContact CA-O 3.42Å; D455-E460 PolarHBondContact N-O 3.35Å; T458-E460 PolarHBondContact O-N 3.45Å; T458-E460 PolarHBondContact OG1-N 3.22Å; E460-T462 PolarHBondContact O-N 3.05Å
461	M	83.4	Confident	81.3	Confident	92 Å²	92	43.3 Å²	43.3	45%	0.453	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	121	173.9	-62.2	-59.8	-148.8	0	0	108.3	V452 K454 A506 I508	V452-M461 HydrophobicContact CG1-CB 3.88Å; V452-M461 HydrophobicContact CG1-CG 4.46Å; V452-M461 HydrophobicContact CG1-SD 4.43Å; K454-M461 HydrophobicContact CB-SD 3.8Å; K454-M461 HydrophobicContact CG-SD 4.08Å; M461-A506 HydrophobicContact CE-CB 3.93Å; M461-I508 HydrophobicContact CB-CD1 3.8Å; M461-I508 HydrophobicContact CB-CG1 4.33Å
462	T	82.5	Confident	81.4	Confident	14 Å²	14	42.7 Å²	42.7	9%	0.086	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	149.8	179.3	58.3	0	0	0	0	110	V452 M453 D455 E460	V452-T462 WeakPolarHBondContact CA-O 3.3Å; M453-T462 PolarHBondContact N-O 3.42Å; M453-T462 PolarHBondContact O-N 3.45Å; M453-T462 PolarHBondContact O-OG1 2.78Å; D455-T462 HydrophobicContact CB-CG2 4.13Å; E460-T462 PolarHBondContact O-N 3.05Å
463	L	82.1	Confident	81.3	Confident	30 Å²	30	44.5 Å²	44.5	16%	0.157	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	136.5	175.8	-70.8	159.7	0	0	0	109.9	V452 I503 I508 T510	V452-L463 HydrophobicContact CG2-CD2 3.83Å; L463-I503 HydrophobicContact CD2-CD1 3.92Å; L463-I503 HydrophobicContact CD2-CG2 4.25Å; L463-I508 HydrophobicContact CD1-CG2 3.93Å; L463-I508 HydrophobicContact CD2-CD1 4.42Å; L463-I508 HydrophobicContact CD2-CG2 4.23Å; L463-I508 HydrophobicContact CG-CD1 4.14Å; L463-I508 HydrophobicContact CG-CG2 4.22Å; L463-T510 HydrophobicContact CD1-CG2 4.29Å; L463-T510 WeakPolarHBondContact CD1-OG1 3.23Å
464	E	82.1	Confident	81.4	Confident	52 Å²	52	42.2 Å²	42.2	24%	0.243	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	125.9	167.5	178.3	174.7	-114.7	0	0	109.5	R187 A450 S451 M453	R187-E464 HydrophobicContact CG-CB 4.21Å; R187-E464 HydrophobicContact CG-CG 4.33Å; R187-E464 IonicContact CZ-OE1 2.89Å; R187-E464 IonicContact NE-OE1 2.97Å; R187-E464 PolarHBondContact NE-OE1 2.69Å; R187-E464 IonicContact NH2-OE1 2.8Å; R187-E464 PolarHBondContact NH2-OE1 3.39Å; R187-E464 IonicContact NH2-OE2 3.71Å; A450-E464 CarbonylContact C-O 3.39Å; A450-E464 WeakPolarHBondContact CA-O 3.35Å; A450-E464 WeakPolarHBondContact CB-O 3.23Å; S451-E464 PolarHBondContact N-O 3.25Å; S451-E464 PolarHBondContact O-N 3.25Å; M453-E464 HydrophobicContact CE-CB 3.41Å; M453-E464 VanDerWaalsContact CE-CB 3.41Å; M453-E464 HydrophobicContact CE-CG 4Å; M453-E464 WeakPolarHBondContact CE-OE2 3.44Å
465	G	79.2	Confident	81.9	Confident	12 Å²	12	35.9 Å²	35.9	12%	0.124	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.7	135.2	178.8	0	0	0	0	0	112.6
466	G	86.2	Confident	82.7	Confident	7 Å²	7	35.2 Å²	35.2	7%	0.072	20%	0.204	C	C	.	.			trans	-84.1	-174.9	168.8	0	0	0	0	0	112.5	G447 T449 L468 V469 L470	G447-G466 CarbonylContact O-C 3.39Å; G447-G466 WeakPolarHBondContact O-CA 3.48Å; T449-G466 WeakPolarHBondContact O-CA 3.42Å; T449-G466 PolarHBondContact O-N 2.61Å; G466-L468 VanDerWaalsContact C-N 3.28Å; G466-L468 PolarHBondContact O-N 2.98Å; G466-V469 PolarHBondContact O-N 2.88Å; G466-L470 WeakPolarHBondContact O-CG 3.46Å; G466-L470 PolarHBondContact O-N 3.29Å
467	A	86.5	Confident	83.6	Confident	13 Å²	13	29.6 Å²	29.6	11%	0.107	17%	0.167	C	C	.	.	H	α-helix	trans	-56.2	-38.5	-175.9	0	0	0	0	0	113.5	T438 G447 L448 A471	T438-A467 HydrophobicContact CG2-CB 3.64Å; G447-A467 PolarHBondContact O-N 2.71Å; L448-A467 HydrophobicContact CD2-CB 4.39Å; L448-A467 PolarHBondContact O-N 3.4Å; A467-A471 VanDerWaalsContact O-CB 3.28Å; A467-A471 WeakPolarHBondContact O-CB 3.26Å; A467-A471 PolarHBondContact O-N 3.34Å
468	L	88.2	Confident	84.8	Confident	0 Å²	0	24.1 Å²	24.1	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-71	-34.4	178.8	-64.2	170.7	0	0	0	112.2	L448 G466 A471 C476 V495 I501 V516	L448-L468 HydrophobicContact CB-CD1 4.28Å; L448-L468 VanDerWaalsContact O-CB 3.27Å; L448-L468 WeakPolarHBondContact O-CB 3.23Å; L448-L468 WeakPolarHBondContact O-CG 3.27Å; L448-L468 PolarHBondContact O-N 3.49Å; G466-L468 VanDerWaalsContact C-N 3.28Å; G466-L468 PolarHBondContact O-N 2.98Å; L468-A471 PolarHBondContact O-N 3.13Å; L468-C476 HydrophobicContact CD2-CB 3.82Å; L468-V495 HydrophobicContact CD1-CG1 4.5Å; L468-V495 HydrophobicContact CD1-CG2 3.99Å; L468-I501 HydrophobicContact CB-CD1 4.09Å; L468-V516 WeakPolarHBondContact O-CG2 3.26Å
469	V	87.2	Confident	85.8	Confident	4 Å²	4	22.2 Å²	22.2	2%	0.024	13%	0.126	C	C	.	.	H	α-helix	trans	-71.5	-41.1	177.2	177.8	0	0	0	0	110.4	T449 G466 A471 D472 I501 L512	T449-V469 VanDerWaalsContact O-CG2 3.22Å; T449-V469 WeakPolarHBondContact O-CG2 3.3Å; G466-V469 PolarHBondContact O-N 2.88Å; V469-A471 PolarHBondContact O-N 3Å; V469-D472 PolarHBondContact O-N 3.41Å; V469-I501 HydrophobicContact CG2-CD1 3.74Å; V469-L512 HydrophobicContact CG1-CD1 4.44Å; V469-L512 HydrophobicContact CG2-CB 4.33Å; V469-L512 HydrophobicContact CG2-CD1 3.92Å
470	L	84.1	Confident	86.5	Confident	27 Å²	27	23.3 Å²	23.3	14%	0.141	12%	0.122	C	C	.	.	H	α-helix	trans	-64.1	-32.6	176.1	-63.4	172.1	0	0	0	111.9	V184 R434 Q436 G466 D472	V184-L470 HydrophobicContact CG1-CD2 3.81Å; R434-L470 PolarHBondContact NH2-O 3.14Å; Q436-L470 HydrophobicContact CG-CB 4.25Å; G466-L470 WeakPolarHBondContact O-CG 3.46Å; G466-L470 PolarHBondContact O-N 3.29Å; L470-D472 VanDerWaalsContact C-N 3.31Å; L470-D472 PolarHBondContact O-N 3.27Å
471	A	86.1	Confident	86.8	Confident	0 Å²	0	19.7 Å²	19.7	0%	0	11%	0.105	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.1	12.8	178.6	0	0	0	0	0	114.8	Q436 A467 L468 V469 Q473 G474 C476 V516	Q436-A471 HydrophobicContact CB-CB 4.24Å; Q436-A471 HydrophobicContact CG-CB 3.98Å; A467-A471 VanDerWaalsContact O-CB 3.28Å; A467-A471 WeakPolarHBondContact O-CB 3.26Å; A467-A471 PolarHBondContact O-N 3.34Å; L468-A471 PolarHBondContact O-N 3.13Å; V469-A471 PolarHBondContact O-N 3Å; A471-Q473 PolarHBondContact O-N 2.9Å; A471-G474 VanDerWaalsContact O-CA 3.3Å; A471-G474 WeakPolarHBondContact O-CA 3.4Å; A471-G474 PolarHBondContact O-N 2.96Å; A471-C476 HydrophobicContact CB-CB 4.25Å; A471-V516 HydrophobicContact CB-CG1 3.91Å; A471-V516 HydrophobicContact CB-CG2 4.2Å; A471-V516 WeakPolarHBondContact O-CG2 3.31Å
472	D	86	Confident	87	Confident	10 Å²	10	16.8 Å²	16.8	5%	0.053	9%	0.092	C	C	.	.	T	Hydrogen-bonded Turn	trans	-50.9	140.1	179.1	-172.3	35.3	0	0	0	112	R434 V469 L470 G474 R515	R434-D472 PolarHBondContact NE-O 3.36Å; R434-D472 PolarHBondContact NH1-O 3.04Å; R434-D472 VanDerWaalsContact NH1-O 3.14Å; R434-D472 PolarHBondContact NH2-O 2.74Å; V469-D472 PolarHBondContact O-N 3.41Å; L470-D472 VanDerWaalsContact C-N 3.31Å; L470-D472 PolarHBondContact O-N 3.27Å; D472-G474 PolarHBondContact O-N 2.91Å; D472-R515 WeakPolarHBondContact OD1-CA 2.98Å; D472-R515 WeakPolarHBondContact OD1-CB 3.45Å; D472-R515 PolarHBondContact OD1-N 3.16Å; D472-R515 IonicContact OD1-NE 2.98Å; D472-R515 PolarHBondContact OD1-NE 3.01Å; D472-R515 IonicContact OD2-CZ 2.99Å; D472-R515 IonicContact OD2-NE 3.57Å; D472-R515 PolarHBondContact OD2-NE 2.96Å; D472-R515 IonicContact OD2-NH2 3.07Å; D472-R515 PolarHBondContact OD2-NH2 3.49Å
473	Q	82.5	Confident	87.1	Confident	74 Å²	74	19.7 Å²	19.7	35%	0.346	10%	0.103	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.9	14.7	-172.8	-56.6	-176.6	-26.8	0	0	115.6	K342 A471 R515	K342-Q473 PolarHBondContact NZ-O 3.43Å; A471-Q473 PolarHBondContact O-N 2.9Å; Q473-R515 VanDerWaalsContact CA-O 3.23Å; Q473-R515 WeakPolarHBondContact CA-O 3.39Å; Q473-R515 PolarHBondContact N-O 3.48Å; Q473-R515 VanDerWaalsContact NE2-CZ 3.26Å; Q473-R515 VanDerWaalsContact NE2-NH2 3.19Å
474	G	87.6	Confident	87.2	Confident	4 Å²	4	18.5 Å²	18.5	4%	0.041	10%	0.097	C	C	.	.	S	Bend	trans	-119.2	-157.1	-177.8	0	0	0	0	0	112.7	R434 A471 D472 A517	R434-G474 CarbonylContact O-C 3.57Å; R434-G474 WeakPolarHBondContact O-CA 3.11Å; A471-G474 VanDerWaalsContact O-CA 3.3Å; A471-G474 WeakPolarHBondContact O-CA 3.4Å; A471-G474 PolarHBondContact O-N 2.96Å; D472-G474 PolarHBondContact O-N 2.91Å; G474-A517 PolarHBondContact O-N 3.05Å
475	V	91.6	Very high	87.4	Confident	4 Å²	4	19.7 Å²	19.7	2%	0.024	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	125.5	176.7	-177.9	0	0	0	0	109.5	L390 L391 V428 R434 S435 Q436 A517 L519	L390-V475 HydrophobicContact CD2-CB 4.42Å; L390-V475 HydrophobicContact CD2-CG1 3.82Å; L390-V475 HydrophobicContact CD2-CG2 3.65Å; L391-V475 HydrophobicContact CD2-CG2 4.15Å; V428-V475 HydrophobicContact CG1-CG1 4.1Å; R434-V475 PolarHBondContact O-N 3.31Å; S435-V475 WeakPolarHBondContact CA-O 3.22Å; S435-V475 WeakPolarHBondContact CB-O 3.28Å; Q436-V475 PolarHBondContact N-O 3.08Å; V475-A517 CarbonylContact C-O 3.59Å; V475-A517 WeakPolarHBondContact CA-O 3.38Å; V475-A517 HydrophobicContact CG2-CB 4.36Å; V475-L519 HydrophobicContact CG1-CB 4.06Å
476	C	92.6	Very high	87.6	Confident	0 Å²	0	26.6 Å²	26.6	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	118.2	169	179.1	0	0	0	0	108.8	L468 A471 V516 A517 L519	L468-C476 HydrophobicContact CD2-CB 3.82Å; A471-C476 HydrophobicContact CB-CB 4.25Å; C476-V516 HydrophobicContact CB-CG1 3.52Å; C476-V516 VanDerWaalsContact N-CG1 3.34Å; C476-A517 PolarHBondContact N-O 3.02Å; C476-L519 PolarHBondContact O-N 2.71Å
477	C	93.8	Very high	87.4	Confident	0 Å²	0	32.8 Å²	32.8	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	122.3	175.5	-60.7	0	0	0	0	108.6	L425 Q436 Y437 T438 L519	L425-C477 HydrophobicContact CB-CB 4.34Å; L425-C477 HydrophobicContact CD2-CB 4.27Å; Q436-C477 PolarHBondContact O-N 2.63Å; Y437-C477 HydrophobicContact CD2-CB 3.91Å; T438-C477 PolarHBondContact N-O 3.31Å; T438-C477 PolarHBondContact OG1-O 3.47Å; T438-C477 VanDerWaalsContact OG1-O 3.13Å; C477-L519 CarbonylContact C-O 3.47Å; C477-L519 WeakPolarHBondContact CA-O 3.15Å
478	I	92.3	Very high	87.3	Confident	1 Å²	1	32.8 Å²	32.8	1%	0.005	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	110.7	178.1	-51.2	176.4	0	0	0	108.5	T438 F481 M484 I492 I518 L519 A520 A521	T438-I478 WeakPolarHBondContact O-CA 3.18Å; I478-F481 HydrophobicContact CB-CD2 4.26Å; I478-F481 HydrophobicContact CD1-CD2 4.39Å; I478-F481 HydrophobicContact CD1-CE2 4.31Å; I478-F481 HydrophobicContact CG2-CD2 3.88Å; I478-M484 HydrophobicContact CG2-SD 3.98Å; I478-I492 HydrophobicContact CD1-CD1 4.08Å; I478-I518 HydrophobicContact CD1-CG2 4.04Å; I478-L519 PolarHBondContact N-O 3.34Å; I478-A520 CarbonylContact O-C 3.57Å; I478-A520 WeakPolarHBondContact O-CA 3.22Å; I478-A521 PolarHBondContact O-N 3.31Å
479	D	91.9	Very high	86.9	Confident	13 Å²	13	33.8 Å²	33.8	7%	0.07	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	156.5	172.3	-152.9	-12.6	0	0	0	111.3	S422 L425 Y437 T438 T439 G440 F481	S422-D479 VanDerWaalsContact CB-OD2 3.26Å; S422-D479 WeakPolarHBondContact CB-OD2 3.48Å; S422-D479 PolarHBondContact OG-OD2 3.5Å; L425-D479 HydrophobicContact CD1-CB 3.83Å; Y437-D479 HydrophobicContact CE2-CB 4.28Å; Y437-D479 WeakPolarHBondContact OH-CB 3.4Å; Y437-D479 PolarHBondContact OH-OD2 2.99Å; T438-D479 PolarHBondContact O-N 3.49Å; T439-D479 CarbonylContact C-O 3.6Å; T439-D479 WeakPolarHBondContact CA-O 3.42Å; T439-D479 HydrophobicContact CG2-CB 4.48Å; G440-D479 PolarHBondContact N-O 3.45Å; D479-F481 VanDerWaalsContact C-N 3.31Å; D479-F481 PolarHBondContact O-N 3.38Å
480	E	89.7	Confident	86.7	Confident	57 Å²	57	37.5 Å²	37.5	27%	0.266	19%	0.187	S	C	.	.	S	Bend	trans	50.4	46.6	-178.7	-50.8	-163.8	142.2	0	0	113.8	D482 K483 A521	E480-D482 PolarHBondContact O-N 2.9Å; E480-K483 HydrophobicContact CB-CB 4.47Å; E480-K483 HydrophobicContact CB-CD 4.21Å; E480-K483 HydrophobicContact CB-CG 4.33Å; E480-K483 PolarHBondContact O-N 3.06Å; E480-K483 IonicContact OE1-NZ 3.61Å; E480-K483 PolarHBondContact OE1-NZ 2.87Å; E480-K483 WeakPolarHBondContact OE2-CD 3.34Å; E480-K483 WeakPolarHBondContact OE2-CE 3.47Å; E480-K483 IonicContact OE2-NZ 3.86Å; E480-K483 PolarHBondContact OE2-NZ 3.48Å; E480-A521 PolarHBondContact N-O 3.28Å
481	F	87.9	Confident	86.7	Confident	0 Å²	0	37 Å²	37	0%	0	19%	0.186	C	C	.	.	G	3₁₀ helix	trans	-59	-29.6	-176.4	-169.8	-92.4	0	0	0	113.1	I478 D479 K483 M484 I492 A520 A521 A522 L541 L545 F549	I478-F481 HydrophobicContact CB-CD2 4.26Å; I478-F481 HydrophobicContact CD1-CD2 4.39Å; I478-F481 HydrophobicContact CD1-CE2 4.31Å; I478-F481 HydrophobicContact CG2-CD2 3.88Å; D479-F481 VanDerWaalsContact C-N 3.31Å; D479-F481 PolarHBondContact O-N 3.38Å; F481-K483 VanDerWaalsContact C-N 3.27Å; F481-K483 PolarHBondContact O-N 3.21Å; F481-M484 HydrophobicContact CD1-CE 4.02Å; F481-M484 HydrophobicContact CD2-CE 3.23Å; F481-M484 HydrophobicContact CD2-SD 4.07Å; F481-M484 HydrophobicContact CE1-CE 3.89Å; F481-M484 HydrophobicContact CE2-CE 3.11Å; F481-M484 HydrophobicContact CE2-SD 4.27Å; F481-M484 HydrophobicContact CG-CE 3.7Å; F481-M484 HydrophobicContact CZ-CE 3.44Å; F481-M484 VanDerWaalsContact CZ-CE 3.44Å; F481-M484 PolarHBondContact O-N 2.78Å; F481-I492 HydrophobicContact CE2-CD1 3.96Å; F481-I492 HydrophobicContact CZ-CD1 4.46Å; F481-A520 HydrophobicContact CB-CB 4.23Å; F481-A520 HydrophobicContact CD2-CB 3.74Å; F481-A520 HydrophobicContact CE2-CB 4.25Å; F481-A520 HydrophobicContact CG-CB 4.01Å; F481-A521 VanDerWaalsContact CB-O 3.32Å; F481-A521 WeakPolarHBondContact CB-O 3.43Å; F481-A521 PolarHBondContact N-O 3.33Å; F481-A522 HydrophobicContact CB-CB 4.26Å; F481-L541 HydrophobicContact CD1-CD1 3.95Å; F481-L541 HydrophobicContact CD1-CD2 3.73Å; F481-L541 HydrophobicContact CE1-CD1 4.2Å; F481-L541 HydrophobicContact CE1-CD2 3.8Å; F481-L545 HydrophobicContact CE1-CD1 3.8Å; F481-L545 HydrophobicContact CE1-CD2 3.57Å; F481-L545 HydrophobicContact CE1-CG 4.37Å; F481-L545 HydrophobicContact CZ-CD1 3.82Å; F481-L545 HydrophobicContact CZ-CD2 3.71Å; F481-L545 HydrophobicContact CZ-CG 4.37Å; F481-F549 HydrophobicContact CE1-CE2 4.45Å; F481-F549 HydrophobicContact CE1-CZ 4.43Å; F481-F549 HydrophobicContact CE2-CZ 4.47Å; F481-F549 HydrophobicContact CZ-CZ 4.16Å
482	D	86.4	Confident	86.7	Confident	31 Å²	31	37 Å²	37	17%	0.166	19%	0.186	C	C	.	.	G	3₁₀ helix	trans	-62.3	-31.7	175	57.5	-65.1	0	0	0	112.7	E480 M484 R489 N523	E480-D482 PolarHBondContact O-N 2.9Å; D482-M484 VanDerWaalsContact C-N 3.31Å; D482-M484 PolarHBondContact O-N 2.85Å; D482-R489 PolarHBondContact O-NH2 2.9Å; D482-N523 PolarHBondContact OD1-N 3.1Å
483	K	84.8	Confident	86.8	Confident	74 Å²	74	38.5 Å²	38.5	32%	0.322	19%	0.193	S	C	.	.	G	3₁₀ helix	trans	-85.9	0.7	-176.3	-57.1	-172.2	-162.2	163.4	0	114.2	R441 E480 F481	R441-K483 HydrophobicContact CG-CB 3.8Å; R441-K483 HydrophobicContact CG-CD 4.44Å; E480-K483 HydrophobicContact CB-CB 4.47Å; E480-K483 HydrophobicContact CB-CD 4.21Å; E480-K483 HydrophobicContact CB-CG 4.33Å; E480-K483 PolarHBondContact O-N 3.06Å; E480-K483 IonicContact OE1-NZ 3.61Å; E480-K483 PolarHBondContact OE1-NZ 2.87Å; E480-K483 WeakPolarHBondContact OE2-CD 3.34Å; E480-K483 WeakPolarHBondContact OE2-CE 3.47Å; E480-K483 IonicContact OE2-NZ 3.86Å; E480-K483 PolarHBondContact OE2-NZ 3.48Å; F481-K483 VanDerWaalsContact C-N 3.27Å; F481-K483 PolarHBondContact O-N 3.21Å
484	M	84.9	Confident	87	Confident	6 Å²	6	37.1 Å²	37.1	3%	0.03	19%	0.186	C	C	.	.	S	Bend	trans	-70	144	175.7	-70.7	-167.2	-46	0	0	111.6	G440 I478 F481 D482 R489 I492	G440-M484 WeakPolarHBondContact O-CG 3.24Å; I478-M484 HydrophobicContact CG2-SD 3.98Å; F481-M484 HydrophobicContact CD1-CE 4.02Å; F481-M484 HydrophobicContact CD2-CE 3.23Å; F481-M484 HydrophobicContact CD2-SD 4.07Å; F481-M484 HydrophobicContact CE1-CE 3.89Å; F481-M484 HydrophobicContact CE2-CE 3.11Å; F481-M484 HydrophobicContact CE2-SD 4.27Å; F481-M484 HydrophobicContact CG-CE 3.7Å; F481-M484 HydrophobicContact CZ-CE 3.44Å; F481-M484 VanDerWaalsContact CZ-CE 3.44Å; F481-M484 PolarHBondContact O-N 2.78Å; D482-M484 VanDerWaalsContact C-N 3.31Å; D482-M484 PolarHBondContact O-N 2.85Å; M484-R489 HydrophobicContact CB-CG 4.41Å; M484-R489 HydrophobicContact CE-CG 4.2Å; M484-R489 PolarHBondContact O-NE 3.09Å; M484-I492 HydrophobicContact CE-CD1 3.56Å; M484-I492 HydrophobicContact SD-CD1 3.87Å
485	T	85.4	Confident	87	Confident	77 Å²	77	37 Å²	37	47%	0.472	19%	0.185	S	C	.	.			trans	-67.1	152.6	176.4	77.9	0	0	0	0	111.1	F487 D488 R489	T485-F487 PolarHBondContact O-N 2.75Å; T485-D488 PolarHBondContact O-N 2.71Å; T485-D488 VanDerWaalsContact O-N 3.15Å; T485-D488 PolarHBondContact OG1-N 3.35Å; T485-D488 PolarHBondContact OG1-OD1 3.44Å; T485-D488 PolarHBondContact OG1-OD2 3.48Å; T485-R489 WeakPolarHBondContact O-CG 3.48Å; T485-R489 PolarHBondContact O-N 3.39Å; T485-R489 VanDerWaalsContact O-N 3.14Å
486	E	84	Confident	86.9	Confident	157 Å²	157	37 Å²	37	73%	0.734	19%	0.185	S	C	*	.	H	α-helix	trans	-59.8	-33.6	178.8	-65.4	-176.7	166.8	0	0	112.7	R489 T490	E486-R489 WeakPolarHBondContact O-CB 3.3Å; E486-R489 PolarHBondContact O-N 3.09Å; E486-T490 PolarHBondContact O-N 3.25Å
487	F	81.5	Confident	86.4	Confident	136 Å²	136	40.8 Å²	40.8	60%	0.596	20%	0.202	S	C	*	.	H	α-helix	trans	-62.1	-45.2	176.4	-175.2	-96	0	0	0	111.2	T485 R489 T490	T485-F487 PolarHBondContact O-N 2.75Å; F487-R489 VanDerWaalsContact C-N 3.28Å; F487-R489 PolarHBondContact O-N 3.19Å; F487-T490 PolarHBondContact O-N 3.5Å; F487-T490 VanDerWaalsContact O-N 3.14Å; F487-T490 PolarHBondContact O-OG1 2.96Å
488	D	84.1	Confident	85.9	Confident	13 Å²	13	46.5 Å²	46.5	7%	0.07	23%	0.229	C	C	.	.	H	α-helix	trans	-68	-31.4	-179.6	-52.7	-30.1	0	0	0	111.6	G445 L448 T485 T490 A491 I492	G445-D488 WeakPolarHBondContact CA-OD1 3.37Å; G445-D488 VanDerWaalsContact N-CG 3.26Å; G445-D488 PolarHBondContact N-OD1 3.16Å; L448-D488 HydrophobicContact CD1-CB 4.44Å; T485-D488 PolarHBondContact O-N 2.71Å; T485-D488 VanDerWaalsContact O-N 3.15Å; T485-D488 PolarHBondContact OG1-N 3.35Å; T485-D488 PolarHBondContact OG1-OD1 3.44Å; T485-D488 PolarHBondContact OG1-OD2 3.48Å; D488-T490 VanDerWaalsContact C-N 3.3Å; D488-T490 PolarHBondContact O-N 3.26Å; D488-A491 PolarHBondContact O-N 3.16Å; D488-I492 PolarHBondContact O-N 3.14Å
489	R	81.5	Confident	85.7	Confident	22 Å²	22	46.7 Å²	46.7	8%	0.083	23%	0.23	C	C	.	.	H	α-helix	trans	-62.2	-35.5	173.5	-65	173.9	-168.3	-164.9	-5.4	111.8	D482 M484 T485 E486 F487 A491 I492 H493 D540 L545	D482-R489 PolarHBondContact O-NH2 2.9Å; M484-R489 HydrophobicContact CB-CG 4.41Å; M484-R489 HydrophobicContact CE-CG 4.2Å; M484-R489 PolarHBondContact O-NE 3.09Å; T485-R489 WeakPolarHBondContact O-CG 3.48Å; T485-R489 PolarHBondContact O-N 3.39Å; T485-R489 VanDerWaalsContact O-N 3.14Å; E486-R489 WeakPolarHBondContact O-CB 3.3Å; E486-R489 PolarHBondContact O-N 3.09Å; F487-R489 VanDerWaalsContact C-N 3.28Å; F487-R489 PolarHBondContact O-N 3.19Å; R489-A491 VanDerWaalsContact C-N 3.34Å; R489-A491 PolarHBondContact O-N 2.88Å; R489-I492 PolarHBondContact O-N 3.09Å; R489-H493 PolarHBondContact O-CD2 3.12Å; R489-H493 PolarHBondContact O-N 2.86Å; R489-D540 PolarHBondContact NH1-O 3.41Å; R489-D540 PolarHBondContact NH2-O 2.92Å; R489-L545 HydrophobicContact CB-CD1 4.33Å; R489-L545 HydrophobicContact CG-CD1 4.46Å
490	T	82.9	Confident	85.5	Confident	82 Å²	82	47.3 Å²	47.3	50%	0.503	24%	0.235	S	C	.	.	H	α-helix	trans	-64.8	-37.4	178.3	67.8	0	0	0	0	112.8	E486 F487 D488 I492 H493	E486-T490 PolarHBondContact O-N 3.25Å; F487-T490 PolarHBondContact O-N 3.5Å; F487-T490 VanDerWaalsContact O-N 3.14Å; F487-T490 PolarHBondContact O-OG1 2.96Å; D488-T490 VanDerWaalsContact C-N 3.3Å; D488-T490 PolarHBondContact O-N 3.26Å; T490-I492 VanDerWaalsContact C-N 3.31Å; T490-I492 PolarHBondContact O-N 3.15Å; T490-H493 WeakPolarHBondContact O-CB 3.32Å; T490-H493 PolarHBondContact O-N 3.2Å
491	A	83.3	Confident	85.4	Confident	16 Å²	16	44.8 Å²	44.8	13%	0.132	22%	0.223	C	C	.	.	H	α-helix	trans	-64.7	-36.6	178	0	0	0	0	0	112.1	T449 D488 R489 H493 E494	T449-A491 HydrophobicContact CG2-CB 3.55Å; D488-A491 PolarHBondContact O-N 3.16Å; R489-A491 VanDerWaalsContact C-N 3.34Å; R489-A491 PolarHBondContact O-N 2.88Å; A491-H493 VanDerWaalsContact C-N 3.32Å; A491-H493 PolarHBondContact O-N 3.28Å; A491-E494 PolarHBondContact O-N 3.49Å
492	I	86.8	Confident	85.4	Confident	0 Å²	0	48 Å²	48	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-70.4	-30.5	178.3	-65.6	170	0	0	0	111.5	L448 I478 F481 M484 D488 R489 T490 E494 V495 M496 I518	L448-I492 HydrophobicContact CD1-CD1 4.32Å; I478-I492 HydrophobicContact CD1-CD1 4.08Å; F481-I492 HydrophobicContact CE2-CD1 3.96Å; F481-I492 HydrophobicContact CZ-CD1 4.46Å; M484-I492 HydrophobicContact CE-CD1 3.56Å; M484-I492 HydrophobicContact SD-CD1 3.87Å; D488-I492 PolarHBondContact O-N 3.14Å; R489-I492 PolarHBondContact O-N 3.09Å; T490-I492 VanDerWaalsContact C-N 3.31Å; T490-I492 PolarHBondContact O-N 3.15Å; I492-E494 VanDerWaalsContact C-N 3.25Å; I492-E494 PolarHBondContact O-N 3Å; I492-V495 PolarHBondContact O-N 2.72Å; I492-M496 HydrophobicContact CG2-CG 3.9Å; I492-M496 HydrophobicContact CG2-SD 3.83Å; I492-M496 WeakPolarHBondContact O-CB 3.41Å; I492-M496 WeakPolarHBondContact O-CG 3.17Å; I492-M496 PolarHBondContact O-N 3.42Å; I492-I518 HydrophobicContact CG2-CD1 3.81Å
493	H	86.6	Confident	85.3	Confident	41 Å²	41	46.9 Å²	46.9	19%	0.19	24%	0.239	C	C	.	.	H	α-helix	trans	-58.8	-38.3	177.7	-67.7	169.1	0	0	0	112.8	R489 T490 A491 E497 R548	R489-H493 PolarHBondContact O-CD2 3.12Å; R489-H493 PolarHBondContact O-N 2.86Å; T490-H493 WeakPolarHBondContact O-CB 3.32Å; T490-H493 PolarHBondContact O-N 3.2Å; A491-H493 VanDerWaalsContact C-N 3.32Å; A491-H493 PolarHBondContact O-N 3.28Å; H493-E497 PolarHBondContact O-N 2.86Å; H493-R548 PolarHBondContact CD2-NH1 3.43Å; H493-R548 VanDerWaalsContact CD2-NH1 3.25Å
494	E	87.6	Confident	85.3	Confident	45 Å²	45	47.2 Å²	47.2	21%	0.21	26%	0.255	C	S	.	.	H	α-helix	trans	-67.2	-49.2	178.5	-166.1	-175.5	168.2	0	0	110.8	A491 I492 M496 E497 Q498 T500 S502	A491-E494 PolarHBondContact O-N 3.49Å; I492-E494 VanDerWaalsContact C-N 3.25Å; I492-E494 PolarHBondContact O-N 3Å; E494-M496 VanDerWaalsContact C-N 3.34Å; E494-M496 PolarHBondContact O-N 2.72Å; E494-E497 PolarHBondContact O-N 2.82Å; E494-E497 VanDerWaalsContact O-N 3.16Å; E494-Q498 PolarHBondContact O-N 3.29Å; E494-T500 WeakPolarHBondContact CG-O 3.33Å; E494-S502 VanDerWaalsContact CD-OG 3.31Å; E494-S502 WeakPolarHBondContact OE1-CB 3.06Å; E494-S502 PolarHBondContact OE1-N 2.92Å; E494-S502 PolarHBondContact OE1-OG 3.03Å; E494-S502 PolarHBondContact OE2-OG 3.24Å
495	V	88.6	Confident	85.2	Confident	3 Å²	3	51.4 Å²	51.4	2%	0.018	27%	0.274	C	S	.	.	H	α-helix	trans	-61.6	-41.9	-179.7	179.2	0	0	0	0	111.7	L468 I492 E497 Q499 I501 A514	L468-V495 HydrophobicContact CD1-CG1 4.5Å; L468-V495 HydrophobicContact CD1-CG2 3.99Å; I492-V495 PolarHBondContact O-N 2.72Å; V495-E497 VanDerWaalsContact C-N 3.32Å; V495-E497 PolarHBondContact O-N 2.93Å; V495-Q499 VanDerWaalsContact O-CA 3.22Å; V495-Q499 WeakPolarHBondContact O-CA 3.47Å; V495-Q499 PolarHBondContact O-N 3.02Å; V495-I501 HydrophobicContact CG2-CD1 3.9Å; V495-I501 HydrophobicContact CG2-CG1 3.41Å; V495-I501 VanDerWaalsContact CG2-CG1 3.41Å; V495-A514 HydrophobicContact CG1-CB 4.12Å; V495-A514 HydrophobicContact CG2-CB 4.44Å
496	M	88.1	Confident	85	Confident	2 Å²	2	50.8 Å²	50.8	1%	0.01	28%	0.276	C	S	.	.	H	α-helix	trans	-65.7	-34.3	178.4	-72	-176	92.6	0	0	112.5	R406 N410 I492 E494 I518 R548 F549	R406-M496 WeakPolarHBondContact CD-O 3.4Å; R406-M496 PolarHBondContact NH1-O 2.87Å; N410-M496 HydrophobicContact CB-CE 3.7Å; I492-M496 HydrophobicContact CG2-CG 3.9Å; I492-M496 HydrophobicContact CG2-SD 3.83Å; I492-M496 WeakPolarHBondContact O-CB 3.41Å; I492-M496 WeakPolarHBondContact O-CG 3.17Å; I492-M496 PolarHBondContact O-N 3.42Å; E494-M496 VanDerWaalsContact C-N 3.34Å; E494-M496 PolarHBondContact O-N 2.72Å; M496-I518 HydrophobicContact CG-CD1 3.62Å; M496-I518 HydrophobicContact SD-CD1 4.48Å; M496-R548 HydrophobicContact CB-CB 4.28Å; M496-R548 HydrophobicContact CE-CB 3.67Å; M496-R548 WeakPolarHBondContact CE-O 3.49Å; M496-R548 HydrophobicContact SD-CB 3.86Å; M496-F549 HydrophobicContact CE-CD1 3.5Å; M496-F549 HydrophobicContact CE-CD2 4.37Å; M496-F549 HydrophobicContact CE-CE1 3.5Å; M496-F549 HydrophobicContact CE-CE2 4.42Å; M496-F549 HydrophobicContact CE-CG 3.94Å; M496-F549 HydrophobicContact CE-CZ 3.99Å
497	E	82.3	Confident	84.7	Confident	80 Å²	80	47.5 Å²	47.5	37%	0.374	28%	0.284	S	S	.	.	H	α-helix	trans	-86.7	-54.7	-175.4	-162.7	68.2	-139.1	0	0	112.4	H493 E494 V495 R548 R651	H493-E497 PolarHBondContact O-N 2.86Å; E494-E497 PolarHBondContact O-N 2.82Å; E494-E497 VanDerWaalsContact O-N 3.16Å; V495-E497 VanDerWaalsContact C-N 3.32Å; V495-E497 PolarHBondContact O-N 2.93Å; E497-R548 IonicContact OE2-NE 3.13Å; E497-R548 PolarHBondContact OE2-NE 3.46Å; E497-R651 IonicContact OE1-CZ 2.64Å; E497-R651 IonicContact OE1-NH2 3.65Å; E497-R651 PolarHBondContact OE1-NH2 3.47Å; E497-R651 IonicContact OE2-CZ 3.39Å; E497-R651 IonicContact OE2-NH2 3.42Å; E497-R651 PolarHBondContact OE2-NH2 2.86Å
498	Q	84.3	Confident	84.7	Confident	121 Å²	121	42.4 Å²	42.4	57%	0.565	26%	0.263	S	S	*	.	H	α-helix	trans	-101.8	-15	-168.8	-65.9	176.3	-11.8	0	0	112.7	E494 T500	E494-Q498 PolarHBondContact O-N 3.29Å; Q498-T500 WeakPolarHBondContact CB-OG1 3.44Å; Q498-T500 PolarHBondContact O-N 3.38Å
499	Q	87.5	Confident	84.8	Confident	4 Å²	4	48.9 Å²	48.9	2%	0.019	30%	0.297	C	S	.	.	S	Bend	trans	57.2	32.2	-172.4	-59.6	-177.8	-50.3	0	0	113	R406 N408 V495 A514 R515	R406-Q499 VanDerWaalsContact CB-CD 3.49Å; R406-Q499 HydrophobicContact CB-CG 4.03Å; N408-Q499 PolarHBondContact ND2-NE2 3.29Å; V495-Q499 VanDerWaalsContact O-CA 3.22Å; V495-Q499 WeakPolarHBondContact O-CA 3.47Å; V495-Q499 PolarHBondContact O-N 3.02Å; Q499-A514 CarbonylContact O-C 3.6Å; Q499-A514 PolarHBondContact O-N 2.89Å; Q499-R515 HydrophobicContact CB-CG 4.37Å
500	T	88.1	Confident	84.9	Confident	27 Å²	27	50.2 Å²	50.2	17%	0.166	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	155.5	177.4	54.6	0	0	0	0	109.5	E494 Q498 L512	E494-T500 WeakPolarHBondContact CG-O 3.33Å; Q498-T500 WeakPolarHBondContact CB-OG1 3.44Å; Q498-T500 PolarHBondContact O-N 3.38Å; T500-L512 CarbonylContact C-O 3.53Å; T500-L512 VanDerWaalsContact CA-O 3.3Å; T500-L512 WeakPolarHBondContact CA-O 3.32Å
501	I	87.9	Confident	85	Confident	3 Å²	3	51 Å²	51	2%	0.015	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	113.9	173.8	-63.6	169.2	0	0	0	107	T449 L468 V469 V495 I503 T511 L512 A514	T449-I501 HydrophobicContact CG2-CG2 4.08Å; L468-I501 HydrophobicContact CB-CD1 4.09Å; V469-I501 HydrophobicContact CG2-CD1 3.74Å; V495-I501 HydrophobicContact CG2-CD1 3.9Å; V495-I501 HydrophobicContact CG2-CG1 3.41Å; V495-I501 VanDerWaalsContact CG2-CG1 3.41Å; I501-I503 HydrophobicContact CG2-CD1 4.41Å; I501-I503 HydrophobicContact CG2-CG1 4.03Å; I501-T511 CarbonylContact O-C 3.51Å; I501-T511 WeakPolarHBondContact O-CA 3.32Å; I501-L512 HydrophobicContact CB-CB 4.49Å; I501-L512 PolarHBondContact N-O 2.91Å; I501-L512 PolarHBondContact O-N 2.71Å; I501-A514 HydrophobicContact CD1-CB 3.7Å; I501-A514 HydrophobicContact CG1-CB 3.9Å
502	S	86.3	Confident	85	Confident	67 Å²	67	51.4 Å²	51.4	47%	0.469	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	126.5	173.9	59.2	0	0	0	0	110.5	E494	E494-S502 VanDerWaalsContact CD-OG 3.31Å; E494-S502 WeakPolarHBondContact OE1-CB 3.06Å; E494-S502 PolarHBondContact OE1-N 2.92Å; E494-S502 PolarHBondContact OE1-OG 3.03Å; E494-S502 PolarHBondContact OE2-OG 3.24Å
503	I	85.4	Confident	84.9	Confident	9 Å²	9	55.6 Å²	55.6	5%	0.046	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	116.9	178.1	-57.3	173.1	0	0	0	107.4	A450 V452 L463 I501 K505 L509 T510 L512	A450-I503 HydrophobicContact CB-CD1 3.32Å; V452-I503 HydrophobicContact CG2-CG2 4.14Å; L463-I503 HydrophobicContact CD2-CD1 3.92Å; L463-I503 HydrophobicContact CD2-CG2 4.25Å; I501-I503 HydrophobicContact CG2-CD1 4.41Å; I501-I503 HydrophobicContact CG2-CG1 4.03Å; I503-K505 HydrophobicContact CG2-CB 4.14Å; I503-K505 HydrophobicContact CG2-CG 4.41Å; I503-L509 WeakPolarHBondContact O-CA 3.44Å; I503-T510 PolarHBondContact N-O 2.89Å; I503-T510 PolarHBondContact O-N 3.37Å; I503-L512 HydrophobicContact CD1-CD1 3.71Å; I503-L512 HydrophobicContact CD1-CG 4.33Å
504	A	84.9	Confident	84.9	Confident	80 Å²	80	53.6 Å²	53.6	66%	0.661	33%	0.325	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-120.6	69.5	172.9	0	0	0	0	0	108.8	I508 L509	A504-I508 WeakPolarHBondContact CA-O 3.28Å; A504-L509 HydrophobicContact CB-CD1 3.83Å
505	K	82.7	Confident	84.8	Confident	95 Å²	95	54.1 Å²	54.1	41%	0.413	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	140.6	-177	-70.9	-176.8	-178.2	172.6	0	110.9	V452 I503 G507 I508	V452-K505 HydrophobicContact CG2-CB 4.04Å; I503-K505 HydrophobicContact CG2-CB 4.14Å; I503-K505 HydrophobicContact CG2-CG 4.41Å; K505-G507 PolarHBondContact O-N 2.81Å; K505-G507 VanDerWaalsContact O-N 3.14Å; K505-I508 PolarHBondContact N-O 3.34Å; K505-I508 VanDerWaalsContact N-O 3.1Å; K505-I508 WeakPolarHBondContact O-CB 3.41Å; K505-I508 PolarHBondContact O-N 2.8Å
506	A	81.1	Confident	84.9	Confident	64 Å²	64	54.2 Å²	54.2	53%	0.529	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.5	33.8	172.4	0	0	0	0	0	115.4	V452 M461 I508	V452-A506 HydrophobicContact CG1-CB 3.96Å; M461-A506 HydrophobicContact CE-CB 3.93Å; A506-I508 VanDerWaalsContact C-N 3.3Å
507	G	77.7	Confident	85.1	Confident	87 Å²	87	54.3 Å²	54.3	90%	0.897	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	85.2	-4.2	-179	0	0	0	0	0	114.7	K505	K505-G507 PolarHBondContact O-N 2.81Å; K505-G507 VanDerWaalsContact O-N 3.14Å
508	I	80.3	Confident	85.7	Confident	30 Å²	30	50.5 Å²	50.5	15%	0.154	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	116.6	173.8	-54.3	-179.6	0	0	0	108	V452 M461 L463 A504 K505 A506 T510	V452-I508 HydrophobicContact CG1-CD1 3.75Å; V452-I508 HydrophobicContact CG2-CD1 4.3Å; M461-I508 HydrophobicContact CB-CD1 3.8Å; M461-I508 HydrophobicContact CB-CG1 4.33Å; L463-I508 HydrophobicContact CD1-CG2 3.93Å; L463-I508 HydrophobicContact CD2-CD1 4.42Å; L463-I508 HydrophobicContact CD2-CG2 4.23Å; L463-I508 HydrophobicContact CG-CD1 4.14Å; L463-I508 HydrophobicContact CG-CG2 4.22Å; A504-I508 WeakPolarHBondContact CA-O 3.28Å; K505-I508 PolarHBondContact N-O 3.34Å; K505-I508 VanDerWaalsContact N-O 3.1Å; K505-I508 WeakPolarHBondContact O-CB 3.41Å; K505-I508 PolarHBondContact O-N 2.8Å; A506-I508 VanDerWaalsContact C-N 3.3Å; I508-T510 HydrophobicContact CG2-CG2 3.53Å; I508-T510 WeakPolarHBondContact CG2-OG1 2.97Å
509	L	87.5	Confident	86.1	Confident	149 Å²	149	44.7 Å²	44.7	78%	0.78	28%	0.282	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-111.1	93.2	169.4	-178.4	70.5	0	0	0	108.2	I503 A504	I503-L509 WeakPolarHBondContact O-CA 3.44Å; A504-L509 HydrophobicContact CB-CD1 3.83Å
510	T	83.6	Confident	86.4	Confident	49 Å²	49	44.5 Å²	44.5	30%	0.301	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	146.8	-176.4	54.2	0	0	0	0	111.2	L463 I503 I508	L463-T510 HydrophobicContact CD1-CG2 4.29Å; L463-T510 WeakPolarHBondContact CD1-OG1 3.23Å; I503-T510 PolarHBondContact N-O 2.89Å; I503-T510 PolarHBondContact O-N 3.37Å; I508-T510 HydrophobicContact CG2-CG2 3.53Å; I508-T510 WeakPolarHBondContact CG2-OG1 2.97Å
511	T	84.7	Confident	86.6	Confident	100 Å²	100	43.2 Å²	43.2	61%	0.613	27%	0.273	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.6	122	170.8	54.2	0	0	0	0	109.6	I501	I501-T511 CarbonylContact O-C 3.51Å; I501-T511 WeakPolarHBondContact O-CA 3.32Å
512	L	84.2	Confident	86.7	Confident	24 Å²	24	43.1 Å²	43.1	13%	0.126	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	141	172.2	-62.7	175.7	0	0	0	109.2	A450 V469 T500 I501 I503	A450-L512 HydrophobicContact CB-CD1 3.72Å; V469-L512 HydrophobicContact CG1-CD1 4.44Å; V469-L512 HydrophobicContact CG2-CB 4.33Å; V469-L512 HydrophobicContact CG2-CD1 3.92Å; T500-L512 CarbonylContact C-O 3.53Å; T500-L512 VanDerWaalsContact CA-O 3.3Å; T500-L512 WeakPolarHBondContact CA-O 3.32Å; I501-L512 HydrophobicContact CB-CB 4.49Å; I501-L512 PolarHBondContact N-O 2.91Å; I501-L512 PolarHBondContact O-N 2.71Å; I503-L512 HydrophobicContact CD1-CD1 3.71Å; I503-L512 HydrophobicContact CD1-CG 4.33Å
513	N	83.9	Confident	86.8	Confident	87 Å²	87	41.9 Å²	41.9	47%	0.465	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	132.1	175.1	-67.8	-28.1	0	0	0	109.6
514	A	85.6	Confident	86.9	Confident	0 Å²	0	41.9 Å²	41.9	0%	0	26%	0.261	C	S	.	.			trans	-137.4	68.7	179.7	0	0	0	0	0	109.7	V495 Q499 I501 V516	V495-A514 HydrophobicContact CG1-CB 4.12Å; V495-A514 HydrophobicContact CG2-CB 4.44Å; Q499-A514 CarbonylContact O-C 3.6Å; Q499-A514 PolarHBondContact O-N 2.89Å; I501-A514 HydrophobicContact CD1-CB 3.7Å; I501-A514 HydrophobicContact CG1-CB 3.9Å; A514-V516 HydrophobicContact CB-CG2 4.38Å; A514-V516 PolarHBondContact O-N 2.95Å
515	R	87.2	Confident	86.7	Confident	56 Å²	56	40.8 Å²	40.8	21%	0.211	25%	0.253	C	S	.	.			trans	-79.9	58.1	179.8	-52.6	165.9	-73.1	-172.2	-6.7	110.6	N408 D472 Q473 Q499	N408-R515 PolarHBondContact ND2-O 2.92Å; D472-R515 WeakPolarHBondContact OD1-CA 2.98Å; D472-R515 WeakPolarHBondContact OD1-CB 3.45Å; D472-R515 PolarHBondContact OD1-N 3.16Å; D472-R515 IonicContact OD1-NE 2.98Å; D472-R515 PolarHBondContact OD1-NE 3.01Å; D472-R515 IonicContact OD2-CZ 2.99Å; D472-R515 IonicContact OD2-NE 3.57Å; D472-R515 PolarHBondContact OD2-NE 2.96Å; D472-R515 IonicContact OD2-NH2 3.07Å; D472-R515 PolarHBondContact OD2-NH2 3.49Å; Q473-R515 VanDerWaalsContact CA-O 3.23Å; Q473-R515 WeakPolarHBondContact CA-O 3.39Å; Q473-R515 PolarHBondContact N-O 3.48Å; Q473-R515 VanDerWaalsContact NE2-CZ 3.26Å; Q473-R515 VanDerWaalsContact NE2-NH2 3.19Å; Q499-R515 HydrophobicContact CB-CG 4.37Å
516	V	90.7	Very high	86.7	Confident	4 Å²	4	43 Å²	43	2%	0.024	26%	0.26	C	S	.	.	P	Polyproline II helix	trans	-95.4	149.3	-176	-166.2	0	0	0	0	110.2	N408 L468 A471 C476 A514	N408-V516 PolarHBondContact ND2-O 2.93Å; L468-V516 WeakPolarHBondContact O-CG2 3.26Å; A471-V516 HydrophobicContact CB-CG1 3.91Å; A471-V516 HydrophobicContact CB-CG2 4.2Å; A471-V516 WeakPolarHBondContact O-CG2 3.31Å; C476-V516 HydrophobicContact CB-CG1 3.52Å; C476-V516 VanDerWaalsContact N-CG1 3.34Å; A514-V516 HydrophobicContact CB-CG2 4.38Å; A514-V516 PolarHBondContact O-N 2.95Å
517	A	92	Very high	86.6	Confident	4 Å²	4	41.4 Å²	41.4	3%	0.033	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	124.9	161.8	0	0	0	0	0	108.9	L390 N408 G474 V475 C476	L390-A517 HydrophobicContact CD2-CB 4.42Å; L390-A517 HydrophobicContact CG-CB 4.27Å; N408-A517 HydrophobicContact CB-CB 4.21Å; G474-A517 PolarHBondContact O-N 3.05Å; V475-A517 CarbonylContact C-O 3.59Å; V475-A517 WeakPolarHBondContact CA-O 3.38Å; V475-A517 HydrophobicContact CG2-CB 4.36Å; C476-A517 PolarHBondContact N-O 3.02Å
518	I	93.4	Very high	86.7	Confident	0 Å²	0	45.2 Å²	45.2	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	123.9	-178.3	-57.7	-175.7	0	0	0	109.4	N410 I411 I478 I492 M496 F549	N410-I518 WeakPolarHBondContact CA-O 3.41Å; N410-I518 PolarHBondContact OD1-N 3.2Å; I411-I518 PolarHBondContact N-O 3.36Å; I478-I518 HydrophobicContact CD1-CG2 4.04Å; I492-I518 HydrophobicContact CG2-CD1 3.81Å; M496-I518 HydrophobicContact CG-CD1 3.62Å; M496-I518 HydrophobicContact SD-CD1 4.48Å; I518-F549 HydrophobicContact CG2-CE1 4.43Å
519	L	94.5	Very high	86.6	Confident	0 Å²	0	45 Å²	45	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	108.1	168.3	-178.4	61.4	0	0	0	108.6	L387 L390 I411 L413 L425 V428 V475 C476 C477 I478	L387-L519 HydrophobicContact CD2-CD1 3.51Å; L387-L519 HydrophobicContact CD2-CD2 3.74Å; L387-L519 HydrophobicContact CD2-CG 4.3Å; L390-L519 HydrophobicContact CD1-CB 4.13Å; L390-L519 HydrophobicContact CD1-CD1 4.21Å; I411-L519 HydrophobicContact CB-CD1 3.91Å; I411-L519 HydrophobicContact CG2-CD1 4.05Å; I411-L519 WeakPolarHBondContact O-CA 3.21Å; L413-L519 HydrophobicContact CG-CD1 4.39Å; L425-L519 HydrophobicContact CD2-CB 4.3Å; L425-L519 HydrophobicContact CD2-CD1 4.38Å; L425-L519 HydrophobicContact CD2-CD2 3.41Å; L425-L519 VanDerWaalsContact CD2-CD2 3.41Å; L425-L519 HydrophobicContact CD2-CG 3.37Å; V428-L519 HydrophobicContact CB-CD2 4.07Å; V428-L519 HydrophobicContact CG1-CD2 3.94Å; V428-L519 HydrophobicContact CG2-CD2 4.1Å; V475-L519 HydrophobicContact CG1-CB 4.06Å; C476-L519 PolarHBondContact O-N 2.71Å; C477-L519 CarbonylContact C-O 3.47Å; C477-L519 WeakPolarHBondContact CA-O 3.15Å; I478-L519 PolarHBondContact N-O 3.34Å
520	A	92.7	Very high	86.2	Confident	0 Å²	0	40.8 Å²	40.8	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	143.9	-179	0	0	0	0	0	111	I411 C412 L413 I478 F481 F549	I411-A520 PolarHBondContact O-N 2.87Å; C412-A520 CarbonylContact C-O 3.59Å; C412-A520 VanDerWaalsContact CA-O 3.31Å; C412-A520 WeakPolarHBondContact CA-O 3.48Å; C412-A520 HydrophobicContact CB-CB 4.21Å; L413-A520 PolarHBondContact N-O 2.77Å; I478-A520 CarbonylContact O-C 3.57Å; I478-A520 WeakPolarHBondContact O-CA 3.22Å; F481-A520 HydrophobicContact CB-CB 4.23Å; F481-A520 HydrophobicContact CD2-CB 3.74Å; F481-A520 HydrophobicContact CE2-CB 4.25Å; F481-A520 HydrophobicContact CG-CB 4.01Å; A520-F549 HydrophobicContact CB-CE1 4.16Å; A520-F549 HydrophobicContact CB-CZ 3.93Å
521	A	92.8	Very high	85.8	Confident	0 Å²	0	41 Å²	41	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	133.2	163.7	0	0	0	0	0	109.7	L413 K421 L425 I478 E480 F481	L413-A521 CarbonylContact O-C 3.34Å; L413-A521 WeakPolarHBondContact O-CA 3.49Å; K421-A521 HydrophobicContact CB-CB 4.27Å; K421-A521 HydrophobicContact CD-CB 4.36Å; L425-A521 HydrophobicContact CD1-CB 3.7Å; L425-A521 HydrophobicContact CG-CB 4.34Å; I478-A521 PolarHBondContact O-N 3.31Å; E480-A521 PolarHBondContact N-O 3.28Å; F481-A521 VanDerWaalsContact CB-O 3.32Å; F481-A521 WeakPolarHBondContact CB-O 3.43Å; F481-A521 PolarHBondContact N-O 3.33Å
522	A	89.9	Confident	85.4	Confident	1 Å²	1	42.6 Å²	42.6	1%	0.008	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	148.6	179.8	0	0	0	0	0	110.5	L413 M414 K421 F481	L413-A522 PolarHBondContact O-N 3.21Å; M414-A522 WeakPolarHBondContact CA-O 3.43Å; M414-A522 HydrophobicContact CG-CB 4.37Å; K421-A522 PolarHBondContact NZ-O 3.14Å; F481-A522 HydrophobicContact CB-CB 4.26Å
523	N	88.8	Confident	85	Confident	40 Å²	40	44.6 Å²	44.6	21%	0.214	23%	0.226	C	C	.	.			trans	-105.3	149.3	174.2	-62.2	-34.7	0	0	0	110.4	K421 D482	K421-N523 PolarHBondContact NZ-OD1 2.89Å; K421-N523 VanDerWaalsContact NZ-OD1 3.12Å; D482-N523 PolarHBondContact OD1-N 3.1Å
524	P	86	Confident	84.6	Confident	9 Å²	9	43 Å²	43	6%	0.058	22%	0.222	C	C	.	.			trans	-66	149.4	173.2	28.6	-34.9	0	0	0	110.1	G415 Y526 G527	G415-P524 WeakPolarHBondContact O-CD 3.25Å; P524-Y526 PolarHBondContact O-N 3.12Å; P524-Y526 VanDerWaalsContact O-N 3.08Å; P524-G527 PolarHBondContact O-N 3.45Å
525	A	81.9	Confident	83.9	Confident	58 Å²	58	43.9 Å²	43.9	48%	0.479	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.9	-30.7	-171	0	0	0	0	0	114.3	N538	A525-N538 PolarHBondContact N-O 3.23Å
526	Y	81.6	Confident	83.3	Confident	142 Å²	142	47 Å²	47	56%	0.557	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-100.4	13.2	-178.9	-57	-78	0	0	0	113.2	P524 R528 K533	P524-Y526 PolarHBondContact O-N 3.12Å; P524-Y526 VanDerWaalsContact O-N 3.08Å; Y526-R528 PolarHBondContact O-N 3.36Å; Y526-K533 HydrophobicContact CE2-CD 4.17Å; Y526-K533 PolarHBondContact OH-NZ 3.06Å; Y526-K533 VanDerWaalsContact OH-NZ 3.09Å
527	G	78.9	Confident	82.7	Confident	29 Å²	29	52.7 Å²	52.7	30%	0.299	27%	0.271	S	S	.	.	S	Bend	trans	76.4	-29.8	-175.7	0	0	0	0	0	114.1	P417 P524	P417-G527 WeakPolarHBondContact CD-O 3.47Å; P524-G527 PolarHBondContact O-N 3.45Å
528	R	80	Confident	82.1	Confident	168 Å²	168	52.6 Å²	52.6	63%	0.634	27%	0.27	S	S	*	.	S	Bend	trans	-120.8	149.5	168.6	-70	-173.4	178.1	-143.5	-5.3	111.7	D416 Y526 N530	D416-R528 VanDerWaalsContact OD1-CA 3.31Å; D416-R528 WeakPolarHBondContact OD1-CA 3.42Å; Y526-R528 PolarHBondContact O-N 3.36Å; R528-N530 PolarHBondContact O-N 2.86Å
529	Y	77.9	Confident	81.2	Confident	26 Å²	26	52.9 Å²	52.9	10%	0.102	27%	0.271	C	S	.	.			trans	-70.3	117.7	172.7	-167.6	-94.6	0	0	0	110.8	D416 V535 N538 L554 Q556	D416-Y529 PolarHBondContact OD1-N 3.44Å; Y529-V535 WeakPolarHBondContact OH-CG2 3.4Å; Y529-N538 HydrophobicContact CD2-CB 4.14Å; Y529-N538 HydrophobicContact CE2-CB 3.86Å; Y529-N538 VanDerWaalsContact CE2-ND2 3.34Å; Y529-N538 WeakPolarHBondContact CE2-ND2 3.44Å; Y529-L554 HydrophobicContact CD1-CD2 4.38Å; Y529-L554 HydrophobicContact CD2-CD1 3.88Å; Y529-L554 HydrophobicContact CD2-CD2 3.89Å; Y529-L554 HydrophobicContact CE1-CD2 4.18Å; Y529-L554 HydrophobicContact CE2-CD1 4.19Å; Y529-L554 HydrophobicContact CE2-CD2 3.65Å; Y529-L554 HydrophobicContact CG-CD2 4.24Å; Y529-Q556 VanDerWaalsContact CD1-NE2 3.29Å
530	N	79.7	Confident	80.5	Confident	59 Å²	59	58.1 Å²	58.1	32%	0.316	30%	0.3	S	S	.	.			trans	-90.2	118.4	175.9	-74.9	-20.8	0	0	0	109.6	R528 D532 K533 N538	R528-N530 PolarHBondContact O-N 2.86Å; N530-D532 PolarHBondContact O-N 2.86Å; N530-K533 PolarHBondContact O-N 3.16Å; N530-N538 PolarHBondContact O-ND2 2.94Å
531	P	75.1	Confident	79.7	Confident	55 Å²	55	58.6 Å²	58.6	36%	0.357	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64	-28.5	-176.2	26.5	-35.1	0	0	0	113.1	K533 Y695	P531-K533 PolarHBondContact O-N 2.88Å; P531-Y695 HydrophobicContact CB-CE2 4.45Å; P531-Y695 WeakPolarHBondContact O-CE2 3.46Å; P531-Y695 PolarHBondContact O-OH 3.43Å
532	D	76.3	Confident	79.1	Confident	133 Å²	133	61.4 Å²	61.4	71%	0.711	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.8	-10.9	-176.8	-55.4	-42.5	0	0	0	114.8	N530 Y695	N530-D532 PolarHBondContact O-N 2.86Å; D532-Y695 VanDerWaalsContact CA-OH 3.23Å; D532-Y695 WeakPolarHBondContact CA-OH 3.45Å; D532-Y695 PolarHBondContact N-OH 2.68Å; D532-Y695 PolarHBondContact OD1-OH 2.92Å
533	K	76.8	Confident	78.5	Confident	65 Å²	65	63.4 Å²	63.4	28%	0.283	34%	0.337	S	S	.	.	S	Bend	trans	-107.4	146.3	-179.2	-70.2	-177.1	-176.3	-178.6	0	110.1	Y526 N530 P531 Q537 N538	Y526-K533 HydrophobicContact CE2-CD 4.17Å; Y526-K533 PolarHBondContact OH-NZ 3.06Å; Y526-K533 VanDerWaalsContact OH-NZ 3.09Å; N530-K533 PolarHBondContact O-N 3.16Å; P531-K533 PolarHBondContact O-N 2.88Å; K533-Q537 HydrophobicContact CB-CB 4.37Å; K533-N538 VanDerWaalsContact CB-OD1 3.26Å; K533-N538 WeakPolarHBondContact CB-OD1 3.16Å; K533-N538 PolarHBondContact O-ND2 2.87Å; K533-N538 VanDerWaalsContact O-ND2 3.1Å
534	S	73.9	Confident	78.2	Confident	55 Å²	55	64.1 Å²	64.1	39%	0.385	35%	0.348	S	S	.	.			trans	-65.1	154.9	173.8	64.8	0	0	0	0	111.1	E536 Q537 N538	S534-E536 PolarHBondContact O-N 3.24Å; S534-Q537 PolarHBondContact O-N 2.84Å; S534-Q537 WeakPolarHBondContact OG-CG 3.43Å; S534-N538 PolarHBondContact O-N 2.96Å
535	V	72.3	Confident	78.1	Confident	17 Å²	17	63.7 Å²	63.7	10%	0.103	35%	0.346	C	S	.	.	H	α-helix	trans	-52.2	-40.5	179	-178.4	0	0	0	0	111.7	Y529 Q537 N538 V539 T646 I691	Y529-V535 WeakPolarHBondContact OH-CG2 3.4Å; V535-Q537 VanDerWaalsContact C-N 3.29Å; V535-Q537 PolarHBondContact O-N 3.44Å; V535-N538 PolarHBondContact O-N 2.91Å; V535-V539 HydrophobicContact CG1-CG2 4.2Å; V535-V539 VanDerWaalsContact O-CB 3.31Å; V535-V539 WeakPolarHBondContact O-CB 3.38Å; V535-V539 WeakPolarHBondContact O-CG2 3.32Å; V535-V539 PolarHBondContact O-N 2.94Å; V535-T646 HydrophobicContact CB-CG2 4.4Å; V535-T646 HydrophobicContact CG1-CG2 4.34Å; V535-T646 HydrophobicContact CG2-CG2 4.18Å; V535-I691 HydrophobicContact CG2-CG2 3.34Å
536	E	74.1	Confident	78.1	Confident	121 Å²	121	62 Å²	62	57%	0.565	33%	0.328	S	S	*	.	H	α-helix	trans	-66.9	-27.7	179.9	-60.6	-178.1	170.7	0	0	113.4	S534	S534-E536 PolarHBondContact O-N 3.24Å
537	Q	78	Confident	78.2	Confident	125 Å²	125	56.7 Å²	56.7	58%	0.584	31%	0.312	S	S	*	.	H	α-helix	trans	-88.6	-27.7	176.5	-68.2	178.4	1.1	0	0	112.2	K533 S534 V535	K533-Q537 HydrophobicContact CB-CB 4.37Å; S534-Q537 PolarHBondContact O-N 2.84Å; S534-Q537 WeakPolarHBondContact OG-CG 3.43Å; V535-Q537 VanDerWaalsContact C-N 3.29Å; V535-Q537 PolarHBondContact O-N 3.44Å
538	N	79.2	Confident	78.6	Confident	1 Å²	1	57.5 Å²	57.5	1%	0.005	31%	0.306	C	S	.	.	H	α-helix	trans	-76.4	-30.9	175.6	-82.2	-24.9	0	0	0	112.4	A525 Y529 N530 K533 S534 V535	A525-N538 PolarHBondContact N-O 3.23Å; Y529-N538 HydrophobicContact CD2-CB 4.14Å; Y529-N538 HydrophobicContact CE2-CB 3.86Å; Y529-N538 VanDerWaalsContact CE2-ND2 3.34Å; Y529-N538 WeakPolarHBondContact CE2-ND2 3.44Å; N530-N538 PolarHBondContact O-ND2 2.94Å; K533-N538 VanDerWaalsContact CB-OD1 3.26Å; K533-N538 WeakPolarHBondContact CB-OD1 3.16Å; K533-N538 PolarHBondContact O-ND2 2.87Å; K533-N538 VanDerWaalsContact O-ND2 3.1Å; S534-N538 PolarHBondContact O-N 2.96Å; V535-N538 PolarHBondContact O-N 2.91Å
539	V	74	Confident	79.1	Confident	6 Å²	6	50 Å²	50	4%	0.036	28%	0.278	C	S	.	.	S	Bend	trans	-112.2	113.3	-177.6	-175.2	0	0	0	0	107.9	M414 V535 L541	M414-V539 HydrophobicContact CE-CG1 3.73Å; M414-V539 HydrophobicContact SD-CG1 4.07Å; M414-V539 HydrophobicContact SD-CG2 3.79Å; V535-V539 HydrophobicContact CG1-CG2 4.2Å; V535-V539 VanDerWaalsContact O-CB 3.31Å; V535-V539 WeakPolarHBondContact O-CB 3.38Å; V535-V539 WeakPolarHBondContact O-CG2 3.32Å; V535-V539 PolarHBondContact O-N 2.94Å; V539-L541 HydrophobicContact CG1-CB 3.82Å; V539-L541 HydrophobicContact CG1-CD1 3.64Å; V539-L541 HydrophobicContact CG1-CG 3.65Å; V539-L541 PolarHBondContact O-N 2.96Å
540	D	79.9	Confident	79.6	Confident	111 Å²	111	49.2 Å²	49.2	59%	0.594	28%	0.275	S	S	*	.			trans	-73.9	47	178.7	-171.2	30.1	0	0	0	112.6	R489	R489-D540 PolarHBondContact NH1-O 3.41Å; R489-D540 PolarHBondContact NH2-O 2.92Å
541	L	77.2	Confident	80.1	Confident	9 Å²	9	46.5 Å²	46.5	5%	0.047	26%	0.261	C	S	.	.	S	Bend	trans	-123.1	131.2	179.8	-63.1	178.1	0	0	0	110	M414 F481 V539 L546	M414-L541 HydrophobicContact CE-CD1 3.89Å; F481-L541 HydrophobicContact CD1-CD1 3.95Å; F481-L541 HydrophobicContact CD1-CD2 3.73Å; F481-L541 HydrophobicContact CE1-CD1 4.2Å; F481-L541 HydrophobicContact CE1-CD2 3.8Å; V539-L541 HydrophobicContact CG1-CB 3.82Å; V539-L541 HydrophobicContact CG1-CD1 3.64Å; V539-L541 HydrophobicContact CG1-CG 3.65Å; V539-L541 PolarHBondContact O-N 2.96Å; L541-L546 HydrophobicContact CB-CD2 4.27Å; L541-L546 HydrophobicContact CB-CG 4.5Å; L541-L546 HydrophobicContact CD1-CD2 4.25Å
542	P	79.6	Confident	80.8	Confident	59 Å²	59	45.6 Å²	45.6	38%	0.383	25%	0.253	S	S	.	.			trans	-64.7	140.7	178.2	26.4	-33.1	0	0	0	110.8	A544 L545 L546	P542-A544 PolarHBondContact O-N 3.15Å; P542-L545 HydrophobicContact CG-CB 4.08Å; P542-L545 WeakPolarHBondContact O-CB 3.48Å; P542-L545 PolarHBondContact O-N 3.16Å; P542-L546 PolarHBondContact O-N 3.16Å
543	A	77.6	Confident	81.4	Confident	44 Å²	44	39.7 Å²	39.7	36%	0.364	22%	0.221	S	C	.	.	H	α-helix	trans	-55	-28.6	178.4	0	0	0	0	0	113.4	L545 L546 S547	A543-L545 VanDerWaalsContact C-N 3.26Å; A543-L545 PolarHBondContact O-N 3.47Å; A543-L546 PolarHBondContact O-N 3.12Å; A543-S547 WeakPolarHBondContact O-CB 3.49Å; A543-S547 PolarHBondContact O-N 3.23Å
544	A	81.7	Confident	81.8	Confident	55 Å²	55	37.3 Å²	37.3	46%	0.455	21%	0.211	S	C	.	.	H	α-helix	trans	-58.8	-36.3	173.8	0	0	0	0	0	112.8	P542 S547 R548	P542-A544 PolarHBondContact O-N 3.15Å; A544-S547 PolarHBondContact O-OG 3.38Å; A544-R548 PolarHBondContact O-NH1 3.13Å
545	L	84.4	Confident	82.4	Confident	0 Å²	0	35.1 Å²	35.1	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-79.5	-42.9	179.1	-160.8	159.8	0	0	0	110.4	F481 R489 P542 A543 S547 R548 F549	F481-L545 HydrophobicContact CE1-CD1 3.8Å; F481-L545 HydrophobicContact CE1-CD2 3.57Å; F481-L545 HydrophobicContact CE1-CG 4.37Å; F481-L545 HydrophobicContact CZ-CD1 3.82Å; F481-L545 HydrophobicContact CZ-CD2 3.71Å; F481-L545 HydrophobicContact CZ-CG 4.37Å; R489-L545 HydrophobicContact CB-CD1 4.33Å; R489-L545 HydrophobicContact CG-CD1 4.46Å; P542-L545 HydrophobicContact CG-CB 4.08Å; P542-L545 WeakPolarHBondContact O-CB 3.48Å; P542-L545 PolarHBondContact O-N 3.16Å; A543-L545 VanDerWaalsContact C-N 3.26Å; A543-L545 PolarHBondContact O-N 3.47Å; L545-S547 PolarHBondContact O-N 3.17Å; L545-R548 WeakPolarHBondContact O-CB 3.39Å; L545-R548 PolarHBondContact O-N 2.98Å; L545-F549 HydrophobicContact CD2-CD2 3.88Å; L545-F549 HydrophobicContact CD2-CE2 3.14Å; L545-F549 HydrophobicContact CD2-CZ 3.85Å
546	L	81.7	Confident	82.9	Confident	22 Å²	22	36.6 Å²	36.6	12%	0.115	20%	0.2	C	C	.	.	H	α-helix	trans	-55.2	-39	174	-62.9	179.5	0	0	0	112	M414 L541 P542 A543 R548 F549 L552	M414-L546 HydrophobicContact CE-CD2 3.54Å; L541-L546 HydrophobicContact CB-CD2 4.27Å; L541-L546 HydrophobicContact CB-CG 4.5Å; L541-L546 HydrophobicContact CD1-CD2 4.25Å; P542-L546 PolarHBondContact O-N 3.16Å; A543-L546 PolarHBondContact O-N 3.12Å; L546-R548 PolarHBondContact O-N 2.74Å; L546-R548 VanDerWaalsContact O-N 3.14Å; L546-F549 PolarHBondContact O-N 3.35Å; L546-L552 HydrophobicContact CB-CD1 4.24Å; L546-L552 HydrophobicContact CD2-CD1 4.31Å; L546-L552 HydrophobicContact CD2-CD2 3.87Å
547	S	83.5	Confident	83.3	Confident	30 Å²	30	34.6 Å²	34.6	21%	0.21	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-15.2	177.2	82.3	0	0	0	0	114.7	A543 A544 L545 R651	A543-S547 WeakPolarHBondContact O-CB 3.49Å; A543-S547 PolarHBondContact O-N 3.23Å; A544-S547 PolarHBondContact O-OG 3.38Å; L545-S547 PolarHBondContact O-N 3.17Å; S547-R651 VanDerWaalsContact O-CD 3.29Å; S547-R651 WeakPolarHBondContact O-CD 2.95Å; S547-R651 PolarHBondContact O-NH1 3.14Å
548	R	88.5	Confident	83.6	Confident	46 Å²	46	32 Å²	32	17%	0.174	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.1	-18.6	-179.4	-69	-171.2	178.4	96.6	-7.4	113.3	R406 H493 M496 E497 A544 L545 L546	R406-R548 PolarHBondContact NH1-O 3.08Å; R406-R548 PolarHBondContact NH2-O 3.48Å; H493-R548 PolarHBondContact CD2-NH1 3.43Å; H493-R548 VanDerWaalsContact CD2-NH1 3.25Å; M496-R548 HydrophobicContact CB-CB 4.28Å; M496-R548 HydrophobicContact CE-CB 3.67Å; M496-R548 WeakPolarHBondContact CE-O 3.49Å; M496-R548 HydrophobicContact SD-CB 3.86Å; E497-R548 IonicContact OE2-NE 3.13Å; E497-R548 PolarHBondContact OE2-NE 3.46Å; A544-R548 PolarHBondContact O-NH1 3.13Å; L545-R548 WeakPolarHBondContact O-CB 3.39Å; L545-R548 PolarHBondContact O-N 2.98Å; L546-R548 PolarHBondContact O-N 2.74Å; L546-R548 VanDerWaalsContact O-N 3.14Å
549	F	89.2	Confident	83.7	Confident	12 Å²	12	37.7 Å²	37.7	5%	0.053	22%	0.217	C	C	.	.			trans	-75	138.2	169	-70.1	-65.3	0	0	0	109.6	N410 C412 F481 M496 I518 A520 L545 L546 L552	N410-F549 HydrophobicContact CB-CD1 3.76Å; N410-F549 HydrophobicContact CB-CE1 4.3Å; C412-F549 HydrophobicContact CB-CD1 3.9Å; C412-F549 HydrophobicContact CB-CD2 3.87Å; C412-F549 HydrophobicContact CB-CE1 3.91Å; C412-F549 HydrophobicContact CB-CE2 3.8Å; C412-F549 HydrophobicContact CB-CG 3.91Å; C412-F549 HydrophobicContact CB-CZ 3.87Å; F481-F549 HydrophobicContact CE1-CE2 4.45Å; F481-F549 HydrophobicContact CE1-CZ 4.43Å; F481-F549 HydrophobicContact CE2-CZ 4.47Å; F481-F549 HydrophobicContact CZ-CZ 4.16Å; M496-F549 HydrophobicContact CE-CD1 3.5Å; M496-F549 HydrophobicContact CE-CD2 4.37Å; M496-F549 HydrophobicContact CE-CE1 3.5Å; M496-F549 HydrophobicContact CE-CE2 4.42Å; M496-F549 HydrophobicContact CE-CG 3.94Å; M496-F549 HydrophobicContact CE-CZ 3.99Å; I518-F549 HydrophobicContact CG2-CE1 4.43Å; A520-F549 HydrophobicContact CB-CE1 4.16Å; A520-F549 HydrophobicContact CB-CZ 3.93Å; L545-F549 HydrophobicContact CD2-CD2 3.88Å; L545-F549 HydrophobicContact CD2-CE2 3.14Å; L545-F549 HydrophobicContact CD2-CZ 3.85Å; L546-F549 PolarHBondContact O-N 3.35Å; F549-L552 HydrophobicContact CB-CD2 4.05Å; F549-L552 HydrophobicContact CB-CG 4.25Å; F549-L552 HydrophobicContact CD2-CD2 4.07Å; F549-L552 HydrophobicContact CG-CD2 4.34Å
550	D	90	Very high	84.3	Confident	8 Å²	8	41.8 Å²	41.8	4%	0.043	24%	0.239	C	C	.	.	S	Bend	trans	-82.9	-37.2	178.6	-61.2	-60.1	0	0	0	110.1	R406 L409 N410 A655 R658	R406-D550 IonicContact CZ-OD2 3.26Å; R406-D550 VanDerWaalsContact NH2-CG 3.26Å; R406-D550 IonicContact NH2-OD1 2.79Å; R406-D550 PolarHBondContact NH2-OD1 3.19Å; R406-D550 IonicContact NH2-OD2 2.73Å; R406-D550 PolarHBondContact NH2-OD2 2.78Å; L409-D550 WeakPolarHBondContact CA-OD2 3.34Å; L409-D550 HydrophobicContact CD2-CB 4.11Å; N410-D550 PolarHBondContact N-OD2 3.48Å; N410-D550 PolarHBondContact O-N 3.19Å; D550-A655 HydrophobicContact CB-CB 3.75Å; D550-R658 IonicContact OD1-NH1 3.87Å; D550-R658 PolarHBondContact OD1-NH1 3.21Å; D550-R658 IonicContact OD2-NH1 2.88Å
551	L	89.5	Confident	84.8	Confident	2 Å²	2	47 Å²	47	1%	0.01	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	135.1	173.2	-66.4	171.4	0	0	0	111.4	A386 N410 I411 C412 L659 M684	A386-L551 HydrophobicContact CB-CD1 3.75Å; N410-L551 PolarHBondContact O-N 2.91Å; I411-L551 WeakPolarHBondContact CA-O 3.46Å; I411-L551 HydrophobicContact CD1-CD1 4.25Å; I411-L551 HydrophobicContact CG1-CB 4.22Å; I411-L551 HydrophobicContact CG1-CD1 4.5Å; I411-L551 HydrophobicContact CG2-CB 4.47Å; C412-L551 PolarHBondContact N-O 2.95Å; C412-L551 VanDerWaalsContact N-O 3.09Å; L551-L659 HydrophobicContact CD1-CD1 4.15Å; L551-L659 HydrophobicContact CD1-CD2 3.89Å; L551-L659 HydrophobicContact CD2-CD1 4.02Å; L551-L659 HydrophobicContact CG-CD1 4.14Å; L551-M684 HydrophobicContact CD2-CG 4.18Å; L551-M684 HydrophobicContact CD2-SD 3.45Å; L551-M684 WeakPolarHBondContact CD2-SD 3.19Å
552	L	88.9	Confident	85.4	Confident	37 Å²	37	53.3 Å²	53.3	19%	0.194	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	107	175	-71.1	163.9	0	0	0	108	C412 M414 L546 F549 S687	C412-L552 HydrophobicContact CB-CD2 3.95Å; M414-L552 HydrophobicContact CE-CD2 3.76Å; L546-L552 HydrophobicContact CB-CD1 4.24Å; L546-L552 HydrophobicContact CD2-CD1 4.31Å; L546-L552 HydrophobicContact CD2-CD2 3.87Å; F549-L552 HydrophobicContact CB-CD2 4.05Å; F549-L552 HydrophobicContact CB-CG 4.25Å; F549-L552 HydrophobicContact CD2-CD2 4.07Å; F549-L552 HydrophobicContact CG-CD2 4.34Å; L552-S687 WeakPolarHBondContact O-CB 3.23Å
553	W	88.9	Confident	85.6	Confident	9 Å²	9	53.8 Å²	53.8	3%	0.034	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	120.4	178.2	-79.8	110.8	0	0	0	110	D382 V383 C412 L413 M414 L683 A686	D382-W553 HydrophobicContact CB-CH2 3.68Å; D382-W553 HydrophobicContact CB-CZ2 4.04Å; D382-W553 HydrophobicContact CB-CZ3 4.48Å; V383-W553 HydrophobicContact CG2-CD2 4.05Å; V383-W553 HydrophobicContact CG2-CE3 4.27Å; V383-W553 HydrophobicContact CG2-CG 4.2Å; C412-W553 PolarHBondContact O-N 2.91Å; L413-W553 HydrophobicContact CD2-CB 3.88Å; L413-W553 HydrophobicContact CD2-CG 4.35Å; M414-W553 WeakPolarHBondContact CA-O 3.46Å; M414-W553 PolarHBondContact N-O 3.37Å; W553-L683 HydrophobicContact CZ2-CD2 4.45Å; W553-A686 HydrophobicContact CH2-CB 3.65Å; W553-A686 HydrophobicContact CZ3-CB 4.15Å
554	L	86.4	Confident	86.1	Confident	14 Å²	14	55 Å²	55	7%	0.073	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	112.6	169.5	-176.8	67.5	0	0	0	109	M414 Y529 Q556 S690 I691	M414-L554 HydrophobicContact CB-CD1 3.81Å; Y529-L554 HydrophobicContact CD1-CD2 4.38Å; Y529-L554 HydrophobicContact CD2-CD1 3.88Å; Y529-L554 HydrophobicContact CD2-CD2 3.89Å; Y529-L554 HydrophobicContact CE1-CD2 4.18Å; Y529-L554 HydrophobicContact CE2-CD1 4.19Å; Y529-L554 HydrophobicContact CE2-CD2 3.65Å; Y529-L554 HydrophobicContact CG-CD2 4.24Å; L554-Q556 HydrophobicContact CD2-CG 4.21Å; L554-Q556 VanDerWaalsContact CD2-NE2 3.33Å; L554-Q556 HydrophobicContact CG-CG 4.1Å; L554-S690 WeakPolarHBondContact O-CB 3.38Å; L554-I691 HydrophobicContact CB-CG1 4.31Å; L554-I691 HydrophobicContact CD2-CG1 4.26Å
555	I	86	Confident	86.6	Confident	10 Å²	10	56.6 Å²	56.6	5%	0.051	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	106.2	178.1	-51.1	173.5	0	0	0	107.8	H380 V383 M414 G415 D416 V419	H380-I555 VanDerWaalsContact CE1-CG2 3.43Å; H380-I555 WeakPolarHBondContact CE1-CG2 3.15Å; V383-I555 HydrophobicContact CG2-CD1 4.36Å; M414-I555 PolarHBondContact O-N 3.31Å; G415-I555 WeakPolarHBondContact CA-O 3.44Å; D416-I555 PolarHBondContact N-O 2.63Å; V419-I555 HydrophobicContact CB-CB 4.48Å; V419-I555 HydrophobicContact CB-CG2 3.79Å; V419-I555 HydrophobicContact CG1-CG2 3.92Å; V419-I555 HydrophobicContact CG2-CB 4.08Å; V419-I555 HydrophobicContact CG2-CG2 3.93Å
556	Q	82.9	Confident	86.7	Confident	47 Å²	47	62.6 Å²	62.6	22%	0.22	30%	0.3	C	S	.	.			trans	-97.2	138.6	175.7	-62.8	-179.6	5.5	0	0	109.7	Y529 L554 K558	Y529-Q556 VanDerWaalsContact CD1-NE2 3.29Å; L554-Q556 HydrophobicContact CD2-CG 4.21Å; L554-Q556 VanDerWaalsContact CD2-NE2 3.33Å; L554-Q556 HydrophobicContact CG-CG 4.1Å; Q556-K558 PolarHBondContact O-N 3.27Å
557	D	83.2	Confident	87	Confident	79 Å²	79	64.5 Å²	64.5	42%	0.422	31%	0.31	S	S	.	.			trans	-89	86.8	172.6	-174.3	22.9	0	0	0	109.1	D416 V419	D416-D557 HydrophobicContact CB-CB 4.46Å; V419-D557 HydrophobicContact CG1-CB 4.17Å
558	K	82.7	Confident	87.2	Confident	72 Å²	72	65.4 Å²	65.4	31%	0.313	32%	0.32	S	S	.	.			trans	-83.8	126.5	174.5	-71.5	-176	174.6	-173.1	0	108.8	Q556 D560 T693	Q556-K558 PolarHBondContact O-N 3.27Å; K558-D560 PolarHBondContact O-N 2.8Å; K558-T693 VanDerWaalsContact NZ-CG2 3.27Å; K558-T693 PolarHBondContact NZ-O 3.33Å
559	P	83.1	Confident	87.3	Confident	119 Å²	119	68.8 Å²	68.8	77%	0.773	34%	0.337	S	S	*	.			trans	-72.2	92.1	-177.8	29.5	-34.8	0	0	0	110.9
560	D	85.9	Confident	87.1	Confident	92 Å²	92	69.1 Å²	69.1	49%	0.492	34%	0.339	S	S	.	.			trans	-113.2	113.3	-179.9	-75.6	-30	0	0	0	110.7	K558 E562 H563 D564	K558-D560 PolarHBondContact O-N 2.8Å; D560-E562 VanDerWaalsContact C-N 3.28Å; D560-E562 PolarHBondContact O-N 3.46Å; D560-E562 VanDerWaalsContact O-N 3.13Å; D560-H563 HydrophobicContact CB-CB 3.89Å; D560-H563 PolarHBondContact O-N 2.96Å; D560-H563 VanDerWaalsContact O-N 3.08Å; D560-D564 WeakPolarHBondContact O-CB 3.18Å; D560-D564 PolarHBondContact O-N 3.13Å
561	R	89.2	Confident	87	Confident	221 Å²	221	72.2 Å²	72.2	83%	0.834	36%	0.355	S	S	*	.	H	α-helix	trans	-54.6	-38.8	-173.9	179.9	179.8	167.6	128.1	0.1	114.1	L565	R561-L565 WeakPolarHBondContact O-CB 3.32Å; R561-L565 PolarHBondContact O-N 3.4Å
562	E	90	Very high	87	Confident	141 Å²	141	75.8 Å²	75.8	66%	0.659	38%	0.377	S	S	*	.	H	α-helix	trans	-74.8	-39.6	-179.6	-65.9	-175.3	-174.6	0	0	112.2	D560 L565 R566	D560-E562 VanDerWaalsContact C-N 3.28Å; D560-E562 PolarHBondContact O-N 3.46Å; D560-E562 VanDerWaalsContact O-N 3.13Å; E562-L565 PolarHBondContact O-N 2.62Å; E562-R566 WeakPolarHBondContact O-CG 3.49Å; E562-R566 PolarHBondContact O-N 2.99Å; E562-R566 VanDerWaalsContact O-N 3.15Å
563	H	84.6	Confident	87	Confident	70 Å²	70	76.8 Å²	76.8	32%	0.324	38%	0.38	S	S	.	.	H	α-helix	trans	-65.1	-46.2	177.2	-174.1	71	0	0	0	110.3	D560 L565 R566 L567	D560-H563 HydrophobicContact CB-CB 3.89Å; D560-H563 PolarHBondContact O-N 2.96Å; D560-H563 VanDerWaalsContact O-N 3.08Å; H563-L565 VanDerWaalsContact C-N 3.31Å; H563-L565 PolarHBondContact O-N 2.83Å; H563-R566 PolarHBondContact O-N 2.76Å; H563-L567 VanDerWaalsContact O-CB 3.3Å; H563-L567 WeakPolarHBondContact O-CB 3.49Å; H563-L567 PolarHBondContact O-N 2.87Å
564	D	88.2	Confident	86.9	Confident	68 Å²	68	77.5 Å²	77.5	36%	0.364	39%	0.385	S	S	.	.	H	α-helix	trans	-59.4	-41.3	177.3	-66.4	-17.8	0	0	0	111.9	D560 A568	D560-D564 WeakPolarHBondContact O-CB 3.18Å; D560-D564 PolarHBondContact O-N 3.13Å; D564-A568 WeakPolarHBondContact O-CB 3.28Å; D564-A568 PolarHBondContact O-N 3.21Å
565	L	91	Very high	86.9	Confident	90 Å²	90	84.3 Å²	84.3	47%	0.471	42%	0.416	S	S	.	.	H	α-helix	trans	-63.8	-45.8	177.7	-178	149.6	0	0	0	111.5	R561 E562 H563 A568 Q569	R561-L565 WeakPolarHBondContact O-CB 3.32Å; R561-L565 PolarHBondContact O-N 3.4Å; E562-L565 PolarHBondContact O-N 2.62Å; H563-L565 VanDerWaalsContact C-N 3.31Å; H563-L565 PolarHBondContact O-N 2.83Å; L565-A568 PolarHBondContact O-N 3.47Å; L565-Q569 HydrophobicContact CD2-CG 4.36Å; L565-Q569 WeakPolarHBondContact O-CB 3.32Å; L565-Q569 VanDerWaalsContact O-CG 3.3Å; L565-Q569 WeakPolarHBondContact O-CG 3.42Å; L565-Q569 PolarHBondContact O-N 2.83Å
566	R	88.1	Confident	87	Confident	126 Å²	126	90.8 Å²	90.8	48%	0.475	45%	0.448	S	S	.	.	H	α-helix	trans	-67.2	-41.5	178.6	-68.1	-177.2	-168.3	156.4	7.5	111.7	Y378 E562 H563 Q569 H570	Y378-R566 HydrophobicContact CD1-CB 4.37Å; Y378-R566 HydrophobicContact CE1-CB 3.68Å; Y378-R566 VanDerWaalsContact OH-CD 3.28Å; Y378-R566 WeakPolarHBondContact OH-CD 3.37Å; E562-R566 WeakPolarHBondContact O-CG 3.49Å; E562-R566 PolarHBondContact O-N 2.99Å; E562-R566 VanDerWaalsContact O-N 3.15Å; H563-R566 PolarHBondContact O-N 2.76Å; R566-Q569 PolarHBondContact O-N 2.89Å; R566-H570 WeakPolarHBondContact O-CB 3.29Å; R566-H570 PolarHBondContact O-N 2.83Å
567	L	87.3	Confident	87.1	Confident	61 Å²	61	93.9 Å²	93.9	32%	0.319	46%	0.462	S	S	.	.	H	α-helix	trans	-62.2	-44.7	175.7	-179.6	142	0	0	0	111.1	Y378 H563 H570 I571	Y378-L567 HydrophobicContact CD1-CB 4.44Å; H563-L567 VanDerWaalsContact O-CB 3.3Å; H563-L567 WeakPolarHBondContact O-CB 3.49Å; H563-L567 PolarHBondContact O-N 2.87Å; L567-H570 PolarHBondContact O-N 2.87Å; L567-I571 HydrophobicContact CD2-CD1 3.45Å; L567-I571 VanDerWaalsContact CD2-CD1 3.45Å; L567-I571 HydrophobicContact CD2-CG1 4.48Å; L567-I571 HydrophobicContact CG-CD1 3.97Å; L567-I571 VanDerWaalsContact O-CG1 3.31Å; L567-I571 WeakPolarHBondContact O-CG1 3.2Å; L567-I571 PolarHBondContact O-N 2.92Å
568	A	88.5	Confident	86.9	Confident	50 Å²	50	93.2 Å²	93.2	41%	0.413	47%	0.474	S	S	.	.	H	α-helix	trans	-64.2	-41.9	176.5	0	0	0	0	0	112	D564 L565 H570 T572	D564-A568 WeakPolarHBondContact O-CB 3.28Å; D564-A568 PolarHBondContact O-N 3.21Å; L565-A568 PolarHBondContact O-N 3.47Å; A568-H570 VanDerWaalsContact C-N 3.34Å; A568-H570 PolarHBondContact O-N 2.77Å; A568-T572 WeakPolarHBondContact O-CB 3.04Å; A568-T572 VanDerWaalsContact O-CG2 3.28Å; A568-T572 WeakPolarHBondContact O-CG2 3.43Å; A568-T572 PolarHBondContact O-N 2.87Å; A568-T572 PolarHBondContact O-OG1 2.9Å
569	Q	89.8	Confident	86.6	Confident	116 Å²	116	93.5 Å²	93.5	54%	0.542	49%	0.485	S	S	.	.	H	α-helix	trans	-61.5	-42	174.2	-76.7	177.1	-15.4	0	0	111.8	L565 R566 T572 F573	L565-Q569 HydrophobicContact CD2-CG 4.36Å; L565-Q569 WeakPolarHBondContact O-CB 3.32Å; L565-Q569 VanDerWaalsContact O-CG 3.3Å; L565-Q569 WeakPolarHBondContact O-CG 3.42Å; L565-Q569 PolarHBondContact O-N 2.83Å; R566-Q569 PolarHBondContact O-N 2.89Å; Q569-T572 WeakPolarHBondContact CA-OG1 3.25Å; Q569-T572 PolarHBondContact O-OG1 3.4Å; Q569-F573 VanDerWaalsContact O-CB 3.26Å; Q569-F573 WeakPolarHBondContact O-CB 3.47Å; Q569-F573 PolarHBondContact O-N 3.22Å
570	H	85.6	Confident	86.1	Confident	19 Å²	19	88.5 Å²	88.5	9%	0.088	45%	0.454	C	S	.	.	H	α-helix	trans	-65.4	-49	178.1	-171.6	86.9	0	0	0	112.1	P375 E376 Y378 R566 L567 A568 T572 F573 V574 P581	P375-H570 PolarHBondContact O-CE1 2.76Å; P375-H570 VanDerWaalsContact O-CE1 3.31Å; P375-H570 PolarHBondContact O-NE2 2.84Å; E376-H570 PolarHBondContact O-CD2 2.67Å; E376-H570 VanDerWaalsContact O-CD2 3.28Å; E376-H570 PolarHBondContact O-NE2 2.79Å; Y378-H570 HydrophobicContact CD2-CB 4.4Å; Y378-H570 HydrophobicContact CG-CB 4.26Å; R566-H570 WeakPolarHBondContact O-CB 3.29Å; R566-H570 PolarHBondContact O-N 2.83Å; L567-H570 PolarHBondContact O-N 2.87Å; A568-H570 VanDerWaalsContact C-N 3.34Å; A568-H570 PolarHBondContact O-N 2.77Å; H570-T572 PolarHBondContact O-N 3.41Å; H570-F573 WeakPolarHBondContact O-CB 3.39Å; H570-F573 PolarHBondContact O-N 2.99Å; H570-V574 VanDerWaalsContact O-CG2 3.29Å; H570-V574 WeakPolarHBondContact O-CG2 3.41Å; H570-V574 PolarHBondContact O-N 3.38Å; H570-P581 VanDerWaalsContact CE1-CD 3.43Å; H570-P581 WeakPolarHBondContact CE1-CD 3.45Å; H570-P581 WeakPolarHBondContact ND1-CD 2.97Å; H570-P581 WeakPolarHBondContact ND1-CG 3.45Å
571	I	87.7	Confident	85	Confident	73 Å²	73	86.2 Å²	86.2	37%	0.374	44%	0.444	S	S	.	.	H	α-helix	trans	-62.2	-44.7	179	-68.5	172.3	0	0	0	110.7	L567 F573 V574 H575	L567-I571 HydrophobicContact CD2-CD1 3.45Å; L567-I571 VanDerWaalsContact CD2-CD1 3.45Å; L567-I571 HydrophobicContact CD2-CG1 4.48Å; L567-I571 HydrophobicContact CG-CD1 3.97Å; L567-I571 VanDerWaalsContact O-CG1 3.31Å; L567-I571 WeakPolarHBondContact O-CG1 3.2Å; L567-I571 PolarHBondContact O-N 2.92Å; I571-F573 VanDerWaalsContact C-N 3.32Å; I571-F573 PolarHBondContact O-N 2.9Å; I571-V574 PolarHBondContact O-N 2.87Å; I571-H575 PolarHBondContact O-CD2 3.3Å; I571-H575 PolarHBondContact O-N 3.13Å
572	T	89	Confident	83.6	Confident	78 Å²	78	77.8 Å²	77.8	48%	0.479	42%	0.419	S	S	.	.	H	α-helix	trans	-62.6	-40.9	176.7	50.1	0	0	0	0	111.6	A568 Q569 H570 H575 M576	A568-T572 WeakPolarHBondContact O-CB 3.04Å; A568-T572 VanDerWaalsContact O-CG2 3.28Å; A568-T572 WeakPolarHBondContact O-CG2 3.43Å; A568-T572 PolarHBondContact O-N 2.87Å; A568-T572 PolarHBondContact O-OG1 2.9Å; Q569-T572 WeakPolarHBondContact CA-OG1 3.25Å; Q569-T572 PolarHBondContact O-OG1 3.4Å; H570-T572 PolarHBondContact O-N 3.41Å; T572-H575 PolarHBondContact O-N 2.85Å; T572-M576 WeakPolarHBondContact O-CB 3.36Å; T572-M576 VanDerWaalsContact O-CG 3.25Å; T572-M576 WeakPolarHBondContact O-CG 3.28Å; T572-M576 PolarHBondContact O-N 2.63Å
573	F	89.3	Confident	81.9	Confident	57 Å²	57	75.1 Å²	75.1	25%	0.25	42%	0.421	C	S	.	.	H	α-helix	trans	-61.6	-47	175.1	-173.4	-80.7	0	0	0	112.3	Q569 H570 I571 H575 M576 H577 S579 P581	Q569-F573 VanDerWaalsContact O-CB 3.26Å; Q569-F573 WeakPolarHBondContact O-CB 3.47Å; Q569-F573 PolarHBondContact O-N 3.22Å; H570-F573 WeakPolarHBondContact O-CB 3.39Å; H570-F573 PolarHBondContact O-N 2.99Å; I571-F573 VanDerWaalsContact C-N 3.32Å; I571-F573 PolarHBondContact O-N 2.9Å; F573-H575 VanDerWaalsContact C-N 3.3Å; F573-H575 PolarHBondContact O-N 3.15Å; F573-M576 PolarHBondContact O-N 2.99Å; F573-M576 VanDerWaalsContact O-N 3.13Å; F573-H577 HydrophobicContact CD1-CB 4.38Å; F573-H577 AromaticContact CD1-ND1 3.71Å; F573-H577 AromaticContact CD2-CE1 3.5Å; F573-H577 AromaticContact CD2-ND1 3.4Å; F573-H577 WeakPolarHBondContact CD2-ND1 3.44Å; F573-H577 HydrophobicContact CE1-CB 3.97Å; F573-H577 AromaticContact CE1-CG 3.89Å; F573-H577 AromaticContact CE1-ND1 3.66Å; F573-H577 AromaticContact CE2-CE1 3.34Å; F573-H577 WeakPolarHBondContact CE2-CE1 3.3Å; F573-H577 AromaticContact CE2-ND1 3.35Å; F573-H577 WeakPolarHBondContact CE2-ND1 3.29Å; F573-H577 AromaticContact CG-ND1 3.59Å; F573-H577 HydrophobicContact CZ-CB 4.28Å; F573-H577 AromaticContact CZ-CE1 3.86Å; F573-H577 AromaticContact CZ-CG 3.77Å; F573-H577 AromaticContact CZ-ND1 3.5Å; F573-H577 WeakPolarHBondContact CZ-ND1 3.4Å; F573-H577 PolarHBondContact O-N 3.17Å; F573-H577 PolarHBondContact O-ND1 3.27Å; F573-H577 VanDerWaalsContact O-ND1 3.12Å; F573-S579 VanDerWaalsContact CD1-O 3.31Å; F573-S579 WeakPolarHBondContact CD1-O 3.37Å; F573-S579 VanDerWaalsContact CE1-O 3.3Å; F573-S579 WeakPolarHBondContact CE1-O 3.49Å; F573-P581 HydrophobicContact CB-CG 4.5Å; F573-P581 HydrophobicContact CD1-CB 3.66Å; F573-P581 HydrophobicContact CD1-CG 3.88Å; F573-P581 HydrophobicContact CD2-CB 4.23Å; F573-P581 HydrophobicContact CE1-CB 3.63Å; F573-P581 HydrophobicContact CE1-CG 4.31Å; F573-P581 VanDerWaalsContact CE1-N 3.28Å; F573-P581 HydrophobicContact CE2-CB 4.21Å; F573-P581 HydrophobicContact CG-CB 3.96Å; F573-P581 HydrophobicContact CG-CG 4.15Å; F573-P581 HydrophobicContact CZ-CB 3.91Å
574	V	86.9	Confident	80.1	Confident	24 Å²	24	75.2 Å²	75.2	15%	0.145	43%	0.427	C	S	.	.	H	α-helix	trans	-59	-42.6	178.5	170.2	0	0	0	0	110.7	E376 H570 I571 G578 A580	E376-V574 HydrophobicContact CG-CG1 4.36Å; H570-V574 VanDerWaalsContact O-CG2 3.29Å; H570-V574 WeakPolarHBondContact O-CG2 3.41Å; H570-V574 PolarHBondContact O-N 3.38Å; I571-V574 PolarHBondContact O-N 2.87Å; V574-G578 WeakPolarHBondContact O-CA 3.4Å; V574-G578 PolarHBondContact O-N 3.09Å; V574-A580 HydrophobicContact CG2-CB 4.48Å
575	H	86.4	Confident	78.1	Confident	158 Å²	158	78.1 Å²	78.1	73%	0.731	44%	0.442	S	S	*	.	H	α-helix	trans	-71	-30	176.7	-78.3	-67	0	0	0	113.9	I571 T572 F573	I571-H575 PolarHBondContact O-CD2 3.3Å; I571-H575 PolarHBondContact O-N 3.13Å; T572-H575 PolarHBondContact O-N 2.85Å; F573-H575 VanDerWaalsContact C-N 3.3Å; F573-H575 PolarHBondContact O-N 3.15Å
576	M	87.8	Confident	75.9	Confident	146 Å²	146	79 Å²	79	72%	0.719	46%	0.456	S	S	*	.	H	α-helix	trans	-77	-42.1	178.1	-75.2	179.6	70.5	0	0	112.9	T572 F573	T572-M576 WeakPolarHBondContact O-CB 3.36Å; T572-M576 VanDerWaalsContact O-CG 3.25Å; T572-M576 WeakPolarHBondContact O-CG 3.28Å; T572-M576 PolarHBondContact O-N 2.63Å; F573-M576 PolarHBondContact O-N 2.99Å; F573-M576 VanDerWaalsContact O-N 3.13Å
577	H	85.2	Confident	73.5	Confident	111 Å²	111	81.3 Å²	81.3	51%	0.514	47%	0.472	S	S	.	.	H	α-helix	trans	-104	-13.8	-171.9	-58.5	89.7	0	0	0	113.3	F573 S579	F573-H577 HydrophobicContact CD1-CB 4.38Å; F573-H577 AromaticContact CD1-ND1 3.71Å; F573-H577 AromaticContact CD2-CE1 3.5Å; F573-H577 AromaticContact CD2-ND1 3.4Å; F573-H577 WeakPolarHBondContact CD2-ND1 3.44Å; F573-H577 HydrophobicContact CE1-CB 3.97Å; F573-H577 AromaticContact CE1-CG 3.89Å; F573-H577 AromaticContact CE1-ND1 3.66Å; F573-H577 AromaticContact CE2-CE1 3.34Å; F573-H577 WeakPolarHBondContact CE2-CE1 3.3Å; F573-H577 AromaticContact CE2-ND1 3.35Å; F573-H577 WeakPolarHBondContact CE2-ND1 3.29Å; F573-H577 AromaticContact CG-ND1 3.59Å; F573-H577 HydrophobicContact CZ-CB 4.28Å; F573-H577 AromaticContact CZ-CE1 3.86Å; F573-H577 AromaticContact CZ-CG 3.77Å; F573-H577 AromaticContact CZ-ND1 3.5Å; F573-H577 WeakPolarHBondContact CZ-ND1 3.4Å; F573-H577 PolarHBondContact O-N 3.17Å; F573-H577 PolarHBondContact O-ND1 3.27Å; F573-H577 VanDerWaalsContact O-ND1 3.12Å; H577-S579 PolarHBondContact O-N 2.88Å
578	G	79.2	Confident	71.1	Confident	65 Å²	65	86 Å²	86	67%	0.67	50%	0.496	S	S	*	.	S	Bend	trans	66.6	14.8	-173.3	0	0	0	0	0	113.4	V574	V574-G578 WeakPolarHBondContact O-CA 3.4Å; V574-G578 PolarHBondContact O-N 3.09Å
579	S	76.2	Confident	68.5	Low	78 Å²	78	91 Å²	91	55%	0.545	52%	0.515	S	S	.	.	S	Bend	trans	-146.9	148.8	179.8	-69.9	0	0	0	0	108.9	F573 H577	F573-S579 VanDerWaalsContact CD1-O 3.31Å; F573-S579 WeakPolarHBondContact CD1-O 3.37Å; F573-S579 VanDerWaalsContact CE1-O 3.3Å; F573-S579 WeakPolarHBondContact CE1-O 3.49Å; H577-S579 PolarHBondContact O-N 2.88Å
580	A	71.2	Confident	65.8	Low	14 Å²	14	90.4 Å²	90.4	12%	0.116	53%	0.525	C	S	.	.	P	Polyproline II helix	trans	-65.6	147.4	174.3	0	0	0	0	0	110.1	P375 V574 S582 L599	P375-A580 HydrophobicContact CB-CB 3.78Å; P375-A580 WeakPolarHBondContact O-CB 3.48Å; V574-A580 HydrophobicContact CG2-CB 4.48Å; A580-S582 PolarHBondContact O-N 3.07Å; A580-S582 VanDerWaalsContact O-N 3.14Å; A580-L599 HydrophobicContact CB-CD1 4.4Å
581	P	64.1	Low	63.3	Low	44 Å²	44	96.1 Å²	96.1	29%	0.286	56%	0.561	S	S	.	*	P	Polyproline II helix	trans	-63.2	117.5	173.9	25.2	-28.9	0	0	0	109	H570 F573 A583	H570-P581 VanDerWaalsContact CE1-CD 3.43Å; H570-P581 WeakPolarHBondContact CE1-CD 3.45Å; H570-P581 WeakPolarHBondContact ND1-CD 2.97Å; H570-P581 WeakPolarHBondContact ND1-CG 3.45Å; F573-P581 HydrophobicContact CB-CG 4.5Å; F573-P581 HydrophobicContact CD1-CB 3.66Å; F573-P581 HydrophobicContact CD1-CG 3.88Å; F573-P581 HydrophobicContact CD2-CB 4.23Å; F573-P581 HydrophobicContact CE1-CB 3.63Å; F573-P581 HydrophobicContact CE1-CG 4.31Å; F573-P581 VanDerWaalsContact CE1-N 3.28Å; F573-P581 HydrophobicContact CE2-CB 4.21Å; F573-P581 HydrophobicContact CG-CB 3.96Å; F573-P581 HydrophobicContact CG-CG 4.15Å; F573-P581 HydrophobicContact CZ-CB 3.91Å; P581-A583 PolarHBondContact O-N 3.02Å
582	S	59.7	Low	60.8	Low	44 Å²	44	97.9 Å²	97.9	31%	0.308	58%	0.58	S	S	.	*	P	Polyproline II helix	trans	-61	126.2	161.7	-55.2	0	0	0	0	106.4	A580 T584 D585	A580-S582 PolarHBondContact O-N 3.07Å; A580-S582 VanDerWaalsContact O-N 3.14Å; S582-T584 PolarHBondContact O-N 2.76Å; S582-D585 PolarHBondContact O-N 3.35Å
583	A	54.3	Low	57.9	Low	86 Å²	86	99.9 Å²	99.9	71%	0.711	60%	0.597	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57	-4.4	-177.9	0	0	0	0	0	114.2	P581	P581-A583 PolarHBondContact O-N 3.02Å
584	T	46.3	Very low	55.2	Low	71 Å²	71	102.2 Å²	102.2	44%	0.436	62%	0.616	S	S	.	*	T	Hydrogen-bonded Turn	trans	-94.6	-20.8	-174.5	-26.2	0	0	0	0	114.5	S582 S586 Q587 Q597	S582-T584 PolarHBondContact O-N 2.76Å; T584-S586 PolarHBondContact O-N 3.36Å; T584-S586 VanDerWaalsContact O-N 3.13Å; T584-Q587 PolarHBondContact O-N 3.28Å; T584-Q597 PolarHBondContact OG1-OE1 3.34Å
585	D	45.9	Very low	52.6	Low	129 Å²	129	108.7 Å²	108.7	69%	0.69	65%	0.65	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.4	-3.8	-169.1	-77.3	-13.6	0	0	0	114.9	S582	S582-D585 PolarHBondContact O-N 3.35Å
586	S	44.8	Very low	50.3	Low	110 Å²	110	108.5 Å²	108.5	77%	0.769	65%	0.649	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.7	6.3	175.9	36.6	0	0	0	0	115.4	T584	T584-S586 PolarHBondContact O-N 3.36Å; T584-S586 VanDerWaalsContact O-N 3.13Å
587	Q	38	Very low	48.6	Very low	173 Å²	173	106.8 Å²	106.8	81%	0.808	64%	0.639	S	S	*	*			trans	-122.8	83.9	171.4	-68.3	-173.6	2.6	0	0	111.4	T584 D589	T584-Q587 PolarHBondContact O-N 3.28Å; Q587-D589 PolarHBondContact O-N 3.3Å
588	I	37.8	Very low	47.3	Very low	161 Å²	161	109.6 Å²	109.6	83%	0.826	65%	0.653	S	S	*	*			trans	-66.1	89	153.8	-59.3	166.7	0	0	0	105.8
589	D	33.4	Very low	46.6	Very low	153 Å²	153	109.9 Å²	109.9	82%	0.818	64%	0.638	S	S	*	*			trans	-154.7	111.6	153.7	-90.3	-28.8	0	0	0	109.8	Q587 T591	Q587-D589 PolarHBondContact O-N 3.3Å; D589-T591 PolarHBondContact O-N 2.79Å
590	S	33.3	Very low	46.3	Very low	105 Å²	105	107.7 Å²	107.7	73%	0.734	62%	0.62	S	S	*	*			trans	-56.9	121.8	174.9	48.9	0	0	0	0	111.9
591	T	32.3	Very low	46.6	Very low	138 Å²	138	109.2 Å²	109.2	85%	0.847	63%	0.63	S	S	*	*			trans	145.5	69.4	140.8	55.8	0	0	0	0	112.8	D589	D589-T591 PolarHBondContact O-N 2.79Å
592	S	34.7	Very low	47.3	Very low	111 Å²	111	110.6 Å²	110.6	78%	0.776	64%	0.635	S	S	*	*			trans	-169.2	94.2	149.2	49.4	0	0	0	0	109.7	T594	S592-T594 PolarHBondContact O-N 2.99Å; S592-T594 VanDerWaalsContact O-N 3.15Å
593	S	28.9	Very low	48.2	Very low	120 Å²	120	112.6 Å²	112.6	84%	0.839	65%	0.647	S	S	*	*			trans	-66.9	94.4	171.7	47.2	0	0	0	0	111.5
594	T	33	Very low	49.5	Very low	106 Å²	106	113.1 Å²	113.1	65%	0.65	64%	0.635	S	S	*	*			trans	-151.8	79.8	159.7	49	0	0	0	0	111.7	S592 H596	S592-T594 PolarHBondContact O-N 2.99Å; S592-T594 VanDerWaalsContact O-N 3.15Å; T594-H596 VanDerWaalsContact C-N 3.35Å; T594-H596 PolarHBondContact O-CD2 2.85Å; T594-H596 PolarHBondContact O-N 2.7Å
595	N	32.7	Very low	51.3	Low	160 Å²	160	110 Å²	110	86%	0.856	62%	0.615	S	S	*	*			trans	27.7	8.1	144	-70.4	-12.6	0	0	0	125.6
596	H	38.4	Very low	53.1	Low	153 Å²	153	108.4 Å²	108.4	71%	0.708	60%	0.599	S	S	*	*			trans	-113.9	37.3	-156	-74.8	-69.5	0	0	0	120	T594	T594-H596 VanDerWaalsContact C-N 3.35Å; T594-H596 PolarHBondContact O-CD2 2.85Å; T594-H596 PolarHBondContact O-N 2.7Å
597	Q	50.8	Low	54.8	Low	111 Å²	111	106.9 Å²	106.9	52%	0.519	58%	0.577	S	S	.	*			trans	-147.1	44.7	170.4	-67.9	-171.6	-16.3	0	0	114.9	T584	T584-Q597 PolarHBondContact OG1-OE1 3.34Å
598	Q	57.4	Low	56.9	Low	170 Å²	170	98.9 Å²	98.9	79%	0.794	54%	0.539	S	S	*	.	P	Polyproline II helix	trans	-87.1	122.1	167.3	-72.1	-178.7	-9	0	0	109.7	L600	Q598-L600 PolarHBondContact O-N 2.97Å
599	L	64.9	Low	59.2	Low	71 Å²	71	91.9 Å²	91.9	37%	0.372	50%	0.503	S	S	.	.	P	Polyproline II helix	trans	-56	132.3	171.8	-68.3	168	0	0	0	109.4	P375 A580	P375-L599 HydrophobicContact CB-CD1 4.24Å; A580-L599 HydrophobicContact CB-CD1 4.4Å
600	L	70.1	Confident	61.4	Low	31 Å²	31	86.3 Å²	86.3	16%	0.162	48%	0.479	C	S	.	.	P	Polyproline II helix	trans	-66.5	141.1	179	-77.9	81.3	0	0	0	110.8	F365 L368 Q598 L608	F365-L600 HydrophobicContact CE2-CD1 4.28Å; F365-L600 HydrophobicContact CE2-CD2 4.05Å; F365-L600 HydrophobicContact CZ-CD2 3.75Å; L368-L600 HydrophobicContact CD2-CD1 3.62Å; L368-L600 HydrophobicContact CG-CD1 3.78Å; Q598-L600 PolarHBondContact O-N 2.97Å; L600-L608 HydrophobicContact CD2-CD1 3.3Å
601	S	77.1	Confident	63.7	Low	47 Å²	47	81.7 Å²	81.7	33%	0.329	45%	0.446	S	S	.	.	P	Polyproline II helix	trans	-71.1	151.9	173.2	71.4	0	0	0	0	110.9	P603 E604 L605	S601-P603 VanDerWaalsContact C-CD 3.49Å; S601-E604 WeakPolarHBondContact CB-OE2 3.4Å; S601-E604 PolarHBondContact N-OE2 2.96Å; S601-E604 PolarHBondContact O-N 2.73Å; S601-E604 WeakPolarHBondContact OG-CG 3.2Å; S601-E604 PolarHBondContact OG-OE2 3.37Å; S601-L605 PolarHBondContact O-N 3.19Å
602	L	79.1	Confident	66.1	Low	72 Å²	72	75.1 Å²	75.1	38%	0.377	41%	0.406	S	S	.	.	H	α-helix	trans	-50.1	-47.1	175.2	-79.8	165.1	0	0	0	114.5	F427 L431 L605 R606	F427-L602 HydrophobicContact CE1-CD2 4.37Å; F427-L602 HydrophobicContact CE2-CD2 4.09Å; F427-L602 HydrophobicContact CZ-CD2 3.65Å; L431-L602 HydrophobicContact CD1-CD2 4.08Å; L602-L605 PolarHBondContact O-N 3.14Å; L602-R606 WeakPolarHBondContact O-CG 3.48Å; L602-R606 PolarHBondContact O-N 3.17Å
603	P	80.1	Confident	68.3	Low	86 Å²	86	73.1 Å²	73.1	56%	0.558	38%	0.383	S	S	*	.	H	α-helix	trans	-66.8	-36.4	179.9	25.7	-34.5	0	0	0	112.9	S601 R606 R607	S601-P603 VanDerWaalsContact C-CD 3.49Å; P603-R606 PolarHBondContact O-N 3.27Å; P603-R607 WeakPolarHBondContact O-CB 3.46Å; P603-R607 PolarHBondContact O-N 2.96Å
604	E	81.3	Confident	70.6	Confident	98 Å²	98	71.5 Å²	71.5	46%	0.458	38%	0.377	S	S	.	.	H	α-helix	trans	-64.9	-44.8	174.9	-70.5	165.5	156.8	0	0	110.9	S601 R606 R607 L608	S601-E604 WeakPolarHBondContact CB-OE2 3.4Å; S601-E604 PolarHBondContact N-OE2 2.96Å; S601-E604 PolarHBondContact O-N 2.73Å; S601-E604 WeakPolarHBondContact OG-CG 3.2Å; S601-E604 PolarHBondContact OG-OE2 3.37Å; E604-R606 VanDerWaalsContact C-N 3.31Å; E604-R606 PolarHBondContact O-N 2.87Å; E604-R607 WeakPolarHBondContact O-CB 3.29Å; E604-R607 PolarHBondContact O-N 2.64Å; E604-R607 VanDerWaalsContact O-N 3.15Å; E604-L608 WeakPolarHBondContact O-CD1 3.45Å; E604-L608 VanDerWaalsContact O-CG 3.29Å; E604-L608 WeakPolarHBondContact O-CG 3.42Å; E604-L608 PolarHBondContact O-N 3.3Å
605	L	83.6	Confident	72.6	Confident	4 Å²	4	67.8 Å²	67.8	2%	0.021	35%	0.352	C	S	.	.	H	α-helix	trans	-60.1	-41.8	176.9	-172.8	64.6	0	0	0	111.5	M369 L431 S601 L602 L608 I609	M369-L605 HydrophobicContact CB-CD1 4.26Å; M369-L605 HydrophobicContact CG-CD1 4.14Å; M369-L605 HydrophobicContact SD-CD1 4.38Å; L431-L605 HydrophobicContact CD1-CB 4.28Å; L431-L605 HydrophobicContact CD1-CD2 3.81Å; L431-L605 HydrophobicContact CD1-CG 4.06Å; L431-L605 HydrophobicContact CD2-CD2 3.56Å; L431-L605 HydrophobicContact CD2-CG 4.24Å; L431-L605 HydrophobicContact CG-CD2 4.38Å; S601-L605 PolarHBondContact O-N 3.19Å; L602-L605 PolarHBondContact O-N 3.14Å; L605-L608 PolarHBondContact O-N 2.93Å; L605-I609 HydrophobicContact CD1-CD1 4.41Å; L605-I609 HydrophobicContact CG-CD1 4.06Å; L605-I609 WeakPolarHBondContact O-CD1 3.25Å; L605-I609 VanDerWaalsContact O-CG1 3.25Å; L605-I609 WeakPolarHBondContact O-CG1 3.42Å; L605-I609 PolarHBondContact O-N 3.15Å
606	R	83.2	Confident	74.7	Confident	96 Å²	96	65 Å²	65	36%	0.362	34%	0.343	S	S	.	.	H	α-helix	trans	-61	-45.6	174	-72.7	-173.2	-172.3	148.7	-0.7	112.2	R430 L431 L602 P603 E604 I609 A610	R430-R606 PolarHBondContact O-NE 3.14Å; R430-R606 PolarHBondContact O-NH2 3.1Å; L431-R606 HydrophobicContact CD1-CG 3.63Å; L431-R606 WeakPolarHBondContact O-CD 3.28Å; L431-R606 VanDerWaalsContact O-CG 3.28Å; L431-R606 WeakPolarHBondContact O-CG 3.37Å; L431-R606 PolarHBondContact O-NE 3.49Å; L602-R606 WeakPolarHBondContact O-CG 3.48Å; L602-R606 PolarHBondContact O-N 3.17Å; P603-R606 PolarHBondContact O-N 3.27Å; E604-R606 VanDerWaalsContact C-N 3.31Å; E604-R606 PolarHBondContact O-N 2.87Å; R606-I609 PolarHBondContact O-N 3.5Å; R606-A610 WeakPolarHBondContact O-CB 3.38Å; R606-A610 PolarHBondContact O-N 3.33Å
607	R	81.2	Confident	76.7	Confident	78 Å²	78	60.5 Å²	60.5	29%	0.294	33%	0.333	S	S	.	.	H	α-helix	trans	-60.8	-46.9	178.7	-179.3	176	170.4	165	-4.5	110.9	N350 E356 P603 E604 I609 A610 V611	N350-R607 VanDerWaalsContact CG-NH2 3.26Å; N350-R607 PolarHBondContact ND2-NH1 2.82Å; N350-R607 PolarHBondContact OD1-NH2 3.39Å; E356-R607 VanDerWaalsContact CD-NE 3.26Å; E356-R607 WeakPolarHBondContact OE1-CD 3.38Å; E356-R607 IonicContact OE1-CZ 3.33Å; E356-R607 IonicContact OE1-NE 3.83Å; E356-R607 PolarHBondContact OE1-NE 2.93Å; E356-R607 IonicContact OE1-NH1 2.76Å; E356-R607 IonicContact OE1-NH2 2.69Å; E356-R607 PolarHBondContact OE1-NH2 2.71Å; E356-R607 IonicContact OE2-CZ 2.81Å; E356-R607 IonicContact OE2-NE 3.95Å; E356-R607 PolarHBondContact OE2-NE 3.04Å; E356-R607 IonicContact OE2-NH2 2.88Å; E356-R607 PolarHBondContact OE2-NH2 3.07Å; E356-R607 VanDerWaalsContact OE2-NH2 3.11Å; P603-R607 WeakPolarHBondContact O-CB 3.46Å; P603-R607 PolarHBondContact O-N 2.96Å; E604-R607 WeakPolarHBondContact O-CB 3.29Å; E604-R607 PolarHBondContact O-N 2.64Å; E604-R607 VanDerWaalsContact O-N 3.15Å; R607-I609 PolarHBondContact O-N 3Å; R607-A610 WeakPolarHBondContact O-CB 3.34Å; R607-A610 PolarHBondContact O-N 2.92Å; R607-A610 VanDerWaalsContact O-N 3.11Å; R607-V611 WeakPolarHBondContact O-CG2 3.35Å; R607-V611 PolarHBondContact O-N 3.25Å
608	L	82.2	Confident	78.4	Confident	5 Å²	5	55.6 Å²	55.6	3%	0.026	31%	0.31	C	S	.	.	H	α-helix	trans	-63	-42.3	178.8	-69.8	163	0	0	0	112.7	E356 L360 F365 L600 E604 L605 A610 V611 A612	E356-L608 HydrophobicContact CB-CD2 4.31Å; E356-L608 HydrophobicContact CG-CD2 4.48Å; L360-L608 HydrophobicContact CD1-CD2 4.36Å; L360-L608 HydrophobicContact CD2-CD2 4.33Å; L360-L608 HydrophobicContact CG-CD2 4.17Å; F365-L608 HydrophobicContact CE1-CD1 4.08Å; F365-L608 HydrophobicContact CZ-CD1 3.59Å; F365-L608 HydrophobicContact CZ-CD2 4.41Å; L600-L608 HydrophobicContact CD2-CD1 3.3Å; E604-L608 WeakPolarHBondContact O-CD1 3.45Å; E604-L608 VanDerWaalsContact O-CG 3.29Å; E604-L608 WeakPolarHBondContact O-CG 3.42Å; E604-L608 PolarHBondContact O-N 3.3Å; L605-L608 PolarHBondContact O-N 2.93Å; L608-A610 VanDerWaalsContact C-N 3.28Å; L608-A610 PolarHBondContact O-N 2.88Å; L608-V611 PolarHBondContact O-N 3.46Å; L608-A612 WeakPolarHBondContact O-CB 3.16Å; L608-A612 PolarHBondContact O-N 3.36Å
609	I	84.5	Confident	79.8	Confident	14 Å²	14	50.3 Å²	50.3	7%	0.072	30%	0.296	C	S	.	.	H	α-helix	trans	-62.9	-37.7	174.4	-67.4	165.4	0	0	0	110.6	L391 L431 L605 R606 R607 A612 K613	L391-I609 HydrophobicContact CB-CD1 4.3Å; L391-I609 HydrophobicContact CB-CG2 4.47Å; L391-I609 HydrophobicContact CD1-CD1 4.2Å; L431-I609 HydrophobicContact CD2-CD1 4.1Å; L431-I609 HydrophobicContact CG-CD1 4.35Å; L605-I609 HydrophobicContact CD1-CD1 4.41Å; L605-I609 HydrophobicContact CG-CD1 4.06Å; L605-I609 WeakPolarHBondContact O-CD1 3.25Å; L605-I609 VanDerWaalsContact O-CG1 3.25Å; L605-I609 WeakPolarHBondContact O-CG1 3.42Å; L605-I609 PolarHBondContact O-N 3.15Å; R606-I609 PolarHBondContact O-N 3.5Å; R607-I609 PolarHBondContact O-N 3Å; I609-A612 PolarHBondContact O-N 3.16Å; I609-K613 WeakPolarHBondContact O-CG 3.24Å; I609-K613 PolarHBondContact O-N 3.31Å
610	A	80.8	Confident	80.8	Confident	36 Å²	36	49.5 Å²	49.5	30%	0.298	29%	0.293	S	S	.	.	H	α-helix	trans	-66.1	-43.5	175.8	0	0	0	0	0	111.8	R606 R607 L608 A612 K613 A614	R606-A610 WeakPolarHBondContact O-CB 3.38Å; R606-A610 PolarHBondContact O-N 3.33Å; R607-A610 WeakPolarHBondContact O-CB 3.34Å; R607-A610 PolarHBondContact O-N 2.92Å; R607-A610 VanDerWaalsContact O-N 3.11Å; L608-A610 VanDerWaalsContact C-N 3.28Å; L608-A610 PolarHBondContact O-N 2.88Å; A610-A612 PolarHBondContact O-N 3.23Å; A610-K613 WeakPolarHBondContact O-CB 3.49Å; A610-K613 PolarHBondContact O-N 3.03Å; A610-K613 VanDerWaalsContact O-N 3.14Å; A610-A614 PolarHBondContact O-N 3.39Å
611	V	81.5	Confident	81.7	Confident	9 Å²	9	48.9 Å²	48.9	6%	0.055	29%	0.291	C	S	.	.	H	α-helix	trans	-59.8	-46.4	174.3	171.6	0	0	0	0	110.9	P352 I357 L360 R607 L608 K613 A614 Q615	P352-V611 HydrophobicContact CB-CG1 3.85Å; P352-V611 HydrophobicContact CB-CG2 4.35Å; I357-V611 HydrophobicContact CG1-CG1 4.38Å; L360-V611 HydrophobicContact CD1-CG1 4.04Å; R607-V611 WeakPolarHBondContact O-CG2 3.35Å; R607-V611 PolarHBondContact O-N 3.25Å; L608-V611 PolarHBondContact O-N 3.46Å; V611-K613 PolarHBondContact O-N 3.32Å; V611-A614 PolarHBondContact O-N 3.25Å; V611-A614 VanDerWaalsContact O-N 3.16Å; V611-Q615 WeakPolarHBondContact O-CG 3.38Å; V611-Q615 PolarHBondContact O-N 3.04Å
612	A	81.7	Confident	82.2	Confident	0 Å²	0	50.8 Å²	50.8	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-62	-29	176.8	0	0	0	0	0	113	V392 L608 I609 A610 L666	V392-A612 HydrophobicContact CG1-CB 4.49Å; L608-A612 WeakPolarHBondContact O-CB 3.16Å; L608-A612 PolarHBondContact O-N 3.36Å; I609-A612 PolarHBondContact O-N 3.16Å; A610-A612 PolarHBondContact O-N 3.23Å; A612-L666 HydrophobicContact CB-CD2 4.31Å
613	K	81.6	Confident	82.7	Confident	69 Å²	69	53.9 Å²	53.9	30%	0.3	32%	0.322	S	S	.	.	H	α-helix	trans	-78.3	-33.8	174.2	-79.7	-179.3	174	176.8	0	113.9	L391 V392 I609 A610 V611 Q615	L391-K613 WeakPolarHBondContact O-CE 3.36Å; L391-K613 PolarHBondContact O-NZ 2.83Å; V392-K613 WeakPolarHBondContact O-CE 3.48Å; V392-K613 WeakPolarHBondContact O-CG 3.49Å; I609-K613 WeakPolarHBondContact O-CG 3.24Å; I609-K613 PolarHBondContact O-N 3.31Å; A610-K613 WeakPolarHBondContact O-CB 3.49Å; A610-K613 PolarHBondContact O-N 3.03Å; A610-K613 VanDerWaalsContact O-N 3.14Å; V611-K613 PolarHBondContact O-N 3.32Å; K613-Q615 VanDerWaalsContact C-N 3.25Å; K613-Q615 PolarHBondContact O-N 2.86Å
614	A	77.6	Confident	83.1	Confident	86 Å²	86	50.2 Å²	50.2	71%	0.711	30%	0.298	S	S	*	.	H	α-helix	trans	-72.6	-20.8	-178.3	0	0	0	0	0	112.8	A610 V611	A610-A614 PolarHBondContact O-N 3.39Å; V611-A614 PolarHBondContact O-N 3.25Å; V611-A614 VanDerWaalsContact O-N 3.16Å
615	Q	75.4	Confident	83.4	Confident	28 Å²	28	47.7 Å²	47.7	13%	0.131	29%	0.293	C	S	.	.	S	Bend	trans	-65	153.6	-179.9	-77.1	167.2	2	0	0	113.4	V611 K613 R665 A668	V611-Q615 WeakPolarHBondContact O-CG 3.38Å; V611-Q615 PolarHBondContact O-N 3.04Å; K613-Q615 VanDerWaalsContact C-N 3.25Å; K613-Q615 PolarHBondContact O-N 2.86Å; Q615-R665 PolarHBondContact OE1-O 2.78Å; Q615-R665 VanDerWaalsContact OE1-O 3.05Å; Q615-A668 VanDerWaalsContact CD-CB 3.44Å
616	P	75.8	Confident	83.7	Confident	100 Å²	100	53.9 Å²	53.9	65%	0.649	33%	0.327	S	S	*	.	P	Polyproline II helix	trans	-57.5	144.8	-179.3	23.5	-33.9	0	0	0	111.5	P618	P616-P618 WeakPolarHBondContact O-CD 3.5Å
617	A	80.9	Confident	84	Confident	60 Å²	60	53.2 Å²	53.2	50%	0.496	33%	0.325	S	S	.	.	P	Polyproline II helix	trans	-62	120.6	180	0	0	0	0	0	111	V395	V395-A617 HydrophobicContact CB-CB 4.45Å; V395-A617 HydrophobicContact CG1-CB 3.69Å; V395-A617 HydrophobicContact CG2-CB 3.84Å
618	P	87	Confident	84.4	Confident	8 Å²	8	50 Å²	50	5%	0.052	31%	0.313	C	S	.	.	P	Polyproline II helix	trans	-65.7	138.6	-180	23.8	-34.5	0	0	0	111.9	V395 P616 T661 A664 R665 S670 V672	V395-P618 HydrophobicContact CG2-CG 3.92Å; P616-P618 WeakPolarHBondContact O-CD 3.5Å; P618-T661 HydrophobicContact CG-CG2 4.48Å; P618-A664 HydrophobicContact CB-CB 3.84Å; P618-A664 HydrophobicContact CG-CB 3.93Å; P618-R665 HydrophobicContact CG-CG 3.93Å; P618-S670 CarbonylContact C-O 3.59Å; P618-S670 VanDerWaalsContact CA-O 3.23Å; P618-S670 WeakPolarHBondContact CA-O 3.48Å; P618-V672 HydrophobicContact CB-CG2 4.36Å
619	A	86.3	Confident	84.7	Confident	59 Å²	59	53.6 Å²	53.6	49%	0.488	34%	0.335	S	S	.	.	B	Isolated β-bridge	trans	-87.7	141.4	173.8	0	0	0	0	0	110.9	P621 S670 E671 V672	A619-P621 WeakPolarHBondContact O-CD 3.36Å; A619-S670 PolarHBondContact N-O 3.36Å; A619-E671 WeakPolarHBondContact O-CA 3.34Å; A619-V672 PolarHBondContact O-N 2.76Å; A619-V672 VanDerWaalsContact O-N 3.09Å
620	V	85	Confident	85	Confident	53 Å²	53	54.5 Å²	54.5	32%	0.321	35%	0.348	S	S	.	.	P	Polyproline II helix	trans	-86.1	116.5	170.3	-178.9	0	0	0	0	107.9	L628 M657 T661 V672	V620-L628 HydrophobicContact CG1-CD1 4.33Å; V620-M657 HydrophobicContact CG2-CE 4.32Å; V620-T661 HydrophobicContact CG2-CG2 4.14Å; V620-V672 HydrophobicContact CG2-CG2 4.09Å
621	P	89.1	Confident	85.2	Confident	19 Å²	19	53.2 Å²	53.2	12%	0.123	34%	0.337	C	S	.	.	P	Polyproline II helix	trans	-73.9	144.3	-178.9	31.9	-36.5	0	0	0	111.3	A619 H623 L624	A619-P621 WeakPolarHBondContact O-CD 3.36Å; P621-H623 VanDerWaalsContact C-N 3.27Å; P621-H623 WeakPolarHBondContact CB-CE1 3.47Å; P621-H623 VanDerWaalsContact CG-CE1 3.46Å; P621-H623 WeakPolarHBondContact CG-CE1 3.49Å; P621-H623 PolarHBondContact O-N 3.2Å; P621-L624 HydrophobicContact CG-CB 4.45Å; P621-L624 HydrophobicContact CG-CD1 3.57Å; P621-L624 HydrophobicContact CG-CG 3.89Å; P621-L624 PolarHBondContact O-N 2.81Å; P621-L624 VanDerWaalsContact O-N 3.15Å
622	A	88.3	Confident	85.4	Confident	87 Å²	87	54 Å²	54	72%	0.719	34%	0.34	S	S	*	.	G	3₁₀ helix	trans	-61.6	-30.7	-172.5	0	0	0	0	0	113.9	L624 A625	A622-L624 PolarHBondContact O-N 3.19Å; A622-A625 VanDerWaalsContact O-CB 3.26Å; A622-A625 WeakPolarHBondContact O-CB 3.48Å; A622-A625 PolarHBondContact O-N 2.94Å; A622-A625 VanDerWaalsContact O-N 3.12Å
623	H	89.5	Confident	85.8	Confident	137 Å²	137	58.1 Å²	58.1	63%	0.634	36%	0.364	S	S	*	.	G	3₁₀ helix	trans	-66.9	-20.3	-179.9	66.8	-93.6	0	0	0	113.5	P621	P621-H623 VanDerWaalsContact C-N 3.27Å; P621-H623 WeakPolarHBondContact CB-CE1 3.47Å; P621-H623 VanDerWaalsContact CG-CE1 3.46Å; P621-H623 WeakPolarHBondContact CG-CE1 3.49Å; P621-H623 PolarHBondContact O-N 3.2Å
624	L	88.9	Confident	86	Confident	9 Å²	9	61 Å²	61	5%	0.047	38%	0.379	C	S	.	.	G	3₁₀ helix	trans	-87	-9.9	176.1	-63.1	178.8	0	0	0	112.8	P621 A622 D626 Y627 L628 V672 K674 I677	P621-L624 HydrophobicContact CG-CB 4.45Å; P621-L624 HydrophobicContact CG-CD1 3.57Å; P621-L624 HydrophobicContact CG-CG 3.89Å; P621-L624 PolarHBondContact O-N 2.81Å; P621-L624 VanDerWaalsContact O-N 3.15Å; A622-L624 PolarHBondContact O-N 3.19Å; L624-D626 PolarHBondContact O-N 2.85Å; L624-Y627 WeakPolarHBondContact O-CB 3.25Å; L624-Y627 PolarHBondContact O-N 2.89Å; L624-L628 WeakPolarHBondContact O-CG 3.33Å; L624-L628 PolarHBondContact O-N 3.46Å; L624-V672 VanDerWaalsContact CD1-O 3.22Å; L624-V672 WeakPolarHBondContact CD1-O 3.3Å; L624-K674 HydrophobicContact CD2-CB 4.11Å; L624-I677 HydrophobicContact CB-CD1 3.9Å; L624-I677 HydrophobicContact CD1-CD1 3.76Å; L624-I677 HydrophobicContact CD2-CD1 4.41Å; L624-I677 HydrophobicContact CG-CD1 4.23Å
625	A	87.8	Confident	86.2	Confident	44 Å²	44	57.4 Å²	57.4	36%	0.364	35%	0.348	S	S	.	.	H	α-helix	trans	-61.6	-44.5	179.9	0	0	0	0	0	111.5	A622 Y627 L628 V629	A622-A625 VanDerWaalsContact O-CB 3.26Å; A622-A625 WeakPolarHBondContact O-CB 3.48Å; A622-A625 PolarHBondContact O-N 2.94Å; A622-A625 VanDerWaalsContact O-N 3.12Å; A625-Y627 VanDerWaalsContact C-N 3.28Å; A625-Y627 PolarHBondContact O-N 3.18Å; A625-L628 PolarHBondContact O-N 3.2Å; A625-V629 VanDerWaalsContact O-CG2 3.3Å; A625-V629 WeakPolarHBondContact O-CG2 3.42Å; A625-V629 PolarHBondContact O-N 2.85Å
626	D	89.8	Confident	86.6	Confident	134 Å²	134	61 Å²	61	72%	0.717	36%	0.36	S	S	*	.	H	α-helix	trans	-63.8	-36.7	177.7	-65.7	-22.8	0	0	0	111.5	L624 V629 G630	L624-D626 PolarHBondContact O-N 2.85Å; D626-V629 PolarHBondContact O-N 3.38Å; D626-G630 PolarHBondContact O-N 3.19Å
627	Y	89.9	Confident	87.1	Confident	82 Å²	82	63.9 Å²	63.9	32%	0.322	36%	0.362	S	S	.	.	H	α-helix	trans	-66.5	-45.8	176.4	-172.6	-112.7	0	0	0	112	L624 A625 V629 G630 A631 K674 I677 D678 M681	L624-Y627 WeakPolarHBondContact O-CB 3.25Å; L624-Y627 PolarHBondContact O-N 2.89Å; A625-Y627 VanDerWaalsContact C-N 3.28Å; A625-Y627 PolarHBondContact O-N 3.18Å; Y627-V629 VanDerWaalsContact C-N 3.31Å; Y627-V629 PolarHBondContact O-N 3.4Å; Y627-G630 PolarHBondContact O-N 2.86Å; Y627-A631 WeakPolarHBondContact O-CB 3.33Å; Y627-A631 PolarHBondContact O-N 3.21Å; Y627-K674 HydrophobicContact CD1-CG 4.26Å; Y627-K674 HydrophobicContact CE1-CD 4.46Å; Y627-K674 HydrophobicContact CE1-CG 3.97Å; Y627-I677 HydrophobicContact CD1-CD1 4.46Å; Y627-I677 HydrophobicContact CD1-CG2 4.2Å; Y627-I677 HydrophobicContact CE1-CG2 4.1Å; Y627-D678 WeakPolarHBondContact CE1-OD1 3.47Å; Y627-D678 PolarHBondContact OH-OD1 3.16Å; Y627-M681 HydrophobicContact CE1-CE 3.93Å
628	L	88.9	Confident	87.1	Confident	11 Å²	11	65.9 Å²	65.9	6%	0.058	36%	0.361	C	S	.	.	H	α-helix	trans	-60	-41	175.4	-74.4	168.5	0	0	0	112.1	V620 L624 A625 Y632 L653 I656 M657 I677	V620-L628 HydrophobicContact CG1-CD1 4.33Å; L624-L628 WeakPolarHBondContact O-CG 3.33Å; L624-L628 PolarHBondContact O-N 3.46Å; A625-L628 PolarHBondContact O-N 3.2Å; L628-Y632 VanDerWaalsContact O-CB 3.31Å; L628-Y632 WeakPolarHBondContact O-CB 3.46Å; L628-Y632 PolarHBondContact O-N 3.23Å; L628-L653 HydrophobicContact CB-CD1 4.36Å; L628-I656 HydrophobicContact CD2-CG2 3.85Å; L628-M657 HydrophobicContact CD1-CG 4.4Å; L628-I677 HydrophobicContact CD1-CD1 4.34Å; L628-I677 HydrophobicContact CD2-CB 4.43Å; L628-I677 HydrophobicContact CD2-CD1 3.81Å; L628-I677 HydrophobicContact CD2-CG1 4.02Å; L628-I677 HydrophobicContact CD2-CG2 3.55Å; L628-I677 HydrophobicContact CG-CD1 3.92Å
629	V	89.4	Confident	86.7	Confident	81 Å²	81	66.2 Å²	66.2	49%	0.491	36%	0.364	S	S	.	.	H	α-helix	trans	-67.2	-45.1	177.2	173	0	0	0	0	110.7	A625 D626 Y627 Y632 V633	A625-V629 VanDerWaalsContact O-CG2 3.3Å; A625-V629 WeakPolarHBondContact O-CG2 3.42Å; A625-V629 PolarHBondContact O-N 2.85Å; D626-V629 PolarHBondContact O-N 3.38Å; Y627-V629 VanDerWaalsContact C-N 3.31Å; Y627-V629 PolarHBondContact O-N 3.4Å; V629-Y632 PolarHBondContact O-N 2.94Å; V629-V633 HydrophobicContact CG1-CG2 4.44Å; V629-V633 VanDerWaalsContact O-CG2 3.27Å; V629-V633 WeakPolarHBondContact O-CG2 3.17Å; V629-V633 PolarHBondContact O-N 3.38Å
630	G	89.8	Confident	86.3	Confident	33 Å²	33	72.2 Å²	72.2	34%	0.34	37%	0.374	S	S	.	.	H	α-helix	trans	-56.9	-51.7	176.1	0	0	0	0	0	112.1	D626 Y627 Y632 V633 E634	D626-G630 PolarHBondContact O-N 3.19Å; Y627-G630 PolarHBondContact O-N 2.86Å; G630-Y632 PolarHBondContact O-N 2.98Å; G630-V633 PolarHBondContact O-N 3.17Å; G630-V633 VanDerWaalsContact O-N 3.15Å; G630-E634 PolarHBondContact O-N 3.38Å
631	A	84.8	Confident	86.1	Confident	8 Å²	8	73.3 Å²	73.3	7%	0.066	39%	0.389	C	S	.	.	H	α-helix	trans	-57.3	-45.9	176.2	0	0	0	0	0	112.8	Y627 V633 E634 M635 M681	Y627-A631 WeakPolarHBondContact O-CB 3.33Å; Y627-A631 PolarHBondContact O-N 3.21Å; A631-V633 VanDerWaalsContact C-N 3.31Å; A631-V633 PolarHBondContact O-N 3.49Å; A631-E634 PolarHBondContact O-N 2.89Å; A631-M635 WeakPolarHBondContact O-CG 3.49Å; A631-M635 PolarHBondContact O-N 3.44Å; A631-M681 HydrophobicContact CB-SD 3.31Å; A631-M681 WeakPolarHBondContact CB-SD 3.5Å
632	Y	87	Confident	85.4	Confident	27 Å²	27	76 Å²	76	11%	0.106	40%	0.403	C	S	.	.	H	α-helix	trans	-63	-37.2	177.6	172.1	-105.6	0	0	0	112.6	L628 V629 G630 R636 A650 T652 L653	L628-Y632 VanDerWaalsContact O-CB 3.31Å; L628-Y632 WeakPolarHBondContact O-CB 3.46Å; L628-Y632 PolarHBondContact O-N 3.23Å; V629-Y632 PolarHBondContact O-N 2.94Å; G630-Y632 PolarHBondContact O-N 2.98Å; Y632-R636 VanDerWaalsContact O-CB 3.31Å; Y632-R636 WeakPolarHBondContact O-CB 3.45Å; Y632-R636 PolarHBondContact O-N 2.99Å; Y632-A650 WeakPolarHBondContact OH-CA 2.98Å; Y632-T652 WeakPolarHBondContact CE2-OG1 3.19Å; Y632-L653 HydrophobicContact CD2-CB 4.08Å; Y632-L653 HydrophobicContact CE2-CB 4.36Å; Y632-L653 HydrophobicContact CG-CB 4.4Å; Y632-L653 HydrophobicContact CG-CD1 4.39Å
633	V	88.7	Confident	84.3	Confident	85 Å²	85	82 Å²	82	52%	0.515	41%	0.413	S	S	.	.	H	α-helix	trans	-66	-41.5	176.2	170.5	0	0	0	0	111	V629 G630 A631 R636 K637	V629-V633 HydrophobicContact CG1-CG2 4.44Å; V629-V633 VanDerWaalsContact O-CG2 3.27Å; V629-V633 WeakPolarHBondContact O-CG2 3.17Å; V629-V633 PolarHBondContact O-N 3.38Å; G630-V633 PolarHBondContact O-N 3.17Å; G630-V633 VanDerWaalsContact O-N 3.15Å; A631-V633 VanDerWaalsContact C-N 3.31Å; A631-V633 PolarHBondContact O-N 3.49Å; V633-R636 PolarHBondContact O-N 3.46Å; V633-K637 WeakPolarHBondContact O-CB 3.34Å; V633-K637 PolarHBondContact O-N 3.35Å
634	E	86.1	Confident	82.9	Confident	130 Å²	130	82.7 Å²	82.7	61%	0.607	42%	0.416	S	S	*	.	H	α-helix	trans	-61.7	-51.5	175.1	-71.5	179.6	168.1	0	0	111.3	G630 A631 R636 K637 E638	G630-E634 PolarHBondContact O-N 3.38Å; A631-E634 PolarHBondContact O-N 2.89Å; E634-R636 PolarHBondContact O-N 3.37Å; E634-R636 VanDerWaalsContact O-N 3.16Å; E634-K637 WeakPolarHBondContact O-CA 3.47Å; E634-K637 WeakPolarHBondContact O-CB 3.32Å; E634-K637 PolarHBondContact O-N 3.3Å; E634-E638 PolarHBondContact O-N 3.13Å
635	M	82.7	Confident	81.7	Confident	11 Å²	11	83.5 Å²	83.5	5%	0.054	42%	0.42	C	S	.	.	H	α-helix	trans	-56.7	-35.7	176.8	-69.7	-172.7	86.7	0	0	113	A631 A639 I656 M684 R688	A631-M635 WeakPolarHBondContact O-CG 3.49Å; A631-M635 PolarHBondContact O-N 3.44Å; M635-A639 WeakPolarHBondContact O-CB 3.32Å; M635-A639 PolarHBondContact O-N 3.37Å; M635-A639 VanDerWaalsContact O-N 3.11Å; M635-I656 HydrophobicContact SD-CD1 3.89Å; M635-M684 HydrophobicContact CE-CB 3.93Å; M635-M684 HydrophobicContact CE-CE 4.45Å; M635-R688 PolarHBondContact O-NH1 3.38Å
636	R	83.8	Confident	80.6	Confident	104 Å²	104	83.2 Å²	83.2	39%	0.392	41%	0.414	S	S	.	.	H	α-helix	trans	-76.8	-31.6	177.9	-166.1	174.1	-170.1	-173	3.4	112.3	Y632 V633 E634 R640	Y632-R636 VanDerWaalsContact O-CB 3.31Å; Y632-R636 WeakPolarHBondContact O-CB 3.45Å; Y632-R636 PolarHBondContact O-N 2.99Å; V633-R636 PolarHBondContact O-N 3.46Å; E634-R636 PolarHBondContact O-N 3.37Å; E634-R636 VanDerWaalsContact O-N 3.16Å; R636-R640 WeakPolarHBondContact O-CG 3.35Å; R636-R640 PolarHBondContact O-N 3.22Å; R636-R640 VanDerWaalsContact O-N 3.13Å
637	K	86	Confident	79.5	Confident	160 Å²	160	85.2 Å²	85.2	70%	0.696	41%	0.412	S	S	*	.	H	α-helix	trans	-66.7	-44.1	174.1	-173.3	-178.2	176.5	-173.1	0	110.4	V633 E634 R640 A641	V633-K637 WeakPolarHBondContact O-CB 3.34Å; V633-K637 PolarHBondContact O-N 3.35Å; E634-K637 WeakPolarHBondContact O-CA 3.47Å; E634-K637 WeakPolarHBondContact O-CB 3.32Å; E634-K637 PolarHBondContact O-N 3.3Å; K637-R640 PolarHBondContact O-N 3.41Å; K637-A641 PolarHBondContact O-N 2.95Å; K637-A641 VanDerWaalsContact O-N 3.12Å
638	E	81.1	Confident	78.8	Confident	102 Å²	102	82.4 Å²	82.4	48%	0.477	40%	0.404	S	S	.	.	H	α-helix	trans	-62.7	-43.4	174.4	-68.2	179.5	169	0	0	112.1	E634 R640 A641 N642	E634-E638 PolarHBondContact O-N 3.13Å; E638-R640 PolarHBondContact O-N 3.22Å; E638-A641 PolarHBondContact O-N 2.94Å; E638-A641 VanDerWaalsContact O-N 3.16Å; E638-N642 PolarHBondContact O-N 3.36Å
639	A	77.4	Confident	78.2	Confident	14 Å²	14	82.8 Å²	82.8	12%	0.116	41%	0.408	C	S	.	.	H	α-helix	trans	-60.2	-33	175.9	0	0	0	0	0	113	M635 N642 M645 T648 R688	M635-A639 WeakPolarHBondContact O-CB 3.32Å; M635-A639 PolarHBondContact O-N 3.37Å; M635-A639 VanDerWaalsContact O-N 3.11Å; A639-N642 VanDerWaalsContact O-O 3.09Å; A639-M645 HydrophobicContact CB-CG 4.46Å; A639-T648 HydrophobicContact CB-CG2 3.6Å; A639-T648 WeakPolarHBondContact CB-OG1 3.46Å; A639-R688 VanDerWaalsContact CB-NH2 3.33Å
640	R	79.3	Confident	77.9	Confident	185 Å²	185	82.4 Å²	82.4	70%	0.698	41%	0.413	S	S	*	.	H	α-helix	trans	-76.9	-31	177.3	-76.5	176.7	177.2	-176.4	-0.1	113	R636 K637 E638	R636-R640 WeakPolarHBondContact O-CG 3.35Å; R636-R640 PolarHBondContact O-N 3.22Å; R636-R640 VanDerWaalsContact O-N 3.13Å; K637-R640 PolarHBondContact O-N 3.41Å; E638-R640 PolarHBondContact O-N 3.22Å
641	A	80.4	Confident	77.7	Confident	77 Å²	77	83.2 Å²	83.2	64%	0.636	41%	0.406	S	S	*	.	H	α-helix	trans	-68.7	-38.5	178.1	0	0	0	0	0	111.2	K637 E638	K637-A641 PolarHBondContact O-N 2.95Å; K637-A641 VanDerWaalsContact O-N 3.12Å; E638-A641 PolarHBondContact O-N 2.94Å; E638-A641 VanDerWaalsContact O-N 3.16Å
642	N	73	Confident	77.8	Confident	76 Å²	76	84.1 Å²	84.1	41%	0.406	41%	0.41	S	S	.	.			trans	-102.2	105.3	-176.7	-66.7	-9.4	0	0	0	111	E638 A639 E644 M645	E638-N642 PolarHBondContact O-N 3.36Å; A639-N642 VanDerWaalsContact O-O 3.09Å; N642-E644 PolarHBondContact O-N 2.87Å; N642-M645 HydrophobicContact CB-CB 3.93Å; N642-M645 VanDerWaalsContact O-CB 3.28Å; N642-M645 WeakPolarHBondContact O-CB 3.21Å; N642-M645 PolarHBondContact O-N 3.18Å; N642-M645 VanDerWaalsContact O-N 3.13Å
643	K	65.1	Low	77.9	Confident	212 Å²	212	85.1 Å²	85.1	92%	0.922	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.8	-23	178.5	-74.7	-179.1	179.6	175.3	0	114.2	M645	K643-M645 VanDerWaalsContact C-N 3.3Å
644	E	60.7	Low	77.9	Confident	151 Å²	151	84.1 Å²	84.1	71%	0.706	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.8	-8.7	179.9	-65.2	174.8	-176	0	0	112.8	N642	N642-E644 PolarHBondContact O-N 2.87Å
645	M	63	Low	78	Confident	27 Å²	27	78 Å²	78	13%	0.133	38%	0.38	C	S	.	.	S	Bend	trans	-79.7	141.3	-177.9	-174.5	68.1	97.4	0	0	111.2	A639 N642 K643 R688 I692	A639-M645 HydrophobicContact CB-CG 4.46Å; N642-M645 HydrophobicContact CB-CB 3.93Å; N642-M645 VanDerWaalsContact O-CB 3.28Å; N642-M645 WeakPolarHBondContact O-CB 3.21Å; N642-M645 PolarHBondContact O-N 3.18Å; N642-M645 VanDerWaalsContact O-N 3.13Å; K643-M645 VanDerWaalsContact C-N 3.3Å; M645-R688 HydrophobicContact CE-CB 4.26Å; M645-R688 HydrophobicContact SD-CB 4.17Å; M645-R688 HydrophobicContact SD-CG 4.5Å; M645-R688 PolarHBondContact SD-NE 2.89Å; M645-R688 VanDerWaalsContact SD-NE 3.4Å; M645-I692 HydrophobicContact CE-CD1 3.41Å; M645-I692 VanDerWaalsContact CE-CD1 3.41Å; M645-I692 HydrophobicContact CE-CG1 4.29Å; M645-I692 HydrophobicContact SD-CD1 4.25Å
646	T	64.9	Low	78.4	Confident	37 Å²	37	77.6 Å²	77.6	23%	0.227	38%	0.378	C	S	.	.			trans	-54.8	150.1	179.7	52.3	0	0	0	0	113.3	V535 T648 I691	V535-T646 HydrophobicContact CB-CG2 4.4Å; V535-T646 HydrophobicContact CG1-CG2 4.34Å; V535-T646 HydrophobicContact CG2-CG2 4.18Å; T646-T648 PolarHBondContact O-N 2.92Å; T646-I691 HydrophobicContact CG2-CD1 3.83Å
647	Y	67.5	Low	78.7	Confident	176 Å²	176	75.3 Å²	75.3	69%	0.69	37%	0.373	S	S	*	.			trans	-59.9	105.8	178.6	-177.7	-96.7	0	0	0	111.8	S649	Y647-S649 PolarHBondContact O-N 3.17Å
648	T	74.7	Confident	78.9	Confident	24 Å²	24	68.5 Å²	68.5	15%	0.147	34%	0.343	C	S	.	.			trans	-81.1	109.6	171.9	56.7	0	0	0	0	110.3	A639 T646	A639-T648 HydrophobicContact CB-CG2 3.6Å; A639-T648 WeakPolarHBondContact CB-OG1 3.46Å; T646-T648 PolarHBondContact O-N 2.92Å
649	S	77.3	Confident	79.5	Confident	19 Å²	19	63.7 Å²	63.7	13%	0.133	32%	0.32	C	S	.	.			trans	-93.1	167.3	176.1	76.2	0	0	0	0	111.8	Y647 R651 T652	Y647-S649 PolarHBondContact O-N 3.17Å; S649-R651 PolarHBondContact O-N 2.69Å; S649-R651 VanDerWaalsContact O-N 3.11Å; S649-R651 WeakPolarHBondContact OG-CB 3.37Å; S649-R651 PolarHBondContact OG-N 2.71Å; S649-T652 PolarHBondContact O-N 3.39Å; S649-T652 VanDerWaalsContact O-N 3.15Å; S649-T652 PolarHBondContact O-OG1 2.99Å
650	A	83.1	Confident	80.1	Confident	73 Å²	73	63.1 Å²	63.1	60%	0.603	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-16.7	171.2	0	0	0	0	0	113.4	Y632 T652 L653	Y632-A650 WeakPolarHBondContact OH-CA 2.98Å; A650-T652 VanDerWaalsContact C-N 3.25Å; A650-T652 PolarHBondContact O-N 3.37Å; A650-L653 PolarHBondContact O-N 2.56Å
651	R	85.7	Confident	80.7	Confident	50 Å²	50	54.8 Å²	54.8	19%	0.189	29%	0.285	C	S	.	.	H	α-helix	trans	-68.9	-22.7	176.4	-170.5	174.7	-72.7	119.5	-3.7	112.3	E497 S547 S649 L653 L654 A655	E497-R651 IonicContact OE1-CZ 2.64Å; E497-R651 IonicContact OE1-NH2 3.65Å; E497-R651 PolarHBondContact OE1-NH2 3.47Å; E497-R651 IonicContact OE2-CZ 3.39Å; E497-R651 IonicContact OE2-NH2 3.42Å; E497-R651 PolarHBondContact OE2-NH2 2.86Å; S547-R651 VanDerWaalsContact O-CD 3.29Å; S547-R651 WeakPolarHBondContact O-CD 2.95Å; S547-R651 PolarHBondContact O-NH1 3.14Å; S649-R651 PolarHBondContact O-N 2.69Å; S649-R651 VanDerWaalsContact O-N 3.11Å; S649-R651 WeakPolarHBondContact OG-CB 3.37Å; S649-R651 PolarHBondContact OG-N 2.71Å; R651-L653 PolarHBondContact O-N 3.19Å; R651-L654 WeakPolarHBondContact O-CA 3.45Å; R651-L654 WeakPolarHBondContact O-CB 3.33Å; R651-L654 PolarHBondContact O-N 2.78Å; R651-A655 PolarHBondContact O-N 2.77Å
652	T	86.6	Confident	81.2	Confident	27 Å²	27	51.1 Å²	51.1	17%	0.166	26%	0.255	C	S	.	.	H	α-helix	trans	-63.8	-31.8	177	57.2	0	0	0	0	112.2	Y632 S649 A650 L654 A655 I656 M684	Y632-T652 WeakPolarHBondContact CE2-OG1 3.19Å; S649-T652 PolarHBondContact O-N 3.39Å; S649-T652 VanDerWaalsContact O-N 3.15Å; S649-T652 PolarHBondContact O-OG1 2.99Å; A650-T652 VanDerWaalsContact C-N 3.25Å; A650-T652 PolarHBondContact O-N 3.37Å; T652-L654 VanDerWaalsContact C-N 3.33Å; T652-L654 PolarHBondContact O-N 2.86Å; T652-A655 WeakPolarHBondContact O-CB 3.49Å; T652-A655 PolarHBondContact O-N 2.94Å; T652-I656 WeakPolarHBondContact O-CG1 3.5Å; T652-I656 PolarHBondContact O-N 3.41Å; T652-M684 HydrophobicContact CG2-CE 4.07Å
653	L	88.9	Confident	82	Confident	47 Å²	47	49.4 Å²	49.4	25%	0.246	24%	0.242	C	C	.	.	H	α-helix	trans	-61.3	-43.4	171.9	-179.3	65.6	0	0	0	111.2	L628 Y632 A650 R651 A655 I656 M657	L628-L653 HydrophobicContact CB-CD1 4.36Å; Y632-L653 HydrophobicContact CD2-CB 4.08Å; Y632-L653 HydrophobicContact CE2-CB 4.36Å; Y632-L653 HydrophobicContact CG-CB 4.4Å; Y632-L653 HydrophobicContact CG-CD1 4.39Å; A650-L653 PolarHBondContact O-N 2.56Å; R651-L653 PolarHBondContact O-N 3.19Å; L653-A655 VanDerWaalsContact C-N 3.31Å; L653-A655 PolarHBondContact O-N 3.47Å; L653-I656 PolarHBondContact O-N 3.28Å; L653-M657 WeakPolarHBondContact O-CG 3.29Å; L653-M657 PolarHBondContact O-N 2.97Å; L653-M657 VanDerWaalsContact O-N 3.08Å
654	L	88.3	Confident	83.2	Confident	65 Å²	65	39.3 Å²	39.3	34%	0.34	20%	0.199	S	C	.	.	H	α-helix	trans	-65.4	-35.8	175.3	-61.6	175.8	0	0	0	111.7	R651 T652 M657 R658	R651-L654 WeakPolarHBondContact O-CA 3.45Å; R651-L654 WeakPolarHBondContact O-CB 3.33Å; R651-L654 PolarHBondContact O-N 2.78Å; T652-L654 VanDerWaalsContact C-N 3.33Å; T652-L654 PolarHBondContact O-N 2.86Å; L654-M657 PolarHBondContact O-N 2.9Å; L654-R658 WeakPolarHBondContact O-CG 3.46Å; L654-R658 PolarHBondContact O-N 2.85Å
655	A	88.9	Confident	84.4	Confident	1 Å²	1	33.9 Å²	33.9	1%	0.008	17%	0.172	C	C	.	.	H	α-helix	trans	-62.2	-46.3	175	0	0	0	0	0	111.5	D550 R651 T652 L653 M657 R658 L659	D550-A655 HydrophobicContact CB-CB 3.75Å; R651-A655 PolarHBondContact O-N 2.77Å; T652-A655 WeakPolarHBondContact O-CB 3.49Å; T652-A655 PolarHBondContact O-N 2.94Å; L653-A655 VanDerWaalsContact C-N 3.31Å; L653-A655 PolarHBondContact O-N 3.47Å; A655-M657 VanDerWaalsContact C-N 3.32Å; A655-M657 PolarHBondContact O-N 2.89Å; A655-R658 PolarHBondContact O-N 2.74Å; A655-R658 VanDerWaalsContact O-N 3.17Å; A655-L659 WeakPolarHBondContact O-CG 3.47Å; A655-L659 PolarHBondContact O-N 3.12Å
656	I	91.2	Very high	85.6	Confident	2 Å²	2	32.9 Å²	32.9	1%	0.01	17%	0.167	C	C	.	.	H	α-helix	trans	-59.9	-43.5	176.4	-65.6	165.5	0	0	0	110.5	L628 M635 T652 L653 R658 L659 S660 I677 A680 M684	L628-I656 HydrophobicContact CD2-CG2 3.85Å; M635-I656 HydrophobicContact SD-CD1 3.89Å; T652-I656 WeakPolarHBondContact O-CG1 3.5Å; T652-I656 PolarHBondContact O-N 3.41Å; L653-I656 PolarHBondContact O-N 3.28Å; I656-R658 PolarHBondContact O-N 3.31Å; I656-L659 PolarHBondContact O-N 3.36Å; I656-S660 WeakPolarHBondContact O-CB 3.3Å; I656-S660 PolarHBondContact O-N 3.27Å; I656-S660 PolarHBondContact O-OG 3.44Å; I656-I677 HydrophobicContact CG2-CG2 4.37Å; I656-A680 HydrophobicContact CG2-CB 4.35Å; I656-M684 HydrophobicContact CG1-CG 4.17Å
657	M	89.6	Confident	86.5	Confident	57 Å²	57	34 Å²	34	28%	0.281	17%	0.167	S	C	.	.	H	α-helix	trans	-62.5	-40.7	175.6	-70.3	-178	67.1	0	0	112.9	V620 L628 L653 L654 A655 S660 T661	V620-M657 HydrophobicContact CG2-CE 4.32Å; L628-M657 HydrophobicContact CD1-CG 4.4Å; L653-M657 WeakPolarHBondContact O-CG 3.29Å; L653-M657 PolarHBondContact O-N 2.97Å; L653-M657 VanDerWaalsContact O-N 3.08Å; L654-M657 PolarHBondContact O-N 2.9Å; A655-M657 VanDerWaalsContact C-N 3.32Å; A655-M657 PolarHBondContact O-N 2.89Å; M657-S660 PolarHBondContact O-OG 3.35Å; M657-T661 WeakPolarHBondContact O-CB 3.4Å; M657-T661 WeakPolarHBondContact O-CG2 3.28Å; M657-T661 PolarHBondContact O-N 3.18Å; M657-T661 PolarHBondContact O-OG1 3.33Å
658	R	90.9	Very high	87.2	Confident	17 Å²	17	26.9 Å²	26.9	6%	0.064	14%	0.144	C	C	.	.	H	α-helix	trans	-67.5	-41.6	177.2	-71.7	175.3	-170.2	134.4	7	112	R406 L409 D550 L654 A655 I656 T661 A662	R406-R658 VanDerWaalsContact CG-CZ 3.44Å; R406-R658 VanDerWaalsContact NH2-NH1 3.17Å; R406-R658 PolarHBondContact O-NE 2.97Å; R406-R658 PolarHBondContact O-NH2 3.17Å; L409-R658 HydrophobicContact CD2-CB 3.59Å; L409-R658 HydrophobicContact CG-CB 4.45Å; D550-R658 IonicContact OD1-NH1 3.87Å; D550-R658 PolarHBondContact OD1-NH1 3.21Å; D550-R658 IonicContact OD2-NH1 2.88Å; L654-R658 WeakPolarHBondContact O-CG 3.46Å; L654-R658 PolarHBondContact O-N 2.85Å; A655-R658 PolarHBondContact O-N 2.74Å; A655-R658 VanDerWaalsContact O-N 3.17Å; I656-R658 PolarHBondContact O-N 3.31Å; R658-T661 WeakPolarHBondContact CA-OG1 3.11Å; R658-T661 PolarHBondContact O-OG1 3.05Å; R658-A662 VanDerWaalsContact O-CB 3.28Å; R658-A662 WeakPolarHBondContact O-CB 3.27Å; R658-A662 PolarHBondContact O-N 3.15Å
659	L	92	Very high	87.7	Confident	1 Å²	1	26.9 Å²	26.9	1%	0.005	15%	0.147	C	C	.	.	H	α-helix	trans	-65	-43.2	177.1	-71.3	167.6	0	0	0	111.4	L389 L409 L551 A655 I656 A662 R663 A680 M684	L389-L659 HydrophobicContact CB-CD2 4.3Å; L389-L659 HydrophobicContact CD1-CD2 3.81Å; L409-L659 HydrophobicContact CD1-CD2 3.68Å; L409-L659 HydrophobicContact CD2-CD2 3.87Å; L409-L659 HydrophobicContact CD2-CG 3.99Å; L409-L659 HydrophobicContact CG-CD2 4.44Å; L551-L659 HydrophobicContact CD1-CD1 4.15Å; L551-L659 HydrophobicContact CD1-CD2 3.89Å; L551-L659 HydrophobicContact CD2-CD1 4.02Å; L551-L659 HydrophobicContact CG-CD1 4.14Å; A655-L659 WeakPolarHBondContact O-CG 3.47Å; A655-L659 PolarHBondContact O-N 3.12Å; I656-L659 PolarHBondContact O-N 3.36Å; L659-A662 PolarHBondContact O-N 2.78Å; L659-R663 PolarHBondContact O-N 3.13Å; L659-A680 HydrophobicContact CB-CB 3.8Å; L659-M684 HydrophobicContact CD1-CG 4.32Å; L659-M684 HydrophobicContact CD1-SD 4.44Å
660	S	92	Very high	88.1	Confident	1 Å²	1	29.9 Å²	29.9	1%	0.007	17%	0.168	C	C	.	.	H	α-helix	trans	-67.1	-40.6	178.7	67.9	0	0	0	0	112.1	I656 M657 R663 A664	I656-S660 WeakPolarHBondContact O-CB 3.3Å; I656-S660 PolarHBondContact O-N 3.27Å; I656-S660 PolarHBondContact O-OG 3.44Å; M657-S660 PolarHBondContact O-OG 3.35Å; S660-R663 PolarHBondContact O-N 2.95Å; S660-A664 WeakPolarHBondContact O-CB 3.26Å; S660-A664 PolarHBondContact O-N 2.78Å
661	T	91.7	Very high	88.5	Confident	11 Å²	11	32 Å²	32	7%	0.067	17%	0.165	C	C	.	.	H	α-helix	trans	-67.4	-37.7	173.6	54.9	0	0	0	0	112.9	V395 P618 V620 M657 R658 R663 A664 R665 V672	V395-T661 HydrophobicContact CG2-CG2 4.37Å; P618-T661 HydrophobicContact CG-CG2 4.48Å; V620-T661 HydrophobicContact CG2-CG2 4.14Å; M657-T661 WeakPolarHBondContact O-CB 3.4Å; M657-T661 WeakPolarHBondContact O-CG2 3.28Å; M657-T661 PolarHBondContact O-N 3.18Å; M657-T661 PolarHBondContact O-OG1 3.33Å; R658-T661 WeakPolarHBondContact CA-OG1 3.11Å; R658-T661 PolarHBondContact O-OG1 3.05Å; T661-R663 VanDerWaalsContact C-N 3.33Å; T661-A664 PolarHBondContact O-N 2.8Å; T661-R665 PolarHBondContact O-N 3.42Å; T661-V672 HydrophobicContact CG2-CG2 4.03Å
662	A	90.3	Very high	88.7	Confident	0 Å²	0	29.8 Å²	29.8	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-63.4	-39.7	174	0	0	0	0	0	111.6	L389 L409 R658 L659 R665 L666	L389-A662 HydrophobicContact CB-CB 4.45Å; L389-A662 HydrophobicContact CD2-CB 4.07Å; L409-A662 HydrophobicContact CD1-CB 4.27Å; R658-A662 VanDerWaalsContact O-CB 3.28Å; R658-A662 WeakPolarHBondContact O-CB 3.27Å; R658-A662 PolarHBondContact O-N 3.15Å; L659-A662 PolarHBondContact O-N 2.78Å; A662-R665 WeakPolarHBondContact O-CB 3.24Å; A662-R665 PolarHBondContact O-N 3.03Å; A662-L666 PolarHBondContact O-N 2.8Å
663	R	90.2	Very high	88.9	Confident	39 Å²	39	30.7 Å²	30.7	15%	0.147	16%	0.164	C	C	.	.	H	α-helix	trans	-69.3	-39.5	175.2	-168.3	176.1	179.1	-147.1	2.1	112.6	L389 L659 S660 T661 R665 L666 R667 G675 D676	L389-R663 HydrophobicContact CD2-CB 3.93Å; L659-R663 PolarHBondContact O-N 3.13Å; S660-R663 PolarHBondContact O-N 2.95Å; T661-R663 VanDerWaalsContact C-N 3.33Å; R663-R665 VanDerWaalsContact C-N 3.29Å; R663-R665 PolarHBondContact O-N 3.43Å; R663-L666 WeakPolarHBondContact O-CB 3.36Å; R663-L666 PolarHBondContact O-N 2.88Å; R663-L666 VanDerWaalsContact O-N 3.14Å; R663-R667 PolarHBondContact O-N 3.28Å; R663-G675 VanDerWaalsContact NH1-C 3.34Å; R663-G675 PolarHBondContact NH1-O 2.9Å; R663-D676 HydrophobicContact CB-CB 4.44Å; R663-D676 WeakPolarHBondContact CG-OD1 3.42Å; R663-D676 IonicContact NE-OD1 2.77Å; R663-D676 IonicContact NH1-OD1 3.24Å
664	A	89.3	Confident	89	Confident	0 Å²	0	33.5 Å²	33.5	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-61.8	-37.5	175.2	0	0	0	0	0	112.1	P618 S660 T661 R667 A668 A669 V672	P618-A664 HydrophobicContact CB-CB 3.84Å; P618-A664 HydrophobicContact CG-CB 3.93Å; S660-A664 WeakPolarHBondContact O-CB 3.26Å; S660-A664 PolarHBondContact O-N 2.78Å; T661-A664 PolarHBondContact O-N 2.8Å; A664-R667 PolarHBondContact O-N 2.87Å; A664-A668 PolarHBondContact O-N 3.45Å; A664-A669 PolarHBondContact O-N 2.79Å; A664-A669 VanDerWaalsContact O-N 3.14Å; A664-V672 HydrophobicContact CB-CG2 3.99Å
665	R	87.2	Confident	89.1	Confident	37 Å²	37	32 Å²	32	14%	0.14	18%	0.175	C	C	.	.	H	α-helix	trans	-60.7	-42	171.2	-78.9	-178.1	169.8	170.9	-4.1	112.8	V392 G393 G394 Q615 P618 T661 A662 R663 R667 A668	V392-R665 HydrophobicContact CG1-CB 3.9Å; G393-R665 PolarHBondContact O-NH1 2.95Å; G394-R665 PolarHBondContact O-NH1 2.84Å; Q615-R665 PolarHBondContact OE1-O 2.78Å; Q615-R665 VanDerWaalsContact OE1-O 3.05Å; P618-R665 HydrophobicContact CG-CG 3.93Å; T661-R665 PolarHBondContact O-N 3.42Å; A662-R665 WeakPolarHBondContact O-CB 3.24Å; A662-R665 PolarHBondContact O-N 3.03Å; R663-R665 VanDerWaalsContact C-N 3.29Å; R663-R665 PolarHBondContact O-N 3.43Å; R665-R667 VanDerWaalsContact C-N 3.29Å; R665-R667 PolarHBondContact O-N 2.74Å; R665-A668 PolarHBondContact O-N 2.65Å; R665-A668 VanDerWaalsContact O-N 3.1Å
666	L	86.5	Confident	89.1	Confident	6 Å²	6	32 Å²	32	3%	0.031	18%	0.175	C	C	.	.	H	α-helix	trans	-60.8	-38	176.3	-76.9	166.8	0	0	0	113.1	Y366 M369 L388 L389 V392 A612 A662 R663 A668	Y366-L666 HydrophobicContact CD2-CD1 4.11Å; Y366-L666 HydrophobicContact CE2-CD1 4.11Å; M369-L666 HydrophobicContact CE-CD2 3.9Å; L388-L666 HydrophobicContact CD2-CD1 3.15Å; L388-L666 HydrophobicContact CD2-CD2 3.73Å; L388-L666 HydrophobicContact CD2-CG 4.03Å; L389-L666 HydrophobicContact CD2-CD1 3.69Å; V392-L666 HydrophobicContact CB-CD2 4.49Å; V392-L666 HydrophobicContact CB-CG 4.45Å; V392-L666 HydrophobicContact CG1-CG 4.31Å; V392-L666 HydrophobicContact CG2-CD1 4.15Å; V392-L666 HydrophobicContact CG2-CD2 3.32Å; V392-L666 HydrophobicContact CG2-CG 3.68Å; A612-L666 HydrophobicContact CB-CD2 4.31Å; A662-L666 PolarHBondContact O-N 2.8Å; R663-L666 WeakPolarHBondContact O-CB 3.36Å; R663-L666 PolarHBondContact O-N 2.88Å; R663-L666 VanDerWaalsContact O-N 3.14Å; L666-A668 PolarHBondContact O-N 2.73Å
667	R	84.5	Confident	89.1	Confident	62 Å²	62	31.9 Å²	31.9	23%	0.234	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.5	-0.4	178.1	-62.8	-170.4	-58.8	95.1	7.5	113.6	R663 A664 R665 A669 E671 D676	R663-R667 PolarHBondContact O-N 3.28Å; A664-R667 PolarHBondContact O-N 2.87Å; R665-R667 VanDerWaalsContact C-N 3.29Å; R665-R667 PolarHBondContact O-N 2.74Å; R667-A669 HydrophobicContact CB-CB 4.41Å; R667-A669 PolarHBondContact O-N 2.93Å; R667-E671 PolarHBondContact NH2-O 3.44Å; R667-D676 IonicContact CZ-OD1 2.9Å; R667-D676 IonicContact CZ-OD2 2.95Å; R667-D676 IonicContact NE-OD1 2.8Å; R667-D676 PolarHBondContact NE-OD1 3.32Å; R667-D676 IonicContact NE-OD2 3.28Å; R667-D676 PolarHBondContact NE-OD2 3.49Å; R667-D676 IonicContact NH2-OD1 2.84Å; R667-D676 IonicContact NH2-OD2 3.43Å; R667-D676 PolarHBondContact NH2-OD2 2.88Å
668	A	82.5	Confident	89.3	Confident	25 Å²	25	32 Å²	32	21%	0.207	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	54.3	33.4	-171.4	0	0	0	0	0	114.8	I357 Q615 A664 R665 L666	I357-A668 HydrophobicContact CG2-CB 3.89Å; Q615-A668 VanDerWaalsContact CD-CB 3.44Å; A664-A668 PolarHBondContact O-N 3.45Å; R665-A668 PolarHBondContact O-N 2.65Å; R665-A668 VanDerWaalsContact O-N 3.1Å; L666-A668 PolarHBondContact O-N 2.73Å
669	A	84.2	Confident	89.2	Confident	25 Å²	25	32.5 Å²	32.5	21%	0.207	18%	0.179	C	C	.	.			trans	-98.2	138.3	-179.8	0	0	0	0	0	111.1	A664 R667 E671	A664-A669 PolarHBondContact O-N 2.79Å; A664-A669 VanDerWaalsContact O-N 3.14Å; R667-A669 HydrophobicContact CB-CB 4.41Å; R667-A669 PolarHBondContact O-N 2.93Å; A669-E671 VanDerWaalsContact C-N 3.28Å; A669-E671 PolarHBondContact O-N 3.02Å
670	S	86.7	Confident	89.1	Confident	81 Å²	81	32.6 Å²	32.6	57%	0.566	18%	0.18	S	C	*	.	S	Bend	trans	-74.7	-16.9	175.1	55.8	0	0	0	0	113.6	P618 A619	P618-S670 CarbonylContact C-O 3.59Å; P618-S670 VanDerWaalsContact CA-O 3.23Å; P618-S670 WeakPolarHBondContact CA-O 3.48Å; A619-S670 PolarHBondContact N-O 3.36Å
671	E	90.3	Very high	89	Confident	118 Å²	118	33.5 Å²	33.5	55%	0.551	18%	0.184	S	C	*	.	B	Isolated β-bridge	trans	-127.7	142.1	-178.3	-63.1	-174.2	177.2	0	0	111.2	A619 R667 A669	A619-E671 WeakPolarHBondContact O-CA 3.34Å; R667-E671 PolarHBondContact NH2-O 3.44Å; A669-E671 VanDerWaalsContact C-N 3.28Å; A669-E671 PolarHBondContact O-N 3.02Å
672	V	90.7	Very high	89	Confident	4 Å²	4	36.9 Å²	36.9	2%	0.024	20%	0.196	C	C	.	.			trans	-73.4	127.8	173.9	-179.1	0	0	0	0	109.7	P618 A619 V620 L624 T661 A664 D676 I677	P618-V672 HydrophobicContact CB-CG2 4.36Å; A619-V672 PolarHBondContact O-N 2.76Å; A619-V672 VanDerWaalsContact O-N 3.09Å; V620-V672 HydrophobicContact CG2-CG2 4.09Å; L624-V672 VanDerWaalsContact CD1-O 3.22Å; L624-V672 WeakPolarHBondContact CD1-O 3.3Å; T661-V672 HydrophobicContact CG2-CG2 4.03Å; A664-V672 HydrophobicContact CB-CG2 3.99Å; V672-D676 HydrophobicContact CG1-CB 4.06Å; V672-I677 HydrophobicContact CG1-CG1 4.21Å
673	S	90.3	Very high	89	Confident	45 Å²	45	36.9 Å²	36.9	32%	0.315	20%	0.196	S	C	.	.			trans	-91.3	159.7	176.9	73.4	0	0	0	0	111.6	G675 D676	S673-G675 PolarHBondContact O-N 3.02Å; S673-D676 WeakPolarHBondContact CB-OD2 3.41Å; S673-D676 PolarHBondContact N-OD2 2.8Å; S673-D676 WeakPolarHBondContact O-CB 3.44Å; S673-D676 PolarHBondContact O-N 3.24Å; S673-D676 VanDerWaalsContact O-N 3.11Å; S673-D676 PolarHBondContact OG-N 3.09Å; S673-D676 PolarHBondContact OG-OD2 3.38Å
674	K	91.4	Very high	88.8	Confident	107 Å²	107	35.6 Å²	35.6	47%	0.465	19%	0.191	S	C	.	.	H	α-helix	trans	-56.9	-40.4	171.9	-171.5	-174.8	175.3	-172.5	0	111.7	L624 Y627 D676 I677 D678	L624-K674 HydrophobicContact CD2-CB 4.11Å; Y627-K674 HydrophobicContact CD1-CG 4.26Å; Y627-K674 HydrophobicContact CE1-CD 4.46Å; Y627-K674 HydrophobicContact CE1-CG 3.97Å; K674-D676 PolarHBondContact O-N 3.28Å; K674-I677 WeakPolarHBondContact O-CB 3.3Å; K674-I677 PolarHBondContact O-N 2.84Å; K674-D678 PolarHBondContact O-N 3.19Å
675	G	89.7	Confident	88.7	Confident	33 Å²	33	40.1 Å²	40.1	34%	0.34	21%	0.213	S	C	.	.	H	α-helix	trans	-59.5	-31.6	178	0	0	0	0	0	113.2	R663 S673 D678 E679	R663-G675 VanDerWaalsContact NH1-C 3.34Å; R663-G675 PolarHBondContact NH1-O 2.9Å; S673-G675 PolarHBondContact O-N 3.02Å; G675-D678 PolarHBondContact O-N 3.43Å; G675-E679 PolarHBondContact O-N 3.47Å; G675-E679 VanDerWaalsContact O-N 3.11Å
676	D	90.6	Very high	88.5	Confident	1 Å²	1	39.4 Å²	39.4	1%	0.005	21%	0.214	C	C	.	.	H	α-helix	trans	-66.5	-39.3	175.6	-59.1	-50.4	0	0	0	112.4	R663 R667 V672 S673 K674 A680	R663-D676 HydrophobicContact CB-CB 4.44Å; R663-D676 WeakPolarHBondContact CG-OD1 3.42Å; R663-D676 IonicContact NE-OD1 2.77Å; R663-D676 IonicContact NH1-OD1 3.24Å; R667-D676 IonicContact CZ-OD1 2.9Å; R667-D676 IonicContact CZ-OD2 2.95Å; R667-D676 IonicContact NE-OD1 2.8Å; R667-D676 PolarHBondContact NE-OD1 3.32Å; R667-D676 IonicContact NE-OD2 3.28Å; R667-D676 PolarHBondContact NE-OD2 3.49Å; R667-D676 IonicContact NH2-OD1 2.84Å; R667-D676 IonicContact NH2-OD2 3.43Å; R667-D676 PolarHBondContact NH2-OD2 2.88Å; V672-D676 HydrophobicContact CG1-CB 4.06Å; S673-D676 WeakPolarHBondContact CB-OD2 3.41Å; S673-D676 PolarHBondContact N-OD2 2.8Å; S673-D676 WeakPolarHBondContact O-CB 3.44Å; S673-D676 PolarHBondContact O-N 3.24Å; S673-D676 VanDerWaalsContact O-N 3.11Å; S673-D676 PolarHBondContact OG-N 3.09Å; S673-D676 PolarHBondContact OG-OD2 3.38Å; K674-D676 PolarHBondContact O-N 3.28Å; D676-A680 WeakPolarHBondContact O-CB 3.26Å; D676-A680 PolarHBondContact O-N 2.89Å
677	I	91.3	Very high	88.3	Confident	0 Å²	0	39.4 Å²	39.4	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-67.9	-45.1	176.4	-59.4	170.4	0	0	0	109.5	L624 Y627 L628 I656 V672 K674 E679 A680 M681	L624-I677 HydrophobicContact CB-CD1 3.9Å; L624-I677 HydrophobicContact CD1-CD1 3.76Å; L624-I677 HydrophobicContact CD2-CD1 4.41Å; L624-I677 HydrophobicContact CG-CD1 4.23Å; Y627-I677 HydrophobicContact CD1-CD1 4.46Å; Y627-I677 HydrophobicContact CD1-CG2 4.2Å; Y627-I677 HydrophobicContact CE1-CG2 4.1Å; L628-I677 HydrophobicContact CD1-CD1 4.34Å; L628-I677 HydrophobicContact CD2-CB 4.43Å; L628-I677 HydrophobicContact CD2-CD1 3.81Å; L628-I677 HydrophobicContact CD2-CG1 4.02Å; L628-I677 HydrophobicContact CD2-CG2 3.55Å; L628-I677 HydrophobicContact CG-CD1 3.92Å; I656-I677 HydrophobicContact CG2-CG2 4.37Å; V672-I677 HydrophobicContact CG1-CG1 4.21Å; K674-I677 WeakPolarHBondContact O-CB 3.3Å; K674-I677 PolarHBondContact O-N 2.84Å; I677-E679 VanDerWaalsContact C-N 3.32Å; I677-E679 PolarHBondContact O-N 3.46Å; I677-A680 WeakPolarHBondContact O-CB 3.25Å; I677-A680 PolarHBondContact O-N 3.48Å; I677-A680 VanDerWaalsContact O-N 3.11Å; I677-M681 HydrophobicContact CG2-CE 4.2Å; I677-M681 HydrophobicContact CG2-CG 4.33Å; I677-M681 HydrophobicContact CG2-SD 4.3Å; I677-M681 WeakPolarHBondContact O-CG 3.45Å; I677-M681 PolarHBondContact O-N 3.3Å
678	D	92.2	Very high	88	Confident	60 Å²	60	37.3 Å²	37.3	32%	0.321	21%	0.207	S	C	.	.	H	α-helix	trans	-59.3	-41.9	-179.7	-63.8	-16	0	0	0	111.8	Y627 K674 G675 M681 R682	Y627-D678 WeakPolarHBondContact CE1-OD1 3.47Å; Y627-D678 PolarHBondContact OH-OD1 3.16Å; K674-D678 PolarHBondContact O-N 3.19Å; G675-D678 PolarHBondContact O-N 3.43Å; D678-M681 HydrophobicContact CB-CE 4.47Å; D678-M681 PolarHBondContact O-N 2.89Å; D678-M681 VanDerWaalsContact OD1-CE 3.32Å; D678-M681 WeakPolarHBondContact OD1-CE 3.43Å; D678-R682 WeakPolarHBondContact O-CB 3.31Å; D678-R682 PolarHBondContact O-N 2.78Å
679	E	89.6	Confident	87.6	Confident	27 Å²	27	38.5 Å²	38.5	13%	0.126	22%	0.217	C	C	.	.	H	α-helix	trans	-71.1	-37.8	174.4	-178.6	67.9	-176	0	0	112.7	Y366 G675 I677 M681 R682 L683	Y366-E679 HydrophobicContact CE1-CG 4.44Å; G675-E679 PolarHBondContact O-N 3.47Å; G675-E679 VanDerWaalsContact O-N 3.11Å; I677-E679 VanDerWaalsContact C-N 3.32Å; I677-E679 PolarHBondContact O-N 3.46Å; E679-M681 VanDerWaalsContact C-N 3.26Å; E679-M681 PolarHBondContact O-N 2.75Å; E679-R682 VanDerWaalsContact CD-NE 3.35Å; E679-R682 WeakPolarHBondContact O-CB 3.25Å; E679-R682 PolarHBondContact O-N 2.89Å; E679-R682 IonicContact OE1-CZ 3.34Å; E679-R682 IonicContact OE1-NE 2.77Å; E679-R682 PolarHBondContact OE1-NE 2.9Å; E679-R682 IonicContact OE1-NH2 3.98Å; E679-R682 PolarHBondContact OE1-NH2 3.15Å; E679-R682 IonicContact OE2-CZ 3.97Å; E679-R682 IonicContact OE2-NE 3.52Å; E679-R682 PolarHBondContact OE2-NE 3.01Å; E679-R682 IonicContact OE2-NH2 3.9Å; E679-L683 WeakPolarHBondContact O-CG 3.29Å; E679-L683 PolarHBondContact O-N 2.95Å
680	A	90.9	Very high	86.9	Confident	3 Å²	3	39 Å²	39	3%	0.025	22%	0.219	C	C	.	.	H	α-helix	trans	-61.6	-38.8	174.7	0	0	0	0	0	111.1	I656 L659 D676 I677 M684	I656-A680 HydrophobicContact CG2-CB 4.35Å; L659-A680 HydrophobicContact CB-CB 3.8Å; D676-A680 WeakPolarHBondContact O-CB 3.26Å; D676-A680 PolarHBondContact O-N 2.89Å; I677-A680 WeakPolarHBondContact O-CB 3.25Å; I677-A680 PolarHBondContact O-N 3.48Å; I677-A680 VanDerWaalsContact O-N 3.11Å; A680-M684 VanDerWaalsContact O-CG 3.29Å; A680-M684 WeakPolarHBondContact O-CG 3.18Å; A680-M684 PolarHBondContact O-N 2.84Å
681	M	89.2	Confident	85.9	Confident	20 Å²	20	36 Å²	36	10%	0.099	20%	0.196	C	C	.	.	H	α-helix	trans	-65.8	-46.4	172.1	-68.9	-170.7	-58.4	0	0	111.4	Y627 A631 I677 D678 E679 L683 M684 E685	Y627-M681 HydrophobicContact CE1-CE 3.93Å; A631-M681 HydrophobicContact CB-SD 3.31Å; A631-M681 WeakPolarHBondContact CB-SD 3.5Å; I677-M681 HydrophobicContact CG2-CE 4.2Å; I677-M681 HydrophobicContact CG2-CG 4.33Å; I677-M681 HydrophobicContact CG2-SD 4.3Å; I677-M681 WeakPolarHBondContact O-CG 3.45Å; I677-M681 PolarHBondContact O-N 3.3Å; D678-M681 HydrophobicContact CB-CE 4.47Å; D678-M681 PolarHBondContact O-N 2.89Å; D678-M681 VanDerWaalsContact OD1-CE 3.32Å; D678-M681 WeakPolarHBondContact OD1-CE 3.43Å; E679-M681 VanDerWaalsContact C-N 3.26Å; E679-M681 PolarHBondContact O-N 2.75Å; M681-L683 VanDerWaalsContact C-N 3.28Å; M681-L683 PolarHBondContact O-N 3.11Å; M681-M684 CarbonylContact O-C 3.57Å; M681-M684 WeakPolarHBondContact O-CB 3.23Å; M681-M684 PolarHBondContact O-N 3.25Å; M681-E685 WeakPolarHBondContact O-CB 3.2Å; M681-E685 WeakPolarHBondContact O-CG 3.42Å; M681-E685 PolarHBondContact O-N 3Å
682	R	91.3	Very high	84.6	Confident	82 Å²	82	33.1 Å²	33.1	31%	0.309	18%	0.184	S	C	.	.	H	α-helix	trans	-54.8	-44.3	175.4	-168.6	-169.1	73.1	79.4	2.6	111.7	D382 D678 E679 E685 A686	D382-R682 IonicContact OD1-CZ 3.17Å; D382-R682 VanDerWaalsContact OD1-CZ 3.24Å; D382-R682 IonicContact OD1-NH1 3.54Å; D382-R682 PolarHBondContact OD1-NH1 2.92Å; D382-R682 IonicContact OD1-NH2 3.57Å; D382-R682 PolarHBondContact OD1-NH2 3.32Å; D382-R682 IonicContact OD2-NH1 3.89Å; D678-R682 WeakPolarHBondContact O-CB 3.31Å; D678-R682 PolarHBondContact O-N 2.78Å; E679-R682 VanDerWaalsContact CD-NE 3.35Å; E679-R682 WeakPolarHBondContact O-CB 3.25Å; E679-R682 PolarHBondContact O-N 2.89Å; E679-R682 IonicContact OE1-CZ 3.34Å; E679-R682 IonicContact OE1-NE 2.77Å; E679-R682 PolarHBondContact OE1-NE 2.9Å; E679-R682 IonicContact OE1-NH2 3.98Å; E679-R682 PolarHBondContact OE1-NH2 3.15Å; E679-R682 IonicContact OE2-CZ 3.97Å; E679-R682 IonicContact OE2-NE 3.52Å; E679-R682 PolarHBondContact OE2-NE 3.01Å; E679-R682 IonicContact OE2-NH2 3.9Å; R682-E685 PolarHBondContact O-N 3.33Å; R682-A686 WeakPolarHBondContact O-CB 3.49Å; R682-A686 PolarHBondContact O-N 3.43Å
683	L	90.3	Very high	83	Confident	0 Å²	0	35.2 Å²	35.2	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-65.6	-40.7	176.9	-70.4	175.3	0	0	0	112	D382 K385 L389 W553 E679 M681 S687	D382-L683 HydrophobicContact CB-CD2 4.33Å; K385-L683 HydrophobicContact CB-CD2 4.35Å; L389-L683 HydrophobicContact CD1-CD1 3.6Å; W553-L683 HydrophobicContact CZ2-CD2 4.45Å; E679-L683 WeakPolarHBondContact O-CG 3.29Å; E679-L683 PolarHBondContact O-N 2.95Å; M681-L683 VanDerWaalsContact C-N 3.28Å; M681-L683 PolarHBondContact O-N 3.11Å; L683-S687 WeakPolarHBondContact O-CB 3.26Å; L683-S687 PolarHBondContact O-N 3.06Å
684	M	87.1	Confident	81.1	Confident	11 Å²	11	34.8 Å²	34.8	5%	0.054	19%	0.194	C	C	.	.	H	α-helix	trans	-65.3	-44.6	175.5	-75.2	-73.3	-70.5	0	0	111.8	L551 M635 T652 I656 L659 A680 M681 S687 R688	L551-M684 HydrophobicContact CD2-CG 4.18Å; L551-M684 HydrophobicContact CD2-SD 3.45Å; L551-M684 WeakPolarHBondContact CD2-SD 3.19Å; M635-M684 HydrophobicContact CE-CB 3.93Å; M635-M684 HydrophobicContact CE-CE 4.45Å; T652-M684 HydrophobicContact CG2-CE 4.07Å; I656-M684 HydrophobicContact CG1-CG 4.17Å; L659-M684 HydrophobicContact CD1-CG 4.32Å; L659-M684 HydrophobicContact CD1-SD 4.44Å; A680-M684 VanDerWaalsContact O-CG 3.29Å; A680-M684 WeakPolarHBondContact O-CG 3.18Å; A680-M684 PolarHBondContact O-N 2.84Å; M681-M684 CarbonylContact O-C 3.57Å; M681-M684 WeakPolarHBondContact O-CB 3.23Å; M681-M684 PolarHBondContact O-N 3.25Å; M684-S687 PolarHBondContact O-N 3.47Å; M684-S687 PolarHBondContact O-OG 3.43Å; M684-R688 WeakPolarHBondContact O-CG 3.45Å; M684-R688 PolarHBondContact O-N 2.85Å
685	E	85.2	Confident	79	Confident	96 Å²	96	34.6 Å²	34.6	45%	0.449	19%	0.191	S	C	.	.	H	α-helix	trans	-64.3	-45.6	176.5	-75.1	174.6	-164.9	0	0	111.4	M681 R682 S687 R688 A689	M681-E685 WeakPolarHBondContact O-CB 3.2Å; M681-E685 WeakPolarHBondContact O-CG 3.42Å; M681-E685 PolarHBondContact O-N 3Å; R682-E685 PolarHBondContact O-N 3.33Å; E685-S687 VanDerWaalsContact C-N 3.27Å; E685-S687 PolarHBondContact O-N 3.4Å; E685-R688 CarbonylContact O-C 3.51Å; E685-R688 PolarHBondContact O-N 2.9Å; E685-A689 WeakPolarHBondContact O-CB 2.98Å; E685-A689 PolarHBondContact O-N 3.02Å
686	A	84.8	Confident	77.1	Confident	21 Å²	21	36.4 Å²	36.4	17%	0.174	19%	0.191	C	C	.	.	H	α-helix	trans	-58.8	-39.4	176	0	0	0	0	0	111.8	W553 R682 R688 A689 S690	W553-A686 HydrophobicContact CH2-CB 3.65Å; W553-A686 HydrophobicContact CZ3-CB 4.15Å; R682-A686 WeakPolarHBondContact O-CB 3.49Å; R682-A686 PolarHBondContact O-N 3.43Å; A686-R688 VanDerWaalsContact C-N 3.3Å; A686-R688 PolarHBondContact O-N 3.01Å; A686-A689 PolarHBondContact O-N 3.15Å; A686-S690 PolarHBondContact O-N 3.12Å; A686-S690 VanDerWaalsContact O-N 3.16Å; A686-S690 PolarHBondContact O-OG 3.45Å
687	S	82	Confident	75.1	Confident	7 Å²	7	41.6 Å²	41.6	5%	0.049	22%	0.218	C	C	.	.	H	α-helix	trans	-62.7	-35.9	175.4	81.4	0	0	0	0	112.7	L552 L683 M684 E685	L552-S687 WeakPolarHBondContact O-CB 3.23Å; L683-S687 WeakPolarHBondContact O-CB 3.26Å; L683-S687 PolarHBondContact O-N 3.06Å; M684-S687 PolarHBondContact O-N 3.47Å; M684-S687 PolarHBondContact O-OG 3.43Å; E685-S687 VanDerWaalsContact C-N 3.27Å; E685-S687 PolarHBondContact O-N 3.4Å
688	R	77.8	Confident	72.9	Confident	18 Å²	18	46.6 Å²	46.6	7%	0.068	25%	0.253	C	S	.	.	H	α-helix	trans	-81.2	-40.5	178.4	-65	175.7	82.2	-176.9	9.9	112.3	M635 A639 M645 M684 E685 A686 S690 I691	M635-R688 PolarHBondContact O-NH1 3.38Å; A639-R688 VanDerWaalsContact CB-NH2 3.33Å; M645-R688 HydrophobicContact CE-CB 4.26Å; M645-R688 HydrophobicContact SD-CB 4.17Å; M645-R688 HydrophobicContact SD-CG 4.5Å; M645-R688 PolarHBondContact SD-NE 2.89Å; M645-R688 VanDerWaalsContact SD-NE 3.4Å; M684-R688 WeakPolarHBondContact O-CG 3.45Å; M684-R688 PolarHBondContact O-N 2.85Å; E685-R688 CarbonylContact O-C 3.51Å; E685-R688 PolarHBondContact O-N 2.9Å; A686-R688 VanDerWaalsContact C-N 3.3Å; A686-R688 PolarHBondContact O-N 3.01Å; R688-S690 PolarHBondContact O-N 3.09Å; R688-I691 VanDerWaalsContact O-CB 3.25Å; R688-I691 WeakPolarHBondContact O-CB 3.34Å; R688-I691 PolarHBondContact O-N 3.32Å
689	A	74.2	Confident	70.6	Confident	49 Å²	49	50.9 Å²	50.9	41%	0.405	28%	0.276	S	S	.	.	H	α-helix	trans	-58.9	-38	178.9	0	0	0	0	0	110.7	E685 A686 I691 I692 T693	E685-A689 WeakPolarHBondContact O-CB 2.98Å; E685-A689 PolarHBondContact O-N 3.02Å; A686-A689 PolarHBondContact O-N 3.15Å; A689-I691 PolarHBondContact O-N 3.3Å; A689-I692 PolarHBondContact O-N 3.33Å; A689-T693 PolarHBondContact O-N 2.82Å; A689-T693 PolarHBondContact O-OG1 2.75Å
690	S	68.6	Low	68.7	Low	35 Å²	35	57.8 Å²	57.8	25%	0.245	30%	0.301	C	S	.	.	H	α-helix	trans	-57	-19.3	174.7	-56	0	0	0	0	113.9	L554 A686 R688	L554-S690 WeakPolarHBondContact O-CB 3.38Å; A686-S690 PolarHBondContact O-N 3.12Å; A686-S690 VanDerWaalsContact O-N 3.16Å; A686-S690 PolarHBondContact O-OG 3.45Å; R688-S690 PolarHBondContact O-N 3.09Å
691	I	66.2	Low	66.3	Low	20 Å²	20	63.2 Å²	63.2	10%	0.103	34%	0.339	C	S	.	.	H	α-helix	trans	-87.2	-30.6	176.7	-56.3	174.4	0	0	0	111.6	V535 L554 T646 R688 A689	V535-I691 HydrophobicContact CG2-CG2 3.34Å; L554-I691 HydrophobicContact CB-CG1 4.31Å; L554-I691 HydrophobicContact CD2-CG1 4.26Å; T646-I691 HydrophobicContact CG2-CD1 3.83Å; R688-I691 VanDerWaalsContact O-CB 3.25Å; R688-I691 WeakPolarHBondContact O-CB 3.34Å; R688-I691 PolarHBondContact O-N 3.32Å; A689-I691 PolarHBondContact O-N 3.3Å
692	I	63.9	Low	64.2	Low	57 Å²	57	65 Å²	65	29%	0.292	36%	0.363	S	S	.	.	H	α-helix	trans	-87.6	-25	-168.8	-56.9	167.7	0	0	0	112.2	M645 A689 S694 Y695 E696	M645-I692 HydrophobicContact CE-CD1 3.41Å; M645-I692 VanDerWaalsContact CE-CD1 3.41Å; M645-I692 HydrophobicContact CE-CG1 4.29Å; M645-I692 HydrophobicContact SD-CD1 4.25Å; A689-I692 PolarHBondContact O-N 3.33Å; I692-S694 PolarHBondContact O-N 3.39Å; I692-Y695 PolarHBondContact O-N 3.08Å; I692-E696 HydrophobicContact CG2-CG 4.42Å
693	T	56.2	Low	61.9	Low	47 Å²	47	70.4 Å²	70.4	29%	0.288	38%	0.383	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.9	12.8	-167.7	-26.9	0	0	0	0	115.4	K558 A689 D697	K558-T693 VanDerWaalsContact NZ-CG2 3.27Å; K558-T693 PolarHBondContact NZ-O 3.33Å; A689-T693 PolarHBondContact O-N 2.82Å; A689-T693 PolarHBondContact O-OG1 2.75Å; T693-D697 WeakPolarHBondContact CG2-OD2 3.19Å
694	S	50.4	Low	59.8	Low	36 Å²	36	76.2 Å²	76.2	25%	0.252	42%	0.421	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.1	-18.1	172	24.3	0	0	0	0	114.4	I692	I692-S694 PolarHBondContact O-N 3.39Å
695	Y	48.2	Very low	58.3	Low	103 Å²	103	83.1 Å²	83.1	40%	0.404	45%	0.453	S	S	.	.	T	Hydrogen-bonded Turn	trans	-119.9	-23.3	-175.3	-75	-71.6	0	0	0	115.9	P531 D532 I692	P531-Y695 HydrophobicContact CB-CE2 4.45Å; P531-Y695 WeakPolarHBondContact O-CE2 3.46Å; P531-Y695 PolarHBondContact O-OH 3.43Å; D532-Y695 VanDerWaalsContact CA-OH 3.23Å; D532-Y695 WeakPolarHBondContact CA-OH 3.45Å; D532-Y695 PolarHBondContact N-OH 2.68Å; D532-Y695 PolarHBondContact OD1-OH 2.92Å; I692-Y695 PolarHBondContact O-N 3.08Å
696	E	49.8	Very low	57.5	Low	72 Å²	72	80.6 Å²	80.6	34%	0.336	45%	0.446	S	S	.	.	S	Bend	trans	-90.2	-31.9	-171.2	-64.4	-157.4	162.9	0	0	114.4	I692 S698 N699 R700	I692-E696 HydrophobicContact CG2-CG 4.42Å; E696-S698 VanDerWaalsContact C-N 3.3Å; E696-S698 PolarHBondContact O-N 3.48Å; E696-N699 PolarHBondContact O-N 2.84Å; E696-R700 HydrophobicContact CB-CB 4.41Å; E696-R700 WeakPolarHBondContact O-CA 3.38Å; E696-R700 WeakPolarHBondContact O-CB 3.28Å; E696-R700 PolarHBondContact O-N 3.45Å; E696-R700 IonicContact OE1-CZ 2.71Å; E696-R700 IonicContact OE1-NE 2.69Å; E696-R700 IonicContact OE1-NH1 2.75Å; E696-R700 PolarHBondContact OE1-NH1 3.37Å; E696-R700 IonicContact OE1-NH2 3.71Å; E696-R700 WeakPolarHBondContact OE2-CD 3.16Å; E696-R700 IonicContact OE2-CZ 3.48Å; E696-R700 IonicContact OE2-NE 3.39Å; E696-R700 IonicContact OE2-NH1 3.78Å; E696-R700 PolarHBondContact OE2-NH1 3.06Å
697	D	48.1	Very low	57.2	Low	109 Å²	109	82.9 Å²	82.9	58%	0.583	45%	0.45	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.7	-25.9	-173.3	-77.5	-16.7	0	0	0	114.3	T693	T693-D697 WeakPolarHBondContact CG2-OD2 3.19Å
698	S	45.8	Very low	57.1	Low	105 Å²	105	85.5 Å²	85.5	73%	0.734	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.3	-15.5	174.5	43.8	0	0	0	0	114.3	E696	E696-S698 VanDerWaalsContact C-N 3.3Å; E696-S698 PolarHBondContact O-N 3.48Å
699	N	43.9	Very low	57.2	Low	150 Å²	150	86.7 Å²	86.7	80%	0.802	47%	0.468	S	S	*	.	T	Hydrogen-bonded Turn	trans	-126.5	-7.7	-175.6	-106.9	-8.2	0	0	0	114.7	E696	E696-N699 PolarHBondContact O-N 2.84Å
700	R	48.1	Very low	57.5	Low	172 Å²	172	85.4 Å²	85.4	65%	0.649	46%	0.455	S	S	*	.			trans	-127.3	23.7	179	-80.9	-172.1	173.7	169.5	4.5	114	E696 G702	E696-R700 HydrophobicContact CB-CB 4.41Å; E696-R700 WeakPolarHBondContact O-CA 3.38Å; E696-R700 WeakPolarHBondContact O-CB 3.28Å; E696-R700 PolarHBondContact O-N 3.45Å; E696-R700 IonicContact OE1-CZ 2.71Å; E696-R700 IonicContact OE1-NE 2.69Å; E696-R700 IonicContact OE1-NH1 2.75Å; E696-R700 PolarHBondContact OE1-NH1 3.37Å; E696-R700 IonicContact OE1-NH2 3.71Å; E696-R700 WeakPolarHBondContact OE2-CD 3.16Å; E696-R700 IonicContact OE2-CZ 3.48Å; E696-R700 IonicContact OE2-NE 3.39Å; E696-R700 IonicContact OE2-NH1 3.78Å; E696-R700 PolarHBondContact OE2-NH1 3.06Å; R700-G702 PolarHBondContact O-N 3.21Å
701	S	42.4	Very low	58.2	Low	118 Å²	118	83.7 Å²	83.7	83%	0.825	44%	0.444	S	S	*	.			trans	-66.1	63.3	138.4	-144.3	0	0	0	0	107.8	R703	S701-R703 PolarHBondContact O-N 3.43Å
702	G	43.5	Very low	59	Low	58 Å²	58	86 Å²	86	60%	0.598	45%	0.452	S	S	*	.			trans	-59.7	121.8	174.2	0	0	0	0	0	104.5	R700	R700-G702 PolarHBondContact O-N 3.21Å
703	R	44.1	Very low	59.9	Low	195 Å²	195	88.7 Å²	88.7	74%	0.736	46%	0.463	S	S	*	.			trans	-28.5	131.4	171.5	-83.3	174.1	164.8	172.7	-3.9	109.5	S701 Q705	S701-R703 PolarHBondContact O-N 3.43Å; R703-Q705 PolarHBondContact O-N 3.4Å
704	P	46	Very low	61.1	Low	121 Å²	121	86.5 Å²	86.5	79%	0.786	45%	0.449	S	S	*	.			trans	-48	116.9	165.2	22.7	-31.8	0	0	0	105.3	S706	P704-S706 VanDerWaalsContact C-N 3.33Å; P704-S706 WeakPolarHBondContact O-CA 3.27Å; P704-S706 PolarHBondContact O-N 2.9Å
705	Q	55.5	Low	62.5	Low	157 Å²	157	84.8 Å²	84.8	73%	0.734	44%	0.437	S	S	*	.			trans	-47.4	105.2	-169.9	-82.8	-178.5	-5.2	0	0	106.8	R703 V710	R703-Q705 PolarHBondContact O-N 3.4Å; Q705-V710 HydrophobicContact CB-CG2 4.21Å
706	S	68.3	Low	64.1	Low	42 Å²	42	86.8 Å²	86.8	29%	0.294	44%	0.444	S	S	.	.			trans	-67.7	148.3	-173.1	-170.4	0	0	0	0	105.3	P704 K708 D709 V710	P704-S706 VanDerWaalsContact C-N 3.33Å; P704-S706 WeakPolarHBondContact O-CA 3.27Å; P704-S706 PolarHBondContact O-N 2.9Å; S706-K708 PolarHBondContact O-N 3.17Å; S706-D709 PolarHBondContact N-OD2 3.43Å; S706-D709 PolarHBondContact O-N 3.26Å; S706-V710 PolarHBondContact O-N 3.04Å
707	Y	78.5	Confident	65.7	Low	70 Å²	70	88.4 Å²	88.4	28%	0.275	45%	0.452	S	S	.	.	H	α-helix	trans	-50.4	-28.3	172.2	62.6	-85.3	0	0	0	111.1	I711 Q744 E747 V748	Y707-I711 HydrophobicContact CD2-CD1 4.3Å; Y707-I711 WeakPolarHBondContact O-CB 3.34Å; Y707-I711 WeakPolarHBondContact O-CD1 3.5Å; Y707-I711 WeakPolarHBondContact O-CG1 3.23Å; Y707-I711 PolarHBondContact O-N 2.99Å; Y707-Q744 HydrophobicContact CD2-CB 4.09Å; Y707-Q744 HydrophobicContact CD2-CG 4.2Å; Y707-Q744 HydrophobicContact CE2-CB 4.16Å; Y707-Q744 HydrophobicContact CE2-CG 4.13Å; Y707-E747 PolarHBondContact OH-OE1 2.9Å; Y707-E747 PolarHBondContact OH-OE2 3.26Å; Y707-V748 HydrophobicContact CD2-CG2 4.14Å; Y707-V748 HydrophobicContact CE2-CG2 4.06Å
708	K	80.7	Confident	67.2	Low	61 Å²	61	84.4 Å²	84.4	27%	0.265	43%	0.43	S	S	.	.	H	α-helix	trans	-62	-38.2	172.8	-48.9	-159	172.5	-169.9	0	114.4	S706 Y712 E747 V748 Y752	S706-K708 PolarHBondContact O-N 3.17Å; K708-Y712 VanDerWaalsContact O-CB 3.31Å; K708-Y712 WeakPolarHBondContact O-CB 3.41Å; K708-Y712 PolarHBondContact O-N 3.39Å; K708-E747 WeakPolarHBondContact CE-OE1 3.47Å; K708-E747 IonicContact NZ-OE1 2.76Å; K708-E747 PolarHBondContact NZ-OE1 3.05Å; K708-V748 HydrophobicContact CB-CG2 4.01Å; K708-V748 HydrophobicContact CD-CG2 4.33Å; K708-V748 HydrophobicContact CG-CG2 3.73Å; K708-Y752 PolarHBondContact O-OH 2.81Å
709	D	79.8	Confident	68.7	Low	43 Å²	43	80 Å²	80	23%	0.23	40%	0.399	C	S	.	.	H	α-helix	trans	-76.2	-40	-179.4	-60.9	-33.8	0	0	0	110.8	S706 Y712 H713	S706-D709 PolarHBondContact N-OD2 3.43Å; S706-D709 PolarHBondContact O-N 3.26Å; D709-Y712 PolarHBondContact O-N 2.85Å; D709-H713 PolarHBondContact O-CD2 3.44Å; D709-H713 PolarHBondContact O-N 3.46Å
710	V	80.4	Confident	70.2	Confident	22 Å²	22	77.1 Å²	77.1	13%	0.133	40%	0.396	C	S	.	.	H	α-helix	trans	-66.6	-43.1	177.7	-176.6	0	0	0	0	110.7	Q705 S706 H713 I714 K738 Y740	Q705-V710 HydrophobicContact CB-CG2 4.21Å; S706-V710 PolarHBondContact O-N 3.04Å; V710-H713 PolarHBondContact O-N 2.65Å; V710-I714 HydrophobicContact CG1-CD1 4.32Å; V710-I714 VanDerWaalsContact O-CG1 3.27Å; V710-I714 WeakPolarHBondContact O-CG1 3.31Å; V710-I714 PolarHBondContact O-N 2.83Å; V710-I714 VanDerWaalsContact O-N 3.1Å; V710-K738 HydrophobicContact CG1-CD 4.43Å; V710-Y740 HydrophobicContact CB-CE2 4.35Å; V710-Y740 HydrophobicContact CG1-CE2 3.85Å
711	I	82.7	Confident	71.5	Confident	0 Å²	0	73 Å²	73	0%	0	40%	0.399	C	S	.	.	H	α-helix	trans	-63.3	-43.6	174.8	-69.1	166.5	0	0	0	110.3	Y707 H713 I714 V715 Y740 L745 V748	Y707-I711 HydrophobicContact CD2-CD1 4.3Å; Y707-I711 WeakPolarHBondContact O-CB 3.34Å; Y707-I711 WeakPolarHBondContact O-CD1 3.5Å; Y707-I711 WeakPolarHBondContact O-CG1 3.23Å; Y707-I711 PolarHBondContact O-N 2.99Å; I711-H713 VanDerWaalsContact C-N 3.34Å; I711-H713 PolarHBondContact O-N 2.63Å; I711-I714 PolarHBondContact O-N 3.07Å; I711-V715 HydrophobicContact CG2-CG2 4.4Å; I711-V715 WeakPolarHBondContact O-CG2 3.26Å; I711-V715 PolarHBondContact O-N 2.98Å; I711-Y740 HydrophobicContact CD1-CD1 4.45Å; I711-Y740 HydrophobicContact CD1-CG 4.3Å; I711-Y740 HydrophobicContact CG1-CD2 4.32Å; I711-Y740 HydrophobicContact CG1-CG 4.37Å; I711-L745 HydrophobicContact CG2-CD1 3.69Å; I711-V748 HydrophobicContact CB-CG1 4.1Å; I711-V748 HydrophobicContact CD1-CB 4.43Å; I711-V748 HydrophobicContact CD1-CG2 3.96Å; I711-V748 HydrophobicContact CG2-CB 4.18Å; I711-V748 HydrophobicContact CG2-CG1 3.64Å
712	Y	83.6	Confident	72.7	Confident	68 Å²	68	68.7 Å²	68.7	27%	0.267	37%	0.372	S	S	.	.	H	α-helix	trans	-57.7	-43.5	174.8	177.5	-97.3	0	0	0	112.6	K708 D709 I714 V715 R716 Y752 V757 W758	K708-Y712 VanDerWaalsContact O-CB 3.31Å; K708-Y712 WeakPolarHBondContact O-CB 3.41Å; K708-Y712 PolarHBondContact O-N 3.39Å; D709-Y712 PolarHBondContact O-N 2.85Å; Y712-I714 PolarHBondContact O-N 3.29Å; Y712-V715 PolarHBondContact O-N 3.04Å; Y712-R716 VanDerWaalsContact O-CB 3.31Å; Y712-R716 WeakPolarHBondContact O-CB 3.04Å; Y712-R716 PolarHBondContact O-N 3.31Å; Y712-Y752 HydrophobicContact CD2-CD1 4.36Å; Y712-Y752 HydrophobicContact CD2-CD2 4.5Å; Y712-Y752 AromaticContact CD2-CE1 3.88Å; Y712-Y752 HydrophobicContact CD2-CE1 3.88Å; Y712-Y752 HydrophobicContact CD2-CE2 4.03Å; Y712-Y752 AromaticContact CD2-CZ 3.72Å; Y712-Y752 HydrophobicContact CE2-CE1 4.39Å; Y712-Y752 HydrophobicContact CG-CE2 4.38Å; Y712-V757 HydrophobicContact CE2-CG1 4.2Å; Y712-W758 HydrophobicContact CD2-CH2 4.16Å; Y712-W758 AromaticContact CD2-CZ2 3.52Å; Y712-W758 HydrophobicContact CD2-CZ2 3.52Å; Y712-W758 HydrophobicContact CE2-CZ2 4.02Å; Y712-W758 HydrophobicContact CG-CZ2 4.46Å
713	H	81.3	Confident	73.9	Confident	113 Å²	113	74 Å²	74	52%	0.523	39%	0.387	S	S	.	.	H	α-helix	trans	-62.6	-39.3	176	-85.2	-66.5	0	0	0	113.1	D709 V710 I711 R716 E717	D709-H713 PolarHBondContact O-CD2 3.44Å; D709-H713 PolarHBondContact O-N 3.46Å; V710-H713 PolarHBondContact O-N 2.65Å; I711-H713 VanDerWaalsContact C-N 3.34Å; I711-H713 PolarHBondContact O-N 2.63Å; H713-R716 PolarHBondContact O-N 3.18Å; H713-E717 WeakPolarHBondContact O-CB 3.21Å; H713-E717 PolarHBondContact O-N 3.13Å
714	I	81.5	Confident	75.2	Confident	1 Å²	1	65.7 Å²	65.7	1%	0.005	36%	0.362	C	S	.	.	H	α-helix	trans	-64.8	-45.7	176.1	-63.8	161.8	0	0	0	110.5	V710 I711 Y712 R716 E717 L718 R734 K738	V710-I714 HydrophobicContact CG1-CD1 4.32Å; V710-I714 VanDerWaalsContact O-CG1 3.27Å; V710-I714 WeakPolarHBondContact O-CG1 3.31Å; V710-I714 PolarHBondContact O-N 2.83Å; V710-I714 VanDerWaalsContact O-N 3.1Å; I711-I714 PolarHBondContact O-N 3.07Å; Y712-I714 PolarHBondContact O-N 3.29Å; I714-R716 VanDerWaalsContact C-N 3.33Å; I714-E717 PolarHBondContact O-N 3.3Å; I714-L718 HydrophobicContact CG2-CD1 4.14Å; I714-L718 WeakPolarHBondContact O-CG 3.34Å; I714-L718 PolarHBondContact O-N 2.94Å; I714-R734 HydrophobicContact CG2-CB 3.79Å; I714-K738 HydrophobicContact CD1-CD 3.7Å; I714-K738 HydrophobicContact CG1-CD 4.3Å
715	V	81.3	Confident	76.7	Confident	0 Å²	0	62.9 Å²	62.9	0%	0	34%	0.343	C	S	.	.	H	α-helix	trans	-63.6	-42.9	177.7	177.6	0	0	0	0	110	I711 Y712 E717 L718 T719 I731 W758	I711-V715 HydrophobicContact CG2-CG2 4.4Å; I711-V715 WeakPolarHBondContact O-CG2 3.26Å; I711-V715 PolarHBondContact O-N 2.98Å; Y712-V715 PolarHBondContact O-N 3.04Å; V715-E717 PolarHBondContact O-N 3.1Å; V715-L718 PolarHBondContact O-N 3.36Å; V715-T719 HydrophobicContact CG1-CG2 3.94Å; V715-T719 WeakPolarHBondContact O-CB 3.27Å; V715-T719 WeakPolarHBondContact O-CG2 3.26Å; V715-T719 PolarHBondContact O-N 2.96Å; V715-T719 PolarHBondContact O-OG1 3.24Å; V715-T719 VanDerWaalsContact O-OG1 3.04Å; V715-I731 HydrophobicContact CG1-CD1 4.24Å; V715-I731 HydrophobicContact CG2-CD1 4.04Å; V715-I731 HydrophobicContact CG2-CG1 4.28Å; V715-I731 HydrophobicContact CG2-CG2 3.71Å; V715-W758 HydrophobicContact CB-CH2 3.65Å; V715-W758 HydrophobicContact CB-CZ2 3.56Å; V715-W758 HydrophobicContact CG1-CD2 4.4Å; V715-W758 HydrophobicContact CG1-CH2 3.73Å; V715-W758 HydrophobicContact CG1-CZ2 3.37Å; V715-W758 HydrophobicContact CG1-CZ3 4.35Å; V715-W758 HydrophobicContact CG2-CH2 3.64Å; V715-W758 HydrophobicContact CG2-CZ2 4.11Å; V715-W758 HydrophobicContact CG2-CZ3 4.23Å
716	R	81.5	Confident	77.8	Confident	145 Å²	145	55.8 Å²	55.8	55%	0.547	31%	0.311	S	S	.	.	H	α-helix	trans	-59.7	-44.6	176.5	-171.8	176.2	173.9	-177.8	-0.7	112	Y712 H713 I714 L718 T719 A720	Y712-R716 VanDerWaalsContact O-CB 3.31Å; Y712-R716 WeakPolarHBondContact O-CB 3.04Å; Y712-R716 PolarHBondContact O-N 3.31Å; H713-R716 PolarHBondContact O-N 3.18Å; I714-R716 VanDerWaalsContact C-N 3.33Å; R716-L718 PolarHBondContact O-N 3.3Å; R716-T719 VanDerWaalsContact CA-OG1 3.32Å; R716-T719 WeakPolarHBondContact CA-OG1 3.44Å; R716-T719 PolarHBondContact O-N 3.15Å; R716-T719 PolarHBondContact O-OG1 3.06Å; R716-A720 VanDerWaalsContact O-CB 3.26Å; R716-A720 WeakPolarHBondContact O-CB 3.43Å; R716-A720 PolarHBondContact O-N 3.47Å
717	E	83.1	Confident	78.4	Confident	107 Å²	107	60.6 Å²	60.6	50%	0.5	32%	0.323	S	S	.	.	H	α-helix	trans	-61.9	-42.1	176.4	-164.2	-165.5	143.3	0	0	111.9	H713 I714 V715 A721 R734	H713-E717 WeakPolarHBondContact O-CB 3.21Å; H713-E717 PolarHBondContact O-N 3.13Å; I714-E717 PolarHBondContact O-N 3.3Å; V715-E717 PolarHBondContact O-N 3.1Å; E717-A721 PolarHBondContact O-N 2.85Å; E717-R734 VanDerWaalsContact CD-NH1 3.25Å; E717-R734 IonicContact OE1-CZ 2.71Å; E717-R734 IonicContact OE1-NH1 3.67Å; E717-R734 PolarHBondContact OE1-NH1 3.05Å; E717-R734 IonicContact OE2-NH1 2.74Å
718	L	79.5	Confident	78.6	Confident	25 Å²	25	58.7 Å²	58.7	13%	0.131	32%	0.317	C	S	.	.	H	α-helix	trans	-69.9	-38.6	177.3	-74.5	173.8	0	0	0	112.8	I714 V715 R716 A721 G722 A726 I731 R734	I714-L718 HydrophobicContact CG2-CD1 4.14Å; I714-L718 WeakPolarHBondContact O-CG 3.34Å; I714-L718 PolarHBondContact O-N 2.94Å; V715-L718 PolarHBondContact O-N 3.36Å; R716-L718 PolarHBondContact O-N 3.3Å; L718-A721 PolarHBondContact O-N 2.78Å; L718-G722 PolarHBondContact O-N 2.99Å; L718-A726 HydrophobicContact CB-CB 4.35Å; L718-I731 HydrophobicContact CD1-CB 4.19Å; L718-I731 HydrophobicContact CD1-CG1 3.56Å; L718-R734 HydrophobicContact CD1-CG 4.44Å
719	T	76	Confident	78.6	Confident	12 Å²	12	59.1 Å²	59.1	7%	0.074	33%	0.332	C	S	.	.	H	α-helix	trans	-71.4	-33.3	177.3	57.7	0	0	0	0	112.2	V715 R716 A721 G722 G724 A726 T769	V715-T719 HydrophobicContact CG1-CG2 3.94Å; V715-T719 WeakPolarHBondContact O-CB 3.27Å; V715-T719 WeakPolarHBondContact O-CG2 3.26Å; V715-T719 PolarHBondContact O-N 2.96Å; V715-T719 PolarHBondContact O-OG1 3.24Å; V715-T719 VanDerWaalsContact O-OG1 3.04Å; R716-T719 VanDerWaalsContact CA-OG1 3.32Å; R716-T719 WeakPolarHBondContact CA-OG1 3.44Å; R716-T719 PolarHBondContact O-N 3.15Å; R716-T719 PolarHBondContact O-OG1 3.06Å; T719-A721 VanDerWaalsContact C-N 3.26Å; T719-A721 PolarHBondContact O-N 2.67Å; T719-G722 PolarHBondContact O-N 3.03Å; T719-G724 PolarHBondContact O-N 2.82Å; T719-G724 VanDerWaalsContact O-N 3.11Å; T719-A726 HydrophobicContact CG2-CB 3.8Å; T719-T769 HydrophobicContact CG2-CG2 3.59Å
720	A	76.8	Confident	78.8	Confident	89 Å²	89	60.4 Å²	60.4	74%	0.736	34%	0.339	S	S	*	.	H	α-helix	trans	-67.6	-27.7	173.3	0	0	0	0	0	112.2	R716	R716-A720 VanDerWaalsContact O-CB 3.26Å; R716-A720 WeakPolarHBondContact O-CB 3.43Å; R716-A720 PolarHBondContact O-N 3.47Å
721	A	75.9	Confident	78.9	Confident	87 Å²	87	59.4 Å²	59.4	72%	0.719	33%	0.333	S	S	*	.	H	α-helix	trans	-82.7	-16.7	173.8	0	0	0	0	0	113.9	E717 L718 T719	E717-A721 PolarHBondContact O-N 2.85Å; L718-A721 PolarHBondContact O-N 2.78Å; T719-A721 VanDerWaalsContact C-N 3.26Å; T719-A721 PolarHBondContact O-N 2.67Å
722	G	65.8	Low	78.9	Confident	26 Å²	26	61.2 Å²	61.2	27%	0.268	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	-126.6	38.9	-166.1	0	0	0	0	0	116	L718 T719 G724 T725	L718-G722 PolarHBondContact O-N 2.99Å; T719-G722 PolarHBondContact O-N 3.03Å; G722-G724 PolarHBondContact O-N 3.01Å; G722-G724 VanDerWaalsContact O-N 3.11Å; G722-T725 PolarHBondContact O-N 2.82Å; G722-T725 PolarHBondContact O-OG1 2.9Å
723	D	70.5	Confident	79	Confident	169 Å²	169	64.5 Å²	64.5	90%	0.904	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	49	39.6	177.9	-69.7	-22.1	0	0	0	113.8	T725	D723-T725 VanDerWaalsContact C-N 3.26Å; D723-T725 PolarHBondContact O-N 3.17Å
724	G	71	Confident	79	Confident	21 Å²	21	64.2 Å²	64.2	22%	0.216	36%	0.36	C	S	.	.	T	Hydrogen-bonded Turn	trans	76.8	7.3	179.6	0	0	0	0	0	114.9	T719 G722 T768 T769	T719-G724 PolarHBondContact O-N 2.82Å; T719-G724 VanDerWaalsContact O-N 3.11Å; G722-G724 PolarHBondContact O-N 3.01Å; G722-G724 VanDerWaalsContact O-N 3.11Å; G724-T768 WeakPolarHBondContact O-CA 3.4Å; G724-T769 PolarHBondContact O-N 3.31Å; G724-T769 PolarHBondContact O-OG1 2.99Å
725	T	77	Confident	79	Confident	62 Å²	62	64.3 Å²	64.3	38%	0.38	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	130.3	175.2	64.5	0	0	0	0	110.9	G722 D723 I767 T768	G722-T725 PolarHBondContact O-N 2.82Å; G722-T725 PolarHBondContact O-OG1 2.9Å; D723-T725 VanDerWaalsContact C-N 3.26Å; D723-T725 PolarHBondContact O-N 3.17Å; T725-I767 CarbonylContact C-O 3.6Å; T725-I767 WeakPolarHBondContact CA-O 3.45Å; T725-T768 HydrophobicContact CG2-CG2 3.61Å
726	A	79.4	Confident	79.2	Confident	9 Å²	9	67.4 Å²	67.4	7%	0.074	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	138.2	174.8	0	0	0	0	0	110.6	L718 T719 I731 R766 I767	L718-A726 HydrophobicContact CB-CB 4.35Å; T719-A726 HydrophobicContact CG2-CB 3.8Å; A726-I731 HydrophobicContact CB-CD1 3.81Å; A726-I731 HydrophobicContact CB-CG1 4.28Å; A726-R766 CarbonylContact O-C 3.49Å; A726-R766 WeakPolarHBondContact O-CA 3.27Å; A726-I767 PolarHBondContact N-O 3.34Å; A726-I767 PolarHBondContact O-N 3.11Å
727	R	81.4	Confident	79.3	Confident	143 Å²	143	66.2 Å²	66.2	54%	0.54	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	136.6	173.9	-62.8	178.8	-178.5	-174.2	1.4	109.2	A729 D730 I731 R766	R727-A729 PolarHBondContact O-N 3.5Å; R727-D730 PolarHBondContact O-N 3.16Å; R727-I731 PolarHBondContact O-N 3.32Å; R727-R766 HydrophobicContact CG-CG 4.48Å
728	I	81.3	Confident	79.1	Confident	30 Å²	30	66.8 Å²	66.8	15%	0.154	40%	0.396	C	S	.	.	H	α-helix	trans	-64.2	-30.4	-179.6	-70.9	165.8	0	0	0	111.4	I731 A732 V760 R764 T765 I767	I728-I731 PolarHBondContact O-N 3.37Å; I728-A732 VanDerWaalsContact O-CB 3.31Å; I728-A732 WeakPolarHBondContact O-CB 3.24Å; I728-A732 PolarHBondContact O-N 2.83Å; I728-V760 HydrophobicContact CD1-CG1 4.09Å; I728-R764 WeakPolarHBondContact CD1-O 3.49Å; I728-T765 PolarHBondContact N-O 3.08Å; I728-T765 VanDerWaalsContact N-O 3.1Å; I728-I767 HydrophobicContact CD1-CD1 4.47Å; I728-I767 HydrophobicContact CD1-CG1 3.94Å; I728-I767 HydrophobicContact CG1-CD1 3.97Å; I728-I767 HydrophobicContact CG1-CG1 3.63Å
729	A	81.7	Confident	79.3	Confident	69 Å²	69	68.6 Å²	68.6	57%	0.57	42%	0.421	S	S	*	.	H	α-helix	trans	-60.6	-44.6	174.4	0	0	0	0	0	112.5	R727 A732 E733	R727-A729 PolarHBondContact O-N 3.5Å; A729-A732 PolarHBondContact O-N 3.36Å; A729-E733 PolarHBondContact O-N 3.17Å
730	D	83.3	Confident	79.7	Confident	71 Å²	71	70.8 Å²	70.8	38%	0.38	43%	0.428	S	S	.	.	H	α-helix	trans	-70.6	-35.6	-178	-53	-12	0	0	0	111.1	R727 R734	R727-D730 PolarHBondContact O-N 3.16Å; D730-R734 PolarHBondContact O-N 3.5Å
731	I	82.2	Confident	80	Confident	0 Å²	0	69.8 Å²	69.8	0%	0	41%	0.413	C	S	.	.	H	α-helix	trans	-66.2	-44.4	173.5	-62.7	164.2	0	0	0	110.3	V715 L718 A726 R727 I728 E733 R734 C735 L745 I767	V715-I731 HydrophobicContact CG1-CD1 4.24Å; V715-I731 HydrophobicContact CG2-CD1 4.04Å; V715-I731 HydrophobicContact CG2-CG1 4.28Å; V715-I731 HydrophobicContact CG2-CG2 3.71Å; L718-I731 HydrophobicContact CD1-CB 4.19Å; L718-I731 HydrophobicContact CD1-CG1 3.56Å; A726-I731 HydrophobicContact CB-CD1 3.81Å; A726-I731 HydrophobicContact CB-CG1 4.28Å; R727-I731 PolarHBondContact O-N 3.32Å; I728-I731 PolarHBondContact O-N 3.37Å; I731-E733 VanDerWaalsContact C-N 3.33Å; I731-E733 PolarHBondContact O-N 2.96Å; I731-R734 PolarHBondContact O-N 3.48Å; I731-C735 WeakPolarHBondContact O-CB 3.48Å; I731-C735 PolarHBondContact O-N 3.11Å; I731-C735 PolarHBondContact O-SG 2.98Å; I731-L745 HydrophobicContact CG2-CD1 3.74Å; I731-L745 HydrophobicContact CG2-CD2 4.2Å; I731-I767 HydrophobicContact CD1-CD1 3.71Å; I731-I767 HydrophobicContact CD1-CG1 4.32Å
732	A	84.1	Confident	80.3	Confident	39 Å²	39	70.3 Å²	70.3	32%	0.322	41%	0.409	S	S	.	.	H	α-helix	trans	-62.3	-39.4	179.1	0	0	0	0	0	111.9	I728 A729 C735 A736 L745	I728-A732 VanDerWaalsContact O-CB 3.31Å; I728-A732 WeakPolarHBondContact O-CB 3.24Å; I728-A732 PolarHBondContact O-N 2.83Å; A729-A732 PolarHBondContact O-N 3.36Å; A732-C735 PolarHBondContact O-N 2.76Å; A732-A736 VanDerWaalsContact O-CB 3.3Å; A732-A736 WeakPolarHBondContact O-CB 3.37Å; A732-A736 PolarHBondContact O-N 2.84Å; A732-L745 HydrophobicContact CB-CD2 3.96Å
733	E	85.3	Confident	81.2	Confident	137 Å²	137	72.3 Å²	72.3	64%	0.64	42%	0.424	S	S	*	.	H	α-helix	trans	-65.7	-43.3	176.8	-168.4	177.6	-178	0	0	112.3	A729 I731 A736 T737	A729-E733 PolarHBondContact O-N 3.17Å; I731-E733 VanDerWaalsContact C-N 3.33Å; I731-E733 PolarHBondContact O-N 2.96Å; E733-A736 PolarHBondContact O-N 3.04Å; E733-T737 PolarHBondContact O-N 3.18Å; E733-T737 VanDerWaalsContact O-N 3.08Å; E733-T737 PolarHBondContact O-OG1 2.77Å
734	R	80.8	Confident	81.8	Confident	106 Å²	106	67.1 Å²	67.1	40%	0.4	39%	0.394	S	S	.	.	H	α-helix	trans	-67.5	-36.8	174.6	-74.6	-157.4	-179.1	-163.6	3.4	112.9	I714 E717 L718 D730 I731 T737 K738	I714-R734 HydrophobicContact CG2-CB 3.79Å; E717-R734 VanDerWaalsContact CD-NH1 3.25Å; E717-R734 IonicContact OE1-CZ 2.71Å; E717-R734 IonicContact OE1-NH1 3.67Å; E717-R734 PolarHBondContact OE1-NH1 3.05Å; E717-R734 IonicContact OE2-NH1 2.74Å; L718-R734 HydrophobicContact CD1-CG 4.44Å; D730-R734 PolarHBondContact O-N 3.5Å; I731-R734 PolarHBondContact O-N 3.48Å; R734-T737 PolarHBondContact O-N 2.83Å; R734-K738 PolarHBondContact O-N 2.97Å
735	C	82	Confident	82.5	Confident	3 Å²	3	66.4 Å²	66.4	2%	0.02	39%	0.385	C	S	.	.	H	α-helix	trans	-69	-38	176.7	-68.7	0	0	0	0	111.8	I731 A732 T737 K738 G739 Y740	I731-C735 WeakPolarHBondContact O-CB 3.48Å; I731-C735 PolarHBondContact O-N 3.11Å; I731-C735 PolarHBondContact O-SG 2.98Å; A732-C735 PolarHBondContact O-N 2.76Å; C735-T737 VanDerWaalsContact C-N 3.32Å; C735-T737 PolarHBondContact O-N 2.87Å; C735-K738 CarbonylContact O-C 3.59Å; C735-K738 PolarHBondContact O-N 2.82Å; C735-G739 PolarHBondContact O-N 3.2Å; C735-Y740 PolarHBondContact O-N 3.41Å
736	A	84.3	Confident	82.8	Confident	66 Å²	66	67.1 Å²	67.1	55%	0.545	39%	0.387	S	S	.	.	H	α-helix	trans	-62.5	-40	173.8	0	0	0	0	0	111.6	A732 E733 K738 G739	A732-A736 VanDerWaalsContact O-CB 3.3Å; A732-A736 WeakPolarHBondContact O-CB 3.37Å; A732-A736 PolarHBondContact O-N 2.84Å; E733-A736 PolarHBondContact O-N 3.04Å; A736-K738 VanDerWaalsContact C-N 3.25Å; A736-K738 PolarHBondContact O-N 2.89Å; A736-G739 PolarHBondContact O-N 3.18Å; A736-G739 VanDerWaalsContact O-N 3.07Å
737	T	84.6	Confident	83.1	Confident	119 Å²	119	70.6 Å²	70.6	73%	0.73	40%	0.401	S	S	*	.	H	α-helix	trans	-62.1	-31.7	176.2	-49.3	0	0	0	0	112.6	E733 R734 C735	E733-T737 PolarHBondContact O-N 3.18Å; E733-T737 VanDerWaalsContact O-N 3.08Å; E733-T737 PolarHBondContact O-OG1 2.77Å; R734-T737 PolarHBondContact O-N 2.83Å; C735-T737 VanDerWaalsContact C-N 3.32Å; C735-T737 PolarHBondContact O-N 2.87Å
738	K	78.8	Confident	83.2	Confident	120 Å²	120	63.8 Å²	63.8	52%	0.522	38%	0.375	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.1	3.7	176	-67.3	-168	-173.8	177.5	0	114.1	V710 I714 R734 C735 A736 Y740	V710-K738 HydrophobicContact CG1-CD 4.43Å; I714-K738 HydrophobicContact CD1-CD 3.7Å; I714-K738 HydrophobicContact CG1-CD 4.3Å; R734-K738 PolarHBondContact O-N 2.97Å; C735-K738 CarbonylContact O-C 3.59Å; C735-K738 PolarHBondContact O-N 2.82Å; A736-K738 VanDerWaalsContact C-N 3.25Å; A736-K738 PolarHBondContact O-N 2.89Å; K738-Y740 HydrophobicContact CB-CD2 3.92Å; K738-Y740 HydrophobicContact CB-CE2 3.85Å
739	G	83	Confident	83.3	Confident	63 Å²	63	62.8 Å²	62.8	65%	0.649	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.8	16	174.4	0	0	0	0	0	116.2	C735 A736	C735-G739 PolarHBondContact O-N 3.2Å; A736-G739 PolarHBondContact O-N 3.18Å; A736-G739 VanDerWaalsContact O-N 3.07Å
740	Y	84.2	Confident	83.5	Confident	57 Å²	57	63.9 Å²	63.9	22%	0.224	36%	0.364	C	S	.	.			trans	-87.9	141.4	177.7	-63.7	-70.1	0	0	0	112.1	V710 I711 C735 K738	V710-Y740 HydrophobicContact CB-CE2 4.35Å; V710-Y740 HydrophobicContact CG1-CE2 3.85Å; I711-Y740 HydrophobicContact CD1-CD1 4.45Å; I711-Y740 HydrophobicContact CD1-CG 4.3Å; I711-Y740 HydrophobicContact CG1-CD2 4.32Å; I711-Y740 HydrophobicContact CG1-CG 4.37Å; C735-Y740 PolarHBondContact O-N 3.41Å; K738-Y740 HydrophobicContact CB-CD2 3.92Å; K738-Y740 HydrophobicContact CB-CE2 3.85Å
741	T	84.4	Confident	83.5	Confident	68 Å²	68	62 Å²	62	42%	0.417	36%	0.358	S	S	.	.			trans	-76.7	150.5	179.5	63.2	0	0	0	0	111.5	A743 Q744 L745	T741-A743 PolarHBondContact O-N 3.41Å; T741-Q744 PolarHBondContact O-N 3.26Å; T741-Q744 VanDerWaalsContact O-N 3.14Å; T741-Q744 VanDerWaalsContact OG1-CD 3.26Å; T741-Q744 VanDerWaalsContact OG1-CG 3.24Å; T741-Q744 WeakPolarHBondContact OG1-CG 3.46Å; T741-Q744 PolarHBondContact OG1-N 3.28Å; T741-Q744 PolarHBondContact OG1-OE1 3.42Å; T741-L745 PolarHBondContact O-N 3.41Å; T741-L745 VanDerWaalsContact O-N 3.14Å
742	P	82.2	Confident	83.6	Confident	98 Å²	98	63.5 Å²	63.5	64%	0.636	36%	0.364	S	S	*	.	H	α-helix	trans	-62.3	-25.2	175.9	25.2	-34.3	0	0	0	112.6	L745 N746	P742-L745 PolarHBondContact O-N 2.96Å; P742-N746 PolarHBondContact O-N 2.95Å; P742-N746 PolarHBondContact O-ND2 3.37Å
743	A	84.1	Confident	83.5	Confident	69 Å²	69	65.3 Å²	65.3	57%	0.57	37%	0.365	S	S	*	.	H	α-helix	trans	-67.3	-44.5	174.1	0	0	0	0	0	112.1	T741 L745 N746 E747	T741-A743 PolarHBondContact O-N 3.41Å; A743-L745 VanDerWaalsContact C-N 3.31Å; A743-L745 PolarHBondContact O-N 3.36Å; A743-N746 PolarHBondContact O-N 3.48Å; A743-E747 WeakPolarHBondContact O-CB 3.27Å; A743-E747 PolarHBondContact O-N 3.19Å
744	Q	84.1	Confident	83.4	Confident	60 Å²	60	65.2 Å²	65.2	28%	0.28	37%	0.369	S	S	.	.	H	α-helix	trans	-63.6	-37.1	174.9	-74.2	164	-21.1	0	0	111.8	Y707 T741 V748	Y707-Q744 HydrophobicContact CD2-CB 4.09Å; Y707-Q744 HydrophobicContact CD2-CG 4.2Å; Y707-Q744 HydrophobicContact CE2-CB 4.16Å; Y707-Q744 HydrophobicContact CE2-CG 4.13Å; T741-Q744 PolarHBondContact O-N 3.26Å; T741-Q744 VanDerWaalsContact O-N 3.14Å; T741-Q744 VanDerWaalsContact OG1-CD 3.26Å; T741-Q744 VanDerWaalsContact OG1-CG 3.24Å; T741-Q744 WeakPolarHBondContact OG1-CG 3.46Å; T741-Q744 PolarHBondContact OG1-N 3.28Å; T741-Q744 PolarHBondContact OG1-OE1 3.42Å; Q744-V748 WeakPolarHBondContact O-CB 3.23Å; Q744-V748 VanDerWaalsContact O-CG2 3.23Å; Q744-V748 WeakPolarHBondContact O-CG2 3.1Å; Q744-V748 PolarHBondContact O-N 3.42Å
745	L	84.5	Confident	83.4	Confident	5 Å²	5	65.7 Å²	65.7	3%	0.026	38%	0.379	C	S	.	.	H	α-helix	trans	-63.2	-47	174.9	177.9	60.6	0	0	0	111.6	I711 I731 A732 T741 P742 A743 V748 I749	I711-L745 HydrophobicContact CG2-CD1 3.69Å; I731-L745 HydrophobicContact CG2-CD1 3.74Å; I731-L745 HydrophobicContact CG2-CD2 4.2Å; A732-L745 HydrophobicContact CB-CD2 3.96Å; T741-L745 PolarHBondContact O-N 3.41Å; T741-L745 VanDerWaalsContact O-N 3.14Å; P742-L745 PolarHBondContact O-N 2.96Å; A743-L745 VanDerWaalsContact C-N 3.31Å; A743-L745 PolarHBondContact O-N 3.36Å; L745-V748 PolarHBondContact O-N 2.95Å; L745-I749 HydrophobicContact CD1-CD1 3.93Å; L745-I749 HydrophobicContact CD1-CG1 4.23Å; L745-I749 HydrophobicContact CG-CD1 3.83Å; L745-I749 VanDerWaalsContact O-CG1 3.27Å; L745-I749 WeakPolarHBondContact O-CG1 3.35Å; L745-I749 PolarHBondContact O-N 3.43Å
746	N	84.2	Confident	83.2	Confident	78 Å²	78	71.8 Å²	71.8	42%	0.417	41%	0.412	S	S	.	.	H	α-helix	trans	-64.2	-41.4	178.2	-71.2	-20.8	0	0	0	112	P742 A743 V748 I749 E750	P742-N746 PolarHBondContact O-N 2.95Å; P742-N746 PolarHBondContact O-ND2 3.37Å; A743-N746 PolarHBondContact O-N 3.48Å; N746-V748 VanDerWaalsContact C-N 3.27Å; N746-V748 PolarHBondContact O-N 2.98Å; N746-I749 PolarHBondContact O-N 2.81Å; N746-E750 WeakPolarHBondContact O-CB 3.21Å; N746-E750 WeakPolarHBondContact O-CG 3.45Å; N746-E750 PolarHBondContact O-N 3.47Å
747	E	85.1	Confident	82.8	Confident	81 Å²	81	70.9 Å²	70.9	38%	0.379	40%	0.399	S	S	.	.	H	α-helix	trans	-59.6	-39.6	175.2	-167	-152	149.3	0	0	111.6	Y707 K708 A743 A751	Y707-E747 PolarHBondContact OH-OE1 2.9Å; Y707-E747 PolarHBondContact OH-OE2 3.26Å; K708-E747 WeakPolarHBondContact CE-OE1 3.47Å; K708-E747 IonicContact NZ-OE1 2.76Å; K708-E747 PolarHBondContact NZ-OE1 3.05Å; A743-E747 WeakPolarHBondContact O-CB 3.27Å; A743-E747 PolarHBondContact O-N 3.19Å; E747-A751 VanDerWaalsContact O-CB 3.29Å; E747-A751 WeakPolarHBondContact O-CB 3.4Å; E747-A751 PolarHBondContact O-N 3.15Å
748	V	83.7	Confident	82.6	Confident	0 Å²	0	65.5 Å²	65.5	0%	0	37%	0.365	C	S	.	.	H	α-helix	trans	-70.5	-41.8	177.5	170.8	0	0	0	0	111.6	Y707 K708 I711 Q744 L745 N746 A751 Y752 W758	Y707-V748 HydrophobicContact CD2-CG2 4.14Å; Y707-V748 HydrophobicContact CE2-CG2 4.06Å; K708-V748 HydrophobicContact CB-CG2 4.01Å; K708-V748 HydrophobicContact CD-CG2 4.33Å; K708-V748 HydrophobicContact CG-CG2 3.73Å; I711-V748 HydrophobicContact CB-CG1 4.1Å; I711-V748 HydrophobicContact CD1-CB 4.43Å; I711-V748 HydrophobicContact CD1-CG2 3.96Å; I711-V748 HydrophobicContact CG2-CB 4.18Å; I711-V748 HydrophobicContact CG2-CG1 3.64Å; Q744-V748 WeakPolarHBondContact O-CB 3.23Å; Q744-V748 VanDerWaalsContact O-CG2 3.23Å; Q744-V748 WeakPolarHBondContact O-CG2 3.1Å; Q744-V748 PolarHBondContact O-N 3.42Å; L745-V748 PolarHBondContact O-N 2.95Å; N746-V748 VanDerWaalsContact C-N 3.27Å; N746-V748 PolarHBondContact O-N 2.98Å; V748-A751 PolarHBondContact O-N 3.44Å; V748-Y752 HydrophobicContact CG1-CD2 3.45Å; V748-Y752 VanDerWaalsContact CG1-CD2 3.45Å; V748-Y752 HydrophobicContact CG1-CE2 3.42Å; V748-Y752 VanDerWaalsContact CG1-CE2 3.42Å; V748-Y752 WeakPolarHBondContact O-CD2 3.35Å; V748-Y752 PolarHBondContact O-N 3.33Å; V748-W758 HydrophobicContact CG1-CZ3 4.48Å
749	I	83.9	Confident	82.6	Confident	10 Å²	10	65.4 Å²	65.4	5%	0.051	37%	0.367	C	S	.	.	H	α-helix	trans	-62.2	-46.7	176.5	-68.5	166	0	0	0	110.3	L745 N746 A751 Y752 E753 W758 V760 I767	L745-I749 HydrophobicContact CD1-CD1 3.93Å; L745-I749 HydrophobicContact CD1-CG1 4.23Å; L745-I749 HydrophobicContact CG-CD1 3.83Å; L745-I749 VanDerWaalsContact O-CG1 3.27Å; L745-I749 WeakPolarHBondContact O-CG1 3.35Å; L745-I749 PolarHBondContact O-N 3.43Å; N746-I749 PolarHBondContact O-N 2.81Å; I749-A751 PolarHBondContact O-N 2.85Å; I749-Y752 PolarHBondContact O-N 2.79Å; I749-E753 VanDerWaalsContact O-CB 3.3Å; I749-E753 WeakPolarHBondContact O-CB 3.47Å; I749-E753 PolarHBondContact O-N 3.14Å; I749-W758 HydrophobicContact CG1-CZ3 4.24Å; I749-V760 HydrophobicContact CG2-CG2 3.73Å; I749-I767 HydrophobicContact CD1-CD1 3.93Å; I749-I767 HydrophobicContact CG1-CD1 3.95Å; I749-I767 HydrophobicContact CG2-CD1 4.38Å
750	E	84.2	Confident	82.4	Confident	92 Å²	92	63.7 Å²	63.7	43%	0.43	34%	0.344	S	S	.	.	H	α-helix	trans	-61.2	-44.8	177.2	-73.4	176.3	177	0	0	111.1	N746 Y752 E753 D754 R764	N746-E750 WeakPolarHBondContact O-CB 3.21Å; N746-E750 WeakPolarHBondContact O-CG 3.45Å; N746-E750 PolarHBondContact O-N 3.47Å; E750-Y752 VanDerWaalsContact C-N 3.33Å; E750-Y752 PolarHBondContact O-N 2.73Å; E750-E753 PolarHBondContact O-N 2.91Å; E750-D754 PolarHBondContact O-N 3.31Å; E750-R764 IonicContact OE1-NH2 2.7Å
751	A	84.3	Confident	82.1	Confident	30 Å²	30	65.2 Å²	65.2	25%	0.248	36%	0.356	C	S	.	.	H	α-helix	trans	-62.4	-36.7	177.1	0	0	0	0	0	113.3	E747 V748 I749 L755	E747-A751 VanDerWaalsContact O-CB 3.29Å; E747-A751 WeakPolarHBondContact O-CB 3.4Å; E747-A751 PolarHBondContact O-N 3.15Å; V748-A751 PolarHBondContact O-N 3.44Å; I749-A751 PolarHBondContact O-N 2.85Å; A751-L755 WeakPolarHBondContact O-CD1 3.35Å; A751-L755 VanDerWaalsContact O-CG 3.22Å; A751-L755 WeakPolarHBondContact O-CG 3.36Å; A751-L755 PolarHBondContact O-N 2.89Å
752	Y	83.2	Confident	81.6	Confident	33 Å²	33	70.4 Å²	70.4	13%	0.129	38%	0.379	C	S	.	.	H	α-helix	trans	-82.6	-22.4	177.6	-76.7	-62.6	0	0	0	113.7	K708 Y712 V748 I749 E750 L755 N756 V757 W758	K708-Y752 PolarHBondContact O-OH 2.81Å; Y712-Y752 HydrophobicContact CD2-CD1 4.36Å; Y712-Y752 HydrophobicContact CD2-CD2 4.5Å; Y712-Y752 AromaticContact CD2-CE1 3.88Å; Y712-Y752 HydrophobicContact CD2-CE1 3.88Å; Y712-Y752 HydrophobicContact CD2-CE2 4.03Å; Y712-Y752 AromaticContact CD2-CZ 3.72Å; Y712-Y752 HydrophobicContact CE2-CE1 4.39Å; Y712-Y752 HydrophobicContact CG-CE2 4.38Å; V748-Y752 HydrophobicContact CG1-CD2 3.45Å; V748-Y752 VanDerWaalsContact CG1-CD2 3.45Å; V748-Y752 HydrophobicContact CG1-CE2 3.42Å; V748-Y752 VanDerWaalsContact CG1-CE2 3.42Å; V748-Y752 WeakPolarHBondContact O-CD2 3.35Å; V748-Y752 PolarHBondContact O-N 3.33Å; I749-Y752 PolarHBondContact O-N 2.79Å; E750-Y752 VanDerWaalsContact C-N 3.33Å; E750-Y752 PolarHBondContact O-N 2.73Å; Y752-L755 HydrophobicContact CD1-CD1 4.12Å; Y752-L755 HydrophobicContact CE1-CD1 4.42Å; Y752-N756 PolarHBondContact O-N 3.43Å; Y752-V757 HydrophobicContact CD1-CB 4.4Å; Y752-V757 HydrophobicContact CD1-CG2 4.3Å; Y752-V757 PolarHBondContact O-N 2.94Å; Y752-W758 HydrophobicContact CD2-CE3 4.21Å; Y752-W758 AromaticContact CD2-CH2 3.63Å; Y752-W758 HydrophobicContact CD2-CH2 3.63Å; Y752-W758 HydrophobicContact CD2-CZ2 4.26Å; Y752-W758 AromaticContact CD2-CZ3 3.61Å; Y752-W758 HydrophobicContact CD2-CZ3 3.61Å; Y752-W758 HydrophobicContact CE2-CH2 4.17Å; Y752-W758 HydrophobicContact CG-CD2 4.48Å; Y752-W758 HydrophobicContact CG-CE3 4.2Å; Y752-W758 HydrophobicContact CG-CH2 4.2Å; Y752-W758 HydrophobicContact CG-CZ2 4.49Å; Y752-W758 HydrophobicContact CG-CZ3 4.06Å; Y752-W758 PolarHBondContact O-N 2.97Å
753	E	82.8	Confident	81	Confident	77 Å²	77	68.2 Å²	68.2	36%	0.36	37%	0.374	S	S	.	.	H	α-helix	trans	-68.1	-45.6	168	-174.4	172.3	-169	0	0	110	I749 E750 L755 N756	I749-E753 VanDerWaalsContact O-CB 3.3Å; I749-E753 WeakPolarHBondContact O-CB 3.47Å; I749-E753 PolarHBondContact O-N 3.14Å; E750-E753 PolarHBondContact O-N 2.91Å; E753-L755 PolarHBondContact O-N 2.89Å; E753-N756 PolarHBondContact O-N 3.4Å
754	D	83.3	Confident	80.4	Confident	134 Å²	134	72.8 Å²	72.8	72%	0.717	38%	0.377	S	S	*	.	H	α-helix	trans	-61	-32.4	174.4	-74.1	-19.8	0	0	0	112.7	E750 N756	E750-D754 PolarHBondContact O-N 3.31Å; D754-N756 PolarHBondContact O-N 3.39Å
755	L	81.2	Confident	79.9	Confident	116 Å²	116	73.8 Å²	73.8	61%	0.607	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.9	3.2	175.9	-69.9	166.6	0	0	0	113.5	A751 Y752 E753 V757	A751-L755 WeakPolarHBondContact O-CD1 3.35Å; A751-L755 VanDerWaalsContact O-CG 3.22Å; A751-L755 WeakPolarHBondContact O-CG 3.36Å; A751-L755 PolarHBondContact O-N 2.89Å; Y752-L755 HydrophobicContact CD1-CD1 4.12Å; Y752-L755 HydrophobicContact CE1-CD1 4.42Å; E753-L755 PolarHBondContact O-N 2.89Å; L755-V757 HydrophobicContact CB-CG2 4.03Å; L755-V757 PolarHBondContact O-N 3.23Å; L755-V757 VanDerWaalsContact O-N 3.16Å
756	N	77.2	Confident	79.6	Confident	132 Å²	132	79.1 Å²	79.1	71%	0.706	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.4	22	-177.8	-62.9	-57.5	0	0	0	115	Y752 E753 D754	Y752-N756 PolarHBondContact O-N 3.43Å; E753-N756 PolarHBondContact O-N 3.4Å; D754-N756 PolarHBondContact O-N 3.39Å
757	V	76.3	Confident	79.5	Confident	47 Å²	47	75.4 Å²	75.4	29%	0.285	39%	0.387	S	S	.	.	S	Bend	trans	-80.3	-34.5	177.7	-176.3	0	0	0	0	110	Y712 Y752 L755 V770	Y712-V757 HydrophobicContact CE2-CG1 4.2Å; Y752-V757 HydrophobicContact CD1-CB 4.4Å; Y752-V757 HydrophobicContact CD1-CG2 4.3Å; Y752-V757 PolarHBondContact O-N 2.94Å; L755-V757 HydrophobicContact CB-CG2 4.03Å; L755-V757 PolarHBondContact O-N 3.23Å; L755-V757 VanDerWaalsContact O-N 3.16Å; V757-V770 PolarHBondContact O-N 2.97Å; V757-V770 VanDerWaalsContact O-N 3.07Å
758	W	80.8	Confident	79.1	Confident	5 Å²	5	74 Å²	74	2%	0.019	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	139	-176.9	-64.9	-18.5	0	0	0	111	Y712 V715 V748 I749 Y752 I767 T768	Y712-W758 HydrophobicContact CD2-CH2 4.16Å; Y712-W758 AromaticContact CD2-CZ2 3.52Å; Y712-W758 HydrophobicContact CD2-CZ2 3.52Å; Y712-W758 HydrophobicContact CE2-CZ2 4.02Å; Y712-W758 HydrophobicContact CG-CZ2 4.46Å; V715-W758 HydrophobicContact CB-CH2 3.65Å; V715-W758 HydrophobicContact CB-CZ2 3.56Å; V715-W758 HydrophobicContact CG1-CD2 4.4Å; V715-W758 HydrophobicContact CG1-CH2 3.73Å; V715-W758 HydrophobicContact CG1-CZ2 3.37Å; V715-W758 HydrophobicContact CG1-CZ3 4.35Å; V715-W758 HydrophobicContact CG2-CH2 3.64Å; V715-W758 HydrophobicContact CG2-CZ2 4.11Å; V715-W758 HydrophobicContact CG2-CZ3 4.23Å; V748-W758 HydrophobicContact CG1-CZ3 4.48Å; I749-W758 HydrophobicContact CG1-CZ3 4.24Å; Y752-W758 HydrophobicContact CD2-CE3 4.21Å; Y752-W758 AromaticContact CD2-CH2 3.63Å; Y752-W758 HydrophobicContact CD2-CH2 3.63Å; Y752-W758 HydrophobicContact CD2-CZ2 4.26Å; Y752-W758 AromaticContact CD2-CZ3 3.61Å; Y752-W758 HydrophobicContact CD2-CZ3 3.61Å; Y752-W758 HydrophobicContact CE2-CH2 4.17Å; Y752-W758 HydrophobicContact CG-CD2 4.48Å; Y752-W758 HydrophobicContact CG-CE3 4.2Å; Y752-W758 HydrophobicContact CG-CH2 4.2Å; Y752-W758 HydrophobicContact CG-CZ2 4.49Å; Y752-W758 HydrophobicContact CG-CZ3 4.06Å; Y752-W758 PolarHBondContact O-N 2.97Å; W758-I767 HydrophobicContact CB-CG2 3.7Å; W758-I767 HydrophobicContact CD2-CG2 4.03Å; W758-I767 HydrophobicContact CE3-CD1 4.39Å; W758-I767 HydrophobicContact CE3-CG2 4.36Å; W758-I767 HydrophobicContact CG-CG2 3.71Å; W758-T768 WeakPolarHBondContact CA-O 3.32Å
759	Q	78.7	Confident	78.6	Confident	119 Å²	119	76.4 Å²	76.4	56%	0.556	40%	0.399	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-106	124.9	167	-80.9	175.2	3.8	0	0	109.1	T768 V770	Q759-T768 PolarHBondContact N-O 3.21Å; Q759-T768 PolarHBondContact O-N 3.11Å; Q759-T768 PolarHBondContact O-OG1 3.01Å; Q759-V770 HydrophobicContact CB-CG2 4.17Å; Q759-V770 HydrophobicContact CG-CG2 3.53Å
760	V	77.4	Confident	77.9	Confident	27 Å²	27	78.9 Å²	78.9	16%	0.164	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	132.2	175.3	-174.3	0	0	0	0	108.7	I728 I749 R764 I767	I728-V760 HydrophobicContact CD1-CG1 4.09Å; I749-V760 HydrophobicContact CG2-CG2 3.73Å; V760-R764 HydrophobicContact CG1-CB 4.45Å; V760-R764 HydrophobicContact CG1-CG 4.19Å; V760-I767 HydrophobicContact CG2-CG1 4.49Å
761	N	79.5	Confident	76.6	Confident	88 Å²	88	82.4 Å²	82.4	47%	0.471	46%	0.459	S	S	.	.			trans	-64	151.5	175.9	-166.3	-12.5	0	0	0	110.8	G763 R764 R766	N761-G763 PolarHBondContact O-N 2.74Å; N761-R764 PolarHBondContact O-N 2.7Å; N761-R766 PolarHBondContact N-O 2.79Å; N761-R766 VanDerWaalsContact N-O 3.09Å
762	I	72.5	Confident	76.2	Confident	177 Å²	177	85.1 Å²	85.1	91%	0.908	47%	0.47	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.9	-29.6	-179.2	-59.4	167.4	0	0	0	112.3
763	G	70.1	Confident	75.8	Confident	52 Å²	52	87.8 Å²	87.8	54%	0.536	49%	0.488	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.9	4.3	175.9	0	0	0	0	0	116.4	N761 T765	N761-G763 PolarHBondContact O-N 2.74Å; G763-T765 WeakPolarHBondContact O-CG2 3.39Å; G763-T765 PolarHBondContact O-N 3.26Å; G763-T765 VanDerWaalsContact O-N 3.11Å
764	R	71	Confident	75.4	Confident	166 Å²	166	88.4 Å²	88.4	63%	0.626	50%	0.495	S	S	*	.	S	Bend	trans	47.4	37.5	-174	-68.2	-175.1	167.6	-168.4	-9.4	114	I728 E750 V760 N761	I728-R764 WeakPolarHBondContact CD1-O 3.49Å; E750-R764 IonicContact OE1-NH2 2.7Å; V760-R764 HydrophobicContact CG1-CB 4.45Å; V760-R764 HydrophobicContact CG1-CG 4.19Å; N761-R764 PolarHBondContact O-N 2.7Å
765	T	74.5	Confident	75	Confident	80 Å²	80	85.7 Å²	85.7	49%	0.491	48%	0.482	S	S	.	.			trans	-107.1	-25.6	-178.7	51.8	0	0	0	0	114.2	I728 G763	I728-T765 PolarHBondContact N-O 3.08Å; I728-T765 VanDerWaalsContact N-O 3.1Å; G763-T765 WeakPolarHBondContact O-CG2 3.39Å; G763-T765 PolarHBondContact O-N 3.26Å; G763-T765 VanDerWaalsContact O-N 3.11Å
766	R	78.7	Confident	74.6	Confident	117 Å²	117	83.8 Å²	83.8	44%	0.442	47%	0.474	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	139.7	-175.5	-65.5	-174.2	-178.1	177.2	0.3	110.8	A726 R727 N761	A726-R766 CarbonylContact O-C 3.49Å; A726-R766 WeakPolarHBondContact O-CA 3.27Å; R727-R766 HydrophobicContact CG-CG 4.48Å; N761-R766 PolarHBondContact N-O 2.79Å; N761-R766 VanDerWaalsContact N-O 3.09Å
767	I	80.4	Confident	74.4	Confident	0 Å²	0	80.6 Å²	80.6	0%	0	46%	0.459	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	128.3	170.3	-56.4	-174.3	0	0	0	107.7	T725 A726 I728 I731 I749 W758 V760	T725-I767 CarbonylContact C-O 3.6Å; T725-I767 WeakPolarHBondContact CA-O 3.45Å; A726-I767 PolarHBondContact N-O 3.34Å; A726-I767 PolarHBondContact O-N 3.11Å; I728-I767 HydrophobicContact CD1-CD1 4.47Å; I728-I767 HydrophobicContact CD1-CG1 3.94Å; I728-I767 HydrophobicContact CG1-CD1 3.97Å; I728-I767 HydrophobicContact CG1-CG1 3.63Å; I731-I767 HydrophobicContact CD1-CD1 3.71Å; I731-I767 HydrophobicContact CD1-CG1 4.32Å; I749-I767 HydrophobicContact CD1-CD1 3.93Å; I749-I767 HydrophobicContact CG1-CD1 3.95Å; I749-I767 HydrophobicContact CG2-CD1 4.38Å; W758-I767 HydrophobicContact CB-CG2 3.7Å; W758-I767 HydrophobicContact CD2-CG2 4.03Å; W758-I767 HydrophobicContact CE3-CD1 4.39Å; W758-I767 HydrophobicContact CE3-CG2 4.36Å; W758-I767 HydrophobicContact CG-CG2 3.71Å; V760-I767 HydrophobicContact CG2-CG1 4.49Å
768	T	78	Confident	74.3	Confident	51 Å²	51	83 Å²	83	31%	0.313	47%	0.471	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	125.2	171	24.6	0	0	0	0	108.9	G724 T725 W758 Q759 V770	G724-T768 WeakPolarHBondContact O-CA 3.4Å; T725-T768 HydrophobicContact CG2-CG2 3.61Å; W758-T768 WeakPolarHBondContact CA-O 3.32Å; Q759-T768 PolarHBondContact N-O 3.21Å; Q759-T768 PolarHBondContact O-N 3.11Å; Q759-T768 PolarHBondContact O-OG1 3.01Å; T768-V770 PolarHBondContact O-N 2.89Å
769	T	73.7	Confident	73.8	Confident	51 Å²	51	89 Å²	89	31%	0.313	51%	0.506	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	121.8	172.3	49.5	0	0	0	0	109	T719 G724	T719-T769 HydrophobicContact CG2-CG2 3.59Å; G724-T769 PolarHBondContact O-N 3.31Å; G724-T769 PolarHBondContact O-OG1 2.99Å
770	V	68.2	Low	73.4	Confident	62 Å²	62	86.5 Å²	86.5	38%	0.376	50%	0.502	S	S	.	.			trans	-77.4	126.3	170.5	-170.8	0	0	0	0	106.6	V757 Q759 T768	V757-V770 PolarHBondContact O-N 2.97Å; V757-V770 VanDerWaalsContact O-N 3.07Å; Q759-V770 HydrophobicContact CB-CG2 4.17Å; Q759-V770 HydrophobicContact CG-CG2 3.53Å; T768-V770 PolarHBondContact O-N 2.89Å
771	A	56.7	Low	73	Confident	167 Å²	167	91.9 Å²	91.9	100%	1.38	53%	0.532	S	S	*	.			trans	-66.6	0	-179.7	0	0	0	0	0	112.3

Retrieved 771 of 771 residues in 869.3 ms (Link to these results)

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