A0A096MGF8_POEFO Loading...

ABC-type oligopeptide transporter ABCB9

ATP-dependent low-affinity peptide transporter which translocates a broad spectrum of peptides from the cytosol to the lysosomal lumen for degradation. Displays a broad peptide length specificity from 6-mer up to at least 59-mer peptides with an optimum of 23-mers. Binds and transports smaller and larger peptides with the same affinity. Favors positively charged, aromatic or hydrophobic residues in the N- and C-terminal positions whereas negatively charged residues as well as asparagine and methionine are not favored.

AlphaFold DB , UniProt , Accession A0A096MGF8, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 801 aa.

						>A0A096MGF8_POEFO|A0A096MGF8
MGIYAPVICTLLYVVLDSVITTVLYIKGTELSLFIRDVLDFNILSSALDLWGIVLLRASLLLGASIGVLWNREDGPPRVARVTTVILLFCMVVITYTLAKLLMLTEVEPLNRQPCFLSLMGWTCASSLGVVLLWRQLGRVSSSASGLEVRNSRGGGGRVSEDTEKLVDTAGEEEEAGGRKEKEKVSSRATLGRLLSYCRKDAGLLSLAVLFLLISAVCEAFIPLYYGKAIDSIVVHQSMEYFAKPVATLASLALVSSMAIAVRGGVFTLTMARLNVRLRSRLFRTLMTQEIAFFDENHTGDILSRLSADTTQVSDLISQNVNVFLRSVIKGTGFIIFMFRMSWKLTLVTVMGFPFIALVSKLYGEYYKKLTKEVQTVLAEANKVAEETISGMRTVRSFANESREANSYYAKLLVMFQLNKKQALAYACYMWSSCISELALEVAVLYYGGHLVLTDQLSSGGLISFFIYMLELGECFESIASVYTGLMQGVGAAEKVFEYLDRKPKHPADGTEAPNSCTGLVEFKDVTFAYPTRPETDVLKGVSFTLRPGEVTALVGPSGSGKSSCVSLLENFYLPQGGQVLLDGKPVNEFQHDYLHSKIALVGQEPVLFARTIKDNISYGLSDVSMEMVVQAATKANAHDFITTLPKGYDTSVGEKGLQLSGGQKQRVAIARALIRQPRVLILDEATSALDAESEHIVQQALNSIMQEHTVLVIAHRLSTVEKADNIIVIDRGQVAERGTHSQLMATGGLYCKLVQRQVLGIETGAEVLNPSETVRWKSDRGRRRRNSSSSGSESEHNKCY
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	49.3	Very low	77.5	Confident	211 Å²	211	67.8 Å²	67.8	100%	1.039	39%	0.388	S	S	*	.				0	-25.7	0	-81.4	176.8	169.7	0	0	115.1	I3 Y4 A5	M1-I3 PolarHBondContact O-N 3.4Å; M1-Y4 PolarHBondContact O-N 2.98Å; M1-A5 PolarHBondContact O-N 3.21Å
2	G	62.8	Low	78.4	Confident	58 Å²	58	72.1 Å²	72.1	60%	0.598	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.4	-38.8	-165.5	0	0	0	0	0	119	P6	G2-P6 WeakPolarHBondContact O-CD 3.21Å; G2-P6 WeakPolarHBondContact O-CG 3.27Å
3	I	67.9	Low	79.3	Confident	49 Å²	49	69.6 Å²	69.6	25%	0.251	39%	0.389	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.2	-32.6	-179	-57.2	160.8	0	0	0	112.6	M1 P6 V7 V68 V140	M1-I3 PolarHBondContact O-N 3.4Å; I3-P6 VanDerWaalsContact O-CD 3.31Å; I3-P6 WeakPolarHBondContact O-CD 3.45Å; I3-P6 WeakPolarHBondContact O-CG 3.41Å; I3-V7 HydrophobicContact CG2-CG2 4.31Å; I3-V7 WeakPolarHBondContact O-CG2 3.22Å; I3-V7 PolarHBondContact O-N 3.38Å; I3-V68 HydrophobicContact CG2-CG1 3.71Å; I3-V140 HydrophobicContact CB-CG1 4.18Å; I3-V140 HydrophobicContact CG1-CG1 3.53Å
4	Y	78.3	Confident	80	Confident	117 Å²	117	65.6 Å²	65.6	46%	0.459	37%	0.366	S	S	.	.	H	α-helix	trans	-70	-37.6	-175.9	-70	-81.1	0	0	0	112.6	M1 V7 I8 L69 R72	M1-Y4 PolarHBondContact O-N 2.98Å; Y4-V7 PolarHBondContact O-N 3.42Å; Y4-I8 WeakPolarHBondContact O-CB 3.38Å; Y4-I8 WeakPolarHBondContact O-CD1 3.38Å; Y4-I8 WeakPolarHBondContact O-CG1 3.37Å; Y4-I8 PolarHBondContact O-N 3.37Å; Y4-L69 HydrophobicContact CE1-CD1 4.3Å; Y4-R72 PolarHBondContact OH-NH2 2.62Å; Y4-R72 VanDerWaalsContact OH-NH2 3.09Å
5	A	80.3	Confident	80.5	Confident	63 Å²	63	67.3 Å²	67.3	52%	0.521	38%	0.379	S	S	.	.	H	α-helix	trans	-58.3	-52.8	178.6	0	0	0	0	0	113.9	M1 V7 I8 C9	M1-A5 PolarHBondContact O-N 3.21Å; A5-V7 PolarHBondContact O-N 3.38Å; A5-I8 PolarHBondContact O-N 2.77Å; A5-C9 WeakPolarHBondContact O-CB 3.29Å; A5-C9 PolarHBondContact O-N 3.06Å
6	P	81.6	Confident	81.1	Confident	18 Å²	18	68.5 Å²	68.5	12%	0.117	38%	0.384	C	S	.	.	H	α-helix	trans	-67	-33.9	177.7	23.7	-32.4	0	0	0	113.2	G2 I3 C9 T10 L137 V140	G2-P6 WeakPolarHBondContact O-CD 3.21Å; G2-P6 WeakPolarHBondContact O-CG 3.27Å; I3-P6 VanDerWaalsContact O-CD 3.31Å; I3-P6 WeakPolarHBondContact O-CD 3.45Å; I3-P6 WeakPolarHBondContact O-CG 3.41Å; P6-C9 WeakPolarHBondContact O-CB 3.39Å; P6-C9 PolarHBondContact O-N 3.37Å; P6-T10 PolarHBondContact O-N 3.21Å; P6-T10 PolarHBondContact O-OG1 3.38Å; P6-L137 HydrophobicContact CB-CD1 4.26Å; P6-V140 HydrophobicContact CB-CG2 4.34Å; P6-V140 HydrophobicContact CG-CG2 3.63Å
7	V	84.6	Confident	81.5	Confident	6 Å²	6	64.7 Å²	64.7	4%	0.036	36%	0.362	C	S	.	.	H	α-helix	trans	-70.9	-38.2	176.5	174.8	0	0	0	0	112.3	I3 Y4 A5 C9 T10 L11 V68 L69	I3-V7 HydrophobicContact CG2-CG2 4.31Å; I3-V7 WeakPolarHBondContact O-CG2 3.22Å; I3-V7 PolarHBondContact O-N 3.38Å; Y4-V7 PolarHBondContact O-N 3.42Å; A5-V7 PolarHBondContact O-N 3.38Å; V7-C9 VanDerWaalsContact C-N 3.31Å; V7-T10 WeakPolarHBondContact CA-OG1 3.45Å; V7-T10 PolarHBondContact O-N 2.87Å; V7-T10 PolarHBondContact O-OG1 2.73Å; V7-L11 HydrophobicContact CG1-CD1 4.11Å; V7-L11 VanDerWaalsContact O-CG 3.25Å; V7-L11 WeakPolarHBondContact O-CG 3.47Å; V7-L11 PolarHBondContact O-N 2.88Å; V7-V68 HydrophobicContact CG2-CG1 4.14Å; V7-L69 HydrophobicContact CG1-CD1 4.28Å
8	I	85.9	Confident	81.7	Confident	93 Å²	93	63.1 Å²	63.1	48%	0.477	36%	0.356	S	S	.	.	H	α-helix	trans	-66	-38.8	172.7	-69.1	164.5	0	0	0	109.9	Y4 A5 L11 L12	Y4-I8 WeakPolarHBondContact O-CB 3.38Å; Y4-I8 WeakPolarHBondContact O-CD1 3.38Å; Y4-I8 WeakPolarHBondContact O-CG1 3.37Å; Y4-I8 PolarHBondContact O-N 3.37Å; A5-I8 PolarHBondContact O-N 2.77Å; I8-L11 PolarHBondContact O-N 3.23Å; I8-L12 HydrophobicContact CG2-CD1 3.87Å; I8-L12 HydrophobicContact CG2-CG 4.31Å; I8-L12 WeakPolarHBondContact O-CB 3.48Å; I8-L12 VanDerWaalsContact O-CG 3.31Å; I8-L12 WeakPolarHBondContact O-CG 3.46Å; I8-L12 PolarHBondContact O-N 3.12Å
9	C	87.4	Confident	82	Confident	57 Å²	57	64.1 Å²	64.1	39%	0.385	36%	0.363	S	S	.	.	H	α-helix	trans	-61.1	-44.2	175.2	-166	0	0	0	0	112.3	A5 P6 V7 Y13	A5-C9 WeakPolarHBondContact O-CB 3.29Å; A5-C9 PolarHBondContact O-N 3.06Å; P6-C9 WeakPolarHBondContact O-CB 3.39Å; P6-C9 PolarHBondContact O-N 3.37Å; V7-C9 VanDerWaalsContact C-N 3.31Å; C9-Y13 VanDerWaalsContact O-CB 3.25Å; C9-Y13 WeakPolarHBondContact O-CB 3.5Å; C9-Y13 PolarHBondContact O-N 3.13Å
10	T	86.9	Confident	82.1	Confident	0 Å²	0	63.4 Å²	63.4	0%	0	36%	0.358	C	S	.	.	H	α-helix	trans	-65.1	-41.5	174.7	44.1	0	0	0	0	113.1	P6 V7 Y13 V14 L61 S65 L133 L137	P6-T10 PolarHBondContact O-N 3.21Å; P6-T10 PolarHBondContact O-OG1 3.38Å; V7-T10 WeakPolarHBondContact CA-OG1 3.45Å; V7-T10 PolarHBondContact O-N 2.87Å; V7-T10 PolarHBondContact O-OG1 2.73Å; T10-Y13 WeakPolarHBondContact O-CB 3.33Å; T10-Y13 PolarHBondContact O-N 3.25Å; T10-V14 WeakPolarHBondContact O-CG2 3.38Å; T10-V14 PolarHBondContact O-N 3.32Å; T10-L61 HydrophobicContact CG2-CD2 4.24Å; T10-S65 PolarHBondContact OG1-OG 3.34Å; T10-L133 HydrophobicContact CG2-CB 3.79Å; T10-L133 HydrophobicContact CG2-CD1 4.35Å; T10-L133 HydrophobicContact CG2-CD2 4.28Å; T10-L133 HydrophobicContact CG2-CG 4.37Å; T10-L137 HydrophobicContact CG2-CD1 3.44Å; T10-L137 VanDerWaalsContact CG2-CD1 3.44Å
11	L	87.4	Confident	82.2	Confident	74 Å²	74	60.3 Å²	60.3	39%	0.387	34%	0.341	S	S	.	.	H	α-helix	trans	-64.4	-45.8	179.2	-69.4	171.7	0	0	0	111.7	V7 I8 Y13 V14 V15 L62	V7-L11 HydrophobicContact CG1-CD1 4.11Å; V7-L11 VanDerWaalsContact O-CG 3.25Å; V7-L11 WeakPolarHBondContact O-CG 3.47Å; V7-L11 PolarHBondContact O-N 2.88Å; I8-L11 PolarHBondContact O-N 3.23Å; L11-Y13 VanDerWaalsContact C-N 3.28Å; L11-Y13 PolarHBondContact O-N 3.39Å; L11-V14 PolarHBondContact O-N 3.48Å; L11-V15 WeakPolarHBondContact O-CG2 3.45Å; L11-V15 PolarHBondContact O-N 3.4Å; L11-L62 HydrophobicContact CD2-CD2 3.55Å
12	L	88.4	Confident	83.8	Confident	119 Å²	119	52.5 Å²	52.5	62%	0.623	31%	0.305	S	S	*	.	H	α-helix	trans	-60.4	-39.6	173.8	-71.7	172.2	0	0	0	111.7	I8 V15 L16	I8-L12 HydrophobicContact CG2-CD1 3.87Å; I8-L12 HydrophobicContact CG2-CG 4.31Å; I8-L12 WeakPolarHBondContact O-CB 3.48Å; I8-L12 VanDerWaalsContact O-CG 3.31Å; I8-L12 WeakPolarHBondContact O-CG 3.46Å; I8-L12 PolarHBondContact O-N 3.12Å; L12-V15 PolarHBondContact O-N 3.44Å; L12-L16 WeakPolarHBondContact O-CB 3.43Å; L12-L16 PolarHBondContact O-N 2.73Å
13	Y	89.8	Confident	84.8	Confident	40 Å²	40	53 Å²	53	16%	0.157	30%	0.297	C	S	.	.	H	α-helix	trans	-66	-41.7	177.8	-175.4	-95	0	0	0	113.3	C9 T10 L11 V15 L16 D17 L61 S126 G129 V130 L133	C9-Y13 VanDerWaalsContact O-CB 3.25Å; C9-Y13 WeakPolarHBondContact O-CB 3.5Å; C9-Y13 PolarHBondContact O-N 3.13Å; T10-Y13 WeakPolarHBondContact O-CB 3.33Å; T10-Y13 PolarHBondContact O-N 3.25Å; L11-Y13 VanDerWaalsContact C-N 3.28Å; L11-Y13 PolarHBondContact O-N 3.39Å; Y13-V15 VanDerWaalsContact C-N 3.33Å; Y13-V15 PolarHBondContact O-N 2.89Å; Y13-L16 PolarHBondContact O-N 3.32Å; Y13-D17 WeakPolarHBondContact O-CB 3.47Å; Y13-D17 PolarHBondContact O-N 2.96Å; Y13-L61 HydrophobicContact CD1-CD1 3.85Å; Y13-L61 HydrophobicContact CE1-CD1 4.25Å; Y13-S126 WeakPolarHBondContact OH-CA 3.45Å; Y13-S126 PolarHBondContact OH-O 3.24Å; Y13-S126 PolarHBondContact OH-OG 3.17Å; Y13-G129 WeakPolarHBondContact OH-CA 3.47Å; Y13-V130 HydrophobicContact CE1-CG2 4.26Å; Y13-L133 HydrophobicContact CD1-CD1 3.38Å; Y13-L133 HydrophobicContact CD2-CD1 3.75Å; Y13-L133 HydrophobicContact CE1-CD1 3.96Å; Y13-L133 HydrophobicContact CE2-CD1 4.28Å; Y13-L133 HydrophobicContact CG-CD1 3.24Å
14	V	89.4	Confident	85.4	Confident	13 Å²	13	52.3 Å²	52.3	8%	0.079	29%	0.293	C	S	.	.	H	α-helix	trans	-61.5	-42	176.2	167.8	0	0	0	0	111.3	T10 L11 S18 A58 L61 L62	T10-V14 WeakPolarHBondContact O-CG2 3.38Å; T10-V14 PolarHBondContact O-N 3.32Å; L11-V14 PolarHBondContact O-N 3.48Å; V14-S18 WeakPolarHBondContact O-CB 3.36Å; V14-S18 PolarHBondContact O-N 3.12Å; V14-S18 PolarHBondContact O-OG 3.02Å; V14-A58 HydrophobicContact CG1-CB 3.66Å; V14-L61 HydrophobicContact CG2-CB 3.52Å; V14-L61 HydrophobicContact CG2-CD1 3.71Å; V14-L61 HydrophobicContact CG2-CG 4.28Å; V14-L62 HydrophobicContact CG1-CD1 4.27Å; V14-L62 HydrophobicContact CG1-CG 4.26Å
15	V	87.9	Confident	85.4	Confident	92 Å²	92	47.2 Å²	47.2	56%	0.558	27%	0.273	S	S	*	.	H	α-helix	trans	-62.8	-46.8	173.8	176.1	0	0	0	0	110.7	L11 L12 Y13 D17 S18 V19	L11-V15 WeakPolarHBondContact O-CG2 3.45Å; L11-V15 PolarHBondContact O-N 3.4Å; L12-V15 PolarHBondContact O-N 3.44Å; Y13-V15 VanDerWaalsContact C-N 3.33Å; Y13-V15 PolarHBondContact O-N 2.89Å; V15-D17 PolarHBondContact O-N 3.17Å; V15-S18 PolarHBondContact O-N 3.47Å; V15-V19 HydrophobicContact CG1-CG2 4.32Å; V15-V19 WeakPolarHBondContact O-CB 3.4Å; V15-V19 VanDerWaalsContact O-CG2 3.3Å; V15-V19 WeakPolarHBondContact O-CG2 3.5Å; V15-V19 PolarHBondContact O-N 2.86Å
16	L	88.9	Confident	85.1	Confident	86 Å²	86	48.6 Å²	48.6	45%	0.45	27%	0.27	S	S	.	.	H	α-helix	trans	-59.8	-46.9	179.3	-174.4	68	0	0	0	112.4	L12 Y13 V19 I20	L12-L16 WeakPolarHBondContact O-CB 3.43Å; L12-L16 PolarHBondContact O-N 2.73Å; Y13-L16 PolarHBondContact O-N 3.32Å; L16-V19 PolarHBondContact O-N 3.5Å; L16-I20 HydrophobicContact CD1-CD1 3.65Å; L16-I20 HydrophobicContact CD1-CG1 4.26Å; L16-I20 HydrophobicContact CG-CD1 3.84Å; L16-I20 WeakPolarHBondContact O-CB 3.37Å; L16-I20 WeakPolarHBondContact O-CG1 3.49Å; L16-I20 PolarHBondContact O-N 2.94Å
17	D	87.9	Confident	84.6	Confident	4 Å²	4	55.2 Å²	55.2	2%	0.021	30%	0.298	C	S	.	.	H	α-helix	trans	-62.1	-44.1	178.3	-172	40.9	0	0	0	112	Y13 V15 T21 V54 R57 W122 S126	Y13-D17 WeakPolarHBondContact O-CB 3.47Å; Y13-D17 PolarHBondContact O-N 2.96Å; V15-D17 PolarHBondContact O-N 3.17Å; D17-T21 VanDerWaalsContact O-CB 3.24Å; D17-T21 WeakPolarHBondContact O-CB 3.34Å; D17-T21 PolarHBondContact O-N 3.22Å; D17-T21 PolarHBondContact O-OG1 3.39Å; D17-V54 WeakPolarHBondContact OD2-CG1 3.29Å; D17-R57 IonicContact OD1-CZ 2.71Å; D17-R57 IonicContact OD1-NH2 3.61Å; D17-R57 PolarHBondContact OD1-NH2 2.81Å; D17-R57 IonicContact OD2-CZ 2.73Å; D17-R57 IonicContact OD2-NE 2.64Å; D17-R57 PolarHBondContact OD2-NE 3.36Å; D17-R57 IonicContact OD2-NH2 2.7Å; D17-R57 PolarHBondContact OD2-NH2 3.45Å; D17-W122 PolarHBondContact OD1-NE1 3.25Å; D17-S126 VanDerWaalsContact OD1-CB 3.25Å; D17-S126 WeakPolarHBondContact OD1-CB 3.33Å; D17-S126 PolarHBondContact OD1-OG 3.12Å; D17-S126 PolarHBondContact OD2-OG 3.07Å; D17-S126 VanDerWaalsContact OD2-OG 3.11Å
18	S	86.4	Confident	83.6	Confident	36 Å²	36	56.8 Å²	56.8	25%	0.252	32%	0.315	S	S	.	.	H	α-helix	trans	-65.4	-43.7	179.8	-55.4	0	0	0	0	111.6	V14 V15 T22	V14-S18 WeakPolarHBondContact O-CB 3.36Å; V14-S18 PolarHBondContact O-N 3.12Å; V14-S18 PolarHBondContact O-OG 3.02Å; V15-S18 PolarHBondContact O-N 3.47Å; S18-T22 VanDerWaalsContact O-CB 3.24Å; S18-T22 WeakPolarHBondContact O-CB 3.17Å; S18-T22 PolarHBondContact O-N 2.89Å; S18-T22 VanDerWaalsContact O-N 3.09Å; S18-T22 PolarHBondContact O-OG1 3.05Å
19	V	86.4	Confident	82.4	Confident	81 Å²	81	53.7 Å²	53.7	49%	0.491	30%	0.3	S	S	.	.	H	α-helix	trans	-68.1	-50.2	179	170.3	0	0	0	0	111.1	V15 L16 T21 T22 V23	V15-V19 HydrophobicContact CG1-CG2 4.32Å; V15-V19 WeakPolarHBondContact O-CB 3.4Å; V15-V19 VanDerWaalsContact O-CG2 3.3Å; V15-V19 WeakPolarHBondContact O-CG2 3.5Å; V15-V19 PolarHBondContact O-N 2.86Å; L16-V19 PolarHBondContact O-N 3.5Å; V19-T21 PolarHBondContact O-N 3.32Å; V19-T22 PolarHBondContact O-N 2.68Å; V19-V23 HydrophobicContact CG1-CG2 4.37Å; V19-V23 WeakPolarHBondContact O-CB 3.5Å; V19-V23 VanDerWaalsContact O-CG2 3.3Å; V19-V23 WeakPolarHBondContact O-CG2 3.4Å; V19-V23 PolarHBondContact O-N 2.8Å
20	I	84.8	Confident	81.3	Confident	50 Å²	50	57.6 Å²	57.6	26%	0.256	31%	0.313	S	S	.	.	H	α-helix	trans	-63.3	-45.1	-177.6	-69.9	175.7	0	0	0	110.9	L16 T22 V23 L24 W122	L16-I20 HydrophobicContact CD1-CD1 3.65Å; L16-I20 HydrophobicContact CD1-CG1 4.26Å; L16-I20 HydrophobicContact CG-CD1 3.84Å; L16-I20 WeakPolarHBondContact O-CB 3.37Å; L16-I20 WeakPolarHBondContact O-CG1 3.49Å; L16-I20 PolarHBondContact O-N 2.94Å; I20-T22 PolarHBondContact O-N 2.72Å; I20-V23 PolarHBondContact O-N 3.42Å; I20-L24 HydrophobicContact CG2-CD1 3.72Å; I20-L24 HydrophobicContact CG2-CG 4.28Å; I20-L24 WeakPolarHBondContact O-CB 3.45Å; I20-L24 VanDerWaalsContact O-CG 3.28Å; I20-L24 WeakPolarHBondContact O-CG 3.32Å; I20-L24 PolarHBondContact O-N 3.33Å; I20-W122 HydrophobicContact CB-CD2 4.36Å; I20-W122 HydrophobicContact CB-CZ2 4.07Å; I20-W122 HydrophobicContact CD1-CH2 3.56Å; I20-W122 HydrophobicContact CD1-CZ2 3.7Å; I20-W122 HydrophobicContact CD1-CZ3 4.04Å; I20-W122 HydrophobicContact CG1-CZ2 4.44Å; I20-W122 HydrophobicContact CG2-CD2 3.55Å; I20-W122 HydrophobicContact CG2-CE3 4.03Å; I20-W122 HydrophobicContact CG2-CG 3.82Å; I20-W122 HydrophobicContact CG2-CZ2 4.13Å; I20-W122 HydrophobicContact CG2-CZ3 4.5Å
21	T	84.1	Confident	80	Confident	0 Å²	0	63.8 Å²	63.8	0%	0	35%	0.345	C	S	.	.	H	α-helix	trans	-61.1	-44.6	177.2	-54.3	0	0	0	0	111.5	D17 V19 V23 L24 Y25 V54 L119 W122	D17-T21 VanDerWaalsContact O-CB 3.24Å; D17-T21 WeakPolarHBondContact O-CB 3.34Å; D17-T21 PolarHBondContact O-N 3.22Å; D17-T21 PolarHBondContact O-OG1 3.39Å; V19-T21 PolarHBondContact O-N 3.32Å; T21-V23 PolarHBondContact O-N 2.94Å; T21-L24 PolarHBondContact O-N 3.37Å; T21-Y25 WeakPolarHBondContact O-CB 3.34Å; T21-Y25 PolarHBondContact O-N 2.92Å; T21-V54 HydrophobicContact CG2-CB 4.26Å; T21-V54 HydrophobicContact CG2-CG2 3.41Å; T21-V54 VanDerWaalsContact CG2-CG2 3.41Å; T21-L119 HydrophobicContact CG2-CD1 3.56Å; T21-W122 PolarHBondContact OG1-NE1 3.07Å
22	T	82.9	Confident	78.5	Confident	47 Å²	47	63.7 Å²	63.7	29%	0.288	35%	0.351	S	S	.	.	H	α-helix	trans	-67.5	-37.7	-179.5	-57.2	0	0	0	0	111.8	S18 V19 I20 Y25 I26 W51	S18-T22 VanDerWaalsContact O-CB 3.24Å; S18-T22 WeakPolarHBondContact O-CB 3.17Å; S18-T22 PolarHBondContact O-N 2.89Å; S18-T22 VanDerWaalsContact O-N 3.09Å; S18-T22 PolarHBondContact O-OG1 3.05Å; V19-T22 PolarHBondContact O-N 2.68Å; I20-T22 PolarHBondContact O-N 2.72Å; T22-Y25 PolarHBondContact O-N 3.1Å; T22-I26 HydrophobicContact CG2-CD1 3.7Å; T22-I26 HydrophobicContact CG2-CG1 4.4Å; T22-I26 WeakPolarHBondContact O-CB 3.48Å; T22-I26 VanDerWaalsContact O-CG1 3.28Å; T22-I26 WeakPolarHBondContact O-CG1 3.2Å; T22-I26 PolarHBondContact O-N 2.84Å; T22-W51 PolarHBondContact OG1-NE1 2.93Å
23	V	83.6	Confident	77.3	Confident	69 Å²	69	61.3 Å²	61.3	42%	0.418	34%	0.338	S	S	.	.	H	α-helix	trans	-67.3	-40.4	174	170.7	0	0	0	0	111.9	V19 I20 T21 K27	V19-V23 HydrophobicContact CG1-CG2 4.37Å; V19-V23 WeakPolarHBondContact O-CB 3.5Å; V19-V23 VanDerWaalsContact O-CG2 3.3Å; V19-V23 WeakPolarHBondContact O-CG2 3.4Å; V19-V23 PolarHBondContact O-N 2.8Å; I20-V23 PolarHBondContact O-N 3.42Å; T21-V23 PolarHBondContact O-N 2.94Å; V23-K27 HydrophobicContact CG1-CD 4.25Å; V23-K27 WeakPolarHBondContact O-CB 3.38Å; V23-K27 WeakPolarHBondContact O-CG 3.39Å; V23-K27 PolarHBondContact O-N 3.39Å
24	L	80.1	Confident	76.1	Confident	34 Å²	34	62.8 Å²	62.8	18%	0.178	35%	0.346	C	S	.	.	H	α-helix	trans	-68.1	-35.1	176.8	-72.9	173.1	0	0	0	112.2	I20 T21 G28 L119 W122	I20-L24 HydrophobicContact CG2-CD1 3.72Å; I20-L24 HydrophobicContact CG2-CG 4.28Å; I20-L24 WeakPolarHBondContact O-CB 3.45Å; I20-L24 VanDerWaalsContact O-CG 3.28Å; I20-L24 WeakPolarHBondContact O-CG 3.32Å; I20-L24 PolarHBondContact O-N 3.33Å; T21-L24 PolarHBondContact O-N 3.37Å; L24-G28 PolarHBondContact O-N 3.46Å; L24-L119 HydrophobicContact CB-CB 4.2Å; L24-L119 HydrophobicContact CB-CD1 3.95Å; L24-W122 HydrophobicContact CD1-CB 3.86Å; L24-W122 HydrophobicContact CD1-CG 4.22Å
25	Y	77.8	Confident	75	Confident	10 Å²	10	67.4 Å²	67.4	4%	0.039	37%	0.369	C	S	.	.	H	α-helix	trans	-65.9	-56.8	172.4	-175	-90	0	0	0	111.1	T21 T22 K27 G28 T29 F34 A47 W51 L119	T21-Y25 WeakPolarHBondContact O-CB 3.34Å; T21-Y25 PolarHBondContact O-N 2.92Å; T22-Y25 PolarHBondContact O-N 3.1Å; Y25-K27 VanDerWaalsContact C-N 3.26Å; Y25-K27 PolarHBondContact O-N 2.63Å; Y25-G28 CarbonylContact O-C 3.58Å; Y25-G28 WeakPolarHBondContact O-CA 3.33Å; Y25-G28 PolarHBondContact O-N 3.02Å; Y25-T29 WeakPolarHBondContact CE1-OG1 3.34Å; Y25-T29 PolarHBondContact O-N 2.67Å; Y25-T29 PolarHBondContact O-OG1 3.17Å; Y25-F34 HydrophobicContact CE1-CB 4.41Å; Y25-F34 AromaticContact CE1-CD2 3.61Å; Y25-F34 HydrophobicContact CE1-CD2 3.61Å; Y25-F34 HydrophobicContact CE1-CE2 4.34Å; Y25-F34 HydrophobicContact CE1-CG 4.39Å; Y25-F34 AromaticContact CZ-CD2 3.89Å; Y25-A47 HydrophobicContact CD2-CB 3.9Å; Y25-A47 HydrophobicContact CE2-CB 3.66Å; Y25-W51 HydrophobicContact CD2-CB 4.1Å; Y25-L119 HydrophobicContact CD2-CD2 4.47Å
26	I	75.8	Confident	73.8	Confident	91 Å²	91	70.7 Å²	70.7	47%	0.467	37%	0.371	S	S	.	.	H	α-helix	trans	-63.6	-27.3	-177.4	-65.6	169.5	0	0	0	113.1	T22 T29	T22-I26 HydrophobicContact CG2-CD1 3.7Å; T22-I26 HydrophobicContact CG2-CG1 4.4Å; T22-I26 WeakPolarHBondContact O-CB 3.48Å; T22-I26 VanDerWaalsContact O-CG1 3.28Å; T22-I26 WeakPolarHBondContact O-CG1 3.2Å; T22-I26 PolarHBondContact O-N 2.84Å; I26-T29 VanDerWaalsContact O-O 3.05Å
27	K	71	Confident	72.9	Confident	158 Å²	158	67.7 Å²	67.7	69%	0.687	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83	-13.9	171.4	-73.4	-171.6	174.9	-173.3	0	113.9	V23 Y25	V23-K27 HydrophobicContact CG1-CD 4.25Å; V23-K27 WeakPolarHBondContact O-CB 3.38Å; V23-K27 WeakPolarHBondContact O-CG 3.39Å; V23-K27 PolarHBondContact O-N 3.39Å; Y25-K27 VanDerWaalsContact C-N 3.26Å; Y25-K27 PolarHBondContact O-N 2.63Å
28	G	62.8	Low	72.1	Confident	38 Å²	38	71.6 Å²	71.6	39%	0.392	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.3	-29.9	177.4	0	0	0	0	0	113.9	L24 Y25	L24-G28 PolarHBondContact O-N 3.46Å; Y25-G28 CarbonylContact O-C 3.58Å; Y25-G28 WeakPolarHBondContact O-CA 3.33Å; Y25-G28 PolarHBondContact O-N 3.02Å
29	T	60.9	Low	71.3	Confident	28 Å²	28	76.1 Å²	76.1	17%	0.172	40%	0.4	C	S	.	.	S	Bend	trans	-125.6	138	178.8	48.4	0	0	0	0	111.3	Y25 I26	Y25-T29 WeakPolarHBondContact CE1-OG1 3.34Å; Y25-T29 PolarHBondContact O-N 2.67Å; Y25-T29 PolarHBondContact O-OG1 3.17Å; I26-T29 VanDerWaalsContact O-O 3.05Å
30	E	64.3	Low	70.5	Confident	140 Å²	140	78 Å²	78	65%	0.654	41%	0.407	S	S	*	.			trans	-62.1	145.2	169.5	-64.7	-169.5	167.1	0	0	110.5	S32 L33 F34	E30-S32 WeakPolarHBondContact CB-OG 3.28Å; E30-S32 PolarHBondContact O-N 3.01Å; E30-S32 VanDerWaalsContact O-N 3.07Å; E30-S32 PolarHBondContact OE2-OG 2.75Å; E30-L33 HydrophobicContact CB-CD1 4.26Å; E30-L33 WeakPolarHBondContact O-CA 3.25Å; E30-L33 WeakPolarHBondContact O-CB 3.34Å; E30-L33 PolarHBondContact O-N 2.8Å; E30-F34 PolarHBondContact O-N 2.9Å
31	L	58.7	Low	70	Confident	129 Å²	129	80.2 Å²	80.2	68%	0.675	42%	0.415	S	S	*	.	H	α-helix	trans	-60.3	-24.8	-177.4	-158.2	76.9	0	0	0	113.1	F34	L31-F34 PolarHBondContact O-N 2.9Å
32	S	57.3	Low	69.5	Low	73 Å²	73	83.8 Å²	83.8	51%	0.51	43%	0.434	S	S	.	.	H	α-helix	trans	-64.1	-36.8	171.2	49.9	0	0	0	0	113	E30	E30-S32 WeakPolarHBondContact CB-OG 3.28Å; E30-S32 PolarHBondContact O-N 3.01Å; E30-S32 VanDerWaalsContact O-N 3.07Å; E30-S32 PolarHBondContact OE2-OG 2.75Å
33	L	62.3	Low	69	Low	68 Å²	68	85.5 Å²	85.5	36%	0.356	44%	0.441	S	S	.	.	H	α-helix	trans	-72.9	-29.3	177.5	-75.6	160.1	0	0	0	112.1	E30 I35 R36 D37	E30-L33 HydrophobicContact CB-CD1 4.26Å; E30-L33 WeakPolarHBondContact O-CA 3.25Å; E30-L33 WeakPolarHBondContact O-CB 3.34Å; E30-L33 PolarHBondContact O-N 2.8Å; L33-I35 PolarHBondContact O-N 3.25Å; L33-R36 CarbonylContact O-C 3.59Å; L33-R36 WeakPolarHBondContact O-CB 3.41Å; L33-R36 PolarHBondContact O-N 3.2Å; L33-R36 VanDerWaalsContact O-N 3.13Å; L33-D37 WeakPolarHBondContact O-CB 3.48Å; L33-D37 PolarHBondContact O-N 3.49Å
34	F	65.6	Low	68.1	Low	71 Å²	71	86 Å²	86	31%	0.311	44%	0.441	S	S	.	.	H	α-helix	trans	-59.2	-45.7	176.4	176.7	-107.9	0	0	0	112.4	Y25 E30 L31 R36 D37 V38 L48	Y25-F34 HydrophobicContact CE1-CB 4.41Å; Y25-F34 AromaticContact CE1-CD2 3.61Å; Y25-F34 HydrophobicContact CE1-CD2 3.61Å; Y25-F34 HydrophobicContact CE1-CE2 4.34Å; Y25-F34 HydrophobicContact CE1-CG 4.39Å; Y25-F34 AromaticContact CZ-CD2 3.89Å; E30-F34 PolarHBondContact O-N 2.9Å; L31-F34 PolarHBondContact O-N 2.9Å; F34-R36 PolarHBondContact O-N 3.28Å; F34-D37 PolarHBondContact O-N 3.02Å; F34-V38 HydrophobicContact CD1-CG2 4.47Å; F34-V38 HydrophobicContact CD2-CG2 4.36Å; F34-V38 HydrophobicContact CE1-CG2 4.13Å; F34-V38 HydrophobicContact CE2-CG2 4.02Å; F34-V38 HydrophobicContact CZ-CG2 3.9Å; F34-V38 VanDerWaalsContact O-CG2 3.24Å; F34-V38 WeakPolarHBondContact O-CG2 3.27Å; F34-V38 PolarHBondContact O-N 2.89Å; F34-L48 HydrophobicContact CD2-CD1 4.45Å; F34-L48 HydrophobicContact CE2-CD1 4.16Å
35	I	64.5	Low	67.4	Low	111 Å²	111	87.9 Å²	87.9	57%	0.569	46%	0.457	S	S	*	.	H	α-helix	trans	-63.2	-34.9	177.9	-62.6	173.9	0	0	0	110.6	L33 L39	L33-I35 PolarHBondContact O-N 3.25Å; I35-L39 HydrophobicContact CG2-CD1 4.08Å; I35-L39 WeakPolarHBondContact O-CD1 3.42Å; I35-L39 VanDerWaalsContact O-CG 3.32Å; I35-L39 WeakPolarHBondContact O-CG 3.39Å; I35-L39 PolarHBondContact O-N 3.11Å
36	R	64.5	Low	67.3	Low	160 Å²	160	87.4 Å²	87.4	60%	0.604	46%	0.455	S	S	*	.	H	α-helix	trans	-72.2	-44	177	-165.7	177.3	-175.6	-177.2	-0.4	112.4	L33 F34 V38 L39 D40	L33-R36 CarbonylContact O-C 3.59Å; L33-R36 WeakPolarHBondContact O-CB 3.41Å; L33-R36 PolarHBondContact O-N 3.2Å; L33-R36 VanDerWaalsContact O-N 3.13Å; F34-R36 PolarHBondContact O-N 3.28Å; R36-V38 VanDerWaalsContact C-N 3.26Å; R36-V38 PolarHBondContact O-N 3.38Å; R36-L39 PolarHBondContact O-N 3.18Å; R36-L39 VanDerWaalsContact O-N 3.12Å; R36-D40 PolarHBondContact O-N 3.4Å
37	D	70	Confident	67.2	Low	24 Å²	24	83.3 Å²	83.3	13%	0.128	44%	0.435	C	S	.	.	H	α-helix	trans	-62.2	-31.2	175.8	-88.4	16.8	0	0	0	112.7	L33 F34 F41 S46 L48	L33-D37 WeakPolarHBondContact O-CB 3.48Å; L33-D37 PolarHBondContact O-N 3.49Å; F34-D37 PolarHBondContact O-N 3.02Å; D37-F41 WeakPolarHBondContact O-CA 3.45Å; D37-F41 WeakPolarHBondContact O-CB 3.21Å; D37-F41 PolarHBondContact O-N 2.78Å; D37-S46 VanDerWaalsContact OD2-CB 3.27Å; D37-S46 WeakPolarHBondContact OD2-CB 3.5Å; D37-S46 PolarHBondContact OD2-OG 3.03Å; D37-L48 HydrophobicContact CB-CD1 4.08Å
38	V	69.9	Low	67.6	Low	85 Å²	85	77.6 Å²	77.6	52%	0.515	41%	0.412	S	S	.	.	H	α-helix	trans	-71.8	-32.5	174.1	169	0	0	0	0	112.1	F34 R36 L48	F34-V38 HydrophobicContact CD1-CG2 4.47Å; F34-V38 HydrophobicContact CD2-CG2 4.36Å; F34-V38 HydrophobicContact CE1-CG2 4.13Å; F34-V38 HydrophobicContact CE2-CG2 4.02Å; F34-V38 HydrophobicContact CZ-CG2 3.9Å; F34-V38 VanDerWaalsContact O-CG2 3.24Å; F34-V38 WeakPolarHBondContact O-CG2 3.27Å; F34-V38 PolarHBondContact O-N 2.89Å; R36-V38 VanDerWaalsContact C-N 3.26Å; R36-V38 PolarHBondContact O-N 3.38Å; V38-L48 HydrophobicContact CB-CD1 4.39Å; V38-L48 HydrophobicContact CG2-CD1 3.52Å
39	L	69.3	Low	68.5	Low	132 Å²	132	77 Å²	77	69%	0.691	40%	0.399	S	S	*	.	H	α-helix	trans	-90.8	-44.3	-176.3	-70	168.4	0	0	0	112.7	I35 R36	I35-L39 HydrophobicContact CG2-CD1 4.08Å; I35-L39 WeakPolarHBondContact O-CD1 3.42Å; I35-L39 VanDerWaalsContact O-CG 3.32Å; I35-L39 WeakPolarHBondContact O-CG 3.39Å; I35-L39 PolarHBondContact O-N 3.11Å; R36-L39 PolarHBondContact O-N 3.18Å; R36-L39 VanDerWaalsContact O-N 3.12Å
40	D	70.4	Confident	69.3	Low	119 Å²	119	75.6 Å²	75.6	64%	0.636	39%	0.391	S	S	*	.	S	Bend	trans	-115.5	56.3	-177.8	-68	-38.3	0	0	0	110.7	R36 N42	R36-D40 PolarHBondContact O-N 3.4Å; D40-N42 PolarHBondContact O-N 2.82Å; D40-N42 VanDerWaalsContact O-N 3.16Å
41	F	75	Confident	70.2	Confident	98 Å²	98	72.2 Å²	72.2	43%	0.43	37%	0.372	S	S	.	.			trans	-61	118.3	-176.6	176.4	-100.4	0	0	0	112.5	D37 I43 L48 D49	D37-F41 WeakPolarHBondContact O-CA 3.45Å; D37-F41 WeakPolarHBondContact O-CB 3.21Å; D37-F41 PolarHBondContact O-N 2.78Å; F41-I43 HydrophobicContact CE1-CB 4.07Å; F41-I43 HydrophobicContact CE1-CG1 4.45Å; F41-I43 HydrophobicContact CZ-CB 4.17Å; F41-I43 HydrophobicContact CZ-CG1 4.26Å; F41-L48 HydrophobicContact CD2-CB 4.42Å; F41-L48 HydrophobicContact CD2-CD2 4.46Å; F41-L48 HydrophobicContact CE2-CB 4.39Å; F41-D49 HydrophobicContact CE2-CB 4.29Å; F41-D49 HydrophobicContact CZ-CB 4.14Å; F41-D49 WeakPolarHBondContact CZ-OD2 3.36Å
42	N	73.6	Confident	71.3	Confident	75 Å²	75	67.5 Å²	67.5	40%	0.401	36%	0.355	S	S	.	.			trans	-121.4	118.4	170.9	-175.4	-8	0	0	0	110.6	D40 L44 S45 S46	D40-N42 PolarHBondContact O-N 2.82Å; D40-N42 VanDerWaalsContact O-N 3.16Å; N42-L44 PolarHBondContact O-N 3.44Å; N42-L44 VanDerWaalsContact O-N 3.15Å; N42-L44 PolarHBondContact OD1-N 3.24Å; N42-L44 VanDerWaalsContact OD1-N 3.12Å; N42-S45 PolarHBondContact O-N 3.4Å; N42-S46 WeakPolarHBondContact O-CB 3.36Å; N42-S46 PolarHBondContact O-N 2.95Å
43	I	72.6	Confident	72.6	Confident	82 Å²	82	65.1 Å²	65.1	42%	0.421	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-24	-176	-157.9	165.6	0	0	0	113.5	F41 Y96 K100	F41-I43 HydrophobicContact CE1-CB 4.07Å; F41-I43 HydrophobicContact CE1-CG1 4.45Å; F41-I43 HydrophobicContact CZ-CB 4.17Å; F41-I43 HydrophobicContact CZ-CG1 4.26Å; I43-Y96 HydrophobicContact CD1-CE2 4.45Å; I43-K100 VanDerWaalsContact O-CE 3.23Å; I43-K100 WeakPolarHBondContact O-CE 3.32Å; I43-K100 PolarHBondContact O-NZ 3.4Å
44	L	64.6	Low	73.7	Confident	79 Å²	79	62.1 Å²	62.1	41%	0.414	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.7	-17.1	-178.9	-68.1	166.1	0	0	0	113.8	N42 M103	N42-L44 PolarHBondContact O-N 3.44Å; N42-L44 VanDerWaalsContact O-N 3.15Å; N42-L44 PolarHBondContact OD1-N 3.24Å; N42-L44 VanDerWaalsContact OD1-N 3.12Å; L44-M103 HydrophobicContact CD2-CB 4.32Å; L44-M103 HydrophobicContact CD2-CG 4.49Å; L44-M103 HydrophobicContact CD2-SD 4.15Å
45	S	65.6	Low	74.6	Confident	74 Å²	74	63.4 Å²	63.4	52%	0.517	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-133.3	-31.2	-172.3	58.2	0	0	0	0	115.2	N42	N42-S45 PolarHBondContact O-N 3.4Å
46	S	75.3	Confident	75.6	Confident	1 Å²	1	62 Å²	62	1%	0.007	32%	0.323	C	S	.	.			trans	-76.1	148.8	179	177.1	0	0	0	0	112	D37 N42 L48 K100	D37-S46 VanDerWaalsContact OD2-CB 3.27Å; D37-S46 WeakPolarHBondContact OD2-CB 3.5Å; D37-S46 PolarHBondContact OD2-OG 3.03Å; N42-S46 WeakPolarHBondContact O-CB 3.36Å; N42-S46 PolarHBondContact O-N 2.95Å; S46-L48 WeakPolarHBondContact OG-CB 3.3Å; S46-L48 PolarHBondContact OG-N 3.46Å; S46-K100 WeakPolarHBondContact O-CE 3.43Å; S46-K100 PolarHBondContact O-NZ 3.32Å
47	A	73.1	Confident	76.7	Confident	4 Å²	4	54.4 Å²	54.4	3%	0.033	29%	0.294	C	S	.	.			trans	-93.7	2	169.1	0	0	0	0	0	114.1	Y25 D49 L50 W51 F116 L119	Y25-A47 HydrophobicContact CD2-CB 3.9Å; Y25-A47 HydrophobicContact CE2-CB 3.66Å; A47-D49 PolarHBondContact O-N 3.38Å; A47-L50 WeakPolarHBondContact O-CB 3.16Å; A47-L50 PolarHBondContact O-N 2.87Å; A47-W51 PolarHBondContact O-N 3.49Å; A47-F116 HydrophobicContact CB-CD2 4.04Å; A47-F116 HydrophobicContact CB-CE2 3.54Å; A47-F116 HydrophobicContact CB-CZ 4.3Å; A47-L119 HydrophobicContact CB-CD2 4.17Å
48	L	79.3	Confident	77.5	Confident	39 Å²	39	53.7 Å²	53.7	20%	0.204	29%	0.292	C	S	.	.	H	α-helix	trans	-66.7	-33	-164.5	-175.2	149.8	0	0	0	113.7	F34 D37 V38 F41 S46 W51 G52	F34-L48 HydrophobicContact CD2-CD1 4.45Å; F34-L48 HydrophobicContact CE2-CD1 4.16Å; D37-L48 HydrophobicContact CB-CD1 4.08Å; V38-L48 HydrophobicContact CB-CD1 4.39Å; V38-L48 HydrophobicContact CG2-CD1 3.52Å; F41-L48 HydrophobicContact CD2-CB 4.42Å; F41-L48 HydrophobicContact CD2-CD2 4.46Å; F41-L48 HydrophobicContact CE2-CB 4.39Å; S46-L48 WeakPolarHBondContact OG-CB 3.3Å; S46-L48 PolarHBondContact OG-N 3.46Å; L48-W51 PolarHBondContact O-N 3.4Å; L48-G52 PolarHBondContact O-N 3.01Å
49	D	80.9	Confident	78.4	Confident	24 Å²	24	52.9 Å²	52.9	13%	0.128	29%	0.29	C	S	.	.	H	α-helix	trans	-64.8	-40.2	175	45	27.7	0	0	0	113.2	F41 A47 W51 G52 I53 Y96 K100	F41-D49 HydrophobicContact CE2-CB 4.29Å; F41-D49 HydrophobicContact CZ-CB 4.14Å; F41-D49 WeakPolarHBondContact CZ-OD2 3.36Å; A47-D49 PolarHBondContact O-N 3.38Å; D49-W51 VanDerWaalsContact C-N 3.28Å; D49-W51 PolarHBondContact O-N 2.98Å; D49-G52 PolarHBondContact O-N 3.01Å; D49-I53 WeakPolarHBondContact O-CG1 3.17Å; D49-I53 PolarHBondContact O-N 3.29Å; D49-Y96 PolarHBondContact OD2-OH 2.87Å; D49-K100 IonicContact OD1-NZ 3.23Å; D49-K100 PolarHBondContact OD1-NZ 3.04Å; D49-K100 IonicContact OD2-NZ 2.59Å; D49-K100 PolarHBondContact OD2-NZ 3.08Å
50	L	79.4	Confident	79.2	Confident	0 Å²	0	48.9 Å²	48.9	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-62.2	-37	174	-63.5	175.8	0	0	0	111.9	A47 Y96 T97 K100 F116 L119 M120	A47-L50 WeakPolarHBondContact O-CB 3.16Å; A47-L50 PolarHBondContact O-N 2.87Å; L50-Y96 HydrophobicContact CD2-CE1 4.33Å; L50-T97 HydrophobicContact CD2-CG2 3.53Å; L50-K100 HydrophobicContact CG-CD 4.44Å; L50-F116 HydrophobicContact CD1-CE1 4.49Å; L50-F116 HydrophobicContact CD1-CZ 4.4Å; L50-L119 HydrophobicContact CB-CD2 4.41Å; L50-L119 HydrophobicContact CD1-CD2 4.38Å; L50-M120 HydrophobicContact CD1-CE 3.9Å; L50-M120 HydrophobicContact CD1-CG 3.81Å
51	W	83.1	Confident	80	Confident	69 Å²	69	43.3 Å²	43.3	26%	0.261	24%	0.239	S	C	.	.	H	α-helix	trans	-69.9	-42.3	172.7	-177.9	85.3	0	0	0	111.3	T22 Y25 A47 L48 D49 I53 V54 L55	T22-W51 PolarHBondContact OG1-NE1 2.93Å; Y25-W51 HydrophobicContact CD2-CB 4.1Å; A47-W51 PolarHBondContact O-N 3.49Å; L48-W51 PolarHBondContact O-N 3.4Å; D49-W51 VanDerWaalsContact C-N 3.28Å; D49-W51 PolarHBondContact O-N 2.98Å; W51-I53 VanDerWaalsContact C-N 3.32Å; W51-I53 PolarHBondContact O-N 3.29Å; W51-V54 WeakPolarHBondContact O-CB 3.38Å; W51-V54 PolarHBondContact O-N 3.22Å; W51-V54 VanDerWaalsContact O-N 3.08Å; W51-L55 HydrophobicContact CH2-CD1 4.06Å; W51-L55 HydrophobicContact CZ3-CD1 3.9Å
52	G	81.3	Confident	80.6	Confident	30 Å²	30	41.8 Å²	41.8	31%	0.309	24%	0.235	S	C	.	.	H	α-helix	trans	-60.5	-35.1	175.7	0	0	0	0	0	114.2	L48 D49 V54 L55 L56	L48-G52 PolarHBondContact O-N 3.01Å; D49-G52 PolarHBondContact O-N 3.01Å; G52-V54 PolarHBondContact O-N 3.07Å; G52-L55 WeakPolarHBondContact O-CB 3.49Å; G52-L55 PolarHBondContact O-N 3.32Å; G52-L55 VanDerWaalsContact O-N 3.16Å; G52-L56 PolarHBondContact O-N 2.77Å
53	I	84.3	Confident	81.2	Confident	23 Å²	23	40.3 Å²	40.3	12%	0.118	24%	0.238	C	C	.	.	H	α-helix	trans	-57.1	-30.7	174.2	-77	166.3	0	0	0	112	D49 W51 L56 R57 V93 Y96 T123	D49-I53 WeakPolarHBondContact O-CG1 3.17Å; D49-I53 PolarHBondContact O-N 3.29Å; W51-I53 VanDerWaalsContact C-N 3.32Å; W51-I53 PolarHBondContact O-N 3.29Å; I53-L56 WeakPolarHBondContact O-CB 3.48Å; I53-L56 PolarHBondContact O-N 2.95Å; I53-R57 HydrophobicContact CG2-CG 4.47Å; I53-R57 WeakPolarHBondContact O-CG 3.05Å; I53-R57 PolarHBondContact O-N 3.38Å; I53-V93 HydrophobicContact CD1-CG1 4.49Å; I53-V93 HydrophobicContact CG2-CG1 3.69Å; I53-V93 HydrophobicContact CG2-CG2 4.02Å; I53-Y96 HydrophobicContact CD1-CD1 3.77Å; I53-Y96 HydrophobicContact CD1-CE1 3.88Å; I53-T123 HydrophobicContact CG2-CG2 4.47Å
54	V	85.8	Confident	81.9	Confident	4 Å²	4	36.7 Å²	36.7	2%	0.024	22%	0.22	C	C	.	.	H	α-helix	trans	-70.1	-36.4	179.6	178.9	0	0	0	0	112.3	D17 T21 W51 G52 L56 R57 A58	D17-V54 WeakPolarHBondContact OD2-CG1 3.29Å; T21-V54 HydrophobicContact CG2-CB 4.26Å; T21-V54 HydrophobicContact CG2-CG2 3.41Å; T21-V54 VanDerWaalsContact CG2-CG2 3.41Å; W51-V54 WeakPolarHBondContact O-CB 3.38Å; W51-V54 PolarHBondContact O-N 3.22Å; W51-V54 VanDerWaalsContact O-N 3.08Å; G52-V54 PolarHBondContact O-N 3.07Å; V54-L56 PolarHBondContact O-N 3.08Å; V54-R57 PolarHBondContact O-N 3.28Å; V54-A58 WeakPolarHBondContact O-CB 3.23Å; V54-A58 PolarHBondContact O-N 2.78Å
55	L	85.3	Confident	82.9	Confident	98 Å²	98	33.1 Å²	33.1	51%	0.513	20%	0.202	S	C	.	.	H	α-helix	trans	-61.9	-36.7	172.1	-60.2	174.3	0	0	0	111.3	W51 G52 S59	W51-L55 HydrophobicContact CH2-CD1 4.06Å; W51-L55 HydrophobicContact CZ3-CD1 3.9Å; G52-L55 WeakPolarHBondContact O-CB 3.49Å; G52-L55 PolarHBondContact O-N 3.32Å; G52-L55 VanDerWaalsContact O-N 3.16Å; L55-S59 WeakPolarHBondContact O-CB 3.39Å; L55-S59 PolarHBondContact O-N 3.13Å; L55-S59 PolarHBondContact O-OG 3.29Å
56	L	84.9	Confident	84	Confident	81 Å²	81	34.5 Å²	34.5	42%	0.424	20%	0.203	S	C	.	.	H	α-helix	trans	-69.1	-44.3	176.4	-144.5	171.8	0	0	0	111.4	G52 I53 V54 S59 L60 F89	G52-L56 PolarHBondContact O-N 2.77Å; I53-L56 WeakPolarHBondContact O-CB 3.48Å; I53-L56 PolarHBondContact O-N 2.95Å; V54-L56 PolarHBondContact O-N 3.08Å; L56-S59 PolarHBondContact O-OG 3.31Å; L56-L60 HydrophobicContact CD2-CD1 3.68Å; L56-L60 HydrophobicContact CD2-CG 4.04Å; L56-L60 VanDerWaalsContact O-CG 3.3Å; L56-L60 WeakPolarHBondContact O-CG 3.26Å; L56-L60 PolarHBondContact O-N 2.92Å; L56-L60 VanDerWaalsContact O-N 3.12Å; L56-F89 HydrophobicContact CB-CZ 4.29Å; L56-F89 HydrophobicContact CD1-CE2 3.94Å; L56-F89 HydrophobicContact CD1-CZ 4.04Å; L56-F89 HydrophobicContact CD2-CE1 4.34Å; L56-F89 HydrophobicContact CD2-CE2 3.81Å; L56-F89 HydrophobicContact CD2-CZ 3.62Å; L56-F89 HydrophobicContact CG-CE2 4.43Å; L56-F89 HydrophobicContact CG-CZ 4.19Å
57	R	87.8	Confident	84.3	Confident	1 Å²	1	36 Å²	36	0%	0.004	22%	0.217	C	C	.	.	H	α-helix	trans	-63	-42.7	173.2	-67.2	-170.5	-46.4	-154.7	-0.3	112.9	D17 I53 V54 L60 L61 F89 T123 S126 S127 V130	D17-R57 IonicContact OD1-CZ 2.71Å; D17-R57 IonicContact OD1-NH2 3.61Å; D17-R57 PolarHBondContact OD1-NH2 2.81Å; D17-R57 IonicContact OD2-CZ 2.73Å; D17-R57 IonicContact OD2-NE 2.64Å; D17-R57 PolarHBondContact OD2-NE 3.36Å; D17-R57 IonicContact OD2-NH2 2.7Å; D17-R57 PolarHBondContact OD2-NH2 3.45Å; I53-R57 HydrophobicContact CG2-CG 4.47Å; I53-R57 WeakPolarHBondContact O-CG 3.05Å; I53-R57 PolarHBondContact O-N 3.38Å; V54-R57 PolarHBondContact O-N 3.28Å; R57-L60 PolarHBondContact O-N 3.07Å; R57-L61 PolarHBondContact O-N 3.17Å; R57-F89 HydrophobicContact CG-CE1 4.08Å; R57-T123 PolarHBondContact NH1-O 3Å; R57-S126 PolarHBondContact NH2-OG 3.23Å; R57-S127 PolarHBondContact NH1-OG 2.82Å; R57-V130 HydrophobicContact CB-CG2 4.18Å; R57-V130 HydrophobicContact CG-CG2 4.35Å
58	A	86	Confident	84.9	Confident	10 Å²	10	35.8 Å²	35.8	8%	0.083	22%	0.216	C	C	.	.	H	α-helix	trans	-60.8	-50	178	0	0	0	0	0	111.3	V14 V54 L60 L61 L62	V14-A58 HydrophobicContact CG1-CB 3.66Å; V54-A58 WeakPolarHBondContact O-CB 3.23Å; V54-A58 PolarHBondContact O-N 2.78Å; A58-L60 PolarHBondContact O-N 2.99Å; A58-L61 PolarHBondContact O-N 3.36Å; A58-L62 VanDerWaalsContact O-CB 3.29Å; A58-L62 WeakPolarHBondContact O-CB 3.31Å; A58-L62 WeakPolarHBondContact O-CD1 3.19Å; A58-L62 WeakPolarHBondContact O-CG 3.33Å; A58-L62 PolarHBondContact O-N 3.41Å
59	S	88.2	Confident	85.1	Confident	67 Å²	67	38.1 Å²	38.1	47%	0.469	23%	0.228	S	C	.	.	H	α-helix	trans	-61.8	-38.5	178	56.5	0	0	0	0	113.1	L55 L56 G63	L55-S59 WeakPolarHBondContact O-CB 3.39Å; L55-S59 PolarHBondContact O-N 3.13Å; L55-S59 PolarHBondContact O-OG 3.29Å; L56-S59 PolarHBondContact O-OG 3.31Å; S59-G63 PolarHBondContact O-N 3.43Å
60	L	87.8	Confident	85.3	Confident	48 Å²	48	47.9 Å²	47.9	25%	0.251	26%	0.263	S	S	.	.	H	α-helix	trans	-62.6	-49.3	174.1	-72.4	169.8	0	0	0	112.3	L56 R57 A58 G63 A64 I86 F89 W134	L56-L60 HydrophobicContact CD2-CD1 3.68Å; L56-L60 HydrophobicContact CD2-CG 4.04Å; L56-L60 VanDerWaalsContact O-CG 3.3Å; L56-L60 WeakPolarHBondContact O-CG 3.26Å; L56-L60 PolarHBondContact O-N 2.92Å; L56-L60 VanDerWaalsContact O-N 3.12Å; R57-L60 PolarHBondContact O-N 3.07Å; A58-L60 PolarHBondContact O-N 2.99Å; L60-G63 PolarHBondContact O-N 3.03Å; L60-A64 PolarHBondContact O-N 3.5Å; L60-I86 HydrophobicContact CD1-CD1 4.06Å; L60-I86 HydrophobicContact CD2-CD1 3.93Å; L60-I86 HydrophobicContact CG-CD1 4.43Å; L60-F89 HydrophobicContact CD1-CD1 3.81Å; L60-F89 HydrophobicContact CD1-CE1 3.79Å; L60-F89 HydrophobicContact CD1-CG 4.36Å; L60-F89 HydrophobicContact CD1-CZ 4.31Å; L60-W134 HydrophobicContact CB-CZ3 4.39Å
61	L	86.4	Confident	85.5	Confident	2 Å²	2	50.6 Å²	50.6	1%	0.01	28%	0.278	C	S	.	.	H	α-helix	trans	-67.9	-36.8	178.7	-79	-177.8	0	0	0	112.8	T10 Y13 V14 R57 A58 S65 V130 W134	T10-L61 HydrophobicContact CG2-CD2 4.24Å; Y13-L61 HydrophobicContact CD1-CD1 3.85Å; Y13-L61 HydrophobicContact CE1-CD1 4.25Å; V14-L61 HydrophobicContact CG2-CB 3.52Å; V14-L61 HydrophobicContact CG2-CD1 3.71Å; V14-L61 HydrophobicContact CG2-CG 4.28Å; R57-L61 PolarHBondContact O-N 3.17Å; A58-L61 PolarHBondContact O-N 3.36Å; L61-S65 VanDerWaalsContact O-CB 3.27Å; L61-S65 WeakPolarHBondContact O-CB 3.33Å; L61-S65 PolarHBondContact O-N 2.89Å; L61-S65 PolarHBondContact O-OG 3.1Å; L61-V130 HydrophobicContact CD1-CG2 3.92Å; L61-V130 HydrophobicContact CD2-CG1 4.21Å; L61-V130 HydrophobicContact CG-CG1 4.2Å; L61-V130 HydrophobicContact CG-CG2 4.4Å; L61-W134 HydrophobicContact CD2-CE3 4.33Å
62	L	88.2	Confident	85.1	Confident	66 Å²	66	54.2 Å²	54.2	35%	0.346	29%	0.291	S	S	.	.	H	α-helix	trans	-64.8	-46.5	173.9	-73.7	167.4	0	0	0	110.9	L11 V14 A58 A64 S65 I66	L11-L62 HydrophobicContact CD2-CD2 3.55Å; V14-L62 HydrophobicContact CG1-CD1 4.27Å; V14-L62 HydrophobicContact CG1-CG 4.26Å; A58-L62 VanDerWaalsContact O-CB 3.29Å; A58-L62 WeakPolarHBondContact O-CB 3.31Å; A58-L62 WeakPolarHBondContact O-CD1 3.19Å; A58-L62 WeakPolarHBondContact O-CG 3.33Å; A58-L62 PolarHBondContact O-N 3.41Å; L62-A64 PolarHBondContact O-N 3.27Å; L62-S65 PolarHBondContact O-N 3.5Å; L62-I66 WeakPolarHBondContact O-CB 3.25Å; L62-I66 VanDerWaalsContact O-CG1 3.25Å; L62-I66 WeakPolarHBondContact O-CG1 3.38Å; L62-I66 PolarHBondContact O-N 3.4Å
63	G	86.5	Confident	84.8	Confident	45 Å²	45	60.7 Å²	60.7	46%	0.464	31%	0.314	S	S	.	.	H	α-helix	trans	-59.2	-43.7	176.2	0	0	0	0	0	112.9	S59 L60 G67	S59-G63 PolarHBondContact O-N 3.43Å; L60-G63 PolarHBondContact O-N 3.03Å; G63-G67 PolarHBondContact O-N 3.3Å
64	A	85.6	Confident	84.6	Confident	6 Å²	6	63 Å²	63	5%	0.05	33%	0.326	C	S	.	.	H	α-helix	trans	-64.3	-42.5	174.2	0	0	0	0	0	112.5	L60 L62 G67 V68 V79 W134 L137	L60-A64 PolarHBondContact O-N 3.5Å; L62-A64 PolarHBondContact O-N 3.27Å; A64-G67 PolarHBondContact O-N 2.68Å; A64-V68 WeakPolarHBondContact O-CG2 3.35Å; A64-V68 PolarHBondContact O-N 3.16Å; A64-V79 HydrophobicContact CB-CG2 4.13Å; A64-W134 HydrophobicContact CB-CE3 4.09Å; A64-W134 HydrophobicContact CB-CH2 3.77Å; A64-W134 HydrophobicContact CB-CZ2 4.41Å; A64-W134 HydrophobicContact CB-CZ3 3.59Å; A64-L137 HydrophobicContact CB-CD2 3.96Å
65	S	86.6	Confident	84.4	Confident	3 Å²	3	63 Å²	63	2%	0.021	33%	0.327	C	S	.	.	H	α-helix	trans	-63.7	-45.4	178.7	-60.4	0	0	0	0	111.6	T10 L61 L62 L69	T10-S65 PolarHBondContact OG1-OG 3.34Å; L61-S65 VanDerWaalsContact O-CB 3.27Å; L61-S65 WeakPolarHBondContact O-CB 3.33Å; L61-S65 PolarHBondContact O-N 2.89Å; L61-S65 PolarHBondContact O-OG 3.1Å; L62-S65 PolarHBondContact O-N 3.5Å; S65-L69 WeakPolarHBondContact O-CB 3.26Å; S65-L69 PolarHBondContact O-N 3.07Å
66	I	87.4	Confident	84.3	Confident	104 Å²	104	58.4 Å²	58.4	53%	0.533	30%	0.303	S	S	.	.	H	α-helix	trans	-64.4	-44.4	175.6	-66.9	163.3	0	0	0	110.5	L62 V68 L69 W70	L62-I66 WeakPolarHBondContact O-CB 3.25Å; L62-I66 VanDerWaalsContact O-CG1 3.25Å; L62-I66 WeakPolarHBondContact O-CG1 3.38Å; L62-I66 PolarHBondContact O-N 3.4Å; I66-V68 VanDerWaalsContact C-N 3.35Å; I66-V68 PolarHBondContact O-N 3.47Å; I66-L69 PolarHBondContact O-N 3.03Å; I66-L69 VanDerWaalsContact O-N 3.14Å; I66-W70 VanDerWaalsContact O-CB 3.29Å; I66-W70 WeakPolarHBondContact O-CB 3.42Å; I66-W70 PolarHBondContact O-N 3.1Å
67	G	82.9	Confident	84.2	Confident	31 Å²	31	57.4 Å²	57.4	32%	0.32	30%	0.301	S	S	.	.	H	α-helix	trans	-59.9	-40.9	178.7	0	0	0	0	0	113.5	G63 A64 N71	G63-G67 PolarHBondContact O-N 3.3Å; A64-G67 PolarHBondContact O-N 2.68Å; G67-N71 PolarHBondContact O-N 3.02Å; G67-N71 VanDerWaalsContact O-N 3.12Å
68	V	85.4	Confident	84	Confident	1 Å²	1	64.3 Å²	64.3	1%	0.006	33%	0.328	C	S	.	.	H	α-helix	trans	-71.3	-32.9	174.6	171	0	0	0	0	112.3	I3 V7 A64 I66 P76 V79 L137	I3-V68 HydrophobicContact CG2-CG1 3.71Å; V7-V68 HydrophobicContact CG2-CG1 4.14Å; A64-V68 WeakPolarHBondContact O-CG2 3.35Å; A64-V68 PolarHBondContact O-N 3.16Å; I66-V68 VanDerWaalsContact C-N 3.35Å; I66-V68 PolarHBondContact O-N 3.47Å; V68-P76 HydrophobicContact CG1-CG 4.21Å; V68-P76 HydrophobicContact CG2-CG 4.39Å; V68-V79 HydrophobicContact CG2-CG2 3.85Å; V68-L137 HydrophobicContact CG2-CD2 4.16Å; V68-L137 HydrophobicContact CG2-CG 4.43Å
69	L	83.9	Confident	83.9	Confident	87 Å²	87	64.4 Å²	64.4	46%	0.455	33%	0.327	S	S	.	.	H	α-helix	trans	-72.9	-37.4	177.5	-149.8	76.8	0	0	0	112.3	Y4 V7 S65 I66	Y4-L69 HydrophobicContact CE1-CD1 4.3Å; V7-L69 HydrophobicContact CG1-CD1 4.28Å; S65-L69 WeakPolarHBondContact O-CB 3.26Å; S65-L69 PolarHBondContact O-N 3.07Å; I66-L69 PolarHBondContact O-N 3.03Å; I66-L69 VanDerWaalsContact O-N 3.14Å
70	W	85.4	Confident	83.7	Confident	229 Å²	229	63.2 Å²	63.2	87%	0.867	32%	0.321	S	S	*	.	H	α-helix	trans	-80.4	-41.3	-175	-166.3	-78.1	0	0	0	113.2	I66	I66-W70 VanDerWaalsContact O-CB 3.29Å; I66-W70 WeakPolarHBondContact O-CB 3.42Å; I66-W70 PolarHBondContact O-N 3.1Å
71	N	82.1	Confident	83.4	Confident	57 Å²	57	71 Å²	71	31%	0.305	35%	0.347	S	S	.	.			trans	-125	101.3	175	-172.6	-21.3	0	0	0	109.5	G67 E73 D74 G75	G67-N71 PolarHBondContact O-N 3.02Å; G67-N71 VanDerWaalsContact O-N 3.12Å; N71-E73 PolarHBondContact OD1-N 3Å; N71-D74 PolarHBondContact ND2-OD2 2.82Å; N71-D74 PolarHBondContact OD1-N 2.94Å; N71-G75 WeakPolarHBondContact O-CA 3.37Å; N71-G75 PolarHBondContact O-N 3.37Å
72	R	76.3	Confident	83.4	Confident	145 Å²	145	73.9 Å²	73.9	55%	0.547	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75	-27.7	-171.5	-63.4	-179.7	-177.9	-175.7	-0.4	113.7	Y4	Y4-R72 PolarHBondContact OH-NH2 2.62Å; Y4-R72 VanDerWaalsContact OH-NH2 3.09Å
73	E	74.2	Confident	83.1	Confident	166 Å²	166	71.9 Å²	71.9	78%	0.776	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.2	-53.8	-178.9	-66.2	178.2	-170.3	0	0	110.4	N71 P77	N71-E73 PolarHBondContact OD1-N 3Å; E73-P77 VanDerWaalsContact O-CD 3.32Å; E73-P77 WeakPolarHBondContact O-CD 3.2Å
74	D	79.9	Confident	82.8	Confident	72 Å²	72	71.3 Å²	71.3	39%	0.385	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88	-19.8	-177.6	-69.5	-28.9	0	0	0	114.8	N71 P77 R78	N71-D74 PolarHBondContact ND2-OD2 2.82Å; N71-D74 PolarHBondContact OD1-N 2.94Å; D74-P77 VanDerWaalsContact C-CD 3.5Å; D74-P77 VanDerWaalsContact O-CD 3.26Å; D74-P77 WeakPolarHBondContact O-CD 3.42Å; D74-P77 VanDerWaalsContact O-CG 3.31Å; D74-P77 WeakPolarHBondContact O-CG 3.41Å; D74-R78 WeakPolarHBondContact O-CB 3.37Å; D74-R78 WeakPolarHBondContact O-CG 3.49Å; D74-R78 PolarHBondContact O-N 2.9Å; D74-R78 IonicContact OD2-CZ 3.38Å; D74-R78 IonicContact OD2-NE 3.27Å; D74-R78 IonicContact OD2-NH2 2.61Å; D74-R78 PolarHBondContact OD2-NH2 3.06Å
75	G	81.1	Confident	82.7	Confident	4 Å²	4	75.4 Å²	75.4	4%	0.041	37%	0.367	C	S	.	.	H	α-helix	trans	-57.9	-57.2	-174.3	0	0	0	0	0	112.7	N71 R78 V79	N71-G75 WeakPolarHBondContact O-CA 3.37Å; N71-G75 PolarHBondContact O-N 3.37Å; G75-R78 PolarHBondContact O-N 3.21Å; G75-V79 WeakPolarHBondContact O-CG2 3.5Å; G75-V79 PolarHBondContact O-N 3.32Å
76	P	83.9	Confident	82.6	Confident	2 Å²	2	75.6 Å²	75.6	1%	0.013	37%	0.368	C	S	.	.	H	α-helix	trans	-56.5	-47.7	177.7	-23.8	33.1	0	0	0	114.8	V68 R78 V79 A80	V68-P76 HydrophobicContact CG1-CG 4.21Å; V68-P76 HydrophobicContact CG2-CG 4.39Å; P76-R78 PolarHBondContact O-N 3.02Å; P76-V79 PolarHBondContact O-N 3.04Å; P76-A80 WeakPolarHBondContact O-CB 3.39Å; P76-A80 PolarHBondContact O-N 2.83Å
77	P	81.8	Confident	82.4	Confident	59 Å²	59	72.1 Å²	72.1	38%	0.383	35%	0.35	S	S	.	.	H	α-helix	trans	-67.6	-30.4	177.5	24	-32.6	0	0	0	113.6	E73 D74 A80 R81	E73-P77 VanDerWaalsContact O-CD 3.32Å; E73-P77 WeakPolarHBondContact O-CD 3.2Å; D74-P77 VanDerWaalsContact C-CD 3.5Å; D74-P77 VanDerWaalsContact O-CD 3.26Å; D74-P77 WeakPolarHBondContact O-CD 3.42Å; D74-P77 VanDerWaalsContact O-CG 3.31Å; D74-P77 WeakPolarHBondContact O-CG 3.41Å; P77-A80 PolarHBondContact O-N 2.88Å; P77-R81 PolarHBondContact O-N 3.21Å
78	R	83.8	Confident	82.3	Confident	147 Å²	147	74 Å²	74	56%	0.555	35%	0.352	S	S	*	.	H	α-helix	trans	-65.4	-46.1	171	-71.2	173.3	-166.9	-160.7	12	111.3	D74 G75 P76 A80 R81 V82	D74-R78 WeakPolarHBondContact O-CB 3.37Å; D74-R78 WeakPolarHBondContact O-CG 3.49Å; D74-R78 PolarHBondContact O-N 2.9Å; D74-R78 IonicContact OD2-CZ 3.38Å; D74-R78 IonicContact OD2-NE 3.27Å; D74-R78 IonicContact OD2-NH2 2.61Å; D74-R78 PolarHBondContact OD2-NH2 3.06Å; G75-R78 PolarHBondContact O-N 3.21Å; P76-R78 PolarHBondContact O-N 3.02Å; R78-A80 VanDerWaalsContact C-N 3.34Å; R78-A80 PolarHBondContact O-N 3.3Å; R78-R81 PolarHBondContact O-N 2.82Å; R78-V82 WeakPolarHBondContact O-CG2 3.35Å; R78-V82 PolarHBondContact O-N 3.19Å
79	V	85.1	Confident	82.3	Confident	12 Å²	12	76.1 Å²	76.1	7%	0.073	36%	0.362	C	S	.	.	H	α-helix	trans	-60	-43.9	174	171.6	0	0	0	0	110.9	A64 V68 G75 P76 R81 V82 T83 W134 L137	A64-V79 HydrophobicContact CB-CG2 4.13Å; V68-V79 HydrophobicContact CG2-CG2 3.85Å; G75-V79 WeakPolarHBondContact O-CG2 3.5Å; G75-V79 PolarHBondContact O-N 3.32Å; P76-V79 PolarHBondContact O-N 3.04Å; V79-R81 PolarHBondContact O-N 2.95Å; V79-V82 PolarHBondContact O-N 3.23Å; V79-T83 PolarHBondContact O-N 2.91Å; V79-T83 PolarHBondContact O-OG1 2.83Å; V79-W134 HydrophobicContact CG1-CD2 4.15Å; V79-W134 HydrophobicContact CG1-CG 4.31Å; V79-W134 HydrophobicContact CG1-CZ2 3.98Å; V79-W134 PolarHBondContact O-NE1 3.4Å; V79-L137 HydrophobicContact CG1-CB 4.02Å
80	A	82.6	Confident	82.3	Confident	42 Å²	42	72.1 Å²	72.1	35%	0.347	34%	0.341	S	S	.	.	H	α-helix	trans	-58.4	-45	177.1	0	0	0	0	0	112.2	P76 P77 R78 V82 T83	P76-A80 WeakPolarHBondContact O-CB 3.39Å; P76-A80 PolarHBondContact O-N 2.83Å; P77-A80 PolarHBondContact O-N 2.88Å; R78-A80 VanDerWaalsContact C-N 3.34Å; R78-A80 PolarHBondContact O-N 3.3Å; A80-V82 VanDerWaalsContact C-N 3.29Å; A80-V82 PolarHBondContact O-N 2.99Å; A80-T83 VanDerWaalsContact O-CB 3.25Å; A80-T83 WeakPolarHBondContact O-CB 3.38Å; A80-T83 PolarHBondContact O-N 2.85Å; A80-T83 PolarHBondContact O-OG1 2.92Å
81	R	83.4	Confident	82.1	Confident	210 Å²	210	64.1 Å²	64.1	79%	0.792	31%	0.314	S	S	*	.	H	α-helix	trans	-59.4	-35.9	178.2	-166.7	-176.1	-63.6	-179.9	-0.9	113	P77 R78 V79 T83	P77-R81 PolarHBondContact O-N 3.21Å; R78-R81 PolarHBondContact O-N 2.82Å; V79-R81 PolarHBondContact O-N 2.95Å; R81-T83 VanDerWaalsContact C-N 3.33Å
82	V	84.6	Confident	82.2	Confident	63 Å²	63	65.4 Å²	65.4	38%	0.382	32%	0.324	S	S	.	.	H	α-helix	trans	-84	-5.7	-177.6	-177.6	0	0	0	0	112.8	R78 V79 A80 T84 V85 I86 W134	R78-V82 WeakPolarHBondContact O-CG2 3.35Å; R78-V82 PolarHBondContact O-N 3.19Å; V79-V82 PolarHBondContact O-N 3.23Å; A80-V82 VanDerWaalsContact C-N 3.29Å; A80-V82 PolarHBondContact O-N 2.99Å; V82-T84 PolarHBondContact O-N 3.27Å; V82-T84 VanDerWaalsContact O-N 3.09Å; V82-V85 HydrophobicContact CG1-CB 4.12Å; V82-V85 HydrophobicContact CG1-CG2 4.49Å; V82-V85 WeakPolarHBondContact O-CB 3.33Å; V82-V85 PolarHBondContact O-N 3.46Å; V82-I86 HydrophobicContact CG1-CG1 4.24Å; V82-I86 PolarHBondContact O-N 3.13Å; V82-W134 HydrophobicContact CB-CZ2 4.13Å; V82-W134 HydrophobicContact CG1-CZ2 4.06Å
83	T	83.5	Confident	82.6	Confident	24 Å²	24	58.9 Å²	58.9	15%	0.147	30%	0.3	C	S	.	.	H	α-helix	trans	-52.9	-35.8	-178	-53.1	0	0	0	0	114.1	V79 A80 R81 L87 R135	V79-T83 PolarHBondContact O-N 2.91Å; V79-T83 PolarHBondContact O-OG1 2.83Å; A80-T83 VanDerWaalsContact O-CB 3.25Å; A80-T83 WeakPolarHBondContact O-CB 3.38Å; A80-T83 PolarHBondContact O-N 2.85Å; A80-T83 PolarHBondContact O-OG1 2.92Å; R81-T83 VanDerWaalsContact C-N 3.33Å; T83-L87 WeakPolarHBondContact O-CB 3.35Å; T83-L87 PolarHBondContact O-N 3.38Å; T83-R135 HydrophobicContact CG2-CG 3.9Å
84	T	78.6	Confident	83	Confident	34 Å²	34	52.2 Å²	52.2	21%	0.209	27%	0.269	C	S	.	.	H	α-helix	trans	-66.8	-36.7	177.7	-57.5	0	0	0	0	112.1	V82 L87 L88 K361 L362	V82-T84 PolarHBondContact O-N 3.27Å; V82-T84 VanDerWaalsContact O-N 3.09Å; T84-L87 PolarHBondContact O-N 3.28Å; T84-L88 WeakPolarHBondContact O-CB 3.44Å; T84-L88 PolarHBondContact O-N 3.36Å; T84-K361 HydrophobicContact CG2-CD 4.45Å; T84-K361 PolarHBondContact OG1-NZ 3Å; T84-L362 HydrophobicContact CG2-CD2 4.38Å
85	V	83.4	Confident	83.2	Confident	92 Å²	92	50.8 Å²	50.8	56%	0.558	26%	0.264	S	S	*	.	H	α-helix	trans	-69.5	-41.4	177.9	-175.9	0	0	0	0	110.8	V82 L88 F89	V82-V85 HydrophobicContact CG1-CB 4.12Å; V82-V85 HydrophobicContact CG1-CG2 4.49Å; V82-V85 WeakPolarHBondContact O-CB 3.33Å; V82-V85 PolarHBondContact O-N 3.46Å; V85-L88 WeakPolarHBondContact O-CB 3.17Å; V85-L88 PolarHBondContact O-N 3.15Å; V85-F89 PolarHBondContact O-N 3.21Å
86	I	85.6	Confident	83.4	Confident	7 Å²	7	54 Å²	54	4%	0.036	28%	0.275	C	S	.	.	H	α-helix	trans	-69.2	-36.1	176.9	-61.4	-61.6	0	0	0	111.9	L60 V82 F89 C90 V130 W134	L60-I86 HydrophobicContact CD1-CD1 4.06Å; L60-I86 HydrophobicContact CD2-CD1 3.93Å; L60-I86 HydrophobicContact CG-CD1 4.43Å; V82-I86 HydrophobicContact CG1-CG1 4.24Å; V82-I86 PolarHBondContact O-N 3.13Å; I86-F89 PolarHBondContact O-N 2.86Å; I86-C90 WeakPolarHBondContact O-CB 3.3Å; I86-C90 PolarHBondContact O-N 2.87Å; I86-C90 PolarHBondContact O-SG 3.29Å; I86-V130 HydrophobicContact CG2-CG1 4.14Å; I86-W134 HydrophobicContact CB-CD2 4.12Å; I86-W134 HydrophobicContact CB-CE3 4.39Å; I86-W134 HydrophobicContact CB-CG 4.41Å; I86-W134 HydrophobicContact CD1-CE3 4.21Å; I86-W134 HydrophobicContact CD1-CH2 3.78Å; I86-W134 HydrophobicContact CD1-CZ2 4.18Å; I86-W134 HydrophobicContact CD1-CZ3 3.79Å; I86-W134 HydrophobicContact CG1-CD2 3.69Å; I86-W134 HydrophobicContact CG1-CE3 3.8Å; I86-W134 HydrophobicContact CG1-CG 4.45Å; I86-W134 HydrophobicContact CG1-CH2 3.66Å; I86-W134 HydrophobicContact CG1-CZ2 3.56Å; I86-W134 HydrophobicContact CG1-CZ3 3.77Å; I86-W134 HydrophobicContact CG2-CB 4.46Å; I86-W134 HydrophobicContact CG2-CD2 3.99Å; I86-W134 HydrophobicContact CG2-CE3 3.98Å; I86-W134 HydrophobicContact CG2-CG 4.18Å
87	L	82.3	Confident	83.3	Confident	31 Å²	31	54 Å²	54	16%	0.162	27%	0.274	C	S	.	.	H	α-helix	trans	-62.6	-44.9	172	-172.4	151.2	0	0	0	110.7	T83 T84 C90 M91 V131	T83-L87 WeakPolarHBondContact O-CB 3.35Å; T83-L87 PolarHBondContact O-N 3.38Å; T84-L87 PolarHBondContact O-N 3.28Å; L87-C90 PolarHBondContact O-N 3.01Å; L87-M91 HydrophobicContact CD2-CG 4.01Å; L87-M91 WeakPolarHBondContact O-CB 3.45Å; L87-M91 VanDerWaalsContact O-CG 3.29Å; L87-M91 WeakPolarHBondContact O-CG 3.47Å; L87-M91 PolarHBondContact O-N 2.88Å; L87-V131 HydrophobicContact CD1-CG1 4.44Å
88	L	81	Confident	83.4	Confident	69 Å²	69	52.3 Å²	52.3	36%	0.361	26%	0.262	S	S	.	.	H	α-helix	trans	-58.7	-49.2	174.3	-173.4	164.2	0	0	0	111.2	T84 V85 C90 M91 V92 L358	T84-L88 WeakPolarHBondContact O-CB 3.44Å; T84-L88 PolarHBondContact O-N 3.36Å; V85-L88 WeakPolarHBondContact O-CB 3.17Å; V85-L88 PolarHBondContact O-N 3.15Å; L88-C90 PolarHBondContact O-N 2.93Å; L88-M91 PolarHBondContact O-N 2.85Å; L88-V92 HydrophobicContact CD2-CG2 3.94Å; L88-V92 WeakPolarHBondContact O-CG2 3.39Å; L88-V92 PolarHBondContact O-N 3.43Å; L88-L358 HydrophobicContact CB-CD1 4.46Å; L88-L358 HydrophobicContact CD1-CD1 4.2Å; L88-L358 HydrophobicContact CD1-CD2 3.7Å; L88-L358 HydrophobicContact CG-CD1 4.46Å; L88-L358 HydrophobicContact CG-CD2 3.81Å
89	F	85.8	Confident	83.3	Confident	47 Å²	47	46.9 Å²	46.9	21%	0.206	25%	0.249	C	C	.	.	H	α-helix	trans	-56.7	-48.1	176.4	174	-97.2	0	0	0	112.2	L56 R57 L60 V85 I86 M91 V92 V93	L56-F89 HydrophobicContact CB-CZ 4.29Å; L56-F89 HydrophobicContact CD1-CE2 3.94Å; L56-F89 HydrophobicContact CD1-CZ 4.04Å; L56-F89 HydrophobicContact CD2-CE1 4.34Å; L56-F89 HydrophobicContact CD2-CE2 3.81Å; L56-F89 HydrophobicContact CD2-CZ 3.62Å; L56-F89 HydrophobicContact CG-CE2 4.43Å; L56-F89 HydrophobicContact CG-CZ 4.19Å; R57-F89 HydrophobicContact CG-CE1 4.08Å; L60-F89 HydrophobicContact CD1-CD1 3.81Å; L60-F89 HydrophobicContact CD1-CE1 3.79Å; L60-F89 HydrophobicContact CD1-CG 4.36Å; L60-F89 HydrophobicContact CD1-CZ 4.31Å; V85-F89 PolarHBondContact O-N 3.21Å; I86-F89 PolarHBondContact O-N 2.86Å; F89-M91 VanDerWaalsContact C-N 3.34Å; F89-M91 PolarHBondContact O-N 3.2Å; F89-V92 PolarHBondContact O-N 3.02Å; F89-V93 HydrophobicContact CD1-CG2 4.39Å; F89-V93 HydrophobicContact CE1-CG2 3.84Å; F89-V93 HydrophobicContact CE2-CG2 4.04Å; F89-V93 HydrophobicContact CZ-CG2 3.63Å; F89-V93 WeakPolarHBondContact O-CG2 3.41Å; F89-V93 PolarHBondContact O-N 3.14Å
90	C	84.1	Confident	83.1	Confident	2 Å²	2	46.6 Å²	46.6	1%	0.014	25%	0.247	C	C	.	.	H	α-helix	trans	-66.6	-35.4	179.7	-65.2	0	0	0	0	112.3	I86 L87 L88 I94 V131	I86-C90 WeakPolarHBondContact O-CB 3.3Å; I86-C90 PolarHBondContact O-N 2.87Å; I86-C90 PolarHBondContact O-SG 3.29Å; L87-C90 PolarHBondContact O-N 3.01Å; L88-C90 PolarHBondContact O-N 2.93Å; C90-I94 WeakPolarHBondContact O-CD1 3.2Å; C90-I94 VanDerWaalsContact O-CG1 3.27Å; C90-I94 WeakPolarHBondContact O-CG1 3.39Å; C90-I94 PolarHBondContact O-N 3.18Å; C90-V131 HydrophobicContact CB-CG2 3.59Å
91	M	81.4	Confident	83	Confident	62 Å²	62	45.9 Å²	45.9	31%	0.305	24%	0.237	S	C	.	.	H	α-helix	trans	-63.7	-50.4	172	-72.1	-56.8	-147.9	0	0	110.9	L87 L88 F89 V93 I94 T95 P354	L87-M91 HydrophobicContact CD2-CG 4.01Å; L87-M91 WeakPolarHBondContact O-CB 3.45Å; L87-M91 VanDerWaalsContact O-CG 3.29Å; L87-M91 WeakPolarHBondContact O-CG 3.47Å; L87-M91 PolarHBondContact O-N 2.88Å; L88-M91 PolarHBondContact O-N 2.85Å; F89-M91 VanDerWaalsContact C-N 3.34Å; F89-M91 PolarHBondContact O-N 3.2Å; M91-V93 VanDerWaalsContact C-N 3.28Å; M91-V93 PolarHBondContact O-N 3.07Å; M91-I94 CarbonylContact O-C 3.59Å; M91-I94 WeakPolarHBondContact O-CA 3.44Å; M91-I94 WeakPolarHBondContact O-CB 3.23Å; M91-I94 PolarHBondContact O-N 2.96Å; M91-T95 PolarHBondContact O-N 3.33Å; M91-T95 PolarHBondContact O-OG1 3.37Å; M91-P354 HydrophobicContact CB-CB 4.2Å; M91-P354 HydrophobicContact CE-CB 3.92Å; M91-P354 HydrophobicContact CE-CG 4.26Å; M91-P354 HydrophobicContact CG-CB 4.13Å; M91-P354 HydrophobicContact SD-CB 3.78Å; M91-P354 HydrophobicContact SD-CG 4.07Å
92	V	84	Confident	82.8	Confident	84 Å²	84	36.8 Å²	36.8	51%	0.509	20%	0.204	S	C	.	.	H	α-helix	trans	-57	-41.3	177.6	170.1	0	0	0	0	111.7	L88 F89 T95 Y96	L88-V92 HydrophobicContact CD2-CG2 3.94Å; L88-V92 WeakPolarHBondContact O-CG2 3.39Å; L88-V92 PolarHBondContact O-N 3.43Å; F89-V92 PolarHBondContact O-N 3.02Å; V92-T95 PolarHBondContact O-N 3.36Å; V92-Y96 VanDerWaalsContact O-CB 3.26Å; V92-Y96 WeakPolarHBondContact O-CB 3.41Å; V92-Y96 PolarHBondContact O-N 3Å
93	V	84.1	Confident	82.5	Confident	8 Å²	8	38.5 Å²	38.5	5%	0.048	21%	0.209	C	C	.	.	H	α-helix	trans	-60	-44.7	173.4	166.4	0	0	0	0	111.4	I53 F89 M91 Y96 T97 T123 S127	I53-V93 HydrophobicContact CD1-CG1 4.49Å; I53-V93 HydrophobicContact CG2-CG1 3.69Å; I53-V93 HydrophobicContact CG2-CG2 4.02Å; F89-V93 HydrophobicContact CD1-CG2 4.39Å; F89-V93 HydrophobicContact CE1-CG2 3.84Å; F89-V93 HydrophobicContact CE2-CG2 4.04Å; F89-V93 HydrophobicContact CZ-CG2 3.63Å; F89-V93 WeakPolarHBondContact O-CG2 3.41Å; F89-V93 PolarHBondContact O-N 3.14Å; M91-V93 VanDerWaalsContact C-N 3.28Å; M91-V93 PolarHBondContact O-N 3.07Å; V93-Y96 PolarHBondContact O-N 3.02Å; V93-T97 HydrophobicContact CG1-CG2 4.46Å; V93-T97 VanDerWaalsContact O-CG2 3.3Å; V93-T97 WeakPolarHBondContact O-CG2 3.43Å; V93-T97 PolarHBondContact O-N 2.78Å; V93-T97 PolarHBondContact O-OG1 3.44Å; V93-T123 HydrophobicContact CG1-CG2 4.15Å; V93-S127 WeakPolarHBondContact CG1-OG 3.22Å
94	I	83.2	Confident	82	Confident	25 Å²	25	38.4 Å²	38.4	13%	0.128	21%	0.208	C	C	.	.	H	α-helix	trans	-65.2	-45.1	177.1	-68.6	162.9	0	0	0	110.8	C90 M91 Y96 T97 L98 L128	C90-I94 WeakPolarHBondContact O-CD1 3.2Å; C90-I94 VanDerWaalsContact O-CG1 3.27Å; C90-I94 WeakPolarHBondContact O-CG1 3.39Å; C90-I94 PolarHBondContact O-N 3.18Å; M91-I94 CarbonylContact O-C 3.59Å; M91-I94 WeakPolarHBondContact O-CA 3.44Å; M91-I94 WeakPolarHBondContact O-CB 3.23Å; M91-I94 PolarHBondContact O-N 2.96Å; I94-Y96 VanDerWaalsContact C-N 3.27Å; I94-Y96 PolarHBondContact O-N 3.44Å; I94-T97 PolarHBondContact O-N 3.49Å; I94-T97 PolarHBondContact O-OG1 3.15Å; I94-L98 HydrophobicContact CG2-CD1 4.11Å; I94-L98 HydrophobicContact CG2-CG 4.38Å; I94-L98 VanDerWaalsContact O-CG 3.3Å; I94-L98 WeakPolarHBondContact O-CG 3.5Å; I94-L98 PolarHBondContact O-N 2.98Å; I94-L128 HydrophobicContact CD1-CD2 4.4Å; I94-L128 HydrophobicContact CD1-CG 4.36Å
95	T	83.5	Confident	81.8	Confident	43 Å²	43	37.7 Å²	37.7	26%	0.264	20%	0.203	S	C	.	.	H	α-helix	trans	-59.2	-42.5	176.6	-38	0	0	0	0	110.7	M91 V92 L98 A99 M351	M91-T95 PolarHBondContact O-N 3.33Å; M91-T95 PolarHBondContact O-OG1 3.37Å; V92-T95 PolarHBondContact O-N 3.36Å; T95-L98 PolarHBondContact O-N 3.3Å; T95-A99 WeakPolarHBondContact O-CB 3.44Å; T95-A99 PolarHBondContact O-N 3.13Å; T95-M351 HydrophobicContact CG2-CB 3.7Å; T95-M351 HydrophobicContact CG2-CG 3.77Å; T95-M351 HydrophobicContact CG2-SD 4.18Å; T95-M351 VanDerWaalsContact O-SD 3.4Å
96	Y	85.3	Confident	81.3	Confident	71 Å²	71	38 Å²	38	28%	0.278	20%	0.198	S	C	.	.	H	α-helix	trans	-64.6	-44.4	176.7	176.7	-100.2	0	0	0	112.9	I43 D49 L50 I53 V92 V93 I94 L98 A99 K100	I43-Y96 HydrophobicContact CD1-CE2 4.45Å; D49-Y96 PolarHBondContact OD2-OH 2.87Å; L50-Y96 HydrophobicContact CD2-CE1 4.33Å; I53-Y96 HydrophobicContact CD1-CD1 3.77Å; I53-Y96 HydrophobicContact CD1-CE1 3.88Å; V92-Y96 VanDerWaalsContact O-CB 3.26Å; V92-Y96 WeakPolarHBondContact O-CB 3.41Å; V92-Y96 PolarHBondContact O-N 3Å; V93-Y96 PolarHBondContact O-N 3.02Å; I94-Y96 VanDerWaalsContact C-N 3.27Å; I94-Y96 PolarHBondContact O-N 3.44Å; Y96-L98 VanDerWaalsContact C-N 3.32Å; Y96-L98 PolarHBondContact O-N 3.2Å; Y96-A99 PolarHBondContact O-N 3.46Å; Y96-K100 HydrophobicContact CE1-CD 4.43Å; Y96-K100 VanDerWaalsContact O-CB 3.28Å; Y96-K100 WeakPolarHBondContact O-CB 3.31Å; Y96-K100 PolarHBondContact O-N 3.14Å
97	T	83.3	Confident	80.5	Confident	1 Å²	1	42.2 Å²	42.2	1%	0.006	22%	0.224	C	C	.	.	H	α-helix	trans	-64.8	-36.8	177.4	58.9	0	0	0	0	112.3	L50 V93 I94 L101 M120 T123 C124	L50-T97 HydrophobicContact CD2-CG2 3.53Å; V93-T97 HydrophobicContact CG1-CG2 4.46Å; V93-T97 VanDerWaalsContact O-CG2 3.3Å; V93-T97 WeakPolarHBondContact O-CG2 3.43Å; V93-T97 PolarHBondContact O-N 2.78Å; V93-T97 PolarHBondContact O-OG1 3.44Å; I94-T97 PolarHBondContact O-N 3.49Å; I94-T97 PolarHBondContact O-OG1 3.15Å; T97-L101 WeakPolarHBondContact O-CB 3.29Å; T97-L101 PolarHBondContact O-N 3.36Å; T97-M120 WeakPolarHBondContact O-CE 3.25Å; T97-T123 HydrophobicContact CG2-CG2 3.55Å; T97-C124 PolarHBondContact OG1-SG 2.89Å
98	L	82.9	Confident	79.7	Confident	24 Å²	24	44.7 Å²	44.7	13%	0.126	24%	0.235	C	C	.	.	H	α-helix	trans	-71.7	-39.7	176.5	-64.7	-176.8	0	0	0	112.2	I94 T95 Y96 K100 L101 L102 L347 V350 M351	I94-L98 HydrophobicContact CG2-CD1 4.11Å; I94-L98 HydrophobicContact CG2-CG 4.38Å; I94-L98 VanDerWaalsContact O-CG 3.3Å; I94-L98 WeakPolarHBondContact O-CG 3.5Å; I94-L98 PolarHBondContact O-N 2.98Å; T95-L98 PolarHBondContact O-N 3.3Å; Y96-L98 VanDerWaalsContact C-N 3.32Å; Y96-L98 PolarHBondContact O-N 3.2Å; L98-K100 VanDerWaalsContact C-N 3.34Å; L98-L101 PolarHBondContact O-N 2.79Å; L98-L102 WeakPolarHBondContact O-CB 3.35Å; L98-L102 PolarHBondContact O-N 3.14Å; L98-L347 HydrophobicContact CD2-CD2 3.96Å; L98-V350 HydrophobicContact CD1-CG1 4.02Å; L98-M351 HydrophobicContact CB-CE 3.84Å; L98-M351 HydrophobicContact CB-CG 3.65Å; L98-M351 HydrophobicContact CB-SD 3.76Å; L98-M351 HydrophobicContact CD1-CG 4Å; L98-M351 HydrophobicContact CG-CG 4.48Å
99	A	82.1	Confident	79	Confident	33 Å²	33	45.3 Å²	45.3	27%	0.273	24%	0.243	S	C	.	.	H	α-helix	trans	-63.4	-42.7	173.9	0	0	0	0	0	111	T95 Y96 L102 M103 M351	T95-A99 WeakPolarHBondContact O-CB 3.44Å; T95-A99 PolarHBondContact O-N 3.13Å; Y96-A99 PolarHBondContact O-N 3.46Å; A99-L102 WeakPolarHBondContact O-CB 3.3Å; A99-L102 PolarHBondContact O-N 3.25Å; A99-M103 WeakPolarHBondContact O-CG 3.16Å; A99-M103 PolarHBondContact O-N 3.4Å; A99-M351 HydrophobicContact CB-SD 3.76Å; A99-M351 PolarHBondContact N-SD 3.04Å
100	K	80.4	Confident	77.8	Confident	6 Å²	6	46.7 Å²	46.7	3%	0.026	25%	0.252	C	S	.	.	H	α-helix	trans	-66.3	-38.1	176.4	-174.4	162.4	-174.4	160.3	0	112.6	I43 S46 D49 L50 Y96 L98 L102 M103 L104 M120	I43-K100 VanDerWaalsContact O-CE 3.23Å; I43-K100 WeakPolarHBondContact O-CE 3.32Å; I43-K100 PolarHBondContact O-NZ 3.4Å; S46-K100 WeakPolarHBondContact O-CE 3.43Å; S46-K100 PolarHBondContact O-NZ 3.32Å; D49-K100 IonicContact OD1-NZ 3.23Å; D49-K100 PolarHBondContact OD1-NZ 3.04Å; D49-K100 IonicContact OD2-NZ 2.59Å; D49-K100 PolarHBondContact OD2-NZ 3.08Å; L50-K100 HydrophobicContact CG-CD 4.44Å; Y96-K100 HydrophobicContact CE1-CD 4.43Å; Y96-K100 VanDerWaalsContact O-CB 3.28Å; Y96-K100 WeakPolarHBondContact O-CB 3.31Å; Y96-K100 PolarHBondContact O-N 3.14Å; L98-K100 VanDerWaalsContact C-N 3.34Å; K100-L102 VanDerWaalsContact C-N 3.3Å; K100-L102 PolarHBondContact O-N 2.63Å; K100-M103 PolarHBondContact O-N 2.92Å; K100-L104 WeakPolarHBondContact O-CB 3.49Å; K100-L104 PolarHBondContact O-N 3.04Å; K100-M120 HydrophobicContact CB-CE 3.87Å; K100-M120 HydrophobicContact CD-CE 4.41Å; K100-M120 HydrophobicContact CG-CE 3.74Å
101	L	80.7	Confident	76.6	Confident	28 Å²	28	54.3 Å²	54.3	15%	0.147	29%	0.293	C	S	.	.	H	α-helix	trans	-57.7	-49.2	172.8	176.1	57.7	0	0	0	109.6	T97 L98 M103 L104 T105 M120 L347	T97-L101 WeakPolarHBondContact O-CB 3.29Å; T97-L101 PolarHBondContact O-N 3.36Å; L98-L101 PolarHBondContact O-N 2.79Å; L101-M103 PolarHBondContact O-N 3.4Å; L101-L104 PolarHBondContact O-N 3.07Å; L101-T105 HydrophobicContact CD1-CG2 3.93Å; L101-T105 HydrophobicContact CG-CG2 4.42Å; L101-T105 WeakPolarHBondContact O-CG2 3.49Å; L101-T105 PolarHBondContact O-N 3.5Å; L101-T105 VanDerWaalsContact O-N 3.15Å; L101-T105 PolarHBondContact O-OG1 2.87Å; L101-M120 HydrophobicContact CB-CE 3.93Å; L101-M120 HydrophobicContact CB-SD 3.61Å; L101-M120 HydrophobicContact CD1-SD 3.72Å; L101-M120 HydrophobicContact CG-SD 4.16Å; L101-M120 VanDerWaalsContact N-CE 3.28Å; L101-L347 HydrophobicContact CD2-CD1 3.76Å; L101-L347 HydrophobicContact CG-CD1 4.3Å
102	L	79.2	Confident	75.4	Confident	19 Å²	19	60.7 Å²	60.7	10%	0.099	31%	0.314	C	S	.	.	H	α-helix	trans	-60.2	-47.8	-178.9	-164.1	145.2	0	0	0	111.5	L98 A99 K100 L104 T105 K344 L347 V348 M351 Y447	L98-L102 WeakPolarHBondContact O-CB 3.35Å; L98-L102 PolarHBondContact O-N 3.14Å; A99-L102 WeakPolarHBondContact O-CB 3.3Å; A99-L102 PolarHBondContact O-N 3.25Å; K100-L102 VanDerWaalsContact C-N 3.3Å; K100-L102 PolarHBondContact O-N 2.63Å; L102-L104 PolarHBondContact O-N 3.2Å; L102-T105 PolarHBondContact O-N 2.74Å; L102-T105 PolarHBondContact O-OG1 3.23Å; L102-K344 WeakPolarHBondContact CD1-O 3.31Å; L102-L347 HydrophobicContact CD1-CB 4.47Å; L102-V348 HydrophobicContact CD1-CG2 3.61Å; L102-M351 HydrophobicContact CD1-CE 4.15Å; L102-Y447 HydrophobicContact CD1-CE1 4.13Å; L102-Y447 HydrophobicContact CD2-CE1 4.18Å; L102-Y447 HydrophobicContact CD2-CE2 3.95Å; L102-Y447 HydrophobicContact CG-CE1 4.48Å
103	M	78.3	Confident	74.6	Confident	98 Å²	98	60 Å²	60	48%	0.483	31%	0.305	S	S	.	.	H	α-helix	trans	-56.7	-48.4	173.6	-72.9	176	175.3	0	0	113.2	L44 A99 K100 L101 T105 E106	L44-M103 HydrophobicContact CD2-CB 4.32Å; L44-M103 HydrophobicContact CD2-CG 4.49Å; L44-M103 HydrophobicContact CD2-SD 4.15Å; A99-M103 WeakPolarHBondContact O-CG 3.16Å; A99-M103 PolarHBondContact O-N 3.4Å; K100-M103 PolarHBondContact O-N 2.92Å; L101-M103 PolarHBondContact O-N 3.4Å; M103-T105 PolarHBondContact O-N 3.02Å; M103-E106 PolarHBondContact O-N 2.96Å
104	L	73.6	Confident	73.9	Confident	23 Å²	23	63.9 Å²	63.9	12%	0.12	33%	0.331	C	S	.	.	H	α-helix	trans	-61	-33.4	-177.8	-147.1	102.9	0	0	0	111.8	K100 L101 L102 E106 V107 E108 F116	K100-L104 WeakPolarHBondContact O-CB 3.49Å; K100-L104 PolarHBondContact O-N 3.04Å; L101-L104 PolarHBondContact O-N 3.07Å; L102-L104 PolarHBondContact O-N 3.2Å; L104-E106 PolarHBondContact O-N 3.44Å; L104-V107 PolarHBondContact O-N 3.34Å; L104-V107 VanDerWaalsContact O-N 3.09Å; L104-E108 PolarHBondContact O-N 2.71Å; L104-F116 HydrophobicContact CD1-CE1 3.96Å; L104-F116 HydrophobicContact CD1-CE2 4.15Å; L104-F116 HydrophobicContact CD1-CZ 3.51Å; L104-F116 HydrophobicContact CD2-CD1 3.91Å; L104-F116 HydrophobicContact CD2-CE1 3.6Å; L104-F116 HydrophobicContact CD2-CE2 4.28Å; L104-F116 HydrophobicContact CD2-CG 4.4Å; L104-F116 HydrophobicContact CD2-CZ 3.84Å; L104-F116 HydrophobicContact CG-CE1 4.3Å; L104-F116 HydrophobicContact CG-CZ 4.28Å
105	T	74	Confident	73.3	Confident	19 Å²	19	64.5 Å²	64.5	12%	0.117	34%	0.337	C	S	.	.	H	α-helix	trans	-79.4	-4.6	-176.1	71.7	0	0	0	0	114.1	L101 L102 M103 L110 W343	L101-T105 HydrophobicContact CD1-CG2 3.93Å; L101-T105 HydrophobicContact CG-CG2 4.42Å; L101-T105 WeakPolarHBondContact O-CG2 3.49Å; L101-T105 PolarHBondContact O-N 3.5Å; L101-T105 VanDerWaalsContact O-N 3.15Å; L101-T105 PolarHBondContact O-OG1 2.87Å; L102-T105 PolarHBondContact O-N 2.74Å; L102-T105 PolarHBondContact O-OG1 3.23Å; M103-T105 PolarHBondContact O-N 3.02Å; T105-L110 HydrophobicContact CG2-CD1 3.61Å; T105-L110 HydrophobicContact CG2-CG 4.03Å; T105-W343 HydrophobicContact CG2-CH2 3.73Å
106	E	72.6	Confident	72.8	Confident	98 Å²	98	63.2 Å²	63.2	46%	0.458	33%	0.327	S	S	.	.	H	α-helix	trans	-92.2	-17.9	166.2	-61.2	-167.8	162.1	0	0	112.1	M103 L104 Y447	M103-E106 PolarHBondContact O-N 2.96Å; L104-E106 PolarHBondContact O-N 3.44Å; E106-Y447 VanDerWaalsContact OE1-CE2 3.26Å; E106-Y447 WeakPolarHBondContact OE1-CE2 3.38Å; E106-Y447 PolarHBondContact OE1-OH 3.25Å
107	V	69.8	Low	72.3	Confident	96 Å²	96	63.7 Å²	63.7	58%	0.582	33%	0.334	S	S	*	.	H	α-helix	trans	-96.7	-42.7	179.9	-174.8	0	0	0	0	112.1	L104	L104-V107 PolarHBondContact O-N 3.34Å; L104-V107 VanDerWaalsContact O-N 3.09Å
108	E	65	Low	72.1	Confident	82 Å²	82	66.7 Å²	66.7	38%	0.383	36%	0.355	S	S	.	.	S	Bend	trans	-136.7	148.5	177.8	-73.3	-156.8	134.6	0	0	113.8	L104 Q113	L104-E108 PolarHBondContact O-N 2.71Å; E108-Q113 PolarHBondContact OE2-NE2 3.49Å
109	P	65.8	Low	72.1	Confident	82 Å²	82	65.7 Å²	65.7	53%	0.532	35%	0.35	S	S	.	.			trans	-74.5	130.2	177.2	29.7	-34.2	0	0	0	112.5	N111 R112	P109-N111 PolarHBondContact O-N 2.91Å; P109-R112 PolarHBondContact O-N 3Å
110	L	60	Low	72	Confident	76 Å²	76	64.5 Å²	64.5	40%	0.398	34%	0.339	S	S	.	.	G	3₁₀ helix	trans	-46.8	-34.1	-174.9	-70.3	72.2	0	0	0	114.7	T105 R112 Q113 L117 W343	T105-L110 HydrophobicContact CG2-CD1 3.61Å; T105-L110 HydrophobicContact CG2-CG 4.03Å; L110-R112 PolarHBondContact O-N 2.86Å; L110-Q113 PolarHBondContact O-N 2.81Å; L110-L117 HydrophobicContact CB-CD1 4.36Å; L110-L117 HydrophobicContact CD2-CD1 3.74Å; L110-L117 HydrophobicContact CG-CD1 4.17Å; L110-W343 HydrophobicContact CD1-CH2 4.1Å; L110-W343 HydrophobicContact CD1-CZ2 3.96Å; L110-W343 HydrophobicContact CD2-CH2 4Å; L110-W343 HydrophobicContact CD2-CZ2 4.07Å
111	N	58.7	Low	72	Confident	163 Å²	163	66.2 Å²	66.2	87%	0.872	36%	0.359	S	S	*	.	G	3₁₀ helix	trans	-67	-6.7	-171	-156.4	32.2	0	0	0	114.1	P109	P109-N111 PolarHBondContact O-N 2.91Å
112	R	58.1	Low	72.3	Confident	195 Å²	195	67.8 Å²	67.8	74%	0.736	36%	0.363	S	S	*	.	G	3₁₀ helix	trans	-94.3	-14.2	176.4	-73.9	-175.2	171.7	-179.5	-2.3	115	P109 L110	P109-R112 PolarHBondContact O-N 3Å; L110-R112 PolarHBondContact O-N 2.86Å
113	Q	66.4	Low	72.6	Confident	69 Å²	69	66.9 Å²	66.9	32%	0.322	36%	0.358	S	S	.	.			trans	-136.8	67.7	-171.5	-58.1	-166.3	15.8	0	0	114.7	E108 L110 C115 F116 L117	E108-Q113 PolarHBondContact OE2-NE2 3.49Å; L110-Q113 PolarHBondContact O-N 2.81Å; Q113-C115 VanDerWaalsContact C-N 3.31Å; Q113-C115 PolarHBondContact O-N 3.35Å; Q113-F116 HydrophobicContact CB-CB 3.98Å; Q113-F116 PolarHBondContact O-N 2.9Å; Q113-L117 PolarHBondContact O-N 2.91Å
114	P	69.9	Low	72.8	Confident	91 Å²	91	63.5 Å²	63.5	59%	0.591	34%	0.343	S	S	*	.	H	α-helix	trans	-64.8	-29.3	-178.3	26.5	-35	0	0	0	114.1	S118	P114-S118 WeakPolarHBondContact O-CB 3.08Å; P114-S118 PolarHBondContact O-N 2.82Å; P114-S118 VanDerWaalsContact O-N 3.09Å; P114-S118 PolarHBondContact O-OG 3.07Å
115	C	70.3	Confident	73.4	Confident	38 Å²	38	64.9 Å²	64.9	26%	0.257	36%	0.358	S	S	.	.	H	α-helix	trans	-67.3	-37.5	176.6	-66.4	0	0	0	0	112.4	Q113 S118 L119	Q113-C115 VanDerWaalsContact C-N 3.31Å; Q113-C115 PolarHBondContact O-N 3.35Å; C115-S118 WeakPolarHBondContact O-CB 3.43Å; C115-S118 PolarHBondContact O-N 3.1Å; C115-L119 WeakPolarHBondContact O-CB 3.43Å; C115-L119 PolarHBondContact O-N 3.14Å
116	F	72.8	Confident	73.9	Confident	16 Å²	16	64 Å²	64	7%	0.07	35%	0.353	C	S	.	.	H	α-helix	trans	-66.8	-41.7	178.4	-164.2	-76.6	0	0	0	111.6	A47 L50 L104 Q113 S118 L119 M120	A47-F116 HydrophobicContact CB-CD2 4.04Å; A47-F116 HydrophobicContact CB-CE2 3.54Å; A47-F116 HydrophobicContact CB-CZ 4.3Å; L50-F116 HydrophobicContact CD1-CE1 4.49Å; L50-F116 HydrophobicContact CD1-CZ 4.4Å; L104-F116 HydrophobicContact CD1-CE1 3.96Å; L104-F116 HydrophobicContact CD1-CE2 4.15Å; L104-F116 HydrophobicContact CD1-CZ 3.51Å; L104-F116 HydrophobicContact CD2-CD1 3.91Å; L104-F116 HydrophobicContact CD2-CE1 3.6Å; L104-F116 HydrophobicContact CD2-CE2 4.28Å; L104-F116 HydrophobicContact CD2-CG 4.4Å; L104-F116 HydrophobicContact CD2-CZ 3.84Å; L104-F116 HydrophobicContact CG-CE1 4.3Å; L104-F116 HydrophobicContact CG-CZ 4.28Å; Q113-F116 HydrophobicContact CB-CB 3.98Å; Q113-F116 PolarHBondContact O-N 2.9Å; F116-S118 VanDerWaalsContact C-N 3.32Å; F116-S118 PolarHBondContact O-N 3.35Å; F116-L119 WeakPolarHBondContact O-CB 3.33Å; F116-L119 PolarHBondContact O-N 3.43Å; F116-M120 HydrophobicContact CD1-CE 4.39Å; F116-M120 HydrophobicContact CD1-CG 4.32Å; F116-M120 HydrophobicContact CD1-SD 3.91Å; F116-M120 HydrophobicContact CE1-CE 3.5Å; F116-M120 HydrophobicContact CE1-CG 4.2Å; F116-M120 HydrophobicContact CE1-SD 3.61Å; F116-M120 HydrophobicContact CZ-CE 4.26Å; F116-M120 PolarHBondContact O-N 3.1Å
117	L	73.9	Confident	74.5	Confident	81 Å²	81	59.3 Å²	59.3	42%	0.424	33%	0.331	S	S	.	.	H	α-helix	trans	-67.8	-35.5	177.1	-149.9	143.4	0	0	0	111.6	L110 Q113 G121	L110-L117 HydrophobicContact CB-CD1 4.36Å; L110-L117 HydrophobicContact CD2-CD1 3.74Å; L110-L117 HydrophobicContact CG-CD1 4.17Å; Q113-L117 PolarHBondContact O-N 2.91Å; L117-G121 PolarHBondContact O-N 2.89Å
118	S	80.7	Confident	75.2	Confident	64 Å²	64	59.6 Å²	59.6	45%	0.448	33%	0.328	S	S	.	.	H	α-helix	trans	-66.1	-39.4	171.4	-57.7	0	0	0	0	112.3	P114 C115 F116 G121 W122	P114-S118 WeakPolarHBondContact O-CB 3.08Å; P114-S118 PolarHBondContact O-N 2.82Å; P114-S118 VanDerWaalsContact O-N 3.09Å; P114-S118 PolarHBondContact O-OG 3.07Å; C115-S118 WeakPolarHBondContact O-CB 3.43Å; C115-S118 PolarHBondContact O-N 3.1Å; F116-S118 VanDerWaalsContact C-N 3.32Å; F116-S118 PolarHBondContact O-N 3.35Å; S118-G121 PolarHBondContact O-N 3.12Å; S118-W122 VanDerWaalsContact O-CB 3.31Å; S118-W122 WeakPolarHBondContact O-CB 3.39Å; S118-W122 PolarHBondContact O-N 3.26Å
119	L	81.5	Confident	76.1	Confident	3 Å²	3	56.2 Å²	56.2	2%	0.016	32%	0.316	C	S	.	.	H	α-helix	trans	-61.1	-47.6	174.7	-179.8	66.9	0	0	0	111.1	T21 L24 Y25 A47 L50 C115 F116 W122 T123	T21-L119 HydrophobicContact CG2-CD1 3.56Å; L24-L119 HydrophobicContact CB-CB 4.2Å; L24-L119 HydrophobicContact CB-CD1 3.95Å; Y25-L119 HydrophobicContact CD2-CD2 4.47Å; A47-L119 HydrophobicContact CB-CD2 4.17Å; L50-L119 HydrophobicContact CB-CD2 4.41Å; L50-L119 HydrophobicContact CD1-CD2 4.38Å; C115-L119 WeakPolarHBondContact O-CB 3.43Å; C115-L119 PolarHBondContact O-N 3.14Å; F116-L119 WeakPolarHBondContact O-CB 3.33Å; F116-L119 PolarHBondContact O-N 3.43Å; L119-W122 PolarHBondContact O-N 3.15Å; L119-T123 PolarHBondContact O-N 2.94Å; L119-T123 PolarHBondContact O-OG1 2.94Å
120	M	79.9	Confident	77.1	Confident	7 Å²	7	52.3 Å²	52.3	3%	0.034	29%	0.291	C	S	.	.	H	α-helix	trans	-64.2	-44.3	177	-73.2	-180	146	0	0	112.9	L50 T97 K100 L101 F116 W122 T123 C124	L50-M120 HydrophobicContact CD1-CE 3.9Å; L50-M120 HydrophobicContact CD1-CG 3.81Å; T97-M120 WeakPolarHBondContact O-CE 3.25Å; K100-M120 HydrophobicContact CB-CE 3.87Å; K100-M120 HydrophobicContact CD-CE 4.41Å; K100-M120 HydrophobicContact CG-CE 3.74Å; L101-M120 HydrophobicContact CB-CE 3.93Å; L101-M120 HydrophobicContact CB-SD 3.61Å; L101-M120 HydrophobicContact CD1-SD 3.72Å; L101-M120 HydrophobicContact CG-SD 4.16Å; L101-M120 VanDerWaalsContact N-CE 3.28Å; F116-M120 HydrophobicContact CD1-CE 4.39Å; F116-M120 HydrophobicContact CD1-CG 4.32Å; F116-M120 HydrophobicContact CD1-SD 3.91Å; F116-M120 HydrophobicContact CE1-CE 3.5Å; F116-M120 HydrophobicContact CE1-CG 4.2Å; F116-M120 HydrophobicContact CE1-SD 3.61Å; F116-M120 HydrophobicContact CZ-CE 4.26Å; F116-M120 PolarHBondContact O-N 3.1Å; M120-W122 VanDerWaalsContact C-N 3.34Å; M120-W122 PolarHBondContact O-N 3.14Å; M120-T123 PolarHBondContact O-N 3.13Å; M120-C124 PolarHBondContact O-N 3.47Å
121	G	81	Confident	78.4	Confident	43 Å²	43	49.7 Å²	49.7	44%	0.443	28%	0.278	S	S	.	.	H	α-helix	trans	-59.9	-43.2	174.9	0	0	0	0	0	112.4	L117 S118 C124 A125	L117-G121 PolarHBondContact O-N 2.89Å; S118-G121 PolarHBondContact O-N 3.12Å; G121-C124 PolarHBondContact O-N 3.14Å; G121-A125 WeakPolarHBondContact O-CB 3.28Å; G121-A125 PolarHBondContact O-N 3.2Å
122	W	87.2	Confident	79.6	Confident	61 Å²	61	47 Å²	47	23%	0.231	26%	0.263	C	S	.	.	H	α-helix	trans	-62.6	-42.5	173.1	-177.7	-101.2	0	0	0	111.8	D17 I20 T21 L24 S118 L119 M120 C124 A125 S126	D17-W122 PolarHBondContact OD1-NE1 3.25Å; I20-W122 HydrophobicContact CB-CD2 4.36Å; I20-W122 HydrophobicContact CB-CZ2 4.07Å; I20-W122 HydrophobicContact CD1-CH2 3.56Å; I20-W122 HydrophobicContact CD1-CZ2 3.7Å; I20-W122 HydrophobicContact CD1-CZ3 4.04Å; I20-W122 HydrophobicContact CG1-CZ2 4.44Å; I20-W122 HydrophobicContact CG2-CD2 3.55Å; I20-W122 HydrophobicContact CG2-CE3 4.03Å; I20-W122 HydrophobicContact CG2-CG 3.82Å; I20-W122 HydrophobicContact CG2-CZ2 4.13Å; I20-W122 HydrophobicContact CG2-CZ3 4.5Å; T21-W122 PolarHBondContact OG1-NE1 3.07Å; L24-W122 HydrophobicContact CD1-CB 3.86Å; L24-W122 HydrophobicContact CD1-CG 4.22Å; S118-W122 VanDerWaalsContact O-CB 3.31Å; S118-W122 WeakPolarHBondContact O-CB 3.39Å; S118-W122 PolarHBondContact O-N 3.26Å; L119-W122 PolarHBondContact O-N 3.15Å; M120-W122 VanDerWaalsContact C-N 3.34Å; M120-W122 PolarHBondContact O-N 3.14Å; W122-C124 PolarHBondContact O-N 3.33Å; W122-A125 PolarHBondContact O-N 3.43Å; W122-S126 WeakPolarHBondContact O-CB 3.36Å; W122-S126 PolarHBondContact O-N 2.92Å
123	T	85	Confident	81	Confident	0 Å²	0	38.3 Å²	38.3	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-61.2	-42.6	177.8	-58.8	0	0	0	0	111.6	I53 R57 V93 T97 L119 M120 S126 S127	I53-T123 HydrophobicContact CG2-CG2 4.47Å; R57-T123 PolarHBondContact NH1-O 3Å; V93-T123 HydrophobicContact CG1-CG2 4.15Å; T97-T123 HydrophobicContact CG2-CG2 3.55Å; L119-T123 PolarHBondContact O-N 2.94Å; L119-T123 PolarHBondContact O-OG1 2.94Å; M120-T123 PolarHBondContact O-N 3.13Å; T123-S126 PolarHBondContact O-N 3.48Å; T123-S127 PolarHBondContact O-N 2.81Å; T123-S127 PolarHBondContact O-OG 2.86Å
124	C	83.8	Confident	82.1	Confident	26 Å²	26	35.7 Å²	35.7	18%	0.176	22%	0.218	C	C	.	.	H	α-helix	trans	-63.7	-50.5	174.4	-69.1	0	0	0	0	112.8	T97 M120 G121 W122 S126 S127 L128	T97-C124 PolarHBondContact OG1-SG 2.89Å; M120-C124 PolarHBondContact O-N 3.47Å; G121-C124 PolarHBondContact O-N 3.14Å; W122-C124 PolarHBondContact O-N 3.33Å; C124-S126 PolarHBondContact O-N 3.03Å; C124-S127 PolarHBondContact O-N 2.76Å; C124-L128 PolarHBondContact O-N 2.87Å
125	A	84.8	Confident	82.8	Confident	52 Å²	52	36.5 Å²	36.5	43%	0.43	21%	0.209	S	C	.	.	H	α-helix	trans	-59.7	-37	178	0	0	0	0	0	111.7	G121 W122 L128 G129	G121-A125 WeakPolarHBondContact O-CB 3.28Å; G121-A125 PolarHBondContact O-N 3.2Å; W122-A125 PolarHBondContact O-N 3.43Å; A125-L128 PolarHBondContact O-N 2.86Å; A125-G129 PolarHBondContact O-N 2.85Å; A125-G129 VanDerWaalsContact O-N 3.07Å
126	S	85.6	Confident	83.4	Confident	0 Å²	0	39.3 Å²	39.3	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-74.1	-39.9	-178.3	177.7	0	0	0	0	112.8	Y13 D17 R57 W122 T123 C124 L128 G129 V130	Y13-S126 WeakPolarHBondContact OH-CA 3.45Å; Y13-S126 PolarHBondContact OH-O 3.24Å; Y13-S126 PolarHBondContact OH-OG 3.17Å; D17-S126 VanDerWaalsContact OD1-CB 3.25Å; D17-S126 WeakPolarHBondContact OD1-CB 3.33Å; D17-S126 PolarHBondContact OD1-OG 3.12Å; D17-S126 PolarHBondContact OD2-OG 3.07Å; D17-S126 VanDerWaalsContact OD2-OG 3.11Å; R57-S126 PolarHBondContact NH2-OG 3.23Å; W122-S126 WeakPolarHBondContact O-CB 3.36Å; W122-S126 PolarHBondContact O-N 2.92Å; T123-S126 PolarHBondContact O-N 3.48Å; C124-S126 PolarHBondContact O-N 3.03Å; S126-L128 PolarHBondContact O-N 3.29Å; S126-G129 CarbonylContact O-C 3.51Å; S126-G129 WeakPolarHBondContact O-CA 3.28Å; S126-G129 PolarHBondContact O-N 2.83Å; S126-V130 WeakPolarHBondContact O-CG2 3.41Å; S126-V130 PolarHBondContact O-N 2.85Å
127	S	85	Confident	83.9	Confident	0 Å²	0	38.7 Å²	38.7	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-61	-33.2	172.2	-67	0	0	0	0	112.5	R57 V93 T123 C124 V131	R57-S127 PolarHBondContact NH1-OG 2.82Å; V93-S127 WeakPolarHBondContact CG1-OG 3.22Å; T123-S127 PolarHBondContact O-N 2.81Å; T123-S127 PolarHBondContact O-OG 2.86Å; C124-S127 PolarHBondContact O-N 2.76Å; S127-V131 PolarHBondContact O-N 3.31Å
128	L	83.8	Confident	84.2	Confident	102 Å²	102	35.5 Å²	35.5	53%	0.534	20%	0.202	S	C	.	.	H	α-helix	trans	-67.7	-40.6	170.3	-69.2	170.2	0	0	0	112.4	I94 C124 A125 S126 V131 L132	I94-L128 HydrophobicContact CD1-CD2 4.4Å; I94-L128 HydrophobicContact CD1-CG 4.36Å; C124-L128 PolarHBondContact O-N 2.87Å; A125-L128 PolarHBondContact O-N 2.86Å; S126-L128 PolarHBondContact O-N 3.29Å; L128-V131 PolarHBondContact O-N 2.86Å; L128-L132 WeakPolarHBondContact O-CG 3.48Å; L128-L132 PolarHBondContact O-N 2.62Å
129	G	84.9	Confident	83.9	Confident	12 Å²	12	40.8 Å²	40.8	12%	0.124	21%	0.213	C	C	.	.	H	α-helix	trans	-62.2	-40.1	175.2	0	0	0	0	0	113.2	Y13 A125 S126 V131 L132 L133	Y13-G129 WeakPolarHBondContact OH-CA 3.47Å; A125-G129 PolarHBondContact O-N 2.85Å; A125-G129 VanDerWaalsContact O-N 3.07Å; S126-G129 CarbonylContact O-C 3.51Å; S126-G129 WeakPolarHBondContact O-CA 3.28Å; S126-G129 PolarHBondContact O-N 2.83Å; G129-V131 PolarHBondContact O-N 3.13Å; G129-L132 PolarHBondContact O-N 3.5Å; G129-L133 WeakPolarHBondContact O-CB 3.25Å; G129-L133 WeakPolarHBondContact O-CG 3.44Å; G129-L133 PolarHBondContact O-N 3.38Å
130	V	87.1	Confident	83.2	Confident	0 Å²	0	42 Å²	42	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-55.3	-48.3	171.2	173.2	0	0	0	0	111.1	Y13 R57 L61 I86 S126 L132 L133 W134	Y13-V130 HydrophobicContact CE1-CG2 4.26Å; R57-V130 HydrophobicContact CB-CG2 4.18Å; R57-V130 HydrophobicContact CG-CG2 4.35Å; L61-V130 HydrophobicContact CD1-CG2 3.92Å; L61-V130 HydrophobicContact CD2-CG1 4.21Å; L61-V130 HydrophobicContact CG-CG1 4.2Å; L61-V130 HydrophobicContact CG-CG2 4.4Å; I86-V130 HydrophobicContact CG2-CG1 4.14Å; S126-V130 WeakPolarHBondContact O-CG2 3.41Å; S126-V130 PolarHBondContact O-N 2.85Å; V130-L132 PolarHBondContact O-N 2.9Å; V130-L133 PolarHBondContact O-N 3.15Å; V130-W134 VanDerWaalsContact O-CB 3.26Å; V130-W134 WeakPolarHBondContact O-CB 3.46Å; V130-W134 PolarHBondContact O-N 3.31Å
131	V	85.3	Confident	81.9	Confident	20 Å²	20	43.7 Å²	43.7	12%	0.121	23%	0.233	C	C	.	.	H	α-helix	trans	-63.8	-40.1	179	175.6	0	0	0	0	112	L87 C90 S127 L128 G129 R135	L87-V131 HydrophobicContact CD1-CG1 4.44Å; C90-V131 HydrophobicContact CB-CG2 3.59Å; S127-V131 PolarHBondContact O-N 3.31Å; L128-V131 PolarHBondContact O-N 2.86Å; G129-V131 PolarHBondContact O-N 3.13Å; V131-R135 WeakPolarHBondContact O-CB 3.37Å; V131-R135 WeakPolarHBondContact O-CG 3.4Å; V131-R135 PolarHBondContact O-N 2.93Å; V131-R135 VanDerWaalsContact O-N 3.11Å
132	L	84.8	Confident	80.2	Confident	107 Å²	107	46.5 Å²	46.5	56%	0.56	25%	0.245	S	C	*	.	H	α-helix	trans	-64.5	-47.1	177.6	-72.3	172.8	0	0	0	111.7	L128 G129 V130 R135 Q136	L128-L132 WeakPolarHBondContact O-CG 3.48Å; L128-L132 PolarHBondContact O-N 2.62Å; G129-L132 PolarHBondContact O-N 3.5Å; V130-L132 PolarHBondContact O-N 2.9Å; L132-R135 PolarHBondContact O-N 2.74Å; L132-Q136 WeakPolarHBondContact O-CG 3.48Å; L132-Q136 PolarHBondContact O-N 2.98Å
133	L	87	Confident	77.7	Confident	12 Å²	12	49 Å²	49	6%	0.063	27%	0.272	C	S	.	.	H	α-helix	trans	-69.6	-37.9	-179.7	-71.9	169.6	0	0	0	112.5	T10 Y13 G129 V130 R135 Q136 L137	T10-L133 HydrophobicContact CG2-CB 3.79Å; T10-L133 HydrophobicContact CG2-CD1 4.35Å; T10-L133 HydrophobicContact CG2-CD2 4.28Å; T10-L133 HydrophobicContact CG2-CG 4.37Å; Y13-L133 HydrophobicContact CD1-CD1 3.38Å; Y13-L133 HydrophobicContact CD2-CD1 3.75Å; Y13-L133 HydrophobicContact CE1-CD1 3.96Å; Y13-L133 HydrophobicContact CE2-CD1 4.28Å; Y13-L133 HydrophobicContact CG-CD1 3.24Å; G129-L133 WeakPolarHBondContact O-CB 3.25Å; G129-L133 WeakPolarHBondContact O-CG 3.44Å; G129-L133 PolarHBondContact O-N 3.38Å; V130-L133 PolarHBondContact O-N 3.15Å; L133-R135 VanDerWaalsContact C-N 3.32Å; L133-R135 PolarHBondContact O-N 3.27Å; L133-Q136 WeakPolarHBondContact O-CB 3.18Å; L133-Q136 PolarHBondContact O-N 3.25Å; L133-L137 PolarHBondContact O-N 3.08Å
134	W	89.3	Confident	75.5	Confident	15 Å²	15	51.9 Å²	51.9	6%	0.057	30%	0.296	C	S	.	.	H	α-helix	trans	-58.6	-44.4	172.1	-166.5	-76.3	0	0	0	111.6	L60 L61 A64 V79 V82 I86 V130 Q136 L137 G138	L60-W134 HydrophobicContact CB-CZ3 4.39Å; L61-W134 HydrophobicContact CD2-CE3 4.33Å; A64-W134 HydrophobicContact CB-CE3 4.09Å; A64-W134 HydrophobicContact CB-CH2 3.77Å; A64-W134 HydrophobicContact CB-CZ2 4.41Å; A64-W134 HydrophobicContact CB-CZ3 3.59Å; V79-W134 HydrophobicContact CG1-CD2 4.15Å; V79-W134 HydrophobicContact CG1-CG 4.31Å; V79-W134 HydrophobicContact CG1-CZ2 3.98Å; V79-W134 PolarHBondContact O-NE1 3.4Å; V82-W134 HydrophobicContact CB-CZ2 4.13Å; V82-W134 HydrophobicContact CG1-CZ2 4.06Å; I86-W134 HydrophobicContact CB-CD2 4.12Å; I86-W134 HydrophobicContact CB-CE3 4.39Å; I86-W134 HydrophobicContact CB-CG 4.41Å; I86-W134 HydrophobicContact CD1-CE3 4.21Å; I86-W134 HydrophobicContact CD1-CH2 3.78Å; I86-W134 HydrophobicContact CD1-CZ2 4.18Å; I86-W134 HydrophobicContact CD1-CZ3 3.79Å; I86-W134 HydrophobicContact CG1-CD2 3.69Å; I86-W134 HydrophobicContact CG1-CE3 3.8Å; I86-W134 HydrophobicContact CG1-CG 4.45Å; I86-W134 HydrophobicContact CG1-CH2 3.66Å; I86-W134 HydrophobicContact CG1-CZ2 3.56Å; I86-W134 HydrophobicContact CG1-CZ3 3.77Å; I86-W134 HydrophobicContact CG2-CB 4.46Å; I86-W134 HydrophobicContact CG2-CD2 3.99Å; I86-W134 HydrophobicContact CG2-CE3 3.98Å; I86-W134 HydrophobicContact CG2-CG 4.18Å; V130-W134 VanDerWaalsContact O-CB 3.26Å; V130-W134 WeakPolarHBondContact O-CB 3.46Å; V130-W134 PolarHBondContact O-N 3.31Å; W134-Q136 VanDerWaalsContact C-N 3.29Å; W134-Q136 PolarHBondContact O-N 3.3Å; W134-L137 PolarHBondContact O-N 2.93Å; W134-G138 PolarHBondContact O-N 3.04Å
135	R	84.4	Confident	73.2	Confident	108 Å²	108	54.1 Å²	54.1	41%	0.408	31%	0.312	S	S	.	.	H	α-helix	trans	-64.6	-30.4	174	-75.4	176.4	176.6	-169.6	1.1	112.9	T83 V131 L132 L133 R139	T83-R135 HydrophobicContact CG2-CG 3.9Å; V131-R135 WeakPolarHBondContact O-CB 3.37Å; V131-R135 WeakPolarHBondContact O-CG 3.4Å; V131-R135 PolarHBondContact O-N 2.93Å; V131-R135 VanDerWaalsContact O-N 3.11Å; L132-R135 PolarHBondContact O-N 2.74Å; L133-R135 VanDerWaalsContact C-N 3.32Å; L133-R135 PolarHBondContact O-N 3.27Å; R135-R139 WeakPolarHBondContact O-CD 3.18Å; R135-R139 VanDerWaalsContact O-CG 3.27Å; R135-R139 WeakPolarHBondContact O-CG 3.11Å; R135-R139 PolarHBondContact O-N 2.69Å
136	Q	84.6	Confident	70.7	Confident	97 Å²	97	55.3 Å²	55.3	45%	0.453	33%	0.329	S	S	.	.	H	α-helix	trans	-69.3	-48.2	173.3	-72	-174.7	13.4	0	0	111.4	L132 L133 W134 G138 R139 V140	L132-Q136 WeakPolarHBondContact O-CG 3.48Å; L132-Q136 PolarHBondContact O-N 2.98Å; L133-Q136 WeakPolarHBondContact O-CB 3.18Å; L133-Q136 PolarHBondContact O-N 3.25Å; W134-Q136 VanDerWaalsContact C-N 3.29Å; W134-Q136 PolarHBondContact O-N 3.3Å; Q136-G138 VanDerWaalsContact C-N 3.31Å; Q136-G138 PolarHBondContact O-N 3.36Å; Q136-R139 PolarHBondContact O-N 3.38Å; Q136-R139 VanDerWaalsContact O-N 3.11Å; Q136-V140 WeakPolarHBondContact O-CG2 3.48Å
137	L	83.5	Confident	68.2	Low	2 Å²	2	62.8 Å²	62.8	1%	0.01	37%	0.369	C	S	.	.	H	α-helix	trans	-56.3	-43.8	175.8	-98.6	67.1	0	0	0	112.3	P6 T10 A64 V68 V79 L133 W134 R139 V140	P6-L137 HydrophobicContact CB-CD1 4.26Å; T10-L137 HydrophobicContact CG2-CD1 3.44Å; T10-L137 VanDerWaalsContact CG2-CD1 3.44Å; A64-L137 HydrophobicContact CB-CD2 3.96Å; V68-L137 HydrophobicContact CG2-CD2 4.16Å; V68-L137 HydrophobicContact CG2-CG 4.43Å; V79-L137 HydrophobicContact CG1-CB 4.02Å; L133-L137 PolarHBondContact O-N 3.08Å; W134-L137 PolarHBondContact O-N 2.93Å; L137-R139 PolarHBondContact O-N 3.49Å; L137-V140 WeakPolarHBondContact O-CG2 3.48Å
138	G	79.6	Confident	65.5	Low	14 Å²	14	70.8 Å²	70.8	14%	0.144	41%	0.406	C	S	.	.	H	α-helix	trans	-65.9	-21.8	179.4	0	0	0	0	0	114.7	W134 Q136	W134-G138 PolarHBondContact O-N 3.04Å; Q136-G138 VanDerWaalsContact C-N 3.31Å; Q136-G138 PolarHBondContact O-N 3.36Å
139	R	74.9	Confident	63.1	Low	176 Å²	176	72.1 Å²	72.1	66%	0.664	42%	0.418	S	S	*	.	H	α-helix	trans	-87.7	-14.9	-177.1	-79.3	174.1	177	177.5	-1.9	114.7	R135 Q136 L137 S141 S142	R135-R139 WeakPolarHBondContact O-CD 3.18Å; R135-R139 VanDerWaalsContact O-CG 3.27Å; R135-R139 WeakPolarHBondContact O-CG 3.11Å; R135-R139 PolarHBondContact O-N 2.69Å; Q136-R139 PolarHBondContact O-N 3.38Å; Q136-R139 VanDerWaalsContact O-N 3.11Å; L137-R139 PolarHBondContact O-N 3.49Å; R139-S141 PolarHBondContact O-N 2.9Å; R139-S142 PolarHBondContact O-N 3.01Å; R139-S142 PolarHBondContact O-OG 3.32Å
140	V	66.4	Low	60.4	Low	27 Å²	27	82.4 Å²	82.4	16%	0.164	45%	0.453	C	S	.	.	G	3₁₀ helix	trans	-63.7	-28.5	-168.8	-170.1	0	0	0	0	113.4	I3 P6 Q136 L137 S142	I3-V140 HydrophobicContact CB-CG1 4.18Å; I3-V140 HydrophobicContact CG1-CG1 3.53Å; P6-V140 HydrophobicContact CB-CG2 4.34Å; P6-V140 HydrophobicContact CG-CG2 3.63Å; Q136-V140 WeakPolarHBondContact O-CG2 3.48Å; L137-V140 WeakPolarHBondContact O-CG2 3.48Å; V140-S142 PolarHBondContact O-N 3.46Å
141	S	52.5	Low	57.7	Low	43 Å²	43	89.7 Å²	89.7	30%	0.301	49%	0.492	S	S	.	.	G	3₁₀ helix	trans	-65.5	-33.4	-179.1	165.4	0	0	0	0	113.8	R139 S143 A144 S145	R139-S141 PolarHBondContact O-N 2.9Å; S141-S143 PolarHBondContact O-N 2.93Å; S141-A144 PolarHBondContact O-N 3.5Å; S141-S145 PolarHBondContact O-OG 3.27Å
142	S	43.8	Very low	55	Low	102 Å²	102	93.7 Å²	93.7	71%	0.713	52%	0.521	S	S	*	.	G	3₁₀ helix	trans	-71.5	-3.8	-169.4	72.3	0	0	0	0	115.2	R139 V140	R139-S142 PolarHBondContact O-N 3.01Å; R139-S142 PolarHBondContact O-OG 3.32Å; V140-S142 PolarHBondContact O-N 3.46Å
143	S	35.8	Very low	52.3	Low	114 Å²	114	100.8 Å²	100.8	80%	0.797	54%	0.54	S	S	*	.	G	3₁₀ helix	trans	-108.2	-7.5	179.5	-169.6	0	0	0	0	114	S141	S141-S143 PolarHBondContact O-N 2.93Å
144	A	37.8	Very low	49.3	Very low	60 Å²	60	104 Å²	104	50%	0.496	58%	0.576	S	S	.	*	T	Hydrogen-bonded Turn	trans	-110.2	-35	-176.6	0	0	0	0	0	112.9	S141 G146 L147	S141-A144 PolarHBondContact O-N 3.5Å; A144-G146 PolarHBondContact O-N 2.9Å; A144-G146 VanDerWaalsContact O-N 3.07Å; A144-L147 PolarHBondContact O-N 2.88Å
145	S	36.8	Very low	46.3	Very low	73 Å²	73	107.4 Å²	107.4	51%	0.51	62%	0.616	S	S	.	*	T	Hydrogen-bonded Turn	trans	-65.7	-11.1	-178.1	54.5	0	0	0	0	115	S141	S141-S145 PolarHBondContact O-OG 3.27Å
146	G	32.4	Very low	43.3	Very low	77 Å²	77	106.2 Å²	106.2	79%	0.794	64%	0.638	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76	-14.4	176.3	0	0	0	0	0	115.3	A144	A144-G146 PolarHBondContact O-N 2.9Å; A144-G146 VanDerWaalsContact O-N 3.07Å
147	L	31.9	Very low	40.4	Very low	158 Å²	158	105.2 Å²	105.2	83%	0.827	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111.8	-27.7	-168.3	-143.9	74.4	0	0	0	115.5	A144	A144-L147 PolarHBondContact O-N 2.88Å
148	E	29.4	Very low	37.5	Very low	167 Å²	167	116.9 Å²	116.9	78%	0.78	70%	0.697	S	S	*	*	S	Bend	trans	-103.3	-11.3	-168.3	-69.8	-175.2	140.3	0	0	115.8	R150	E148-R150 PolarHBondContact O-N 3.32Å; E148-R150 VanDerWaalsContact O-N 3.1Å
149	V	33.8	Very low	35.1	Very low	130 Å²	130	123.4 Å²	123.4	79%	0.788	73%	0.733	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.8	-8.3	-176.7	-178.5	0	0	0	0	113.4	N151	V149-N151 PolarHBondContact O-N 2.88Å
150	R	27.6	Very low	32.8	Very low	229 Å²	229	120 Å²	120	86%	0.864	74%	0.737	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.1	-7.9	-173	-170.8	164.1	169.6	177.9	-5.2	115.3	E148	E148-R150 PolarHBondContact O-N 3.32Å; E148-R150 VanDerWaalsContact O-N 3.1Å
151	N	30.2	Very low	30.9	Very low	153 Å²	153	127.3 Å²	127.3	82%	0.818	77%	0.769	S	S	*	*	S	Bend	trans	-143.5	40.5	-165.5	-135.6	21.7	0	0	0	118.7	V149	V149-N151 PolarHBondContact O-N 2.88Å
152	S	28.6	Very low	29.7	Very low	104 Å²	104	132.8 Å²	132.8	73%	0.727	80%	0.795	S	S	*	*			trans	-168.7	110	156.1	55.6	0	0	0	0	114.9
153	R	27.8	Very low	29	Very low	255 Å²	255	134.9 Å²	134.9	96%	0.962	80%	0.804	S	S	*	*				164.1	119.9	124.5	-93.2	174.4	174.7	168.2	0.5	111.9
154	G	25.1	Very low	28.6	Very low	79 Å²	79	138.1 Å²	138.1	81%	0.814	81%	0.806	S	S	*	*			trans	-112.7	146.2	155.7	0	0	0	0	0	110
155	G	24.6	Very low	28.1	Very low	87 Å²	87	144.7 Å²	144.7	90%	0.897	82%	0.824	S	S	*	*			trans	92.9	127.3	163.1	0	0	0	0	0	117.8
156	G	23.1	Very low	27.6	Very low	84 Å²	84	148.6 Å²	148.6	87%	0.866	84%	0.838	S	S	*	*			trans	111	66.5	152.7	0	0	0	0	0	117.5
157	G	22.9	Very low	27.6	Very low	75 Å²	75	148.6 Å²	148.6	77%	0.773	82%	0.822	S	S	*	*			trans	-74.9	167.8	-174.2	0	0	0	0	0	118.3
158	R	23.3	Very low	27.3	Very low	248 Å²	248	148 Å²	148	94%	0.936	82%	0.82	S	S	*	*			trans	-161.3	119.3	134.6	-111.1	177.8	-174.4	176.5	2.4	112.1
159	V	28.2	Very low	27.2	Very low	150 Å²	150	143.2 Å²	143.2	91%	0.909	80%	0.803	S	S	*	*			trans	-7.3	114.5	159.5	-175	0	0	0	0	117.5
160	S	26.4	Very low	26.9	Very low	105 Å²	105	141.4 Å²	141.4	73%	0.734	80%	0.801	S	S	*	*				179.4	157.1	120.6	-167.2	0	0	0	0	109.8
161	E	26.8	Very low	26.9	Very low	181 Å²	181	134.1 Å²	134.1	85%	0.846	80%	0.797	S	S	*	*			trans	72.1	67.1	173.3	-55.5	-173.6	152.3	0	0	118
162	D	27.4	Very low	26.9	Very low	158 Å²	158	134 Å²	134	85%	0.845	79%	0.791	S	S	*	*			trans	-120.9	81.3	160.5	-87.4	-48.2	0	0	0	110.9
163	T	29.7	Very low	26.7	Very low	146 Å²	146	136.5 Å²	136.5	90%	0.896	79%	0.792	S	S	*	*	S	Bend	trans	-153.9	28.8	166.5	-26	0	0	0	0	114.3
164	E	27.2	Very low	26.7	Very low	182 Å²	182	133 Å²	133	85%	0.85	79%	0.787	S	S	*	*	S	Bend	trans	-138.2	22.4	179.7	-141.9	-180	-170.7	0	0	114.9
165	K	26.7	Very low	26.8	Very low	197 Å²	197	135.7 Å²	135.7	86%	0.857	78%	0.778	S	S	*	*	S	Bend	trans	-127.8	24.6	178.6	-83.9	-173.4	177.5	175.2	0	115.7
166	L	26.6	Very low	27.1	Very low	155 Å²	155	137 Å²	137	81%	0.812	78%	0.78	S	S	*	*	S	Bend	trans	-127.9	75.2	171.7	-69.4	171.7	0	0	0	110.2
167	V	31.8	Very low	27.2	Very low	77 Å²	77	135.7 Å²	135.7	47%	0.467	77%	0.767	S	S	.	*	S	Bend	trans	-172.5	64.2	141.3	-169.4	0	0	0	0	108.7	K372 T376	V167-K372 PolarHBondContact O-NZ 2.87Å; V167-T376 HydrophobicContact CG1-CG2 4.29Å
168	D	25.3	Very low	27.2	Very low	145 Å²	145	135.6 Å²	135.6	78%	0.775	77%	0.765	S	S	*	*	S	Bend	trans	-126.4	3.1	153.5	-91.8	-23.4	0	0	0	112.1	K372	D168-K372 IonicContact OD1-NZ 3.97Å; D168-K372 PolarHBondContact OD1-NZ 3.26Å
169	T	27.9	Very low	27.3	Very low	68 Å²	68	135.7 Å²	135.7	42%	0.417	77%	0.766	S	S	.	*			trans	-110.1	55.9	171.9	38.2	0	0	0	0	111.7
170	A	26.9	Very low	27.2	Very low	91 Å²	91	137.4 Å²	137.4	75%	0.752	76%	0.761	S	S	*	*	S	Bend	trans	-119.8	60.4	165.9	0	0	0	0	0	109
171	G	29.5	Very low	27.2	Very low	76 Å²	76	141.7 Å²	141.7	78%	0.784	77%	0.769	S	S	*	*	S	Bend	trans	169.3	-19.1	-173.6	0	0	0	0	0	114.8
172	E	29.5	Very low	27.4	Very low	150 Å²	150	139.2 Å²	139.2	70%	0.701	76%	0.756	S	S	*	*	S	Bend	trans	-139.5	76.9	174	-70.4	179.2	176.9	0	0	109.2
173	E	24.5	Very low	27.7	Very low	157 Å²	157	140.1 Å²	140.1	73%	0.734	76%	0.755	S	S	*	*			trans	-154.1	56.9	166	-131.2	169.2	-116.3	0	0	113.1
174	E	26.8	Very low	28.1	Very low	183 Å²	183	142 Å²	142	86%	0.855	75%	0.751	S	S	*	*	S	Bend	trans	-138.8	46.5	154.2	-130.2	-175.6	-161.1	0	0	110.9
175	E	28.7	Very low	29	Very low	135 Å²	135	137.6 Å²	137.6	63%	0.631	74%	0.736	S	S	*	*			trans	-133.9	56	169.7	-94.1	-171.9	-155.2	0	0	110.5	G177 K182	E175-G177 PolarHBondContact O-N 3.06Å; E175-K182 VanDerWaalsContact OE1-CE 3.3Å; E175-K182 WeakPolarHBondContact OE1-CE 3.39Å; E175-K182 IonicContact OE1-NZ 2.65Å
176	A	29.2	Very low	30.6	Very low	115 Å²	115	132 Å²	132	95%	0.95	72%	0.722	S	S	*	*			trans	-90.4	49.9	168.6	0	0	0	0	0	111.4
177	G	25.3	Very low	32.5	Very low	56 Å²	56	127 Å²	127	58%	0.577	70%	0.7	S	S	*	*	S	Bend	trans	-168.1	96.4	-178.2	0	0	0	0	0	112.6	E175	E175-G177 PolarHBondContact O-N 3.06Å
178	G	24.3	Very low	34.2	Very low	72 Å²	72	133.5 Å²	133.5	74%	0.742	72%	0.716	S	S	*	*			trans	78.7	83.7	171.8	0	0	0	0	0	115.8	K180	G178-K180 PolarHBondContact O-N 2.9Å
179	R	24.8	Very low	36.5	Very low	250 Å²	250	129.2 Å²	129.2	94%	0.943	70%	0.701	S	S	*	*			trans	-55	110.8	172.6	-111	178.6	176.9	159.5	-0.8	112.1
180	K	26	Very low	38.9	Very low	187 Å²	187	126.2 Å²	126.2	81%	0.813	68%	0.682	S	S	*	*			trans	-109.7	138.1	152.6	-76.3	-176.6	177.1	176.9	0	108.5	G178 K182	G178-K180 PolarHBondContact O-N 2.9Å; K180-K182 PolarHBondContact O-N 3.32Å; K180-K182 VanDerWaalsContact O-N 3.11Å
181	E	26	Very low	41.2	Very low	195 Å²	195	123.9 Å²	123.9	91%	0.911	66%	0.657	S	S	*	*			trans	-68.7	107	177.6	-68.2	175.1	124.5	0	0	110	E183	E181-E183 PolarHBondContact O-N 3.49Å
182	K	30.9	Very low	43.4	Very low	129 Å²	129	122.2 Å²	122.2	56%	0.561	64%	0.64	S	S	*	*			trans	-71.7	105.6	164.6	-72	-167.5	-178.7	-169.9	0	108.5	E175 K180 K184 E498	E175-K182 VanDerWaalsContact OE1-CE 3.3Å; E175-K182 WeakPolarHBondContact OE1-CE 3.39Å; E175-K182 IonicContact OE1-NZ 2.65Å; K180-K182 PolarHBondContact O-N 3.32Å; K180-K182 VanDerWaalsContact O-N 3.11Å; K182-K184 PolarHBondContact O-N 3.05Å; K182-K184 VanDerWaalsContact O-N 3.14Å; K182-E498 IonicContact NZ-OE1 2.7Å; K182-E498 PolarHBondContact NZ-OE1 3.43Å
183	E	33.8	Very low	45.8	Very low	177 Å²	177	119.3 Å²	119.3	83%	0.827	62%	0.622	S	S	*	*			trans	-58.2	115.5	171.4	-75.1	-171	123.6	0	0	110.1	E181 V185	E181-E183 PolarHBondContact O-N 3.49Å; E183-V185 VanDerWaalsContact C-N 3.32Å; E183-V185 PolarHBondContact O-N 2.87Å
184	K	38.1	Very low	48.5	Very low	185 Å²	185	112.1 Å²	112.1	80%	0.804	59%	0.589	S	S	*	*			trans	-68.3	92.3	169	-79.5	-177	174.6	173.8	0	109.3	K182 S186	K182-K184 PolarHBondContact O-N 3.05Å; K182-K184 VanDerWaalsContact O-N 3.14Å; K184-S186 PolarHBondContact O-N 3.28Å
185	V	47.3	Very low	50.8	Low	89 Å²	89	108.9 Å²	108.9	54%	0.539	58%	0.577	S	S	.	*			trans	-50.1	121.9	172.4	177.9	0	0	0	0	108.5	E183 S187 A189	E183-V185 VanDerWaalsContact C-N 3.32Å; E183-V185 PolarHBondContact O-N 2.87Å; V185-S187 PolarHBondContact O-N 2.83Å; V185-A189 HydrophobicContact CG1-CB 4.01Å
186	S	59.7	Low	53.4	Low	81 Å²	81	105.8 Å²	105.8	57%	0.566	57%	0.57	S	S	*	*			trans	-59.1	130.9	179.7	-178.6	0	0	0	0	110.1	K184 R188 A189 T190	K184-S186 PolarHBondContact O-N 3.28Å; S186-R188 PolarHBondContact O-N 2.95Å; S186-A189 WeakPolarHBondContact O-CA 3.43Å; S186-A189 VanDerWaalsContact O-CB 3.27Å; S186-A189 WeakPolarHBondContact O-CB 3.31Å; S186-A189 PolarHBondContact O-N 3.23Å; S186-T190 PolarHBondContact O-N 3.4Å
187	S	65.6	Low	55.9	Low	50 Å²	50	101.7 Å²	101.7	35%	0.35	53%	0.53	S	S	.	.	H	α-helix	trans	-50.9	-25.4	177.4	-56.5	0	0	0	0	114.3	V185 T190 L191 E494	V185-S187 PolarHBondContact O-N 2.83Å; S187-T190 WeakPolarHBondContact O-CB 3.37Å; S187-L191 PolarHBondContact O-N 3.24Å; S187-L191 VanDerWaalsContact O-N 3.1Å; S187-E494 PolarHBondContact OG-OE1 2.97Å; S187-E494 VanDerWaalsContact OG-OE1 3.12Å
188	R	68.8	Low	58.6	Low	213 Å²	213	99.6 Å²	99.6	80%	0.804	51%	0.507	S	S	*	.	H	α-helix	trans	-70.1	-35.6	172.9	-168.7	177.2	-176.2	-178.7	1.3	112.8	S186 G192	S186-R188 PolarHBondContact O-N 2.95Å; R188-G192 PolarHBondContact O-N 3.3Å
189	A	73.3	Confident	61.4	Low	55 Å²	55	106 Å²	106	46%	0.455	51%	0.508	S	S	.	.	H	α-helix	trans	-69.9	-40.5	172.4	0	0	0	0	0	111.1	V185 S186 L191 G192 R193	V185-A189 HydrophobicContact CG1-CB 4.01Å; S186-A189 WeakPolarHBondContact O-CA 3.43Å; S186-A189 VanDerWaalsContact O-CB 3.27Å; S186-A189 WeakPolarHBondContact O-CB 3.31Å; S186-A189 PolarHBondContact O-N 3.23Å; A189-L191 VanDerWaalsContact C-N 3.35Å; A189-L191 PolarHBondContact O-N 2.71Å; A189-G192 PolarHBondContact O-N 3.38Å; A189-R193 VanDerWaalsContact O-CB 3.28Å; A189-R193 WeakPolarHBondContact O-CB 3.07Å; A189-R193 PolarHBondContact O-N 2.99Å
190	T	77.6	Confident	64.2	Low	4 Å²	4	102.8 Å²	102.8	3%	0.025	50%	0.501	C	S	.	.	H	α-helix	trans	-54.3	-48.8	171.9	-48.5	0	0	0	0	111.5	S186 S187 R193 L194 V490 A493 E494 F497	S186-T190 PolarHBondContact O-N 3.4Å; S187-T190 WeakPolarHBondContact O-CB 3.37Å; T190-R193 PolarHBondContact O-N 3.29Å; T190-L194 PolarHBondContact O-N 2.81Å; T190-V490 HydrophobicContact CG2-CG1 4.43Å; T190-A493 HydrophobicContact CG2-CB 3.59Å; T190-E494 HydrophobicContact CG2-CG 3.85Å; T190-E494 PolarHBondContact OG1-OE1 3.36Å; T190-F497 HydrophobicContact CG2-CD2 3.92Å; T190-F497 HydrophobicContact CG2-CE2 3.87Å
191	L	75.3	Confident	67.1	Low	42 Å²	42	94.5 Å²	94.5	22%	0.22	47%	0.466	C	S	.	.	H	α-helix	trans	-64.3	-46	175.6	-87.4	157	0	0	0	113.2	S187 A189 R193 L194 L195 I317 L486 V490	S187-L191 PolarHBondContact O-N 3.24Å; S187-L191 VanDerWaalsContact O-N 3.1Å; A189-L191 VanDerWaalsContact C-N 3.35Å; A189-L191 PolarHBondContact O-N 2.71Å; L191-R193 VanDerWaalsContact C-N 3.25Å; L191-R193 PolarHBondContact O-N 2.89Å; L191-L194 PolarHBondContact O-N 3.48Å; L191-L195 WeakPolarHBondContact O-CG 3.06Å; L191-L195 PolarHBondContact O-N 2.97Å; L191-I317 HydrophobicContact CD2-CG2 3.93Å; L191-L486 HydrophobicContact CD2-CD1 4.07Å; L191-V490 HydrophobicContact CD1-CG2 3.89Å; L191-V490 HydrophobicContact CG-CG2 3.94Å
192	G	76.6	Confident	69.9	Low	41 Å²	41	87.6 Å²	87.6	42%	0.423	44%	0.442	S	S	.	.	H	α-helix	trans	-60.3	-36	175.8	0	0	0	0	0	112.8	R188 A189 S196	R188-G192 PolarHBondContact O-N 3.3Å; A189-G192 PolarHBondContact O-N 3.38Å; G192-S196 PolarHBondContact O-N 3.41Å; G192-S196 VanDerWaalsContact O-N 3.14Å
193	R	80.1	Confident	72.7	Confident	89 Å²	89	83.9 Å²	83.9	34%	0.336	44%	0.441	S	S	.	.	H	α-helix	trans	-68.6	-44.2	175.2	-172.2	179.8	-167.3	146	1.4	112	A189 T190 L191 L195 S196 Y197 F497 D501	A189-R193 VanDerWaalsContact O-CB 3.28Å; A189-R193 WeakPolarHBondContact O-CB 3.07Å; A189-R193 PolarHBondContact O-N 2.99Å; T190-R193 PolarHBondContact O-N 3.29Å; L191-R193 VanDerWaalsContact C-N 3.25Å; L191-R193 PolarHBondContact O-N 2.89Å; R193-L195 VanDerWaalsContact C-N 3.3Å; R193-L195 PolarHBondContact O-N 2.96Å; R193-S196 WeakPolarHBondContact O-CA 3.44Å; R193-S196 VanDerWaalsContact O-CB 3.31Å; R193-S196 WeakPolarHBondContact O-CB 3.4Å; R193-S196 PolarHBondContact O-N 3.47Å; R193-S196 PolarHBondContact O-OG 3.31Å; R193-Y197 HydrophobicContact CG-CE2 4.23Å; R193-Y197 WeakPolarHBondContact O-CD2 3.45Å; R193-Y197 PolarHBondContact O-N 3.47Å; R193-F497 HydrophobicContact CB-CE2 4.29Å; R193-F497 HydrophobicContact CG-CE2 4.26Å; R193-F497 HydrophobicContact CG-CZ 4.16Å; R193-D501 IonicContact CZ-OD1 2.62Å; R193-D501 VanDerWaalsContact CZ-OD1 3.23Å; R193-D501 IonicContact CZ-OD2 2.67Å; R193-D501 VanDerWaalsContact CZ-OD2 3.27Å; R193-D501 IonicContact NH1-OD1 2.66Å; R193-D501 PolarHBondContact NH1-OD1 3.24Å; R193-D501 IonicContact NH1-OD2 2.57Å; R193-D501 PolarHBondContact NH1-OD2 3.46Å; R193-D501 IonicContact NH2-OD1 3.43Å; R193-D501 PolarHBondContact NH2-OD1 3.04Å; R193-D501 IonicContact NH2-OD2 3.53Å; R193-D501 PolarHBondContact NH2-OD2 3.11Å
194	L	80.1	Confident	75.4	Confident	6 Å²	6	77.7 Å²	77.7	3%	0.031	41%	0.413	C	S	.	.	H	α-helix	trans	-59.6	-43.2	175.4	-167.3	79.9	0	0	0	111.3	T190 L191 S196 Y197 C198 L274 L278 V313 I317 F497	T190-L194 PolarHBondContact O-N 2.81Å; L191-L194 PolarHBondContact O-N 3.48Å; L194-S196 PolarHBondContact O-N 3.16Å; L194-Y197 WeakPolarHBondContact O-CA 3.34Å; L194-Y197 WeakPolarHBondContact O-CB 3.43Å; L194-Y197 PolarHBondContact O-N 2.86Å; L194-C198 PolarHBondContact O-N 3.27Å; L194-C198 VanDerWaalsContact O-N 3.1Å; L194-L274 HydrophobicContact CD1-CD2 4.46Å; L194-L278 HydrophobicContact CD1-CD1 4.39Å; L194-V313 HydrophobicContact CD1-CG1 3.59Å; L194-I317 HydrophobicContact CD2-CB 3.86Å; L194-I317 HydrophobicContact CD2-CD1 3.58Å; L194-I317 HydrophobicContact CD2-CG1 4.33Å; L194-I317 HydrophobicContact CD2-CG2 3.48Å; L194-I317 VanDerWaalsContact CD2-CG2 3.48Å; L194-F497 HydrophobicContact CD1-CZ 4.24Å
195	L	76.2	Confident	77.8	Confident	115 Å²	115	70.8 Å²	70.8	60%	0.602	39%	0.385	S	S	*	.	H	α-helix	trans	-57.8	-33.5	173.4	-74.6	162.7	0	0	0	112.4	L191 R193 Y197 C198 R199	L191-L195 WeakPolarHBondContact O-CG 3.06Å; L191-L195 PolarHBondContact O-N 2.97Å; R193-L195 VanDerWaalsContact C-N 3.3Å; R193-L195 PolarHBondContact O-N 2.96Å; L195-Y197 VanDerWaalsContact C-N 3.33Å; L195-Y197 PolarHBondContact O-N 2.9Å; L195-C198 WeakPolarHBondContact O-CB 3.27Å; L195-C198 PolarHBondContact O-N 3.31Å; L195-R199 PolarHBondContact O-N 2.93Å; L195-R199 VanDerWaalsContact O-N 3.12Å
196	S	82.7	Confident	79.8	Confident	71 Å²	71	70.1 Å²	70.1	50%	0.497	38%	0.384	S	S	.	.	H	α-helix	trans	-65	-33.6	173.8	84.5	0	0	0	0	113.1	G192 R193 L194 R199	G192-S196 PolarHBondContact O-N 3.41Å; G192-S196 VanDerWaalsContact O-N 3.14Å; R193-S196 WeakPolarHBondContact O-CA 3.44Å; R193-S196 VanDerWaalsContact O-CB 3.31Å; R193-S196 WeakPolarHBondContact O-CB 3.4Å; R193-S196 PolarHBondContact O-N 3.47Å; R193-S196 PolarHBondContact O-OG 3.31Å; L194-S196 PolarHBondContact O-N 3.16Å; S196-R199 VanDerWaalsContact O-CB 3.3Å; S196-R199 WeakPolarHBondContact O-CB 3.36Å; S196-R199 PolarHBondContact O-N 3.15Å
197	Y	81.6	Confident	81.3	Confident	29 Å²	29	69.6 Å²	69.6	11%	0.114	37%	0.374	C	S	.	.	H	α-helix	trans	-69.5	-37	171.3	-76.4	-84.3	0	0	0	111.9	R193 L194 L195 R199 R277 L278 R281 F497 L500	R193-Y197 HydrophobicContact CG-CE2 4.23Å; R193-Y197 WeakPolarHBondContact O-CD2 3.45Å; R193-Y197 PolarHBondContact O-N 3.47Å; L194-Y197 WeakPolarHBondContact O-CA 3.34Å; L194-Y197 WeakPolarHBondContact O-CB 3.43Å; L194-Y197 PolarHBondContact O-N 2.86Å; L195-Y197 VanDerWaalsContact C-N 3.33Å; L195-Y197 PolarHBondContact O-N 2.9Å; Y197-R199 PolarHBondContact O-N 3.06Å; Y197-R277 PolarHBondContact O-NH1 3.41Å; Y197-L278 HydrophobicContact CD1-CD2 4.47Å; Y197-R281 PolarHBondContact OH-NH1 3.18Å; Y197-F497 HydrophobicContact CD2-CE1 4.42Å; Y197-F497 AromaticContact CE2-CE1 3.93Å; Y197-F497 HydrophobicContact CE2-CE1 3.93Å; Y197-F497 HydrophobicContact CE2-CZ 4.39Å; Y197-L500 VanDerWaalsContact OH-CD2 3.28Å; Y197-L500 WeakPolarHBondContact OH-CD2 3.49Å
198	C	81.9	Confident	82.6	Confident	12 Å²	12	67.4 Å²	67.4	8%	0.081	36%	0.36	C	S	.	.	H	α-helix	trans	-66.3	-21.9	175.3	-63.9	0	0	0	0	113.7	L194 L195 K200 D201 A202 L205	L194-C198 PolarHBondContact O-N 3.27Å; L194-C198 VanDerWaalsContact O-N 3.1Å; L195-C198 WeakPolarHBondContact O-CB 3.27Å; L195-C198 PolarHBondContact O-N 3.31Å; C198-K200 PolarHBondContact O-N 3.11Å; C198-D201 PolarHBondContact O-N 2.87Å; C198-A202 PolarHBondContact O-N 3.46Å; C198-L205 HydrophobicContact CB-CD1 3.88Å
199	R	82.6	Confident	83.6	Confident	205 Å²	205	60.2 Å²	60.2	77%	0.774	34%	0.339	S	S	*	.	G	3₁₀ helix	trans	-53.7	-28.5	-178	-169.3	174.7	179.6	169.2	0.5	114.6	L195 S196 Y197 D201 A202	L195-R199 PolarHBondContact O-N 2.93Å; L195-R199 VanDerWaalsContact O-N 3.12Å; S196-R199 VanDerWaalsContact O-CB 3.3Å; S196-R199 WeakPolarHBondContact O-CB 3.36Å; S196-R199 PolarHBondContact O-N 3.15Å; Y197-R199 PolarHBondContact O-N 3.06Å; R199-D201 VanDerWaalsContact C-N 3.33Å; R199-D201 PolarHBondContact O-N 3.05Å; R199-A202 VanDerWaalsContact O-CB 3.24Å; R199-A202 WeakPolarHBondContact O-CB 3.36Å; R199-A202 PolarHBondContact O-N 2.99Å
200	K	83.6	Confident	84.5	Confident	183 Å²	183	62 Å²	62	80%	0.796	34%	0.341	S	S	*	.	G	3₁₀ helix	trans	-68.4	-27.4	176.6	-69	-167.7	175.6	-170.9	0	113.9	C198	C198-K200 PolarHBondContact O-N 3.11Å
201	D	87.1	Confident	85.3	Confident	14 Å²	14	64.5 Å²	64.5	8%	0.075	35%	0.351	C	S	.	.	G	3₁₀ helix	trans	-103.6	21	175.9	-71.5	-61	0	0	0	111.4	C198 R199 G203 L204 L205 T270 R273 R277	C198-D201 PolarHBondContact O-N 2.87Å; R199-D201 VanDerWaalsContact C-N 3.33Å; R199-D201 PolarHBondContact O-N 3.05Å; D201-G203 PolarHBondContact O-N 2.9Å; D201-G203 VanDerWaalsContact O-N 3.12Å; D201-L204 PolarHBondContact O-N 3.42Å; D201-L205 PolarHBondContact O-N 2.99Å; D201-T270 HydrophobicContact CB-CG2 3.71Å; D201-R273 WeakPolarHBondContact OD1-CD 3.21Å; D201-R273 IonicContact OD1-CZ 3.6Å; D201-R273 IonicContact OD1-NH1 3.51Å; D201-R273 PolarHBondContact OD1-NH1 3.05Å; D201-R277 IonicContact OD2-CZ 2.69Å; D201-R277 IonicContact OD2-NE 2.78Å; D201-R277 IonicContact OD2-NH2 3.85Å; D201-R277 PolarHBondContact OD2-NH2 3.48Å
202	A	85.7	Confident	86.2	Confident	49 Å²	49	62.6 Å²	62.6	41%	0.405	34%	0.341	S	S	.	.	H	α-helix	trans	-55.5	-33.3	-175.6	0	0	0	0	0	114	C198 R199 L205 S206	C198-A202 PolarHBondContact O-N 3.46Å; R199-A202 VanDerWaalsContact O-CB 3.24Å; R199-A202 WeakPolarHBondContact O-CB 3.36Å; R199-A202 PolarHBondContact O-N 2.99Å; A202-L205 PolarHBondContact O-N 3.03Å; A202-S206 PolarHBondContact O-N 2.74Å; A202-S206 PolarHBondContact O-OG 3.01Å
203	G	90.1	Very high	87	Confident	52 Å²	52	64.4 Å²	64.4	54%	0.536	34%	0.341	S	S	.	.	H	α-helix	trans	-65.1	-41.4	175.1	0	0	0	0	0	113.4	D201 S206 L207	D201-G203 PolarHBondContact O-N 2.9Å; D201-G203 VanDerWaalsContact O-N 3.12Å; G203-S206 WeakPolarHBondContact CA-OG 3.31Å; G203-S206 PolarHBondContact O-N 3.38Å; G203-S206 PolarHBondContact O-OG 3.45Å; G203-L207 PolarHBondContact O-N 3.19Å; G203-L207 VanDerWaalsContact O-N 3.09Å
204	L	89.8	Confident	87.6	Confident	46 Å²	46	63.2 Å²	63.2	24%	0.241	34%	0.34	C	S	.	.	H	α-helix	trans	-68	-38.9	174.7	-68.5	177	0	0	0	110.9	D201 L207 A208 V266	D201-L204 PolarHBondContact O-N 3.42Å; L204-L207 WeakPolarHBondContact O-CB 3.38Å; L204-L207 PolarHBondContact O-N 3.41Å; L204-A208 PolarHBondContact O-N 3.17Å; L204-V266 HydrophobicContact CB-CG1 3.93Å; L204-V266 HydrophobicContact CD2-CG1 4.27Å; L204-V266 VanDerWaalsContact O-CG1 3.23Å; L204-V266 WeakPolarHBondContact O-CG1 3.46Å
205	L	88.4	Confident	88.3	Confident	41 Å²	41	62.9 Å²	62.9	22%	0.215	34%	0.339	C	S	.	.	H	α-helix	trans	-65.2	-40	174.8	-69.2	171.4	0	0	0	112.4	C198 D201 A202 L207 A208 V209 F267 T270 M271	C198-L205 HydrophobicContact CB-CD1 3.88Å; D201-L205 PolarHBondContact O-N 2.99Å; A202-L205 PolarHBondContact O-N 3.03Å; L205-L207 VanDerWaalsContact C-N 3.3Å; L205-L207 PolarHBondContact O-N 3.34Å; L205-A208 PolarHBondContact O-N 3.11Å; L205-V209 WeakPolarHBondContact O-CG2 3.37Å; L205-V209 PolarHBondContact O-N 3.39Å; L205-F267 HydrophobicContact CD2-CD2 4.37Å; L205-F267 HydrophobicContact CD2-CE2 4.24Å; L205-T270 HydrophobicContact CD1-CG2 4.43Å; L205-T270 HydrophobicContact CD2-CG2 3.93Å; L205-T270 HydrophobicContact CG-CG2 4.06Å; L205-M271 HydrophobicContact CD2-CE 4.04Å
206	S	88.7	Confident	89	Confident	75 Å²	75	57.6 Å²	57.6	52%	0.524	31%	0.311	S	S	.	.	H	α-helix	trans	-63.6	-36.7	173.9	56.2	0	0	0	0	112.4	A202 G203 V209 L210	A202-S206 PolarHBondContact O-N 2.74Å; A202-S206 PolarHBondContact O-OG 3.01Å; G203-S206 WeakPolarHBondContact CA-OG 3.31Å; G203-S206 PolarHBondContact O-N 3.38Å; G203-S206 PolarHBondContact O-OG 3.45Å; S206-V209 PolarHBondContact O-N 3.37Å; S206-L210 PolarHBondContact O-N 3.49Å
207	L	92.6	Very high	89.4	Confident	69 Å²	69	58 Å²	58	36%	0.361	31%	0.311	S	S	.	.	H	α-helix	trans	-65.2	-43.8	174.2	-171.9	65.6	0	0	0	111.3	G203 L204 L205 V209 L210 F211 V266	G203-L207 PolarHBondContact O-N 3.19Å; G203-L207 VanDerWaalsContact O-N 3.09Å; L204-L207 WeakPolarHBondContact O-CB 3.38Å; L204-L207 PolarHBondContact O-N 3.41Å; L205-L207 VanDerWaalsContact C-N 3.3Å; L205-L207 PolarHBondContact O-N 3.34Å; L207-V209 VanDerWaalsContact C-N 3.34Å; L207-V209 PolarHBondContact O-N 2.8Å; L207-L210 WeakPolarHBondContact O-CB 3.35Å; L207-L210 PolarHBondContact O-N 2.96Å; L207-F211 HydrophobicContact CD1-CD2 4.11Å; L207-F211 HydrophobicContact CD1-CE2 3.7Å; L207-F211 HydrophobicContact CG-CD2 4.09Å; L207-F211 HydrophobicContact CG-CE2 3.99Å; L207-F211 WeakPolarHBondContact O-CD2 3.36Å; L207-F211 PolarHBondContact O-N 2.86Å; L207-V266 HydrophobicContact CD2-CG2 4.33Å
208	A	91.6	Very high	89.9	Confident	5 Å²	5	57.4 Å²	57.4	4%	0.041	31%	0.311	C	S	.	.	H	α-helix	trans	-62.8	-38.4	175.8	0	0	0	0	0	112.5	L204 L205 L212 R263 V266	L204-A208 PolarHBondContact O-N 3.17Å; L205-A208 PolarHBondContact O-N 3.11Å; A208-L212 WeakPolarHBondContact O-CB 3.24Å; A208-L212 PolarHBondContact O-N 2.98Å; A208-R263 HydrophobicContact CB-CG 4.44Å; A208-V266 HydrophobicContact CB-CG1 4.1Å
209	V	90.4	Very high	90.3	Very high	61 Å²	61	58 Å²	58	37%	0.37	31%	0.312	S	S	.	.	H	α-helix	trans	-68.8	-36.7	174.9	172.6	0	0	0	0	111.8	L205 S206 L207 L212 L213 L325	L205-V209 WeakPolarHBondContact O-CG2 3.37Å; L205-V209 PolarHBondContact O-N 3.39Å; S206-V209 PolarHBondContact O-N 3.37Å; L207-V209 VanDerWaalsContact C-N 3.34Å; L207-V209 PolarHBondContact O-N 2.8Å; V209-L212 WeakPolarHBondContact O-CB 3.43Å; V209-L212 PolarHBondContact O-N 3.15Å; V209-L213 HydrophobicContact CG1-CD1 4.4Å; V209-L213 WeakPolarHBondContact O-CG 3.48Å; V209-L213 PolarHBondContact O-N 3.3Å; V209-L325 HydrophobicContact CG2-CD2 4.09Å
210	L	92.9	Very high	90.8	Very high	94 Å²	94	48.6 Å²	48.6	49%	0.492	28%	0.278	S	S	.	.	H	α-helix	trans	-61.1	-50.3	173.5	179.4	64.6	0	0	0	111.3	S206 L207 L212 L213 I214	S206-L210 PolarHBondContact O-N 3.49Å; L207-L210 WeakPolarHBondContact O-CB 3.35Å; L207-L210 PolarHBondContact O-N 2.96Å; L210-L212 VanDerWaalsContact C-N 3.28Å; L210-L212 PolarHBondContact O-N 2.96Å; L210-L213 PolarHBondContact O-N 2.84Å; L210-I214 HydrophobicContact CD1-CD1 4.49Å; L210-I214 HydrophobicContact CG-CD1 4.2Å; L210-I214 WeakPolarHBondContact O-CG1 3.15Å; L210-I214 PolarHBondContact O-N 3.09Å
211	F	94.3	Very high	91.2	Very high	55 Å²	55	43.5 Å²	43.5	24%	0.241	26%	0.256	C	S	.	.	H	α-helix	trans	-66.7	-29.3	176.1	-78.6	-71	0	0	0	113	L207 I214 S215 A259 V262 R263	L207-F211 HydrophobicContact CD1-CD2 4.11Å; L207-F211 HydrophobicContact CD1-CE2 3.7Å; L207-F211 HydrophobicContact CG-CD2 4.09Å; L207-F211 HydrophobicContact CG-CE2 3.99Å; L207-F211 WeakPolarHBondContact O-CD2 3.36Å; L207-F211 PolarHBondContact O-N 2.86Å; F211-I214 HydrophobicContact CD1-CD1 4.19Å; F211-I214 HydrophobicContact CE1-CD1 4.47Å; F211-I214 PolarHBondContact O-N 3.11Å; F211-S215 WeakPolarHBondContact O-CB 3.43Å; F211-S215 PolarHBondContact O-N 2.92Å; F211-S215 PolarHBondContact O-OG 3.32Å; F211-A259 HydrophobicContact CB-CB 4.46Å; F211-A259 HydrophobicContact CD1-CB 3.89Å; F211-V262 HydrophobicContact CD1-CB 4.42Å; F211-V262 HydrophobicContact CD1-CG1 4.48Å; F211-V262 HydrophobicContact CD2-CB 4.31Å; F211-V262 HydrophobicContact CD2-CG1 3.59Å; F211-V262 HydrophobicContact CE1-CB 4.48Å; F211-V262 HydrophobicContact CE1-CG1 4.39Å; F211-V262 HydrophobicContact CE2-CB 4.38Å; F211-V262 HydrophobicContact CE2-CG1 3.49Å; F211-V262 VanDerWaalsContact CE2-CG1 3.49Å; F211-V262 HydrophobicContact CG-CB 4.33Å; F211-V262 HydrophobicContact CG-CG1 4.11Å; F211-V262 HydrophobicContact CZ-CB 4.47Å; F211-V262 HydrophobicContact CZ-CG1 3.92Å; F211-R263 HydrophobicContact CB-CB 4.02Å
212	L	93	Very high	91.4	Very high	2 Å²	2	44.1 Å²	44.1	1%	0.01	26%	0.259	C	S	.	.	H	α-helix	trans	-60.3	-50.2	170.3	-176.5	68.5	0	0	0	111.3	A208 V209 L210 I214 S215 A216 R263 L325 R326 I329	A208-L212 WeakPolarHBondContact O-CB 3.24Å; A208-L212 PolarHBondContact O-N 2.98Å; V209-L212 WeakPolarHBondContact O-CB 3.43Å; V209-L212 PolarHBondContact O-N 3.15Å; L210-L212 VanDerWaalsContact C-N 3.28Å; L210-L212 PolarHBondContact O-N 2.96Å; L212-I214 PolarHBondContact O-N 2.83Å; L212-S215 PolarHBondContact O-N 3.12Å; L212-S215 PolarHBondContact O-OG 3.22Å; L212-A216 WeakPolarHBondContact O-CB 3.46Å; L212-A216 PolarHBondContact O-N 3.45Å; L212-R263 VanDerWaalsContact CD1-CD 3.47Å; L212-L325 HydrophobicContact CD2-CB 3.98Å; L212-L325 HydrophobicContact CD2-CD2 3.62Å; L212-L325 HydrophobicContact CD2-CG 3.55Å; L212-R326 HydrophobicContact CD1-CB 3.77Å; L212-R326 HydrophobicContact CD1-CG 4.29Å; L212-I329 HydrophobicContact CD2-CD1 3.88Å; L212-I329 HydrophobicContact CG-CD1 4.37Å
213	L	92.9	Very high	91.8	Very high	80 Å²	80	41.9 Å²	41.9	42%	0.419	24%	0.241	S	C	.	.	H	α-helix	trans	-59.7	-44.8	177.4	-71	166.6	0	0	0	111.5	V209 L210 A216 V217 I329	V209-L213 HydrophobicContact CG1-CD1 4.4Å; V209-L213 WeakPolarHBondContact O-CG 3.48Å; V209-L213 PolarHBondContact O-N 3.3Å; L210-L213 PolarHBondContact O-N 2.84Å; L213-A216 PolarHBondContact O-N 3.04Å; L213-V217 WeakPolarHBondContact O-CB 3.36Å; L213-V217 VanDerWaalsContact O-CG2 3.29Å; L213-V217 WeakPolarHBondContact O-CG2 3.18Å; L213-V217 PolarHBondContact O-N 2.86Å; L213-I329 HydrophobicContact CD2-CD1 3.98Å; L213-I329 HydrophobicContact CD2-CG2 4.24Å
214	I	93.8	Very high	91.9	Very high	63 Å²	63	41.4 Å²	41.4	32%	0.323	23%	0.225	S	C	.	.	H	α-helix	trans	-58.2	-51.7	176.1	-65.7	165.3	0	0	0	110.6	L210 F211 L212 A216 V217 C218 V255 A259	L210-I214 HydrophobicContact CD1-CD1 4.49Å; L210-I214 HydrophobicContact CG-CD1 4.2Å; L210-I214 WeakPolarHBondContact O-CG1 3.15Å; L210-I214 PolarHBondContact O-N 3.09Å; F211-I214 HydrophobicContact CD1-CD1 4.19Å; F211-I214 HydrophobicContact CE1-CD1 4.47Å; F211-I214 PolarHBondContact O-N 3.11Å; L212-I214 PolarHBondContact O-N 2.83Å; I214-A216 PolarHBondContact O-N 2.95Å; I214-V217 PolarHBondContact O-N 2.94Å; I214-C218 PolarHBondContact O-N 3.42Å; I214-C218 PolarHBondContact O-SG 3.5Å; I214-V255 HydrophobicContact CG2-CG1 4.19Å; I214-A259 HydrophobicContact CB-CB 4.36Å; I214-A259 HydrophobicContact CG2-CB 4.01Å
215	S	94	Very high	92	Very high	0 Å²	0	42 Å²	42	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-60.7	-44.6	178.9	61.4	0	0	0	0	112.8	F211 L212 V217 C218 E219	F211-S215 WeakPolarHBondContact O-CB 3.43Å; F211-S215 PolarHBondContact O-N 2.92Å; F211-S215 PolarHBondContact O-OG 3.32Å; L212-S215 PolarHBondContact O-N 3.12Å; L212-S215 PolarHBondContact O-OG 3.22Å; S215-V217 PolarHBondContact O-N 2.97Å; S215-C218 PolarHBondContact O-N 2.89Å; S215-E219 WeakPolarHBondContact O-CB 3.33Å; S215-E219 WeakPolarHBondContact O-CG 3.2Å; S215-E219 PolarHBondContact O-N 2.97Å
216	A	91.8	Very high	92	Very high	3 Å²	3	45.7 Å²	45.7	3%	0.025	24%	0.237	C	C	.	.	H	α-helix	trans	-65.9	-39	-179.4	0	0	0	0	0	112.8	L212 L213 I214 A220 I329 K330	L212-A216 WeakPolarHBondContact O-CB 3.46Å; L212-A216 PolarHBondContact O-N 3.45Å; L213-A216 PolarHBondContact O-N 3.04Å; I214-A216 PolarHBondContact O-N 2.95Å; A216-A220 VanDerWaalsContact O-CB 3.25Å; A216-A220 WeakPolarHBondContact O-CB 3.46Å; A216-A220 PolarHBondContact O-N 3.04Å; A216-I329 HydrophobicContact CB-CB 4.46Å; A216-I329 HydrophobicContact CB-CG2 3.66Å; A216-K330 HydrophobicContact CB-CG 3.75Å
217	V	91.5	Very high	92	Very high	80 Å²	80	42.1 Å²	42.1	49%	0.485	21%	0.212	S	C	.	.	H	α-helix	trans	-66.8	-46.6	174.5	171.7	0	0	0	0	110.7	L213 I214 S215 E219 A220 F221	L213-V217 WeakPolarHBondContact O-CB 3.36Å; L213-V217 VanDerWaalsContact O-CG2 3.29Å; L213-V217 WeakPolarHBondContact O-CG2 3.18Å; L213-V217 PolarHBondContact O-N 2.86Å; I214-V217 PolarHBondContact O-N 2.94Å; S215-V217 PolarHBondContact O-N 2.97Å; V217-E219 PolarHBondContact O-N 2.96Å; V217-A220 PolarHBondContact O-N 2.85Å; V217-F221 HydrophobicContact CG1-CD2 4.13Å; V217-F221 HydrophobicContact CG1-CE2 3.86Å; V217-F221 WeakPolarHBondContact O-CD2 3.21Å; V217-F221 PolarHBondContact O-N 3.26Å
218	C	92.3	Very high	91.8	Very high	16 Å²	16	43.3 Å²	43.3	11%	0.108	21%	0.214	C	C	.	.	H	α-helix	trans	-59.3	-47.8	178.1	-70.5	0	0	0	0	111.9	I214 S215 A220 F221 I222 L252	I214-C218 PolarHBondContact O-N 3.42Å; I214-C218 PolarHBondContact O-SG 3.5Å; S215-C218 PolarHBondContact O-N 2.89Å; C218-A220 PolarHBondContact O-N 3.12Å; C218-F221 PolarHBondContact O-N 3Å; C218-F221 VanDerWaalsContact O-N 3.16Å; C218-I222 PolarHBondContact O-N 3.34Å; C218-L252 HydrophobicContact CB-CD2 4.2Å
219	E	90.4	Very high	91.7	Very high	25 Å²	25	43.4 Å²	43.4	12%	0.117	22%	0.215	C	C	.	.	H	α-helix	trans	-65.8	-35.8	178.1	-70.3	173.5	-107.1	0	0	112.6	S215 V217 F221 I222 P223 K330	S215-E219 WeakPolarHBondContact O-CB 3.33Å; S215-E219 WeakPolarHBondContact O-CG 3.2Å; S215-E219 PolarHBondContact O-N 2.97Å; V217-E219 PolarHBondContact O-N 2.96Å; E219-F221 PolarHBondContact O-N 2.79Å; E219-F221 VanDerWaalsContact O-N 3.15Å; E219-I222 HydrophobicContact CG-CD1 4.3Å; E219-I222 PolarHBondContact O-N 3.32Å; E219-P223 VanDerWaalsContact O-CD 3.23Å; E219-P223 WeakPolarHBondContact O-CD 3.33Å; E219-K330 WeakPolarHBondContact OE1-CE 3.3Å; E219-K330 IonicContact OE1-NZ 2.79Å; E219-K330 PolarHBondContact OE1-NZ 2.87Å; E219-K330 WeakPolarHBondContact OE2-CE 3.49Å; E219-K330 IonicContact OE2-NZ 4Å; E219-K330 PolarHBondContact OE2-NZ 3.42Å
220	A	91.4	Very high	91.5	Very high	7 Å²	7	42.8 Å²	42.8	6%	0.058	21%	0.209	C	C	.	.	H	α-helix	trans	-61.3	-22.5	173.9	0	0	0	0	0	113.7	A216 V217 C218 F334 F337 Y468	A216-A220 VanDerWaalsContact O-CB 3.25Å; A216-A220 WeakPolarHBondContact O-CB 3.46Å; A216-A220 PolarHBondContact O-N 3.04Å; V217-A220 PolarHBondContact O-N 2.85Å; C218-A220 PolarHBondContact O-N 3.12Å; A220-F334 HydrophobicContact CB-CE1 4.48Å; A220-F337 HydrophobicContact CB-CD2 4.3Å; A220-F337 HydrophobicContact CB-CE2 3.92Å; A220-Y468 VanDerWaalsContact O-CE1 3.3Å; A220-Y468 WeakPolarHBondContact O-CE1 3.4Å; A220-Y468 PolarHBondContact O-OH 2.95Å
221	F	92.1	Very high	91.2	Very high	76 Å²	76	40 Å²	40	33%	0.333	20%	0.195	S	C	.	.	H	α-helix	trans	-88.6	-18.8	173.7	-78.1	-70.5	0	0	0	114.3	V217 C218 E219 L224 Y225 L252 F337	V217-F221 HydrophobicContact CG1-CD2 4.13Å; V217-F221 HydrophobicContact CG1-CE2 3.86Å; V217-F221 WeakPolarHBondContact O-CD2 3.21Å; V217-F221 PolarHBondContact O-N 3.26Å; C218-F221 PolarHBondContact O-N 3Å; C218-F221 VanDerWaalsContact O-N 3.16Å; E219-F221 PolarHBondContact O-N 2.79Å; E219-F221 VanDerWaalsContact O-N 3.15Å; F221-L224 PolarHBondContact O-N 2.84Å; F221-Y225 HydrophobicContact CB-CD2 4.33Å; F221-Y225 HydrophobicContact CB-CE2 4.24Å; F221-Y225 VanDerWaalsContact O-CD2 3.32Å; F221-Y225 WeakPolarHBondContact O-CD2 3.05Å; F221-Y225 PolarHBondContact O-N 2.95Å; F221-L252 HydrophobicContact CB-CD1 3.92Å; F221-F337 HydrophobicContact CD1-CE1 4.31Å; F221-F337 AromaticContact CD1-CZ 3.92Å; F221-F337 HydrophobicContact CD1-CZ 3.92Å; F221-F337 AromaticContact CE1-CE1 3.98Å; F221-F337 HydrophobicContact CE1-CE1 3.98Å; F221-F337 AromaticContact CE1-CZ 3.57Å; F221-F337 HydrophobicContact CE1-CZ 3.57Å; F221-F337 AromaticContact CZ-CZ 3.91Å; F221-F337 HydrophobicContact CZ-CZ 3.91Å
222	I	92.7	Very high	90.6	Very high	28 Å²	28	38 Å²	38	14%	0.144	19%	0.188	C	C	.	.	H	α-helix	trans	-58.9	-50.5	-174.3	-73.7	174.7	0	0	0	112.3	C218 E219 L224 Y225 Y226 L249 L252 A253	C218-I222 PolarHBondContact O-N 3.34Å; E219-I222 HydrophobicContact CG-CD1 4.3Å; E219-I222 PolarHBondContact O-N 3.32Å; I222-L224 VanDerWaalsContact C-N 3.32Å; I222-L224 PolarHBondContact O-N 3.02Å; I222-Y225 PolarHBondContact O-N 2.94Å; I222-Y225 VanDerWaalsContact O-N 3.1Å; I222-Y226 HydrophobicContact CG2-CD2 3.74Å; I222-Y226 HydrophobicContact CG2-CE2 3.4Å; I222-Y226 VanDerWaalsContact CG2-CE2 3.4Å; I222-Y226 WeakPolarHBondContact O-CD2 3.48Å; I222-Y226 PolarHBondContact O-N 3.28Å; I222-Y226 VanDerWaalsContact O-N 3.1Å; I222-L249 HydrophobicContact CB-CD2 4.43Å; I222-L249 HydrophobicContact CG2-CD2 3.99Å; I222-L249 WeakPolarHBondContact O-CD2 3.41Å; I222-L252 HydrophobicContact CG1-CB 4.21Å; I222-A253 HydrophobicContact CD1-CB 4.5Å
223	P	93.4	Very high	90.1	Very high	2 Å²	2	42.1 Å²	42.1	1%	0.013	21%	0.209	C	C	.	.	H	α-helix	trans	-60	-37.5	-179.5	-26.2	36.5	0	0	0	113.9	E219 Y225 Y226 G227 S464 I467 Y468	E219-P223 VanDerWaalsContact O-CD 3.23Å; E219-P223 WeakPolarHBondContact O-CD 3.33Å; P223-Y225 VanDerWaalsContact C-N 3.32Å; P223-Y225 PolarHBondContact O-N 3.31Å; P223-Y226 WeakPolarHBondContact O-CB 3.5Å; P223-Y226 PolarHBondContact O-N 3.32Å; P223-G227 PolarHBondContact O-N 3.17Å; P223-S464 PolarHBondContact O-OG 3.29Å; P223-S464 VanDerWaalsContact O-OG 3.12Å; P223-I467 HydrophobicContact CB-CB 4.04Å; P223-I467 HydrophobicContact CB-CG2 3.73Å; P223-I467 HydrophobicContact CG-CG2 3.73Å; P223-Y468 HydrophobicContact CB-CD1 3.77Å; P223-Y468 HydrophobicContact CB-CD2 3.95Å; P223-Y468 HydrophobicContact CB-CE1 3.65Å; P223-Y468 HydrophobicContact CB-CE2 3.82Å; P223-Y468 HydrophobicContact CB-CG 3.91Å; P223-Y468 HydrophobicContact CG-CD1 3.69Å; P223-Y468 HydrophobicContact CG-CE1 3.56Å; P223-Y468 HydrophobicContact CG-CG 4.29Å
224	L	91.6	Very high	89.5	Confident	41 Å²	41	42.3 Å²	42.3	22%	0.215	21%	0.213	C	C	.	.	H	α-helix	trans	-63.5	-34.6	176.4	175.9	155.2	0	0	0	113	F221 I222 K228 F337 Y468	F221-L224 PolarHBondContact O-N 2.84Å; I222-L224 VanDerWaalsContact C-N 3.32Å; I222-L224 PolarHBondContact O-N 3.02Å; L224-K228 HydrophobicContact CD2-CD 4.02Å; L224-K228 PolarHBondContact O-N 3.03Å; L224-F337 HydrophobicContact CD1-CD1 4.13Å; L224-F337 HydrophobicContact CD1-CE1 4.05Å; L224-Y468 HydrophobicContact CB-CE2 4.34Å; L224-Y468 WeakPolarHBondContact CB-OH 3.45Å; L224-Y468 PolarHBondContact N-OH 3.3Å
225	Y	91.3	Very high	88.7	Confident	59 Å²	59	43.8 Å²	43.8	23%	0.231	23%	0.225	C	C	.	.	H	α-helix	trans	-80	-26.3	175.3	-75.5	-77.6	0	0	0	113.1	F221 I222 P223 G227 K228 A229 T248 L252	F221-Y225 HydrophobicContact CB-CD2 4.33Å; F221-Y225 HydrophobicContact CB-CE2 4.24Å; F221-Y225 VanDerWaalsContact O-CD2 3.32Å; F221-Y225 WeakPolarHBondContact O-CD2 3.05Å; F221-Y225 PolarHBondContact O-N 2.95Å; I222-Y225 PolarHBondContact O-N 2.94Å; I222-Y225 VanDerWaalsContact O-N 3.1Å; P223-Y225 VanDerWaalsContact C-N 3.32Å; P223-Y225 PolarHBondContact O-N 3.31Å; Y225-G227 VanDerWaalsContact C-N 3.34Å; Y225-K228 HydrophobicContact CD1-CD 3.89Å; Y225-K228 HydrophobicContact CE1-CD 4.08Å; Y225-K228 PolarHBondContact O-N 3.34Å; Y225-A229 WeakPolarHBondContact O-CB 3.09Å; Y225-A229 PolarHBondContact O-N 3.1Å; Y225-T248 VanDerWaalsContact CD1-OG1 3.31Å; Y225-T248 WeakPolarHBondContact CD1-OG1 3.42Å; Y225-T248 WeakPolarHBondContact CE1-OG1 3.36Å; Y225-L252 HydrophobicContact CD2-CD1 3.66Å; Y225-L252 HydrophobicContact CE2-CD1 3.77Å
226	Y	90.1	Very high	87.7	Confident	118 Å²	118	48.8 Å²	48.8	46%	0.463	25%	0.248	S	C	.	.	H	α-helix	trans	-58.5	-46	167.1	-83.4	-64.3	0	0	0	111.1	I222 P223 A229 I230 L249 I467	I222-Y226 HydrophobicContact CG2-CD2 3.74Å; I222-Y226 HydrophobicContact CG2-CE2 3.4Å; I222-Y226 VanDerWaalsContact CG2-CE2 3.4Å; I222-Y226 WeakPolarHBondContact O-CD2 3.48Å; I222-Y226 PolarHBondContact O-N 3.28Å; I222-Y226 VanDerWaalsContact O-N 3.1Å; P223-Y226 WeakPolarHBondContact O-CB 3.5Å; P223-Y226 PolarHBondContact O-N 3.32Å; Y226-A229 PolarHBondContact O-N 2.75Å; Y226-I230 WeakPolarHBondContact O-CG1 3.32Å; Y226-I230 PolarHBondContact O-N 3.07Å; Y226-I230 VanDerWaalsContact O-N 3.15Å; Y226-L249 HydrophobicContact CD1-CD1 4.16Å; Y226-L249 HydrophobicContact CD2-CD2 4.27Å; Y226-L249 HydrophobicContact CE1-CD1 4.42Å; Y226-L249 HydrophobicContact CE2-CD2 4.41Å; Y226-L249 HydrophobicContact CG-CD1 4.47Å; Y226-L249 HydrophobicContact CG-CD2 4.44Å; Y226-I467 HydrophobicContact CD2-CD1 4.08Å; Y226-I467 HydrophobicContact CG-CD1 4.06Å
227	G	88.4	Confident	87	Confident	0 Å²	0	57 Å²	57	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-59.4	-48	173.9	0	0	0	0	0	113.9	P223 Y225 A229 I230 D231 G460 S464	P223-G227 PolarHBondContact O-N 3.17Å; Y225-G227 VanDerWaalsContact C-N 3.34Å; G227-A229 VanDerWaalsContact C-N 3.27Å; G227-A229 PolarHBondContact O-N 3.48Å; G227-I230 PolarHBondContact O-N 3.5Å; G227-D231 PolarHBondContact O-N 2.94Å; G227-G460 WeakPolarHBondContact CA-O 3.37Å; G227-G460 WeakPolarHBondContact O-CA 3.42Å; G227-S464 WeakPolarHBondContact CA-OG 3.47Å; G227-S464 PolarHBondContact N-OG 3.41Å
228	K	88.3	Confident	86.2	Confident	95 Å²	95	55 Å²	55	41%	0.413	28%	0.275	S	S	.	.	H	α-helix	trans	-59	-37	177.3	-73.5	178.3	177.1	177.8	0	113	L224 Y225 I230 S232 P245	L224-K228 HydrophobicContact CD2-CD 4.02Å; L224-K228 PolarHBondContact O-N 3.03Å; Y225-K228 HydrophobicContact CD1-CD 3.89Å; Y225-K228 HydrophobicContact CE1-CD 4.08Å; Y225-K228 PolarHBondContact O-N 3.34Å; K228-I230 VanDerWaalsContact C-N 3.33Å; K228-S232 WeakPolarHBondContact O-CB 3.06Å; K228-S232 PolarHBondContact O-N 3.12Å; K228-S232 PolarHBondContact O-OG 3.45Å; K228-P245 HydrophobicContact CB-CB 4.29Å; K228-P245 HydrophobicContact CB-CG 4.18Å
229	A	88.4	Confident	85.5	Confident	7 Å²	7	61.4 Å²	61.4	6%	0.058	31%	0.305	C	S	.	.	H	α-helix	trans	-63.9	-40.3	174.8	0	0	0	0	0	111.2	Y225 Y226 G227 S232 I233 F242 P245 V246	Y225-A229 WeakPolarHBondContact O-CB 3.09Å; Y225-A229 PolarHBondContact O-N 3.1Å; Y226-A229 PolarHBondContact O-N 2.75Å; G227-A229 VanDerWaalsContact C-N 3.27Å; G227-A229 PolarHBondContact O-N 3.48Å; A229-S232 WeakPolarHBondContact O-CB 3.42Å; A229-S232 PolarHBondContact O-N 3.42Å; A229-I233 WeakPolarHBondContact O-CG1 3.32Å; A229-I233 PolarHBondContact O-N 2.85Å; A229-F242 HydrophobicContact CB-CD2 4.28Å; A229-F242 HydrophobicContact CB-CE2 4.08Å; A229-P245 HydrophobicContact CB-CB 4.06Å; A229-V246 HydrophobicContact CB-CG2 4.38Å
230	I	87.4	Confident	85	Confident	48 Å²	48	66.1 Å²	66.1	25%	0.246	33%	0.328	C	S	.	.	H	α-helix	trans	-73.9	-44	179.4	-62.4	170.1	0	0	0	111.9	Y226 G227 K228 S232 I233 V234 I463	Y226-I230 WeakPolarHBondContact O-CG1 3.32Å; Y226-I230 PolarHBondContact O-N 3.07Å; Y226-I230 VanDerWaalsContact O-N 3.15Å; G227-I230 PolarHBondContact O-N 3.5Å; K228-I230 VanDerWaalsContact C-N 3.33Å; I230-S232 PolarHBondContact O-N 2.86Å; I230-I233 WeakPolarHBondContact O-CB 3.48Å; I230-I233 PolarHBondContact O-N 3.34Å; I230-V234 HydrophobicContact CG2-CG2 3.98Å; I230-V234 WeakPolarHBondContact O-CG2 3.35Å; I230-V234 PolarHBondContact O-N 3.17Å; I230-I463 HydrophobicContact CD1-CB 4.14Å; I230-I463 HydrophobicContact CD1-CD1 3.69Å; I230-I463 HydrophobicContact CD1-CG2 3.63Å; I230-I463 HydrophobicContact CG2-CD1 3.94Å
231	D	85.9	Confident	84.3	Confident	35 Å²	35	71.9 Å²	71.9	19%	0.187	35%	0.349	C	S	.	.	H	α-helix	trans	-58.2	-34.5	172.7	-79.6	-29.5	0	0	0	111	G227 I233 V235 S458 S459 G460	G227-D231 PolarHBondContact O-N 2.94Å; D231-I233 PolarHBondContact O-N 3.01Å; D231-V235 VanDerWaalsContact O-CB 3.25Å; D231-V235 WeakPolarHBondContact O-CB 3.47Å; D231-V235 WeakPolarHBondContact O-CG2 3.1Å; D231-V235 PolarHBondContact O-N 2.92Å; D231-S458 WeakPolarHBondContact OD1-CB 3.31Å; D231-S458 PolarHBondContact OD1-OG 3.01Å; D231-S458 WeakPolarHBondContact OD2-CB 3.43Å; D231-S458 PolarHBondContact OD2-OG 3.42Å; D231-S459 PolarHBondContact OD1-OG 3.08Å; D231-S459 VanDerWaalsContact OD1-OG 3.11Å; D231-G460 WeakPolarHBondContact OD1-CA 3.49Å; D231-G460 PolarHBondContact OD1-N 2.97Å
232	S	82.9	Confident	84	Confident	14 Å²	14	71.2 Å²	71.2	10%	0.098	35%	0.346	C	S	.	.	H	α-helix	trans	-67	-33.7	174.6	-57.5	0	0	0	0	113.3	K228 A229 I230 H236 Q237 Y241	K228-S232 WeakPolarHBondContact O-CB 3.06Å; K228-S232 PolarHBondContact O-N 3.12Å; K228-S232 PolarHBondContact O-OG 3.45Å; A229-S232 WeakPolarHBondContact O-CB 3.42Å; A229-S232 PolarHBondContact O-N 3.42Å; I230-S232 PolarHBondContact O-N 2.86Å; S232-H236 CarbonylContact O-C 3.6Å; S232-H236 PolarHBondContact O-N 3.22Å; S232-Q237 PolarHBondContact O-N 2.81Å; S232-Q237 VanDerWaalsContact O-N 3.07Å; S232-Y241 PolarHBondContact OG-O 3.36Å
233	I	82.3	Confident	83.7	Confident	88 Å²	88	72.4 Å²	72.4	45%	0.451	36%	0.36	S	S	.	.	H	α-helix	trans	-72.1	-51.3	173.5	-66.4	163.5	0	0	0	110.2	A229 I230 D231 Q237 F242	A229-I233 WeakPolarHBondContact O-CG1 3.32Å; A229-I233 PolarHBondContact O-N 2.85Å; I230-I233 WeakPolarHBondContact O-CB 3.48Å; I230-I233 PolarHBondContact O-N 3.34Å; D231-I233 PolarHBondContact O-N 3.01Å; I233-Q237 WeakPolarHBondContact O-CG 3.02Å; I233-Q237 PolarHBondContact O-N 3.34Å; I233-F242 HydrophobicContact CD1-CD2 3.9Å; I233-F242 HydrophobicContact CD1-CE2 3.58Å; I233-F242 HydrophobicContact CD1-CZ 4.34Å; I233-F242 HydrophobicContact CG1-CD2 3.71Å; I233-F242 HydrophobicContact CG1-CE2 3.94Å; I233-F242 HydrophobicContact CG1-CG 4.45Å
234	V	79.5	Confident	83.4	Confident	84 Å²	84	77.9 Å²	77.9	51%	0.509	38%	0.384	S	S	.	.	H	α-helix	trans	-73.8	-40.4	-169.9	176.4	0	0	0	0	112.1	I230	I230-V234 HydrophobicContact CG2-CG2 3.98Å; I230-V234 WeakPolarHBondContact O-CG2 3.35Å; I230-V234 PolarHBondContact O-N 3.17Å
235	V	76.1	Confident	83.3	Confident	94 Å²	94	76.7 Å²	76.7	57%	0.57	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102	-32.8	-171.1	-168.9	0	0	0	0	112.8	D231	D231-V235 VanDerWaalsContact O-CB 3.25Å; D231-V235 WeakPolarHBondContact O-CB 3.47Å; D231-V235 WeakPolarHBondContact O-CG2 3.1Å; D231-V235 PolarHBondContact O-N 2.92Å
236	H	73.6	Confident	83.2	Confident	105 Å²	105	76.6 Å²	76.6	49%	0.486	38%	0.384	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112.3	-13	-172.5	-67	-7	0	0	0	114.9	S232 S238 Y241	S232-H236 CarbonylContact O-C 3.6Å; S232-H236 PolarHBondContact O-N 3.22Å; H236-S238 VanDerWaalsContact O-CB 3.3Å; H236-S238 WeakPolarHBondContact O-CB 3.08Å; H236-S238 PolarHBondContact O-N 3.14Å; H236-S238 PolarHBondContact O-OG 3.02Å; H236-Y241 AromaticContact CD2-CD1 3.8Å
237	Q	76.3	Confident	83.3	Confident	174 Å²	174	74 Å²	74	81%	0.813	39%	0.386	S	S	*	.			trans	43.2	32.2	174.7	-64.7	-170.2	-11.7	0	0	115.6	S232 I233	S232-Q237 PolarHBondContact O-N 2.81Å; S232-Q237 VanDerWaalsContact O-N 3.07Å; I233-Q237 WeakPolarHBondContact O-CG 3.02Å; I233-Q237 PolarHBondContact O-N 3.34Å
238	S	76.5	Confident	83.5	Confident	38 Å²	38	76.1 Å²	76.1	27%	0.266	40%	0.399	S	S	.	.			trans	-134.9	132.2	-168.6	45.5	0	0	0	0	112.7	H236 E240 Y241 F242	H236-S238 VanDerWaalsContact O-CB 3.3Å; H236-S238 WeakPolarHBondContact O-CB 3.08Å; H236-S238 PolarHBondContact O-N 3.14Å; H236-S238 PolarHBondContact O-OG 3.02Å; S238-E240 VanDerWaalsContact C-N 3.29Å; S238-E240 PolarHBondContact O-N 3.5Å; S238-Y241 PolarHBondContact O-N 3Å; S238-Y241 VanDerWaalsContact OG-CD2 3.31Å; S238-Y241 WeakPolarHBondContact OG-CD2 3.28Å; S238-F242 PolarHBondContact O-N 3.03Å; S238-F242 VanDerWaalsContact O-N 3.15Å
239	M	77.3	Confident	83.7	Confident	151 Å²	151	72.6 Å²	72.6	74%	0.744	39%	0.385	S	S	*	.	H	α-helix	trans	-64.1	-30.4	-173.7	-73.3	-66.7	138.5	0	0	113.5	F242 A243	M239-F242 PolarHBondContact O-N 2.82Å; M239-F242 HydrophobicContact SD-CD1 4.38Å; M239-A243 WeakPolarHBondContact O-CB 3.28Å; M239-A243 PolarHBondContact O-N 2.79Å
240	E	78.5	Confident	83.9	Confident	125 Å²	125	75.2 Å²	75.2	58%	0.584	41%	0.406	S	S	*	.	H	α-helix	trans	-69.5	-38.3	178.9	-158.6	-161.9	143.9	0	0	112.6	S238 K244	S238-E240 VanDerWaalsContact C-N 3.29Å; S238-E240 PolarHBondContact O-N 3.5Å; E240-K244 WeakPolarHBondContact OE1-CE 3.33Å; E240-K244 IonicContact OE1-NZ 3.84Å; E240-K244 PolarHBondContact OE1-NZ 3Å
241	Y	77.6	Confident	84.2	Confident	127 Å²	127	75.9 Å²	75.9	50%	0.498	42%	0.416	S	S	.	.	H	α-helix	trans	-74	-30.4	176.4	-75.7	-90.7	0	0	0	111.9	S232 H236 S238 P245	S232-Y241 PolarHBondContact OG-O 3.36Å; H236-Y241 AromaticContact CD2-CD1 3.8Å; S238-Y241 PolarHBondContact O-N 3Å; S238-Y241 VanDerWaalsContact OG-CD2 3.31Å; S238-Y241 WeakPolarHBondContact OG-CD2 3.28Å; Y241-P245 WeakPolarHBondContact O-CD 3.29Å; Y241-P245 WeakPolarHBondContact O-CG 3.46Å
242	F	85.2	Confident	84.6	Confident	63 Å²	63	75.7 Å²	75.7	28%	0.276	41%	0.414	S	S	.	.	H	α-helix	trans	-74.7	-40.8	173.2	178.8	-112.3	0	0	0	113.5	A229 I233 S238 M239 K244 P245 V246	A229-F242 HydrophobicContact CB-CD2 4.28Å; A229-F242 HydrophobicContact CB-CE2 4.08Å; I233-F242 HydrophobicContact CD1-CD2 3.9Å; I233-F242 HydrophobicContact CD1-CE2 3.58Å; I233-F242 HydrophobicContact CD1-CZ 4.34Å; I233-F242 HydrophobicContact CG1-CD2 3.71Å; I233-F242 HydrophobicContact CG1-CE2 3.94Å; I233-F242 HydrophobicContact CG1-CG 4.45Å; S238-F242 PolarHBondContact O-N 3.03Å; S238-F242 VanDerWaalsContact O-N 3.15Å; M239-F242 PolarHBondContact O-N 2.82Å; M239-F242 HydrophobicContact SD-CD1 4.38Å; F242-K244 VanDerWaalsContact C-N 3.34Å; F242-K244 PolarHBondContact O-N 3.28Å; F242-P245 WeakPolarHBondContact O-CD 3.36Å; F242-V246 HydrophobicContact CD1-CG2 4.33Å; F242-V246 HydrophobicContact CD2-CG2 4.1Å; F242-V246 HydrophobicContact CE1-CG2 3.92Å; F242-V246 HydrophobicContact CE2-CG2 3.66Å; F242-V246 HydrophobicContact CG-CG2 4.42Å; F242-V246 HydrophobicContact CZ-CG2 3.58Å; F242-V246 WeakPolarHBondContact O-CG2 3.3Å; F242-V246 PolarHBondContact O-N 3.43Å
243	A	87	Confident	85	Confident	53 Å²	53	76.8 Å²	76.8	44%	0.438	43%	0.425	S	S	.	.	H	α-helix	trans	-64	-35.3	-175.5	0	0	0	0	0	113.3	M239 V246 A247	M239-A243 WeakPolarHBondContact O-CB 3.28Å; M239-A243 PolarHBondContact O-N 2.79Å; A243-V246 PolarHBondContact O-N 3.12Å; A243-A247 VanDerWaalsContact O-CB 3.31Å; A243-A247 WeakPolarHBondContact O-CB 3.25Å; A243-A247 PolarHBondContact O-N 3.38Å
244	K	88.1	Confident	85.6	Confident	117 Å²	117	77.7 Å²	77.7	51%	0.509	43%	0.43	S	S	.	.	H	α-helix	trans	-65	-54	-178.7	-70.3	166.9	-171.2	165.4	0	112.4	E240 F242 V246 A247 T248	E240-K244 WeakPolarHBondContact OE1-CE 3.33Å; E240-K244 IonicContact OE1-NZ 3.84Å; E240-K244 PolarHBondContact OE1-NZ 3Å; F242-K244 VanDerWaalsContact C-N 3.34Å; F242-K244 PolarHBondContact O-N 3.28Å; K244-V246 VanDerWaalsContact C-N 3.34Å; K244-V246 PolarHBondContact O-N 2.86Å; K244-A247 PolarHBondContact O-N 2.82Å; K244-T248 PolarHBondContact O-N 3.03Å; K244-T248 PolarHBondContact O-OG1 3.18Å
245	P	87.9	Confident	86.4	Confident	15 Å²	15	76.9 Å²	76.9	10%	0.097	43%	0.425	C	S	.	.	H	α-helix	trans	-53.9	-43.9	170.7	-28.1	34.9	0	0	0	114	K228 A229 Y241 F242 T248 L249	K228-P245 HydrophobicContact CB-CB 4.29Å; K228-P245 HydrophobicContact CB-CG 4.18Å; A229-P245 HydrophobicContact CB-CB 4.06Å; Y241-P245 WeakPolarHBondContact O-CD 3.29Å; Y241-P245 WeakPolarHBondContact O-CG 3.46Å; F242-P245 WeakPolarHBondContact O-CD 3.36Å; P245-T248 VanDerWaalsContact CA-OG1 3.31Å; P245-T248 WeakPolarHBondContact CA-OG1 3.14Å; P245-T248 PolarHBondContact O-N 2.66Å; P245-T248 PolarHBondContact O-OG1 3.33Å; P245-L249 WeakPolarHBondContact O-CG 3.42Å; P245-L249 PolarHBondContact O-N 3.09Å
246	V	90.6	Very high	87.3	Confident	58 Å²	58	72.7 Å²	72.7	35%	0.352	40%	0.4	S	S	.	.	H	α-helix	trans	-66.9	-41.1	-178.9	174.7	0	0	0	0	111.9	A229 F242 A243 K244 T248 L249 A250	A229-V246 HydrophobicContact CB-CG2 4.38Å; F242-V246 HydrophobicContact CD1-CG2 4.33Å; F242-V246 HydrophobicContact CD2-CG2 4.1Å; F242-V246 HydrophobicContact CE1-CG2 3.92Å; F242-V246 HydrophobicContact CE2-CG2 3.66Å; F242-V246 HydrophobicContact CG-CG2 4.42Å; F242-V246 HydrophobicContact CZ-CG2 3.58Å; F242-V246 WeakPolarHBondContact O-CG2 3.3Å; F242-V246 PolarHBondContact O-N 3.43Å; A243-V246 PolarHBondContact O-N 3.12Å; K244-V246 VanDerWaalsContact C-N 3.34Å; K244-V246 PolarHBondContact O-N 2.86Å; V246-T248 VanDerWaalsContact C-N 3.33Å; V246-T248 PolarHBondContact O-N 2.94Å; V246-L249 WeakPolarHBondContact O-CB 3.44Å; V246-L249 PolarHBondContact O-N 3.32Å; V246-A250 PolarHBondContact O-N 3.16Å
247	A	91.7	Very high	88.3	Confident	62 Å²	62	71.1 Å²	71.1	51%	0.512	40%	0.4	S	S	.	.	H	α-helix	trans	-63	-39	173.4	0	0	0	0	0	112	A243 K244 A250 S251	A243-A247 VanDerWaalsContact O-CB 3.31Å; A243-A247 WeakPolarHBondContact O-CB 3.25Å; A243-A247 PolarHBondContact O-N 3.38Å; K244-A247 PolarHBondContact O-N 2.82Å; A247-A250 PolarHBondContact O-N 3.47Å; A247-S251 PolarHBondContact O-N 2.93Å; A247-S251 PolarHBondContact O-OG 2.89Å
248	T	91.9	Very high	89.2	Confident	45 Å²	45	68.5 Å²	68.5	28%	0.276	39%	0.39	S	S	.	.	H	α-helix	trans	-69.1	-35	173.9	50.9	0	0	0	0	113.3	Y225 K244 P245 V246 S251 L252	Y225-T248 VanDerWaalsContact CD1-OG1 3.31Å; Y225-T248 WeakPolarHBondContact CD1-OG1 3.42Å; Y225-T248 WeakPolarHBondContact CE1-OG1 3.36Å; K244-T248 PolarHBondContact O-N 3.03Å; K244-T248 PolarHBondContact O-OG1 3.18Å; P245-T248 VanDerWaalsContact CA-OG1 3.31Å; P245-T248 WeakPolarHBondContact CA-OG1 3.14Å; P245-T248 PolarHBondContact O-N 2.66Å; P245-T248 PolarHBondContact O-OG1 3.33Å; V246-T248 VanDerWaalsContact C-N 3.33Å; V246-T248 PolarHBondContact O-N 2.94Å; T248-S251 PolarHBondContact O-N 3.3Å; T248-S251 PolarHBondContact O-OG 2.87Å; T248-S251 VanDerWaalsContact O-OG 3.05Å; T248-L252 WeakPolarHBondContact O-CB 3.24Å; T248-L252 VanDerWaalsContact O-CG 3.25Å; T248-L252 WeakPolarHBondContact O-CG 3.32Å; T248-L252 PolarHBondContact O-N 3.34Å
249	L	92.3	Very high	90.1	Very high	21 Å²	21	66.9 Å²	66.9	11%	0.11	38%	0.378	C	S	.	.	H	α-helix	trans	-61.9	-48.6	172.3	-80.2	165.3	0	0	0	111	I222 Y226 P245 V246 S251 L252 A253	I222-L249 HydrophobicContact CB-CD2 4.43Å; I222-L249 HydrophobicContact CG2-CD2 3.99Å; I222-L249 WeakPolarHBondContact O-CD2 3.41Å; Y226-L249 HydrophobicContact CD1-CD1 4.16Å; Y226-L249 HydrophobicContact CD2-CD2 4.27Å; Y226-L249 HydrophobicContact CE1-CD1 4.42Å; Y226-L249 HydrophobicContact CE2-CD2 4.41Å; Y226-L249 HydrophobicContact CG-CD1 4.47Å; Y226-L249 HydrophobicContact CG-CD2 4.44Å; P245-L249 WeakPolarHBondContact O-CG 3.42Å; P245-L249 PolarHBondContact O-N 3.09Å; V246-L249 WeakPolarHBondContact O-CB 3.44Å; V246-L249 PolarHBondContact O-N 3.32Å; L249-S251 VanDerWaalsContact C-N 3.34Å; L249-S251 PolarHBondContact O-N 2.88Å; L249-L252 PolarHBondContact O-N 2.77Å; L249-A253 VanDerWaalsContact O-CB 3.27Å; L249-A253 WeakPolarHBondContact O-CB 3.34Å; L249-A253 PolarHBondContact O-N 3.43Å
250	A	93	Very high	90.8	Very high	62 Å²	62	62.3 Å²	62.3	51%	0.512	36%	0.356	S	S	.	.	H	α-helix	trans	-60.5	-41.6	179.1	0	0	0	0	0	112.2	V246 A247 L254	V246-A250 PolarHBondContact O-N 3.16Å; A247-A250 PolarHBondContact O-N 3.47Å; A250-L254 WeakPolarHBondContact O-CB 3.38Å; A250-L254 PolarHBondContact O-N 3.49Å
251	S	93.6	Very high	91.5	Very high	63 Å²	63	59.6 Å²	59.6	44%	0.441	36%	0.355	S	S	.	.	H	α-helix	trans	-69.3	-41.8	177.3	69.6	0	0	0	0	112.7	A247 T248 L249 L254 V255	A247-S251 PolarHBondContact O-N 2.93Å; A247-S251 PolarHBondContact O-OG 2.89Å; T248-S251 PolarHBondContact O-N 3.3Å; T248-S251 PolarHBondContact O-OG 2.87Å; T248-S251 VanDerWaalsContact O-OG 3.05Å; L249-S251 VanDerWaalsContact C-N 3.34Å; L249-S251 PolarHBondContact O-N 2.88Å; S251-L254 PolarHBondContact O-N 3.24Å; S251-V255 WeakPolarHBondContact O-CB 3.43Å; S251-V255 VanDerWaalsContact O-CG2 3.31Å; S251-V255 WeakPolarHBondContact O-CG2 3.35Å; S251-V255 PolarHBondContact O-N 3.12Å
252	L	93.9	Very high	92.3	Very high	30 Å²	30	56.4 Å²	56.4	16%	0.157	35%	0.349	C	S	.	.	H	α-helix	trans	-63.1	-42.9	175.3	-74	171.5	0	0	0	112.1	C218 F221 I222 Y225 T248 L249 S256	C218-L252 HydrophobicContact CB-CD2 4.2Å; F221-L252 HydrophobicContact CB-CD1 3.92Å; I222-L252 HydrophobicContact CG1-CB 4.21Å; Y225-L252 HydrophobicContact CD2-CD1 3.66Å; Y225-L252 HydrophobicContact CE2-CD1 3.77Å; T248-L252 WeakPolarHBondContact O-CB 3.24Å; T248-L252 VanDerWaalsContact O-CG 3.25Å; T248-L252 WeakPolarHBondContact O-CG 3.32Å; T248-L252 PolarHBondContact O-N 3.34Å; L249-L252 PolarHBondContact O-N 2.77Å; L252-S256 WeakPolarHBondContact O-CB 3.45Å; L252-S256 PolarHBondContact O-N 3.44Å; L252-S256 PolarHBondContact O-OG 3.12Å
253	A	92.8	Very high	92.6	Very high	38 Å²	38	54.1 Å²	54.1	31%	0.314	34%	0.338	S	S	.	.	H	α-helix	trans	-66.1	-37.5	177.7	0	0	0	0	0	112.4	I222 L249 S256 S257	I222-A253 HydrophobicContact CD1-CB 4.5Å; L249-A253 VanDerWaalsContact O-CB 3.27Å; L249-A253 WeakPolarHBondContact O-CB 3.34Å; L249-A253 PolarHBondContact O-N 3.43Å; A253-S256 WeakPolarHBondContact CA-OG 3.4Å; A253-S256 PolarHBondContact O-OG 3.47Å; A253-S256 VanDerWaalsContact O-OG 3.06Å; A253-S257 WeakPolarHBondContact O-CB 3.33Å; A253-S257 PolarHBondContact O-N 2.92Å; A253-S257 PolarHBondContact O-OG 3.45Å
254	L	95.1	Very high	92.7	Very high	107 Å²	107	52.8 Å²	52.8	56%	0.56	33%	0.329	S	S	*	.	H	α-helix	trans	-69.6	-45	176.3	-173.2	142.1	0	0	0	111.5	A250 S251 S257 M258	A250-L254 WeakPolarHBondContact O-CB 3.38Å; A250-L254 PolarHBondContact O-N 3.49Å; S251-L254 PolarHBondContact O-N 3.24Å; L254-S257 PolarHBondContact O-N 3.35Å; L254-M258 HydrophobicContact CD2-SD 3.7Å; L254-M258 WeakPolarHBondContact O-CG 3.45Å; L254-M258 PolarHBondContact O-N 3.17Å
255	V	95.6	Very high	92.9	Very high	67 Å²	67	49.3 Å²	49.3	41%	0.406	33%	0.327	S	S	.	.	H	α-helix	trans	-64.7	-43.2	176.6	172.6	0	0	0	0	111.5	I214 S251 M258 A259	I214-V255 HydrophobicContact CG2-CG1 4.19Å; S251-V255 WeakPolarHBondContact O-CB 3.43Å; S251-V255 VanDerWaalsContact O-CG2 3.31Å; S251-V255 WeakPolarHBondContact O-CG2 3.35Å; S251-V255 PolarHBondContact O-N 3.12Å; V255-M258 PolarHBondContact O-N 3.4Å; V255-A259 WeakPolarHBondContact O-CB 3.36Å; V255-A259 PolarHBondContact O-N 3.41Å
256	S	94.2	Very high	93	Very high	6 Å²	6	49.6 Å²	49.6	4%	0.042	33%	0.328	C	S	.	.	H	α-helix	trans	-63.8	-44.4	176.3	69.1	0	0	0	0	111.4	L252 A253 M258 A259 I260	L252-S256 WeakPolarHBondContact O-CB 3.45Å; L252-S256 PolarHBondContact O-N 3.44Å; L252-S256 PolarHBondContact O-OG 3.12Å; A253-S256 WeakPolarHBondContact CA-OG 3.4Å; A253-S256 PolarHBondContact O-OG 3.47Å; A253-S256 VanDerWaalsContact O-OG 3.06Å; S256-M258 PolarHBondContact O-N 2.97Å; S256-A259 PolarHBondContact O-N 3.43Å; S256-I260 WeakPolarHBondContact O-CB 3.35Å; S256-I260 WeakPolarHBondContact O-CG1 3.48Å; S256-I260 PolarHBondContact O-N 3.3Å
257	S	94.6	Very high	92.9	Very high	71 Å²	71	47.9 Å²	47.9	50%	0.497	32%	0.316	S	S	.	.	H	α-helix	trans	-60.2	-44.7	177.6	-62.4	0	0	0	0	112.3	A253 L254 I260 A261	A253-S257 WeakPolarHBondContact O-CB 3.33Å; A253-S257 PolarHBondContact O-N 2.92Å; A253-S257 PolarHBondContact O-OG 3.45Å; L254-S257 PolarHBondContact O-N 3.35Å; S257-I260 PolarHBondContact O-N 2.84Å; S257-A261 WeakPolarHBondContact O-CB 3.44Å; S257-A261 PolarHBondContact O-N 3.13Å
258	M	95.6	Very high	92.8	Very high	120 Å²	120	49.6 Å²	49.6	59%	0.591	32%	0.32	S	S	*	.	H	α-helix	trans	-62.7	-44.2	174.6	-71.6	-179.4	72.4	0	0	111.9	L254 V255 S256 I260 A261 V262	L254-M258 HydrophobicContact CD2-SD 3.7Å; L254-M258 WeakPolarHBondContact O-CG 3.45Å; L254-M258 PolarHBondContact O-N 3.17Å; V255-M258 PolarHBondContact O-N 3.4Å; S256-M258 PolarHBondContact O-N 2.97Å; M258-I260 PolarHBondContact O-N 2.7Å; M258-A261 PolarHBondContact O-N 3.42Å; M258-V262 WeakPolarHBondContact O-CG2 3.28Å; M258-V262 PolarHBondContact O-N 2.87Å
259	A	95	Very high	92.6	Very high	3 Å²	3	51.6 Å²	51.6	3%	0.025	33%	0.329	C	S	.	.	H	α-helix	trans	-64.5	-38.7	177.3	0	0	0	0	0	112.5	F211 I214 V255 S256 R263	F211-A259 HydrophobicContact CB-CB 4.46Å; F211-A259 HydrophobicContact CD1-CB 3.89Å; I214-A259 HydrophobicContact CB-CB 4.36Å; I214-A259 HydrophobicContact CG2-CB 4.01Å; V255-A259 WeakPolarHBondContact O-CB 3.36Å; V255-A259 PolarHBondContact O-N 3.41Å; S256-A259 PolarHBondContact O-N 3.43Å; A259-R263 WeakPolarHBondContact O-CB 3.25Å; A259-R263 PolarHBondContact O-N 3.19Å
260	I	93	Very high	92.5	Very high	56 Å²	56	50.7 Å²	50.7	29%	0.287	32%	0.324	S	S	.	.	H	α-helix	trans	-61.3	-46.5	172.7	-70.6	163.6	0	0	0	110.6	S256 S257 M258 G264	S256-I260 WeakPolarHBondContact O-CB 3.35Å; S256-I260 WeakPolarHBondContact O-CG1 3.48Å; S256-I260 PolarHBondContact O-N 3.3Å; S257-I260 PolarHBondContact O-N 2.84Å; M258-I260 PolarHBondContact O-N 2.7Å; I260-G264 PolarHBondContact O-N 3.14Å
261	A	93.6	Very high	92.2	Very high	67 Å²	67	48.4 Å²	48.4	55%	0.554	30%	0.303	S	S	*	.	H	α-helix	trans	-63.2	-48.5	-179.4	0	0	0	0	0	112	S257 M258 G264 G265	S257-A261 WeakPolarHBondContact O-CB 3.44Å; S257-A261 PolarHBondContact O-N 3.13Å; M258-A261 PolarHBondContact O-N 3.42Å; A261-G264 PolarHBondContact O-N 3.25Å; A261-G265 PolarHBondContact O-N 2.61Å
262	V	94.1	Very high	91.9	Very high	60 Å²	60	48 Å²	48	36%	0.364	30%	0.304	S	S	.	.	H	α-helix	trans	-63.4	-47	177.8	176.3	0	0	0	0	111	F211 M258 G264 G265 V266	F211-V262 HydrophobicContact CD1-CB 4.42Å; F211-V262 HydrophobicContact CD1-CG1 4.48Å; F211-V262 HydrophobicContact CD2-CB 4.31Å; F211-V262 HydrophobicContact CD2-CG1 3.59Å; F211-V262 HydrophobicContact CE1-CB 4.48Å; F211-V262 HydrophobicContact CE1-CG1 4.39Å; F211-V262 HydrophobicContact CE2-CB 4.38Å; F211-V262 HydrophobicContact CE2-CG1 3.49Å; F211-V262 VanDerWaalsContact CE2-CG1 3.49Å; F211-V262 HydrophobicContact CG-CB 4.33Å; F211-V262 HydrophobicContact CG-CG1 4.11Å; F211-V262 HydrophobicContact CZ-CB 4.47Å; F211-V262 HydrophobicContact CZ-CG1 3.92Å; M258-V262 WeakPolarHBondContact O-CG2 3.28Å; M258-V262 PolarHBondContact O-N 2.87Å; V262-G264 VanDerWaalsContact C-N 3.34Å; V262-G264 PolarHBondContact O-N 3.12Å; V262-G265 PolarHBondContact O-N 2.8Å; V262-V266 HydrophobicContact CG1-CG2 4.25Å; V262-V266 WeakPolarHBondContact O-CB 3.29Å; V262-V266 VanDerWaalsContact O-CG2 3.29Å; V262-V266 WeakPolarHBondContact O-CG2 3.22Å; V262-V266 PolarHBondContact O-N 3.12Å
263	R	91.3	Very high	91.7	Very high	16 Å²	16	52 Å²	52	6%	0.06	32%	0.317	C	S	.	.	H	α-helix	trans	-55.9	-48.3	174.6	175.8	-176.4	62.1	82.8	9.4	111.4	A208 F211 L212 A259 F267 N322	A208-R263 HydrophobicContact CB-CG 4.44Å; F211-R263 HydrophobicContact CB-CB 4.02Å; L212-R263 VanDerWaalsContact CD1-CD 3.47Å; A259-R263 WeakPolarHBondContact O-CB 3.25Å; A259-R263 PolarHBondContact O-N 3.19Å; R263-F267 WeakPolarHBondContact O-CB 3.28Å; R263-F267 PolarHBondContact O-N 3.38Å; R263-N322 VanDerWaalsContact NH1-CG 3.34Å; R263-N322 PolarHBondContact NH1-ND2 3.14Å; R263-N322 VanDerWaalsContact NH1-ND2 3.16Å; R263-N322 PolarHBondContact NH1-OD1 2.93Å
264	G	89.7	Confident	91.5	Very high	24 Å²	24	50.2 Å²	50.2	25%	0.247	30%	0.302	C	S	.	.	H	α-helix	trans	-58.1	-52.2	179.7	0	0	0	0	0	111.9	I260 A261 V262 F267 T268	I260-G264 PolarHBondContact O-N 3.14Å; A261-G264 PolarHBondContact O-N 3.25Å; V262-G264 VanDerWaalsContact C-N 3.34Å; V262-G264 PolarHBondContact O-N 3.12Å; G264-F267 PolarHBondContact O-N 2.61Å; G264-T268 PolarHBondContact O-N 3.06Å; G264-T268 PolarHBondContact O-OG1 3.02Å; G264-T268 VanDerWaalsContact O-OG1 3.08Å
265	G	91.1	Very high	91.2	Very high	45 Å²	45	45.9 Å²	45.9	46%	0.464	28%	0.279	S	S	.	.	H	α-helix	trans	-60.3	-47	179	0	0	0	0	0	113.5	A261 V262 F267 T268 L269	A261-G265 PolarHBondContact O-N 2.61Å; V262-G265 PolarHBondContact O-N 2.8Å; G265-F267 VanDerWaalsContact C-N 3.32Å; G265-F267 PolarHBondContact O-N 2.59Å; G265-T268 PolarHBondContact O-N 3.5Å; G265-L269 WeakPolarHBondContact O-CB 3.41Å; G265-L269 PolarHBondContact O-N 3.42Å
266	V	91.4	Very high	91	Very high	20 Å²	20	47.4 Å²	47.4	12%	0.121	29%	0.288	C	S	.	.	H	α-helix	trans	-63.6	-39	178.2	174.4	0	0	0	0	111.4	L204 L207 A208 V262 T270	L204-V266 HydrophobicContact CB-CG1 3.93Å; L204-V266 HydrophobicContact CD2-CG1 4.27Å; L204-V266 VanDerWaalsContact O-CG1 3.23Å; L204-V266 WeakPolarHBondContact O-CG1 3.46Å; L207-V266 HydrophobicContact CD2-CG2 4.33Å; A208-V266 HydrophobicContact CB-CG1 4.1Å; V262-V266 HydrophobicContact CG1-CG2 4.25Å; V262-V266 WeakPolarHBondContact O-CB 3.29Å; V262-V266 VanDerWaalsContact O-CG2 3.29Å; V262-V266 WeakPolarHBondContact O-CG2 3.22Å; V262-V266 PolarHBondContact O-N 3.12Å; V266-T270 WeakPolarHBondContact O-CB 3.45Å; V266-T270 PolarHBondContact O-N 3.32Å; V266-T270 VanDerWaalsContact O-N 3.09Å; V266-T270 PolarHBondContact O-OG1 3.36Å
267	F	88.1	Confident	90.8	Very high	22 Å²	22	50 Å²	50	10%	0.096	30%	0.297	C	S	.	.	H	α-helix	trans	-67.3	-50.7	178.3	-160.6	-91.6	0	0	0	111.4	L205 R263 G264 G265 L269 T270 M271 S318 N322	L205-F267 HydrophobicContact CD2-CD2 4.37Å; L205-F267 HydrophobicContact CD2-CE2 4.24Å; R263-F267 WeakPolarHBondContact O-CB 3.28Å; R263-F267 PolarHBondContact O-N 3.38Å; G264-F267 PolarHBondContact O-N 2.61Å; G265-F267 VanDerWaalsContact C-N 3.32Å; G265-F267 PolarHBondContact O-N 2.59Å; F267-L269 VanDerWaalsContact C-N 3.34Å; F267-L269 PolarHBondContact O-N 3.42Å; F267-T270 WeakPolarHBondContact O-CB 3.35Å; F267-T270 PolarHBondContact O-N 3.15Å; F267-T270 VanDerWaalsContact O-N 3.08Å; F267-M271 HydrophobicContact CD1-CE 4.13Å; F267-M271 HydrophobicContact CD1-CG 4.13Å; F267-M271 HydrophobicContact CD2-CE 4.07Å; F267-M271 HydrophobicContact CE1-CE 3.64Å; F267-M271 HydrophobicContact CE1-CG 3.92Å; F267-M271 HydrophobicContact CE2-CE 3.57Å; F267-M271 HydrophobicContact CG-CE 4.32Å; F267-M271 HydrophobicContact CZ-CE 3.32Å; F267-M271 WeakPolarHBondContact O-CG 3.47Å; F267-M271 PolarHBondContact O-N 3.49Å; F267-S318 VanDerWaalsContact CE1-C 3.47Å; F267-S318 VanDerWaalsContact CE1-O 3.25Å; F267-S318 WeakPolarHBondContact CE1-O 3.39Å; F267-S318 WeakPolarHBondContact CZ-O 3.47Å; F267-N322 HydrophobicContact CD1-CB 4.23Å; F267-N322 HydrophobicContact CD2-CB 4.39Å; F267-N322 HydrophobicContact CE1-CB 3.77Å; F267-N322 HydrophobicContact CE2-CB 3.95Å; F267-N322 HydrophobicContact CZ-CB 3.63Å
268	T	88.3	Confident	90.6	Very high	98 Å²	98	46.7 Å²	46.7	60%	0.601	27%	0.274	S	S	*	.	H	α-helix	trans	-58.3	-42.8	177.1	-59.3	0	0	0	0	112.1	G264 G265 T270 M271 A272	G264-T268 PolarHBondContact O-N 3.06Å; G264-T268 PolarHBondContact O-OG1 3.02Å; G264-T268 VanDerWaalsContact O-OG1 3.08Å; G265-T268 PolarHBondContact O-N 3.5Å; T268-T270 VanDerWaalsContact C-N 3.32Å; T268-T270 PolarHBondContact O-N 3.05Å; T268-M271 PolarHBondContact O-N 2.7Å; T268-A272 PolarHBondContact O-N 2.95Å
269	L	89.6	Confident	90.5	Very high	88 Å²	88	44.9 Å²	44.9	46%	0.461	26%	0.26	S	S	.	.	H	α-helix	trans	-60.1	-41.6	174.9	178.1	62.9	0	0	0	112.1	G265 F267 M271 R273	G265-L269 WeakPolarHBondContact O-CB 3.41Å; G265-L269 PolarHBondContact O-N 3.42Å; F267-L269 VanDerWaalsContact C-N 3.34Å; F267-L269 PolarHBondContact O-N 3.42Å; L269-M271 VanDerWaalsContact C-N 3.29Å; L269-M271 PolarHBondContact O-N 2.88Å; L269-R273 WeakPolarHBondContact O-CG 3.37Å; L269-R273 PolarHBondContact O-N 2.94Å; L269-R273 VanDerWaalsContact O-N 3.12Å
270	T	88.9	Confident	90.4	Very high	1 Å²	1	48.5 Å²	48.5	1%	0.006	29%	0.286	C	S	.	.	H	α-helix	trans	-63.8	-36.1	177.7	-57.2	0	0	0	0	111.5	D201 L205 V266 F267 T268 R273 L274	D201-T270 HydrophobicContact CB-CG2 3.71Å; L205-T270 HydrophobicContact CD1-CG2 4.43Å; L205-T270 HydrophobicContact CD2-CG2 3.93Å; L205-T270 HydrophobicContact CG-CG2 4.06Å; V266-T270 WeakPolarHBondContact O-CB 3.45Å; V266-T270 PolarHBondContact O-N 3.32Å; V266-T270 VanDerWaalsContact O-N 3.09Å; V266-T270 PolarHBondContact O-OG1 3.36Å; F267-T270 WeakPolarHBondContact O-CB 3.35Å; F267-T270 PolarHBondContact O-N 3.15Å; F267-T270 VanDerWaalsContact O-N 3.08Å; T268-T270 VanDerWaalsContact C-N 3.32Å; T268-T270 PolarHBondContact O-N 3.05Å; T270-R273 WeakPolarHBondContact O-CB 3.2Å; T270-R273 PolarHBondContact O-N 3.43Å; T270-L274 PolarHBondContact O-N 3.19Å
271	M	86.1	Confident	90.4	Very high	14 Å²	14	52.1 Å²	52.1	7%	0.069	30%	0.296	C	S	.	.	H	α-helix	trans	-78.7	-34.7	-179.3	-56.4	-38.5	156.6	0	0	113.2	L205 F267 T268 L269 R273 L274 N275 S318	L205-M271 HydrophobicContact CD2-CE 4.04Å; F267-M271 HydrophobicContact CD1-CE 4.13Å; F267-M271 HydrophobicContact CD1-CG 4.13Å; F267-M271 HydrophobicContact CD2-CE 4.07Å; F267-M271 HydrophobicContact CE1-CE 3.64Å; F267-M271 HydrophobicContact CE1-CG 3.92Å; F267-M271 HydrophobicContact CE2-CE 3.57Å; F267-M271 HydrophobicContact CG-CE 4.32Å; F267-M271 HydrophobicContact CZ-CE 3.32Å; F267-M271 WeakPolarHBondContact O-CG 3.47Å; F267-M271 PolarHBondContact O-N 3.49Å; T268-M271 PolarHBondContact O-N 2.7Å; L269-M271 VanDerWaalsContact C-N 3.29Å; L269-M271 PolarHBondContact O-N 2.88Å; M271-R273 VanDerWaalsContact C-N 3.3Å; M271-R273 PolarHBondContact O-N 3.22Å; M271-L274 PolarHBondContact O-N 3.1Å; M271-L274 VanDerWaalsContact O-N 3.13Å; M271-L274 HydrophobicContact SD-CD2 4.19Å; M271-N275 WeakPolarHBondContact O-CB 3.38Å; M271-N275 PolarHBondContact O-N 3.07Å; M271-S318 VanDerWaalsContact CG-CB 3.45Å; M271-S318 WeakPolarHBondContact SD-CB 3.47Å; M271-S318 PolarHBondContact SD-OG 3.22Å
272	A	88.6	Confident	90.4	Very high	55 Å²	55	49 Å²	49	46%	0.455	27%	0.269	S	S	.	.	H	α-helix	trans	-57.3	-43.7	166.7	0	0	0	0	0	111.5	T268 L274 N275 V276	T268-A272 PolarHBondContact O-N 2.95Å; A272-L274 VanDerWaalsContact C-N 3.35Å; A272-L274 PolarHBondContact O-N 3.46Å; A272-N275 PolarHBondContact O-N 3.03Å; A272-V276 WeakPolarHBondContact O-CG2 3.49Å; A272-V276 PolarHBondContact O-N 3.4Å; A272-V276 VanDerWaalsContact O-N 3.12Å
273	R	89.5	Confident	90.5	Very high	114 Å²	114	51.2 Å²	51.2	43%	0.43	28%	0.275	S	S	.	.	H	α-helix	trans	-64.2	-35.1	174.2	-71.8	176.3	176.7	-161.1	-0.3	113.2	D201 L269 T270 M271 R277	D201-R273 WeakPolarHBondContact OD1-CD 3.21Å; D201-R273 IonicContact OD1-CZ 3.6Å; D201-R273 IonicContact OD1-NH1 3.51Å; D201-R273 PolarHBondContact OD1-NH1 3.05Å; L269-R273 WeakPolarHBondContact O-CG 3.37Å; L269-R273 PolarHBondContact O-N 2.94Å; L269-R273 VanDerWaalsContact O-N 3.12Å; T270-R273 WeakPolarHBondContact O-CB 3.2Å; T270-R273 PolarHBondContact O-N 3.43Å; M271-R273 VanDerWaalsContact C-N 3.3Å; M271-R273 PolarHBondContact O-N 3.22Å; R273-R277 WeakPolarHBondContact O-CB 3.5Å; R273-R277 VanDerWaalsContact O-CG 3.25Å; R273-R277 WeakPolarHBondContact O-CG 3.31Å; R273-R277 PolarHBondContact O-N 3.44Å; R273-R277 PolarHBondContact O-NE 3.27Å
274	L	88.3	Confident	90.6	Very high	0 Å²	0	59.8 Å²	59.8	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-68.7	-46.4	176	-178.9	62.7	0	0	0	111.1	L194 T270 M271 A272 V276 R277 L278	L194-L274 HydrophobicContact CD1-CD2 4.46Å; T270-L274 PolarHBondContact O-N 3.19Å; M271-L274 PolarHBondContact O-N 3.1Å; M271-L274 VanDerWaalsContact O-N 3.13Å; M271-L274 HydrophobicContact SD-CD2 4.19Å; A272-L274 VanDerWaalsContact C-N 3.35Å; A272-L274 PolarHBondContact O-N 3.46Å; L274-V276 PolarHBondContact O-N 2.97Å; L274-R277 PolarHBondContact O-N 3.28Å; L274-L278 HydrophobicContact CD1-CD1 4.21Å; L274-L278 HydrophobicContact CD1-CG 4.22Å; L274-L278 HydrophobicContact CG-CD1 4Å; L274-L278 HydrophobicContact CG-CG 4.42Å; L274-L278 WeakPolarHBondContact O-CG 3.23Å; L274-L278 PolarHBondContact O-N 3.43Å
275	N	88.9	Confident	90.8	Very high	17 Å²	17	59.8 Å²	59.8	9%	0.091	30%	0.302	C	S	.	.	H	α-helix	trans	-56.3	-51.1	178.3	-172.9	-78.8	0	0	0	111.6	M271 A272 R277 L278 R279 T311 S314	M271-N275 WeakPolarHBondContact O-CB 3.38Å; M271-N275 PolarHBondContact O-N 3.07Å; A272-N275 PolarHBondContact O-N 3.03Å; N275-R277 VanDerWaalsContact C-N 3.3Å; N275-R277 PolarHBondContact O-N 2.93Å; N275-L278 PolarHBondContact O-N 3.35Å; N275-R279 WeakPolarHBondContact O-CB 3.31Å; N275-R279 PolarHBondContact O-N 2.98Å; N275-R279 VanDerWaalsContact OD1-CD 3.28Å; N275-R279 WeakPolarHBondContact OD1-CD 3.48Å; N275-R279 PolarHBondContact OD1-NE 3.47Å; N275-R279 PolarHBondContact OD1-NH1 2.95Å; N275-T311 WeakPolarHBondContact ND2-CA 3.25Å; N275-S314 PolarHBondContact ND2-OG 2.88Å
276	V	91.1	Very high	90.9	Very high	98 Å²	98	57.8 Å²	57.8	59%	0.594	28%	0.281	S	S	*	.	H	α-helix	trans	-56.8	-43.2	176.8	171.1	0	0	0	0	111.6	A272 L274 S280	A272-V276 WeakPolarHBondContact O-CG2 3.49Å; A272-V276 PolarHBondContact O-N 3.4Å; A272-V276 VanDerWaalsContact O-N 3.12Å; L274-V276 PolarHBondContact O-N 2.97Å; V276-S280 WeakPolarHBondContact O-CB 3.39Å; V276-S280 PolarHBondContact O-N 3.31Å
277	R	90.1	Very high	90.9	Very high	62 Å²	62	62.2 Å²	62.2	23%	0.234	30%	0.302	C	S	.	.	H	α-helix	trans	-69.4	-38.6	-179.8	-73	-179.4	-68.7	132.7	-9.9	112.7	Y197 D201 R273 L274 N275 R281	Y197-R277 PolarHBondContact O-NH1 3.41Å; D201-R277 IonicContact OD2-CZ 2.69Å; D201-R277 IonicContact OD2-NE 2.78Å; D201-R277 IonicContact OD2-NH2 3.85Å; D201-R277 PolarHBondContact OD2-NH2 3.48Å; R273-R277 WeakPolarHBondContact O-CB 3.5Å; R273-R277 VanDerWaalsContact O-CG 3.25Å; R273-R277 WeakPolarHBondContact O-CG 3.31Å; R273-R277 PolarHBondContact O-N 3.44Å; R273-R277 PolarHBondContact O-NE 3.27Å; L274-R277 PolarHBondContact O-N 3.28Å; N275-R277 VanDerWaalsContact C-N 3.3Å; N275-R277 PolarHBondContact O-N 2.93Å; R277-R281 VanDerWaalsContact O-CB 3.32Å; R277-R281 WeakPolarHBondContact O-CB 3.24Å; R277-R281 PolarHBondContact O-N 2.94Å; R277-R281 VanDerWaalsContact O-N 3.16Å
278	L	90.9	Very high	91	Very high	1 Å²	1	65.1 Å²	65.1	1%	0.005	32%	0.321	C	S	.	.	H	α-helix	trans	-67	-51.4	175.1	-72.4	173.7	0	0	0	111	L194 Y197 L274 N275 S280 R281 L282 V313	L194-L278 HydrophobicContact CD1-CD1 4.39Å; Y197-L278 HydrophobicContact CD1-CD2 4.47Å; L274-L278 HydrophobicContact CD1-CD1 4.21Å; L274-L278 HydrophobicContact CD1-CG 4.22Å; L274-L278 HydrophobicContact CG-CD1 4Å; L274-L278 HydrophobicContact CG-CG 4.42Å; L274-L278 WeakPolarHBondContact O-CG 3.23Å; L274-L278 PolarHBondContact O-N 3.43Å; N275-L278 PolarHBondContact O-N 3.35Å; L278-S280 PolarHBondContact O-N 3.44Å; L278-R281 PolarHBondContact O-N 3.09Å; L278-L282 VanDerWaalsContact O-CB 3.28Å; L278-L282 WeakPolarHBondContact O-CB 3.49Å; L278-L282 PolarHBondContact O-N 3.08Å; L278-V313 HydrophobicContact CD1-CG1 3.77Å
279	R	92.9	Very high	91.3	Very high	81 Å²	81	61.2 Å²	61.2	31%	0.306	30%	0.296	S	S	.	.	H	α-helix	trans	-60.1	-46.6	178.8	-75.3	-175.5	168.6	161.2	-18.3	112.8	N275 R281 L282 F283 L306 S307 T310 T311	N275-R279 WeakPolarHBondContact O-CB 3.31Å; N275-R279 PolarHBondContact O-N 2.98Å; N275-R279 VanDerWaalsContact OD1-CD 3.28Å; N275-R279 WeakPolarHBondContact OD1-CD 3.48Å; N275-R279 PolarHBondContact OD1-NE 3.47Å; N275-R279 PolarHBondContact OD1-NH1 2.95Å; R279-R281 PolarHBondContact O-N 2.98Å; R279-L282 PolarHBondContact O-N 3.42Å; R279-F283 VanDerWaalsContact O-CB 3.29Å; R279-F283 WeakPolarHBondContact O-CB 3.37Å; R279-F283 PolarHBondContact O-N 3.05Å; R279-L306 HydrophobicContact CB-CD1 4.48Å; R279-L306 PolarHBondContact NE-O 3.05Å; R279-S307 PolarHBondContact NH2-O 2.93Å; R279-T310 HydrophobicContact CG-CG2 4.02Å; R279-T310 VanDerWaalsContact CG-OG1 3.3Å; R279-T310 WeakPolarHBondContact CG-OG1 3.28Å; R279-T310 PolarHBondContact NE-OG1 3.46Å; R279-T311 PolarHBondContact NH2-OG1 2.78Å
280	S	93.4	Very high	91.4	Very high	79 Å²	79	57.8 Å²	57.8	55%	0.552	28%	0.278	S	S	*	.	H	α-helix	trans	-61.5	-43	178.1	176	0	0	0	0	112	V276 L278 R284	V276-S280 WeakPolarHBondContact O-CB 3.39Å; V276-S280 PolarHBondContact O-N 3.31Å; L278-S280 PolarHBondContact O-N 3.44Å; S280-R284 WeakPolarHBondContact O-CB 3.18Å; S280-R284 PolarHBondContact O-N 3.38Å
281	R	92.3	Very high	91.5	Very high	133 Å²	133	60.7 Å²	60.7	50%	0.502	29%	0.292	S	S	.	.	H	α-helix	trans	-70.4	-43.6	178.8	-164.2	-176.5	179.1	159.1	8.7	111.8	Y197 R277 L278 R279 R284 T285 L500	Y197-R281 PolarHBondContact OH-NH1 3.18Å; R277-R281 VanDerWaalsContact O-CB 3.32Å; R277-R281 WeakPolarHBondContact O-CB 3.24Å; R277-R281 PolarHBondContact O-N 2.94Å; R277-R281 VanDerWaalsContact O-N 3.16Å; L278-R281 PolarHBondContact O-N 3.09Å; R279-R281 PolarHBondContact O-N 2.98Å; R281-R284 PolarHBondContact O-N 3.05Å; R281-T285 PolarHBondContact O-N 2.66Å; R281-T285 PolarHBondContact O-OG1 2.9Å; R281-T285 VanDerWaalsContact O-OG1 3.07Å; R281-L500 HydrophobicContact CB-CD1 4.1Å; R281-L500 HydrophobicContact CG-CD1 3.83Å
282	L	93.9	Very high	91.8	Very high	0 Å²	0	60.3 Å²	60.3	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-61.2	-48.1	176.8	178.6	61.3	0	0	0	111.2	L278 R279 R284 T285 L286 L306 T310 V496 L500	L278-L282 VanDerWaalsContact O-CB 3.28Å; L278-L282 WeakPolarHBondContact O-CB 3.49Å; L278-L282 PolarHBondContact O-N 3.08Å; R279-L282 PolarHBondContact O-N 3.42Å; L282-R284 VanDerWaalsContact C-N 3.34Å; L282-R284 PolarHBondContact O-N 3.38Å; L282-T285 PolarHBondContact O-N 3.42Å; L282-L286 HydrophobicContact CD1-CD1 4.3Å; L282-L286 HydrophobicContact CD1-CG 4.31Å; L282-L286 HydrophobicContact CG-CD1 4.05Å; L282-L286 WeakPolarHBondContact O-CG 3.46Å; L282-L286 PolarHBondContact O-N 2.87Å; L282-L306 HydrophobicContact CB-CD1 4.35Å; L282-L306 HydrophobicContact CD2-CB 4.49Å; L282-L306 HydrophobicContact CD2-CD1 4.02Å; L282-L306 HydrophobicContact CG-CD1 4.18Å; L282-T310 HydrophobicContact CD2-CG2 3.72Å; L282-V496 HydrophobicContact CD2-CG1 4.4Å; L282-L500 HydrophobicContact CB-CD1 4.15Å; L282-L500 HydrophobicContact CD1-CD1 4.46Å
283	F	95.4	Very high	92	Very high	107 Å²	107	57.9 Å²	57.9	47%	0.469	27%	0.271	S	S	.	.	H	α-helix	trans	-59.3	-44.8	176.5	-173.5	-103.7	0	0	0	111.7	R279 T285 L286 M287 L306	R279-F283 VanDerWaalsContact O-CB 3.29Å; R279-F283 WeakPolarHBondContact O-CB 3.37Å; R279-F283 PolarHBondContact O-N 3.05Å; F283-T285 VanDerWaalsContact C-N 3.33Å; F283-T285 PolarHBondContact O-N 3.29Å; F283-L286 PolarHBondContact O-N 2.91Å; F283-M287 HydrophobicContact CD1-CG 4.21Å; F283-M287 HydrophobicContact CE1-CG 3.84Å; F283-M287 HydrophobicContact CE1-SD 4.21Å; F283-M287 HydrophobicContact CE2-CE 4.05Å; F283-M287 HydrophobicContact CE2-CG 4.47Å; F283-M287 HydrophobicContact CE2-SD 4.24Å; F283-M287 HydrophobicContact CZ-CE 4.21Å; F283-M287 HydrophobicContact CZ-CG 3.98Å; F283-M287 HydrophobicContact CZ-SD 3.78Å; F283-M287 WeakPolarHBondContact O-CG 3.34Å; F283-M287 PolarHBondContact O-N 3.37Å; F283-L306 HydrophobicContact CB-CD1 4.12Å; F283-L306 HydrophobicContact CD2-CD2 3.82Å
284	R	94.3	Very high	92.1	Very high	196 Å²	196	55.9 Å²	55.9	74%	0.74	27%	0.265	S	S	*	.	H	α-helix	trans	-61.4	-39.5	175.7	-174.7	173.8	179.1	165.3	1.6	112.6	S280 R281 L282	S280-R284 WeakPolarHBondContact O-CB 3.18Å; S280-R284 PolarHBondContact O-N 3.38Å; R281-R284 PolarHBondContact O-N 3.05Å; L282-R284 VanDerWaalsContact C-N 3.34Å; L282-R284 PolarHBondContact O-N 3.38Å
285	T	93.2	Very high	92.1	Very high	24 Å²	24	59.7 Å²	59.7	15%	0.147	29%	0.286	C	S	.	.	H	α-helix	trans	-69.1	-35.1	176	-60	0	0	0	0	112.2	R281 L282 F283 T288 Q289 Y499	R281-T285 PolarHBondContact O-N 2.66Å; R281-T285 PolarHBondContact O-OG1 2.9Å; R281-T285 VanDerWaalsContact O-OG1 3.07Å; L282-T285 PolarHBondContact O-N 3.42Å; F283-T285 VanDerWaalsContact C-N 3.33Å; F283-T285 PolarHBondContact O-N 3.29Å; T285-T288 PolarHBondContact O-N 2.85Å; T285-T288 PolarHBondContact O-OG1 2.85Å; T285-Q289 WeakPolarHBondContact O-CG 3.49Å; T285-Q289 PolarHBondContact O-NE2 2.98Å; T285-Y499 WeakPolarHBondContact CG2-O 3.28Å
286	L	93.7	Very high	92.1	Very high	4 Å²	4	62 Å²	62	2%	0.021	30%	0.296	C	S	.	.	H	α-helix	trans	-65.2	-42.1	174.6	-73.4	167.2	0	0	0	111.5	L282 F283 T288 Q289 F293 F294 I302 Y499	L282-L286 HydrophobicContact CD1-CD1 4.3Å; L282-L286 HydrophobicContact CD1-CG 4.31Å; L282-L286 HydrophobicContact CG-CD1 4.05Å; L282-L286 WeakPolarHBondContact O-CG 3.46Å; L282-L286 PolarHBondContact O-N 2.87Å; F283-L286 PolarHBondContact O-N 2.91Å; L286-T288 PolarHBondContact O-N 2.85Å; L286-T288 VanDerWaalsContact O-N 3.11Å; L286-Q289 PolarHBondContact O-N 3.42Å; L286-Q289 VanDerWaalsContact O-N 3.12Å; L286-F293 HydrophobicContact CD2-CE1 3.65Å; L286-F293 HydrophobicContact CD2-CZ 4Å; L286-F294 WeakPolarHBondContact O-CZ 3.34Å; L286-I302 HydrophobicContact CD1-CG2 3.72Å; L286-I302 HydrophobicContact CD2-CG2 3.87Å; L286-I302 HydrophobicContact CG-CG2 4.41Å; L286-Y499 HydrophobicContact CD2-CD2 3.98Å
287	M	91.7	Very high	91.8	Very high	113 Å²	113	59.3 Å²	59.3	56%	0.557	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.6	-8.1	176.8	-62.1	-63.8	91.3	0	0	114.4	F283	F283-M287 HydrophobicContact CD1-CG 4.21Å; F283-M287 HydrophobicContact CE1-CG 3.84Å; F283-M287 HydrophobicContact CE1-SD 4.21Å; F283-M287 HydrophobicContact CE2-CE 4.05Å; F283-M287 HydrophobicContact CE2-CG 4.47Å; F283-M287 HydrophobicContact CE2-SD 4.24Å; F283-M287 HydrophobicContact CZ-CE 4.21Å; F283-M287 HydrophobicContact CZ-CG 3.98Å; F283-M287 HydrophobicContact CZ-SD 3.78Å; F283-M287 WeakPolarHBondContact O-CG 3.34Å; F283-M287 PolarHBondContact O-N 3.37Å
288	T	90.9	Very high	91.6	Very high	82 Å²	82	63.1 Å²	63.1	50%	0.503	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107	7.7	174.3	57.5	0	0	0	0	113.6	T285 L286 P504	T285-T288 PolarHBondContact O-N 2.85Å; T285-T288 PolarHBondContact O-OG1 2.85Å; L286-T288 PolarHBondContact O-N 2.85Å; L286-T288 VanDerWaalsContact O-N 3.11Å; T288-P504 WeakPolarHBondContact O-CB 3.31Å; T288-P504 WeakPolarHBondContact O-CG 3.31Å
289	Q	92.8	Very high	91.3	Very high	16 Å²	16	68.4 Å²	68.4	8%	0.075	33%	0.331	C	S	.	.	S	Bend	trans	-83.1	150	174.8	-55	-56.9	-51.9	0	0	111.1	T285 L286 F293 F294 R502	T285-Q289 WeakPolarHBondContact O-CG 3.49Å; T285-Q289 PolarHBondContact O-NE2 2.98Å; L286-Q289 PolarHBondContact O-N 3.42Å; L286-Q289 VanDerWaalsContact O-N 3.12Å; Q289-F293 HydrophobicContact CB-CB 4.02Å; Q289-F293 HydrophobicContact CB-CD1 3.64Å; Q289-F293 HydrophobicContact CB-CE1 4.4Å; Q289-F293 HydrophobicContact CB-CG 3.98Å; Q289-F293 HydrophobicContact CG-CD1 3.89Å; Q289-F293 HydrophobicContact CG-CE1 4.19Å; Q289-F293 HydrophobicContact CG-CG 4.32Å; Q289-F294 HydrophobicContact CB-CE2 4.17Å; Q289-R502 PolarHBondContact NE2-O 3.47Å; Q289-R502 VanDerWaalsContact OE1-CD 3.26Å; Q289-R502 PolarHBondContact OE1-O 2.72Å
290	E	92	Very high	90.9	Very high	16 Å²	16	67 Å²	67	8%	0.075	34%	0.342	C	S	.	.			trans	-67.2	157.6	175.5	72.7	-79.1	-174.2	0	0	112.5	A292 F293 R502 P504 K505 H506	E290-A292 VanDerWaalsContact C-N 3.27Å; E290-A292 HydrophobicContact CG-CB 3.99Å; E290-A292 PolarHBondContact O-N 3.39Å; E290-F293 VanDerWaalsContact O-CB 3.29Å; E290-F293 WeakPolarHBondContact O-CB 3.48Å; E290-F293 PolarHBondContact O-N 3.28Å; E290-R502 VanDerWaalsContact CD-NH1 3.26Å; E290-R502 IonicContact OE1-CZ 3.99Å; E290-R502 VanDerWaalsContact OE1-CZ 3.28Å; E290-R502 IonicContact OE1-NH1 3.81Å; E290-R502 PolarHBondContact OE1-NH1 3.12Å; E290-R502 IonicContact OE1-NH2 2.85Å; E290-R502 PolarHBondContact OE1-NH2 3.01Å; E290-R502 IonicContact OE2-CZ 2.95Å; E290-R502 IonicContact OE2-NH1 3.63Å; E290-R502 PolarHBondContact OE2-NH1 2.95Å; E290-R502 IonicContact OE2-NH2 2.86Å; E290-P504 WeakPolarHBondContact OE2-CA 3.18Å; E290-P504 WeakPolarHBondContact OE2-CB 3.32Å; E290-K505 WeakPolarHBondContact OE1-CB 3.35Å; E290-K505 WeakPolarHBondContact OE1-CD 3.37Å; E290-K505 VanDerWaalsContact OE1-CG 3.25Å; E290-K505 WeakPolarHBondContact OE1-CG 3.4Å; E290-K505 PolarHBondContact OE1-N 3.45Å; E290-K505 PolarHBondContact OE2-N 2.92Å; E290-H506 HydrophobicContact CB-CB 4.08Å
291	I	92.3	Very high	90.3	Very high	62 Å²	62	66.6 Å²	66.6	32%	0.318	33%	0.333	S	S	.	.	H	α-helix	trans	-60.4	-36.9	-177.6	-76.3	160.4	0	0	0	112.3	F293 F294 D295 F572	I291-F293 PolarHBondContact O-N 2.97Å; I291-F294 WeakPolarHBondContact O-CA 3.39Å; I291-F294 WeakPolarHBondContact O-CB 3.35Å; I291-F294 PolarHBondContact O-N 3.42Å; I291-D295 PolarHBondContact O-N 2.98Å; I291-D295 VanDerWaalsContact O-N 3.14Å; I291-F572 HydrophobicContact CB-CB 4.45Å; I291-F572 HydrophobicContact CD1-CB 3.61Å; I291-F572 HydrophobicContact CD1-CD1 3.31Å; I291-F572 HydrophobicContact CD1-CD2 3.7Å; I291-F572 HydrophobicContact CD1-CE1 3.75Å; I291-F572 HydrophobicContact CD1-CE2 4.12Å; I291-F572 HydrophobicContact CD1-CG 3.26Å; I291-F572 HydrophobicContact CD1-CZ 4.14Å
292	A	91.6	Very high	90.2	Very high	7 Å²	7	61 Å²	61	6%	0.058	31%	0.313	C	S	.	.	H	α-helix	trans	-52.7	-29.6	173.7	0	0	0	0	0	114.2	E290 F294 D295 E296 P531 Y573	E290-A292 VanDerWaalsContact C-N 3.27Å; E290-A292 HydrophobicContact CG-CB 3.99Å; E290-A292 PolarHBondContact O-N 3.39Å; A292-F294 VanDerWaalsContact C-N 3.34Å; A292-D295 WeakPolarHBondContact CA-OD2 3.45Å; A292-D295 PolarHBondContact O-N 3.48Å; A292-E296 VanDerWaalsContact O-CB 3.28Å; A292-E296 WeakPolarHBondContact O-CB 3.34Å; A292-E296 WeakPolarHBondContact O-CG 3.36Å; A292-E296 PolarHBondContact O-N 2.93Å; A292-P531 HydrophobicContact CB-CB 4.39Å; A292-P531 HydrophobicContact CB-CG 3.85Å; A292-Y573 HydrophobicContact CB-CD1 4.17Å; A292-Y573 HydrophobicContact CB-CE1 3.99Å
293	F	92.1	Very high	90	Very high	3 Å²	3	66.3 Å²	66.3	1%	0.013	34%	0.341	C	S	.	.	H	α-helix	trans	-65.3	-37.7	173.8	170.1	-105.7	0	0	0	112.2	L286 Q289 E290 I291 N297 I302 Y499 R502	L286-F293 HydrophobicContact CD2-CE1 3.65Å; L286-F293 HydrophobicContact CD2-CZ 4Å; Q289-F293 HydrophobicContact CB-CB 4.02Å; Q289-F293 HydrophobicContact CB-CD1 3.64Å; Q289-F293 HydrophobicContact CB-CE1 4.4Å; Q289-F293 HydrophobicContact CB-CG 3.98Å; Q289-F293 HydrophobicContact CG-CD1 3.89Å; Q289-F293 HydrophobicContact CG-CE1 4.19Å; Q289-F293 HydrophobicContact CG-CG 4.32Å; E290-F293 VanDerWaalsContact O-CB 3.29Å; E290-F293 WeakPolarHBondContact O-CB 3.48Å; E290-F293 PolarHBondContact O-N 3.28Å; I291-F293 PolarHBondContact O-N 2.97Å; F293-N297 WeakPolarHBondContact CD2-ND2 3.49Å; F293-N297 HydrophobicContact CE2-CB 4.46Å; F293-N297 WeakPolarHBondContact CE2-ND2 3.36Å; F293-N297 WeakPolarHBondContact O-CB 3.46Å; F293-N297 PolarHBondContact O-N 2.96Å; F293-N297 VanDerWaalsContact O-N 3.07Å; F293-N297 PolarHBondContact O-ND2 2.98Å; F293-I302 HydrophobicContact CE1-CD1 3.91Å; F293-I302 HydrophobicContact CE1-CG1 4.44Å; F293-I302 HydrophobicContact CZ-CD1 4.38Å; F293-Y499 HydrophobicContact CE2-CD1 4.5Å; F293-Y499 HydrophobicContact CE2-CE1 4.11Å; F293-Y499 HydrophobicContact CZ-CD1 4.4Å; F293-Y499 HydrophobicContact CZ-CD2 4.2Å; F293-Y499 HydrophobicContact CZ-CE1 4.12Å; F293-Y499 AromaticContact CZ-CE2 3.91Å; F293-Y499 HydrophobicContact CZ-CE2 3.91Å; F293-Y499 HydrophobicContact CZ-CG 4.43Å; F293-Y499 AromaticContact CZ-CZ 3.86Å; F293-R502 VanDerWaalsContact CD2-NE 3.25Å
294	F	92.2	Very high	89.6	Confident	72 Å²	72	63.6 Å²	63.6	32%	0.316	34%	0.335	S	S	.	.	H	α-helix	trans	-78.7	-21.9	178.7	-63.7	-81.8	0	0	0	113	L286 Q289 I291 A292 N297 I302	L286-F294 WeakPolarHBondContact O-CZ 3.34Å; Q289-F294 HydrophobicContact CB-CE2 4.17Å; I291-F294 WeakPolarHBondContact O-CA 3.39Å; I291-F294 WeakPolarHBondContact O-CB 3.35Å; I291-F294 PolarHBondContact O-N 3.42Å; A292-F294 VanDerWaalsContact C-N 3.34Å; F294-N297 VanDerWaalsContact O-O 3.11Å; F294-I302 HydrophobicContact CD1-CD1 3.67Å; F294-I302 HydrophobicContact CE1-CD1 3.97Å
295	D	89.3	Confident	89.3	Confident	81 Å²	81	56.3 Å²	56.3	43%	0.433	31%	0.308	S	S	.	.	H	α-helix	trans	-78.7	-36.1	168.8	-50.1	-55.1	0	0	0	111.8	I291 A292 T532 Y573	I291-D295 PolarHBondContact O-N 2.98Å; I291-D295 VanDerWaalsContact O-N 3.14Å; A292-D295 WeakPolarHBondContact CA-OD2 3.45Å; A292-D295 PolarHBondContact O-N 3.48Å; D295-T532 HydrophobicContact CB-CG2 4.36Å; D295-Y573 PolarHBondContact OD2-OH 2.87Å
296	E	87.3	Confident	89.2	Confident	66 Å²	66	56.8 Å²	56.8	31%	0.308	31%	0.309	S	S	.	.	H	α-helix	trans	-72.2	-22.8	175.6	-76	168.9	-167.5	0	0	113.1	A292 R502 K505 P531 T532	A292-E296 VanDerWaalsContact O-CB 3.28Å; A292-E296 WeakPolarHBondContact O-CB 3.34Å; A292-E296 WeakPolarHBondContact O-CG 3.36Å; A292-E296 PolarHBondContact O-N 2.93Å; E296-R502 IonicContact OE2-NH2 2.82Å; E296-K505 IonicContact OE1-NZ 3.87Å; E296-K505 PolarHBondContact OE1-NZ 3.47Å; E296-K505 IonicContact OE2-NZ 3.21Å; E296-K505 PolarHBondContact OE2-NZ 2.98Å; E296-P531 WeakPolarHBondContact OE1-CB 3.12Å; E296-T532 HydrophobicContact CG-CG2 4.02Å
297	N	86.1	Confident	89	Confident	40 Å²	40	59.4 Å²	59.4	21%	0.214	33%	0.328	C	S	.	.	S	Bend	trans	-129.4	126	-171.3	-66.9	-105.5	0	0	0	112.1	F293 F294 T299 I302 Y499	F293-N297 WeakPolarHBondContact CD2-ND2 3.49Å; F293-N297 HydrophobicContact CE2-CB 4.46Å; F293-N297 WeakPolarHBondContact CE2-ND2 3.36Å; F293-N297 WeakPolarHBondContact O-CB 3.46Å; F293-N297 PolarHBondContact O-N 2.96Å; F293-N297 VanDerWaalsContact O-N 3.07Å; F293-N297 PolarHBondContact O-ND2 2.98Å; F294-N297 VanDerWaalsContact O-O 3.11Å; N297-T299 PolarHBondContact O-N 3.46Å; N297-I302 HydrophobicContact CB-CD1 4.1Å; N297-I302 HydrophobicContact CB-CG1 4.24Å; N297-Y499 PolarHBondContact OD1-OH 3.35Å
298	H	85.4	Confident	88.8	Confident	143 Å²	143	56.3 Å²	56.3	66%	0.662	32%	0.32	S	S	*	.			trans	-59.3	134.8	177.1	-64.3	-52.2	0	0	0	112.4	G300 D301 I302	H298-G300 PolarHBondContact O-N 3.31Å; H298-G300 VanDerWaalsContact O-N 3.13Å; H298-D301 IonicContact CD2-OD2 3.93Å; H298-D301 WeakPolarHBondContact O-CB 3.49Å; H298-D301 PolarHBondContact O-N 3.23Å; H298-I302 PolarHBondContact O-N 3.28Å
299	T	85.4	Confident	88.8	Confident	112 Å²	112	53 Å²	53	69%	0.687	30%	0.3	S	S	*	.	H	α-helix	trans	-57.4	-31.6	178.9	-43.7	0	0	0	0	112.8	N297 I302 L303	N297-T299 PolarHBondContact O-N 3.46Å; T299-I302 PolarHBondContact O-N 3.03Å; T299-L303 WeakPolarHBondContact O-CB 3.46Å; T299-L303 PolarHBondContact O-N 3.36Å
300	G	83.1	Confident	88.6	Confident	51 Å²	51	52.3 Å²	52.3	53%	0.526	30%	0.296	S	S	.	.	H	α-helix	trans	-62.7	-41.6	174.7	0	0	0	0	0	113	H298 L303 S304	H298-G300 PolarHBondContact O-N 3.31Å; H298-G300 VanDerWaalsContact O-N 3.13Å; G300-L303 PolarHBondContact O-N 3.01Å; G300-S304 VanDerWaalsContact O-CB 3.32Å; G300-S304 WeakPolarHBondContact O-CB 3.48Å; G300-S304 PolarHBondContact O-N 3.38Å
301	D	81.6	Confident	88.5	Confident	71 Å²	71	53.5 Å²	53.5	38%	0.38	31%	0.305	S	S	.	.	H	α-helix	trans	-66.7	-44.5	176.4	-73.4	-47.2	0	0	0	111.5	H298 L303 S304 R305	H298-D301 IonicContact CD2-OD2 3.93Å; H298-D301 WeakPolarHBondContact O-CB 3.49Å; H298-D301 PolarHBondContact O-N 3.23Å; D301-L303 VanDerWaalsContact C-N 3.3Å; D301-L303 PolarHBondContact O-N 3.22Å; D301-S304 CarbonylContact O-C 3.48Å; D301-S304 WeakPolarHBondContact O-CB 3.23Å; D301-S304 PolarHBondContact O-N 2.98Å; D301-S304 VanDerWaalsContact O-N 3.13Å; D301-R305 WeakPolarHBondContact O-CG 3.4Å; D301-R305 PolarHBondContact O-N 2.82Å
302	I	90.4	Very high	88.3	Confident	14 Å²	14	53.5 Å²	53.5	7%	0.072	30%	0.303	C	S	.	.	H	α-helix	trans	-59.8	-42.9	176.7	-59.3	172.2	0	0	0	110.7	L286 F293 F294 N297 H298 T299 R305 L306 Y499	L286-I302 HydrophobicContact CD1-CG2 3.72Å; L286-I302 HydrophobicContact CD2-CG2 3.87Å; L286-I302 HydrophobicContact CG-CG2 4.41Å; F293-I302 HydrophobicContact CE1-CD1 3.91Å; F293-I302 HydrophobicContact CE1-CG1 4.44Å; F293-I302 HydrophobicContact CZ-CD1 4.38Å; F294-I302 HydrophobicContact CD1-CD1 3.67Å; F294-I302 HydrophobicContact CE1-CD1 3.97Å; N297-I302 HydrophobicContact CB-CD1 4.1Å; N297-I302 HydrophobicContact CB-CG1 4.24Å; H298-I302 PolarHBondContact O-N 3.28Å; T299-I302 PolarHBondContact O-N 3.03Å; I302-R305 PolarHBondContact O-N 3.26Å; I302-L306 WeakPolarHBondContact O-CB 3.4Å; I302-L306 PolarHBondContact O-N 2.89Å; I302-Y499 HydrophobicContact CG1-CE2 4.17Å
303	L	89.1	Confident	88.1	Confident	113 Å²	113	53.2 Å²	53.2	59%	0.592	30%	0.301	S	S	*	.	H	α-helix	trans	-66.5	-38	175.8	-176.4	61.8	0	0	0	112.1	T299 G300 D301 L306 S307	T299-L303 WeakPolarHBondContact O-CB 3.46Å; T299-L303 PolarHBondContact O-N 3.36Å; G300-L303 PolarHBondContact O-N 3.01Å; D301-L303 VanDerWaalsContact C-N 3.3Å; D301-L303 PolarHBondContact O-N 3.22Å; L303-L306 PolarHBondContact O-N 3.48Å; L303-S307 VanDerWaalsContact O-CB 3.28Å; L303-S307 WeakPolarHBondContact O-CB 3.47Å; L303-S307 PolarHBondContact O-N 2.86Å
304	S	87	Confident	87.7	Confident	49 Å²	49	53 Å²	53	34%	0.343	30%	0.3	S	S	.	.	H	α-helix	trans	-64.5	-45.5	175	-170.5	0	0	0	0	111.7	G300 D301 L306 S307 A308 D309	G300-S304 VanDerWaalsContact O-CB 3.32Å; G300-S304 WeakPolarHBondContact O-CB 3.48Å; G300-S304 PolarHBondContact O-N 3.38Å; D301-S304 CarbonylContact O-C 3.48Å; D301-S304 WeakPolarHBondContact O-CB 3.23Å; D301-S304 PolarHBondContact O-N 2.98Å; D301-S304 VanDerWaalsContact O-N 3.13Å; S304-L306 VanDerWaalsContact C-N 3.34Å; S304-L306 PolarHBondContact O-N 3.32Å; S304-S307 PolarHBondContact O-N 2.86Å; S304-A308 WeakPolarHBondContact O-CA 3.3Å; S304-A308 WeakPolarHBondContact O-CB 3.28Å; S304-A308 PolarHBondContact O-N 3.41Å; S304-D309 PolarHBondContact O-N 2.99Å; S304-D309 VanDerWaalsContact O-N 3.15Å
305	R	87.8	Confident	87.2	Confident	44 Å²	44	53.1 Å²	53.1	17%	0.166	30%	0.304	C	S	.	.	I	π-helix	trans	-55.1	-49.9	170.7	-65.2	-49.1	176.4	-121.6	-21.3	111	D301 I302 S307 D309 T310 Y499	D301-R305 WeakPolarHBondContact O-CG 3.4Å; D301-R305 PolarHBondContact O-N 2.82Å; I302-R305 PolarHBondContact O-N 3.26Å; R305-S307 PolarHBondContact O-N 3.43Å; R305-D309 WeakPolarHBondContact CD-OD2 3.48Å; R305-D309 IonicContact CZ-OD2 3.47Å; R305-D309 IonicContact NE-OD2 3.52Å; R305-D309 IonicContact NH1-OD2 2.88Å; R305-D309 PolarHBondContact NH1-OD2 3.27Å; R305-T310 WeakPolarHBondContact O-CG2 3.46Å; R305-T310 PolarHBondContact O-N 2.98Å; R305-Y499 HydrophobicContact CB-CD2 4.18Å; R305-Y499 HydrophobicContact CB-CE2 4.19Å; R305-Y499 HydrophobicContact CG-CD2 3.88Å; R305-Y499 HydrophobicContact CG-CE2 3.55Å
306	L	91.1	Very high	86.8	Confident	33 Å²	33	51.3 Å²	51.3	17%	0.173	29%	0.294	C	S	.	.	I	π-helix	trans	-67	-35.4	-176	-176.6	62.4	0	0	0	112.9	R279 L282 F283 I302 L303 S304 T310	R279-L306 HydrophobicContact CB-CD1 4.48Å; R279-L306 PolarHBondContact NE-O 3.05Å; L282-L306 HydrophobicContact CB-CD1 4.35Å; L282-L306 HydrophobicContact CD2-CB 4.49Å; L282-L306 HydrophobicContact CD2-CD1 4.02Å; L282-L306 HydrophobicContact CG-CD1 4.18Å; F283-L306 HydrophobicContact CB-CD1 4.12Å; F283-L306 HydrophobicContact CD2-CD2 3.82Å; I302-L306 WeakPolarHBondContact O-CB 3.4Å; I302-L306 PolarHBondContact O-N 2.89Å; L303-L306 PolarHBondContact O-N 3.48Å; S304-L306 VanDerWaalsContact C-N 3.34Å; S304-L306 PolarHBondContact O-N 3.32Å; L306-T310 PolarHBondContact O-OG1 3.13Å
307	S	89.5	Confident	86.4	Confident	59 Å²	59	48.4 Å²	48.4	41%	0.413	28%	0.281	S	S	.	.	I	π-helix	trans	-99.2	-62.7	-174.7	-170.2	0	0	0	0	113.4	R279 L303 S304 R305 T310 T311	R279-S307 PolarHBondContact NH2-O 2.93Å; L303-S307 VanDerWaalsContact O-CB 3.28Å; L303-S307 WeakPolarHBondContact O-CB 3.47Å; L303-S307 PolarHBondContact O-N 2.86Å; S304-S307 PolarHBondContact O-N 2.86Å; R305-S307 PolarHBondContact O-N 3.43Å; S307-T310 PolarHBondContact O-OG1 2.65Å; S307-T311 PolarHBondContact O-OG1 3.21Å
308	A	88.8	Confident	86	Confident	48 Å²	48	46.9 Å²	46.9	40%	0.397	27%	0.273	S	S	.	.	I	π-helix	trans	-75.6	-55.4	-172.1	0	0	0	0	0	111.3	S304 T310 T311 Q312	S304-A308 WeakPolarHBondContact O-CA 3.3Å; S304-A308 WeakPolarHBondContact O-CB 3.28Å; S304-A308 PolarHBondContact O-N 3.41Å; A308-T310 PolarHBondContact O-N 3.3Å; A308-T311 WeakPolarHBondContact O-CB 3.39Å; A308-T311 PolarHBondContact O-N 3.3Å; A308-T311 VanDerWaalsContact O-N 3.09Å; A308-Q312 PolarHBondContact O-N 3.04Å
309	D	89.3	Confident	85.9	Confident	14 Å²	14	45.6 Å²	45.6	8%	0.075	27%	0.267	C	S	.	.	I	π-helix	trans	-64.8	-41.5	-174.5	-69.5	-10.4	0	0	0	111.4	S304 R305 T311 Q312 V313 A492 V496	S304-D309 PolarHBondContact O-N 2.99Å; S304-D309 VanDerWaalsContact O-N 3.15Å; R305-D309 WeakPolarHBondContact CD-OD2 3.48Å; R305-D309 IonicContact CZ-OD2 3.47Å; R305-D309 IonicContact NE-OD2 3.52Å; R305-D309 IonicContact NH1-OD2 2.88Å; R305-D309 PolarHBondContact NH1-OD2 3.27Å; D309-T311 PolarHBondContact O-N 3.4Å; D309-Q312 PolarHBondContact O-N 2.97Å; D309-V313 WeakPolarHBondContact O-CB 3.29Å; D309-V313 WeakPolarHBondContact O-CG2 3.49Å; D309-V313 PolarHBondContact O-N 2.85Å; D309-A492 HydrophobicContact CB-CB 4.14Å; D309-V496 HydrophobicContact CB-CG2 3.68Å
310	T	90	Very high	86	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-60.4	-32.8	175	58.3	0	0	0	0	113.6	R279 L282 R305 L306 S307 A308 S314 V496	R279-T310 HydrophobicContact CG-CG2 4.02Å; R279-T310 VanDerWaalsContact CG-OG1 3.3Å; R279-T310 WeakPolarHBondContact CG-OG1 3.28Å; R279-T310 PolarHBondContact NE-OG1 3.46Å; L282-T310 HydrophobicContact CD2-CG2 3.72Å; R305-T310 WeakPolarHBondContact O-CG2 3.46Å; R305-T310 PolarHBondContact O-N 2.98Å; L306-T310 PolarHBondContact O-OG1 3.13Å; S307-T310 PolarHBondContact O-OG1 2.65Å; A308-T310 PolarHBondContact O-N 3.3Å; T310-S314 PolarHBondContact O-N 3.18Å; T310-S314 PolarHBondContact O-OG 3.29Å; T310-V496 HydrophobicContact CG2-CG1 4.32Å; T310-V496 HydrophobicContact CG2-CG2 4.15Å
311	T	88.9	Confident	86	Confident	42 Å²	42	41.9 Å²	41.9	26%	0.258	23%	0.233	S	C	.	.	H	α-helix	trans	-73.6	-44	174.8	-51.1	0	0	0	0	110.8	N275 R279 S307 A308 D309 V313 S314 D315	N275-T311 WeakPolarHBondContact ND2-CA 3.25Å; R279-T311 PolarHBondContact NH2-OG1 2.78Å; S307-T311 PolarHBondContact O-OG1 3.21Å; A308-T311 WeakPolarHBondContact O-CB 3.39Å; A308-T311 PolarHBondContact O-N 3.3Å; A308-T311 VanDerWaalsContact O-N 3.09Å; D309-T311 PolarHBondContact O-N 3.4Å; T311-V313 PolarHBondContact O-N 3.29Å; T311-S314 PolarHBondContact O-N 3.26Å; T311-S314 PolarHBondContact O-OG 3.41Å; T311-S314 VanDerWaalsContact O-OG 3.1Å; T311-D315 VanDerWaalsContact CG2-OD2 3.29Å; T311-D315 WeakPolarHBondContact CG2-OD2 3.15Å; T311-D315 VanDerWaalsContact O-CB 3.24Å; T311-D315 WeakPolarHBondContact O-CB 3.28Å; T311-D315 VanDerWaalsContact O-CG 3.3Å; T311-D315 PolarHBondContact O-N 3.48Å
312	Q	87.8	Confident	86.2	Confident	62 Å²	62	39.8 Å²	39.8	29%	0.29	22%	0.222	S	C	.	.	H	α-helix	trans	-59	-38	175.4	-164	173.8	16.3	0	0	111.6	A308 D309 L316 A492	A308-Q312 PolarHBondContact O-N 3.04Å; D309-Q312 PolarHBondContact O-N 2.97Å; Q312-L316 HydrophobicContact CG-CD1 3.4Å; Q312-L316 VanDerWaalsContact CG-CD1 3.4Å; Q312-L316 HydrophobicContact CG-CG 3.82Å; Q312-L316 VanDerWaalsContact O-CB 3.23Å; Q312-L316 WeakPolarHBondContact O-CB 3.23Å; Q312-L316 PolarHBondContact O-N 2.81Å; Q312-A492 HydrophobicContact CB-CB 4.06Å; Q312-A492 HydrophobicContact CG-CB 4.16Å
313	V	87.1	Confident	86.1	Confident	0 Å²	0	41 Å²	41	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-67.3	-47.4	174.3	171.4	0	0	0	0	112.3	L194 L278 D309 T311 I317 A492 A493 V496	L194-V313 HydrophobicContact CD1-CG1 3.59Å; L278-V313 HydrophobicContact CD1-CG1 3.77Å; D309-V313 WeakPolarHBondContact O-CB 3.29Å; D309-V313 WeakPolarHBondContact O-CG2 3.49Å; D309-V313 PolarHBondContact O-N 2.85Å; T311-V313 PolarHBondContact O-N 3.29Å; V313-I317 HydrophobicContact CB-CD1 4.49Å; V313-I317 HydrophobicContact CG1-CD1 4.07Å; V313-I317 WeakPolarHBondContact O-CB 3.42Å; V313-A492 HydrophobicContact CG2-CB 3.79Å; V313-A493 HydrophobicContact CG1-CB 4.23Å; V313-A493 VanDerWaalsContact CG2-CA 3.4Å; V313-A493 HydrophobicContact CG2-CB 3.76Å; V313-A493 VanDerWaalsContact CG2-N 3.26Å; V313-V496 HydrophobicContact CG2-CG2 4.36Å
314	S	83.8	Confident	86.1	Confident	0 Å²	0	40.2 Å²	40.2	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-68.5	-36.7	-179.8	59.4	0	0	0	0	112.7	N275 T310 T311 S318	N275-S314 PolarHBondContact ND2-OG 2.88Å; T310-S314 PolarHBondContact O-N 3.18Å; T310-S314 PolarHBondContact O-OG 3.29Å; T311-S314 PolarHBondContact O-N 3.26Å; T311-S314 PolarHBondContact O-OG 3.41Å; T311-S314 VanDerWaalsContact O-OG 3.1Å; S314-S318 WeakPolarHBondContact O-CB 3.45Å; S314-S318 PolarHBondContact O-OG 3.46Å
315	D	83	Confident	86.1	Confident	73 Å²	73	41 Å²	41	39%	0.39	22%	0.222	S	C	.	.	H	α-helix	trans	-97.2	-53.6	-165.5	-61.4	6.7	0	0	0	110.4	T311 Q319	T311-D315 VanDerWaalsContact CG2-OD2 3.29Å; T311-D315 WeakPolarHBondContact CG2-OD2 3.15Å; T311-D315 VanDerWaalsContact O-CB 3.24Å; T311-D315 WeakPolarHBondContact O-CB 3.28Å; T311-D315 VanDerWaalsContact O-CG 3.3Å; T311-D315 PolarHBondContact O-N 3.48Å; D315-Q319 WeakPolarHBondContact O-CB 3.41Å; D315-Q319 PolarHBondContact O-N 2.99Å
316	L	81.3	Confident	86.2	Confident	44 Å²	44	42.6 Å²	42.6	23%	0.23	23%	0.228	C	C	.	.	H	α-helix	trans	-66.3	-49.6	-177.7	-62.2	-169.5	0	0	0	112	Q312 S318 N320 Q488	Q312-L316 HydrophobicContact CG-CD1 3.4Å; Q312-L316 VanDerWaalsContact CG-CD1 3.4Å; Q312-L316 HydrophobicContact CG-CG 3.82Å; Q312-L316 VanDerWaalsContact O-CB 3.23Å; Q312-L316 WeakPolarHBondContact O-CB 3.23Å; Q312-L316 PolarHBondContact O-N 2.81Å; L316-S318 PolarHBondContact O-N 3.39Å; L316-N320 WeakPolarHBondContact O-CB 3.43Å; L316-N320 VanDerWaalsContact O-CG 3.27Å; L316-N320 PolarHBondContact O-N 3.13Å; L316-N320 PolarHBondContact O-ND2 3.13Å; L316-Q488 HydrophobicContact CD1-CB 4.08Å
317	I	78.2	Confident	86.2	Confident	5 Å²	5	41 Å²	41	3%	0.026	22%	0.22	C	C	.	.	H	α-helix	trans	-60.9	-43.1	-175.8	-57.4	175.1	0	0	0	109.6	L191 L194 V313 V321 L486 G489 A493	L191-I317 HydrophobicContact CD2-CG2 3.93Å; L194-I317 HydrophobicContact CD2-CB 3.86Å; L194-I317 HydrophobicContact CD2-CD1 3.58Å; L194-I317 HydrophobicContact CD2-CG1 4.33Å; L194-I317 HydrophobicContact CD2-CG2 3.48Å; L194-I317 VanDerWaalsContact CD2-CG2 3.48Å; V313-I317 HydrophobicContact CB-CD1 4.49Å; V313-I317 HydrophobicContact CG1-CD1 4.07Å; V313-I317 WeakPolarHBondContact O-CB 3.42Å; I317-V321 HydrophobicContact CG2-CG2 4.41Å; I317-V321 WeakPolarHBondContact O-CB 3.19Å; I317-V321 WeakPolarHBondContact O-CG2 3.43Å; I317-V321 PolarHBondContact O-N 3.47Å; I317-L486 HydrophobicContact CG2-CD1 3.91Å; I317-G489 WeakPolarHBondContact CD1-O 3.35Å; I317-A493 HydrophobicContact CD1-CB 4.06Å
318	S	78.6	Confident	86.3	Confident	7 Å²	7	40.8 Å²	40.8	5%	0.049	22%	0.216	C	C	.	.	H	α-helix	trans	-71.1	-50.1	-177.1	-52.8	0	0	0	0	112.3	F267 M271 S314 L316 N320 V321 N322	F267-S318 VanDerWaalsContact CE1-C 3.47Å; F267-S318 VanDerWaalsContact CE1-O 3.25Å; F267-S318 WeakPolarHBondContact CE1-O 3.39Å; F267-S318 WeakPolarHBondContact CZ-O 3.47Å; M271-S318 VanDerWaalsContact CG-CB 3.45Å; M271-S318 WeakPolarHBondContact SD-CB 3.47Å; M271-S318 PolarHBondContact SD-OG 3.22Å; S314-S318 WeakPolarHBondContact O-CB 3.45Å; S314-S318 PolarHBondContact O-OG 3.46Å; L316-S318 PolarHBondContact O-N 3.39Å; S318-N320 VanDerWaalsContact C-N 3.27Å; S318-N320 PolarHBondContact O-N 3.41Å; S318-V321 PolarHBondContact O-N 3.03Å; S318-N322 WeakPolarHBondContact O-CB 3.01Å; S318-N322 PolarHBondContact O-N 3.23Å
319	Q	82.8	Confident	86.4	Confident	116 Å²	116	40.7 Å²	40.7	54%	0.542	21%	0.208	S	C	.	.	H	α-helix	trans	-57.9	-43.4	177.1	-178.3	175.3	-11.1	0	0	110.7	D315 N322 V323	D315-Q319 WeakPolarHBondContact O-CB 3.41Å; D315-Q319 PolarHBondContact O-N 2.99Å; Q319-N322 WeakPolarHBondContact O-CB 3.4Å; Q319-N322 PolarHBondContact O-N 3.41Å; Q319-V323 WeakPolarHBondContact O-CG2 3.39Å; Q319-V323 PolarHBondContact O-N 2.85Å
320	N	86.9	Confident	86.5	Confident	20 Å²	20	40.1 Å²	40.1	11%	0.107	21%	0.205	C	C	.	.	H	α-helix	trans	-68.1	-38.7	178.2	-70.8	-54.4	0	0	0	112.5	L316 S318 N322 V323 F324 V482 G485 L486	L316-N320 WeakPolarHBondContact O-CB 3.43Å; L316-N320 VanDerWaalsContact O-CG 3.27Å; L316-N320 PolarHBondContact O-N 3.13Å; L316-N320 PolarHBondContact O-ND2 3.13Å; S318-N320 VanDerWaalsContact C-N 3.27Å; S318-N320 PolarHBondContact O-N 3.41Å; N320-N322 VanDerWaalsContact C-N 3.34Å; N320-N322 PolarHBondContact O-N 2.89Å; N320-V323 PolarHBondContact O-N 3.07Å; N320-F324 WeakPolarHBondContact O-CB 3.38Å; N320-F324 PolarHBondContact O-N 3.47Å; N320-V482 HydrophobicContact CB-CB 4.44Å; N320-V482 HydrophobicContact CB-CG1 4.21Å; N320-V482 HydrophobicContact CB-CG2 4.19Å; N320-V482 VanDerWaalsContact O-CG2 3.32Å; N320-V482 WeakPolarHBondContact O-CG2 3.49Å; N320-G485 VanDerWaalsContact ND2-C 3.27Å; N320-G485 WeakPolarHBondContact ND2-CA 3.43Å; N320-L486 HydrophobicContact CB-CB 4.49Å
321	V	83.4	Confident	86.6	Confident	66 Å²	66	40.4 Å²	40.4	40%	0.4	21%	0.208	S	C	.	.	H	α-helix	trans	-62.8	-38.9	172.4	165.6	0	0	0	0	112	I317 S318 L325	I317-V321 HydrophobicContact CG2-CG2 4.41Å; I317-V321 WeakPolarHBondContact O-CB 3.19Å; I317-V321 WeakPolarHBondContact O-CG2 3.43Å; I317-V321 PolarHBondContact O-N 3.47Å; S318-V321 PolarHBondContact O-N 3.03Å; V321-L325 WeakPolarHBondContact O-CB 3.43Å; V321-L325 PolarHBondContact O-N 2.87Å
322	N	85.7	Confident	86.8	Confident	27 Å²	27	42 Å²	42	14%	0.144	22%	0.218	C	C	.	.	H	α-helix	trans	-66.7	-45.4	177	-177	33.6	0	0	0	112.3	R263 F267 S318 Q319 N320 R326	R263-N322 VanDerWaalsContact NH1-CG 3.34Å; R263-N322 PolarHBondContact NH1-ND2 3.14Å; R263-N322 VanDerWaalsContact NH1-ND2 3.16Å; R263-N322 PolarHBondContact NH1-OD1 2.93Å; F267-N322 HydrophobicContact CD1-CB 4.23Å; F267-N322 HydrophobicContact CD2-CB 4.39Å; F267-N322 HydrophobicContact CE1-CB 3.77Å; F267-N322 HydrophobicContact CE2-CB 3.95Å; F267-N322 HydrophobicContact CZ-CB 3.63Å; S318-N322 WeakPolarHBondContact O-CB 3.01Å; S318-N322 PolarHBondContact O-N 3.23Å; Q319-N322 WeakPolarHBondContact O-CB 3.4Å; Q319-N322 PolarHBondContact O-N 3.41Å; N320-N322 VanDerWaalsContact C-N 3.34Å; N320-N322 PolarHBondContact O-N 2.89Å; N322-R326 WeakPolarHBondContact O-CB 3.4Å; N322-R326 PolarHBondContact O-N 3.15Å
323	V	88.7	Confident	87	Confident	39 Å²	39	39.8 Å²	39.8	24%	0.236	21%	0.211	C	C	.	.	H	α-helix	trans	-63.9	-46.2	174.8	172.7	0	0	0	0	110.3	Q319 N320 L325 R326 S327 V482	Q319-V323 WeakPolarHBondContact O-CG2 3.39Å; Q319-V323 PolarHBondContact O-N 2.85Å; N320-V323 PolarHBondContact O-N 3.07Å; V323-L325 PolarHBondContact O-N 2.71Å; V323-R326 WeakPolarHBondContact O-CB 3.35Å; V323-R326 PolarHBondContact O-N 2.83Å; V323-S327 PolarHBondContact O-N 2.87Å; V323-S327 PolarHBondContact O-OG 3.38Å; V323-V482 HydrophobicContact CB-CG2 3.78Å; V323-V482 HydrophobicContact CG1-CG2 3.61Å
324	F	89.3	Confident	87.3	Confident	96 Å²	96	39.8 Å²	39.8	42%	0.421	21%	0.211	S	C	.	.	H	α-helix	trans	-56.2	-52.4	177.7	-175.3	-107.6	0	0	0	112.2	N320 R326 S327 V328 I479 V482	N320-F324 WeakPolarHBondContact O-CB 3.38Å; N320-F324 PolarHBondContact O-N 3.47Å; F324-R326 VanDerWaalsContact C-N 3.32Å; F324-R326 PolarHBondContact O-N 3.1Å; F324-S327 PolarHBondContact O-N 3.3Å; F324-V328 HydrophobicContact CD1-CG2 4.36Å; F324-V328 HydrophobicContact CD2-CG2 4.19Å; F324-V328 HydrophobicContact CE1-CG2 4.04Å; F324-V328 HydrophobicContact CE2-CG2 3.86Å; F324-V328 HydrophobicContact CG-CG2 4.44Å; F324-V328 HydrophobicContact CZ-CG2 3.78Å; F324-V328 WeakPolarHBondContact O-CB 3.07Å; F324-V328 VanDerWaalsContact O-CG2 3.3Å; F324-V328 WeakPolarHBondContact O-CG2 3.21Å; F324-V328 PolarHBondContact O-N 2.8Å; F324-I479 HydrophobicContact CD2-CG1 4.41Å; F324-I479 HydrophobicContact CD2-CG2 4.4Å; F324-I479 HydrophobicContact CE2-CG2 4.22Å; F324-V482 HydrophobicContact CB-CG1 3.86Å; F324-V482 HydrophobicContact CB-CG2 4.2Å; F324-V482 HydrophobicContact CD2-CG1 3.97Å; F324-V482 HydrophobicContact CG-CG1 4.25Å
325	L	87.3	Confident	87.7	Confident	65 Å²	65	42.7 Å²	42.7	34%	0.34	23%	0.227	S	C	.	.	H	α-helix	trans	-64.6	-38.4	-178.3	-169.3	63.9	0	0	0	111.3	V209 L212 V321 V323 I329	V209-L325 HydrophobicContact CG2-CD2 4.09Å; L212-L325 HydrophobicContact CD2-CB 3.98Å; L212-L325 HydrophobicContact CD2-CD2 3.62Å; L212-L325 HydrophobicContact CD2-CG 3.55Å; V321-L325 WeakPolarHBondContact O-CB 3.43Å; V321-L325 PolarHBondContact O-N 2.87Å; V323-L325 PolarHBondContact O-N 2.71Å; L325-I329 HydrophobicContact CD1-CD1 4.03Å; L325-I329 HydrophobicContact CG-CD1 3.9Å; L325-I329 WeakPolarHBondContact O-CB 3.49Å; L325-I329 WeakPolarHBondContact O-CD1 3.24Å; L325-I329 WeakPolarHBondContact O-CG1 3.1Å; L325-I329 PolarHBondContact O-N 3.09Å
326	R	89.1	Confident	88.1	Confident	78 Å²	78	44.3 Å²	44.3	29%	0.294	23%	0.234	S	C	.	.	H	α-helix	trans	-56.7	-56.7	171.3	173.5	-171.4	159	160.6	3.3	111.1	L212 N322 V323 F324 V328 I329 K330	L212-R326 HydrophobicContact CD1-CB 3.77Å; L212-R326 HydrophobicContact CD1-CG 4.29Å; N322-R326 WeakPolarHBondContact O-CB 3.4Å; N322-R326 PolarHBondContact O-N 3.15Å; V323-R326 WeakPolarHBondContact O-CB 3.35Å; V323-R326 PolarHBondContact O-N 2.83Å; F324-R326 VanDerWaalsContact C-N 3.32Å; F324-R326 PolarHBondContact O-N 3.1Å; R326-V328 PolarHBondContact O-N 2.85Å; R326-I329 PolarHBondContact O-N 2.97Å; R326-K330 HydrophobicContact CG-CD 3.89Å; R326-K330 VanDerWaalsContact NE-NZ 3.14Å; R326-K330 WeakPolarHBondContact O-CB 3.46Å; R326-K330 WeakPolarHBondContact O-CG 3.47Å; R326-K330 PolarHBondContact O-N 2.97Å
327	S	91.8	Very high	88.7	Confident	1 Å²	1	44 Å²	44	1%	0.007	23%	0.231	C	C	.	.	H	α-helix	trans	-71.5	-31.5	-170.5	-59.1	0	0	0	0	112.6	V323 F324 G331 S478	V323-S327 PolarHBondContact O-N 2.87Å; V323-S327 PolarHBondContact O-OG 3.38Å; F324-S327 PolarHBondContact O-N 3.3Å; S327-G331 WeakPolarHBondContact O-CA 3.32Å; S327-G331 PolarHBondContact O-N 3.5Å; S327-S478 WeakPolarHBondContact OG-CB 3.49Å
328	V	91.4	Very high	89.4	Confident	53 Å²	53	43.8 Å²	43.8	32%	0.321	23%	0.23	S	C	.	.	H	α-helix	trans	-66.1	-46.3	172	170.3	0	0	0	0	111.4	F324 R326 T332 I479	F324-V328 HydrophobicContact CD1-CG2 4.36Å; F324-V328 HydrophobicContact CD2-CG2 4.19Å; F324-V328 HydrophobicContact CE1-CG2 4.04Å; F324-V328 HydrophobicContact CE2-CG2 3.86Å; F324-V328 HydrophobicContact CG-CG2 4.44Å; F324-V328 HydrophobicContact CZ-CG2 3.78Å; F324-V328 WeakPolarHBondContact O-CB 3.07Å; F324-V328 VanDerWaalsContact O-CG2 3.3Å; F324-V328 WeakPolarHBondContact O-CG2 3.21Å; F324-V328 PolarHBondContact O-N 2.8Å; R326-V328 PolarHBondContact O-N 2.85Å; V328-T332 VanDerWaalsContact O-CB 3.31Å; V328-T332 WeakPolarHBondContact O-CB 3.25Å; V328-T332 PolarHBondContact O-N 3.32Å; V328-T332 PolarHBondContact O-OG1 3.08Å; V328-I479 HydrophobicContact CG2-CD1 4.07Å
329	I	91	Very high	90	Very high	46 Å²	46	48 Å²	48	24%	0.236	25%	0.247	C	C	.	.	H	α-helix	trans	-66.2	-46.7	-179.9	-65.8	167.5	0	0	0	110.4	L212 L213 A216 L325 R326 G333	L212-I329 HydrophobicContact CD2-CD1 3.88Å; L212-I329 HydrophobicContact CG-CD1 4.37Å; L213-I329 HydrophobicContact CD2-CD1 3.98Å; L213-I329 HydrophobicContact CD2-CG2 4.24Å; A216-I329 HydrophobicContact CB-CB 4.46Å; A216-I329 HydrophobicContact CB-CG2 3.66Å; L325-I329 HydrophobicContact CD1-CD1 4.03Å; L325-I329 HydrophobicContact CG-CD1 3.9Å; L325-I329 WeakPolarHBondContact O-CB 3.49Å; L325-I329 WeakPolarHBondContact O-CD1 3.24Å; L325-I329 WeakPolarHBondContact O-CG1 3.1Å; L325-I329 PolarHBondContact O-N 3.09Å; R326-I329 PolarHBondContact O-N 2.97Å; I329-G333 PolarHBondContact O-N 3.47Å; I329-G333 VanDerWaalsContact O-N 3.11Å
330	K	91.1	Very high	90.4	Very high	2 Å²	2	52.6 Å²	52.6	1%	0.009	26%	0.26	C	S	.	.	H	α-helix	trans	-65.3	-51	178.8	-73.1	-176.9	179.7	179.4	0	112.6	A216 E219 R326 T332 G333 F334	A216-K330 HydrophobicContact CB-CG 3.75Å; E219-K330 WeakPolarHBondContact OE1-CE 3.3Å; E219-K330 IonicContact OE1-NZ 2.79Å; E219-K330 PolarHBondContact OE1-NZ 2.87Å; E219-K330 WeakPolarHBondContact OE2-CE 3.49Å; E219-K330 IonicContact OE2-NZ 4Å; E219-K330 PolarHBondContact OE2-NZ 3.42Å; R326-K330 HydrophobicContact CG-CD 3.89Å; R326-K330 VanDerWaalsContact NE-NZ 3.14Å; R326-K330 WeakPolarHBondContact O-CB 3.46Å; R326-K330 WeakPolarHBondContact O-CG 3.47Å; R326-K330 PolarHBondContact O-N 2.97Å; K330-T332 VanDerWaalsContact C-N 3.27Å; K330-T332 PolarHBondContact O-N 3.2Å; K330-G333 CarbonylContact O-C 3.54Å; K330-G333 WeakPolarHBondContact O-CA 3.31Å; K330-G333 PolarHBondContact O-N 3.28Å; K330-F334 HydrophobicContact CB-CD2 4.46Å; K330-F334 HydrophobicContact CB-CE2 3.92Å; K330-F334 HydrophobicContact CB-CZ 4.18Å; K330-F334 WeakPolarHBondContact O-CD2 3.35Å; K330-F334 VanDerWaalsContact O-CG 3.3Å; K330-F334 WeakPolarHBondContact O-CG 3.48Å; K330-F334 PolarHBondContact O-N 3.45Å
331	G	92.3	Very high	90.4	Very high	7 Å²	7	54.4 Å²	54.4	7%	0.072	27%	0.268	C	S	.	.	H	α-helix	trans	-57.5	-39.3	177.9	0	0	0	0	0	112.6	S327 F334 I335	S327-G331 WeakPolarHBondContact O-CA 3.32Å; S327-G331 PolarHBondContact O-N 3.5Å; G331-F334 PolarHBondContact O-N 2.99Å; G331-I335 WeakPolarHBondContact O-CB 3.17Å; G331-I335 WeakPolarHBondContact O-CD1 3.29Å; G331-I335 VanDerWaalsContact O-CG1 3.22Å; G331-I335 WeakPolarHBondContact O-CG1 3.36Å; G331-I335 PolarHBondContact O-N 2.95Å
332	T	91.8	Very high	90.8	Very high	75 Å²	75	51.9 Å²	51.9	46%	0.46	25%	0.254	S	S	.	.	H	α-helix	trans	-61.5	-44.8	172.5	-56.8	0	0	0	0	111.5	V328 K330 I336	V328-T332 VanDerWaalsContact O-CB 3.31Å; V328-T332 WeakPolarHBondContact O-CB 3.25Å; V328-T332 PolarHBondContact O-N 3.32Å; V328-T332 PolarHBondContact O-OG1 3.08Å; K330-T332 VanDerWaalsContact C-N 3.27Å; K330-T332 PolarHBondContact O-N 3.2Å; T332-I336 HydrophobicContact CG2-CD1 4.01Å; T332-I336 WeakPolarHBondContact O-CD1 3.34Å; T332-I336 VanDerWaalsContact O-CG1 3.27Å; T332-I336 WeakPolarHBondContact O-CG1 3.44Å; T332-I336 PolarHBondContact O-N 3.07Å; T332-I336 VanDerWaalsContact O-N 3.13Å
333	G	91.9	Very high	90.9	Very high	15 Å²	15	54.9 Å²	54.9	16%	0.155	26%	0.263	C	S	.	.	H	α-helix	trans	-59.6	-50.3	174.6	0	0	0	0	0	112.9	I329 K330 I335 I336 F337	I329-G333 PolarHBondContact O-N 3.47Å; I329-G333 VanDerWaalsContact O-N 3.11Å; K330-G333 CarbonylContact O-C 3.54Å; K330-G333 WeakPolarHBondContact O-CA 3.31Å; K330-G333 PolarHBondContact O-N 3.28Å; G333-I335 PolarHBondContact O-N 3.21Å; G333-I336 PolarHBondContact O-N 2.73Å; G333-F337 VanDerWaalsContact O-CD2 3.24Å; G333-F337 WeakPolarHBondContact O-CD2 3.27Å; G333-F337 PolarHBondContact O-N 3.18Å
334	F	94.2	Very high	90.9	Very high	0 Å²	0	54 Å²	54	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-58.7	-46.7	179.1	-59.2	-32.3	0	0	0	111.9	A220 K330 G331 I336 F337 M338 Y468 E471 L472	A220-F334 HydrophobicContact CB-CE1 4.48Å; K330-F334 HydrophobicContact CB-CD2 4.46Å; K330-F334 HydrophobicContact CB-CE2 3.92Å; K330-F334 HydrophobicContact CB-CZ 4.18Å; K330-F334 WeakPolarHBondContact O-CD2 3.35Å; K330-F334 VanDerWaalsContact O-CG 3.3Å; K330-F334 WeakPolarHBondContact O-CG 3.48Å; K330-F334 PolarHBondContact O-N 3.45Å; G331-F334 PolarHBondContact O-N 2.99Å; F334-I336 VanDerWaalsContact C-N 3.31Å; F334-I336 PolarHBondContact O-N 3.2Å; F334-F337 PolarHBondContact O-N 3.29Å; F334-F337 VanDerWaalsContact O-N 3.17Å; F334-M338 WeakPolarHBondContact O-CB 3.37Å; F334-M338 VanDerWaalsContact O-CG 3.24Å; F334-M338 WeakPolarHBondContact O-CG 3.3Å; F334-M338 PolarHBondContact O-N 2.87Å; F334-Y468 HydrophobicContact CB-CD1 4.23Å; F334-Y468 AromaticContact CD1-CD1 3.52Å; F334-Y468 HydrophobicContact CD1-CD1 3.52Å; F334-Y468 AromaticContact CD1-CE1 3.73Å; F334-Y468 HydrophobicContact CD1-CE1 3.73Å; F334-Y468 HydrophobicContact CE1-CD1 4.16Å; F334-Y468 HydrophobicContact CE1-CE1 4.23Å; F334-Y468 HydrophobicContact CG-CD1 4.14Å; F334-E471 HydrophobicContact CD2-CB 4.08Å; F334-E471 HydrophobicContact CE1-CB 4.41Å; F334-E471 HydrophobicContact CE2-CB 3.55Å; F334-E471 HydrophobicContact CZ-CB 3.73Å; F334-E471 HydrophobicContact CZ-CG 4.33Å; F334-L472 HydrophobicContact CB-CB 4.49Å; F334-L472 HydrophobicContact CD2-CB 4.46Å
335	I	92	Very high	90.9	Very high	62 Å²	62	49.5 Å²	49.5	32%	0.318	24%	0.236	S	C	.	.	H	α-helix	trans	-57	-44.2	175.8	-70.7	166.6	0	0	0	111.1	G331 G333 M338 F339 L472	G331-I335 WeakPolarHBondContact O-CB 3.17Å; G331-I335 WeakPolarHBondContact O-CD1 3.29Å; G331-I335 VanDerWaalsContact O-CG1 3.22Å; G331-I335 WeakPolarHBondContact O-CG1 3.36Å; G331-I335 PolarHBondContact O-N 2.95Å; G333-I335 PolarHBondContact O-N 3.21Å; I335-M338 PolarHBondContact O-N 3.11Å; I335-F339 HydrophobicContact CG2-CD2 3.68Å; I335-F339 HydrophobicContact CG2-CE2 3.75Å; I335-F339 WeakPolarHBondContact O-CD2 3.46Å; I335-F339 PolarHBondContact O-N 3.32Å; I335-L472 HydrophobicContact CD1-CD1 4.12Å; I335-L472 HydrophobicContact CG1-CD1 3.93Å; I335-L472 HydrophobicContact CG1-CD2 3.89Å
336	I	92.4	Very high	91.1	Very high	106 Å²	106	46.6 Å²	46.6	54%	0.544	22%	0.221	S	C	.	.	H	α-helix	trans	-62.6	-44	177.6	-68.6	163.8	0	0	0	111.4	T332 G333 F334 R340	T332-I336 HydrophobicContact CG2-CD1 4.01Å; T332-I336 WeakPolarHBondContact O-CD1 3.34Å; T332-I336 VanDerWaalsContact O-CG1 3.27Å; T332-I336 WeakPolarHBondContact O-CG1 3.44Å; T332-I336 PolarHBondContact O-N 3.07Å; T332-I336 VanDerWaalsContact O-N 3.13Å; G333-I336 PolarHBondContact O-N 2.73Å; F334-I336 VanDerWaalsContact C-N 3.31Å; F334-I336 PolarHBondContact O-N 3.2Å; I336-R340 WeakPolarHBondContact O-CB 3.45Å; I336-R340 PolarHBondContact O-N 2.91Å; I336-R340 VanDerWaalsContact O-N 3.09Å
337	F	92.8	Very high	91	Very high	38 Å²	38	43.7 Å²	43.7	17%	0.167	21%	0.211	C	C	.	.	H	α-helix	trans	-67.5	-41.5	177.9	-80.7	-71.2	0	0	0	112.7	A220 F221 L224 G333 F334 R340 M341 Y468	A220-F337 HydrophobicContact CB-CD2 4.3Å; A220-F337 HydrophobicContact CB-CE2 3.92Å; F221-F337 HydrophobicContact CD1-CE1 4.31Å; F221-F337 AromaticContact CD1-CZ 3.92Å; F221-F337 HydrophobicContact CD1-CZ 3.92Å; F221-F337 AromaticContact CE1-CE1 3.98Å; F221-F337 HydrophobicContact CE1-CE1 3.98Å; F221-F337 AromaticContact CE1-CZ 3.57Å; F221-F337 HydrophobicContact CE1-CZ 3.57Å; F221-F337 AromaticContact CZ-CZ 3.91Å; F221-F337 HydrophobicContact CZ-CZ 3.91Å; L224-F337 HydrophobicContact CD1-CD1 4.13Å; L224-F337 HydrophobicContact CD1-CE1 4.05Å; G333-F337 VanDerWaalsContact O-CD2 3.24Å; G333-F337 WeakPolarHBondContact O-CD2 3.27Å; G333-F337 PolarHBondContact O-N 3.18Å; F334-F337 PolarHBondContact O-N 3.29Å; F334-F337 VanDerWaalsContact O-N 3.17Å; F337-R340 PolarHBondContact O-N 2.9Å; F337-M341 WeakPolarHBondContact O-CB 3.26Å; F337-M341 PolarHBondContact O-N 3.43Å; F337-Y468 HydrophobicContact CB-CD2 4.43Å; F337-Y468 HydrophobicContact CB-CE1 4.09Å; F337-Y468 HydrophobicContact CB-CE2 3.87Å; F337-Y468 HydrophobicContact CD2-CE1 4.43Å; F337-Y468 HydrophobicContact CG-CE1 4.41Å; F337-Y468 HydrophobicContact CG-CE2 4.48Å; F337-Y468 AromaticContact CG-CZ 3.92Å
338	M	93.1	Very high	90.9	Very high	1 Å²	1	44.7 Å²	44.7	1%	0.005	22%	0.218	C	C	.	.	H	α-helix	trans	-60.3	-51.3	176.7	-70.7	172.7	80.2	0	0	111.4	F334 I335 R340 M341 S342 T346 T349 F465 Y468 M469 L472	F334-M338 WeakPolarHBondContact O-CB 3.37Å; F334-M338 VanDerWaalsContact O-CG 3.24Å; F334-M338 WeakPolarHBondContact O-CG 3.3Å; F334-M338 PolarHBondContact O-N 2.87Å; I335-M338 PolarHBondContact O-N 3.11Å; M338-R340 VanDerWaalsContact C-N 3.31Å; M338-R340 PolarHBondContact O-N 3.5Å; M338-M341 PolarHBondContact O-N 2.89Å; M338-M341 VanDerWaalsContact O-N 3.13Å; M338-S342 CarbonylContact O-C 3.6Å; M338-S342 PolarHBondContact O-N 3.14Å; M338-T346 HydrophobicContact CB-CG2 4.18Å; M338-T346 PolarHBondContact O-OG1 3.46Å; M338-T346 VanDerWaalsContact O-OG1 3.12Å; M338-T349 HydrophobicContact CE-CG2 4.13Å; M338-F465 HydrophobicContact CB-CD2 4.39Å; M338-F465 HydrophobicContact CB-CE2 3.83Å; M338-F465 HydrophobicContact CE-CD2 4.49Å; M338-F465 HydrophobicContact CE-CE1 3.78Å; M338-F465 HydrophobicContact CE-CE2 3.74Å; M338-F465 HydrophobicContact CE-CZ 3.31Å; M338-F465 HydrophobicContact CG-CD2 4.35Å; M338-F465 HydrophobicContact CG-CE2 4.05Å; M338-Y468 HydrophobicContact CG-CG 4.26Å; M338-M469 HydrophobicContact CE-CB 4.03Å; M338-L472 HydrophobicContact CE-CD2 4.42Å; M338-L472 HydrophobicContact SD-CD2 3.77Å
339	F	91.4	Very high	90.8	Very high	94 Å²	94	42.3 Å²	42.3	41%	0.412	20%	0.203	S	C	.	.	H	α-helix	trans	-60.9	-38	177.1	-88.5	-65.5	0	0	0	112.9	I335 M341 W343 T346	I335-F339 HydrophobicContact CG2-CD2 3.68Å; I335-F339 HydrophobicContact CG2-CE2 3.75Å; I335-F339 WeakPolarHBondContact O-CD2 3.46Å; I335-F339 PolarHBondContact O-N 3.32Å; F339-M341 VanDerWaalsContact C-N 3.29Å; F339-M341 PolarHBondContact O-N 3.5Å; F339-W343 HydrophobicContact CD1-CB 4.08Å; F339-W343 PolarHBondContact O-N 3.12Å; F339-T346 HydrophobicContact CD1-CG2 3.82Å; F339-T346 HydrophobicContact CD2-CG2 3.74Å; F339-T346 HydrophobicContact CE1-CG2 3.69Å; F339-T346 HydrophobicContact CE2-CG2 3.6Å; F339-T346 HydrophobicContact CG-CG2 3.84Å; F339-T346 HydrophobicContact CZ-CG2 3.57Å; F339-T346 PolarHBondContact N-OG1 3.1Å
340	R	90.9	Very high	90.6	Very high	213 Å²	213	43 Å²	43	80%	0.804	21%	0.209	S	C	*	.	H	α-helix	trans	-65.8	-31.5	177.3	-178.7	178.8	174.2	93.7	4.6	112.5	I336 F337 M338	I336-R340 WeakPolarHBondContact O-CB 3.45Å; I336-R340 PolarHBondContact O-N 2.91Å; I336-R340 VanDerWaalsContact O-N 3.09Å; F337-R340 PolarHBondContact O-N 2.9Å; M338-R340 VanDerWaalsContact C-N 3.31Å; M338-R340 PolarHBondContact O-N 3.5Å
341	M	87.8	Confident	90.3	Very high	58 Å²	58	44.1 Å²	44.1	29%	0.286	22%	0.215	S	C	.	.	H	α-helix	trans	-93.3	-44.6	-173.6	-165.2	167.5	61.3	0	0	112.9	F337 M338 F339 L457 G461 F465 Y468	F337-M341 WeakPolarHBondContact O-CB 3.26Å; F337-M341 PolarHBondContact O-N 3.43Å; M338-M341 PolarHBondContact O-N 2.89Å; M338-M341 VanDerWaalsContact O-N 3.13Å; F339-M341 VanDerWaalsContact C-N 3.29Å; F339-M341 PolarHBondContact O-N 3.5Å; M341-L457 HydrophobicContact CG-CD1 4.21Å; M341-G461 WeakPolarHBondContact CE-O 3.48Å; M341-F465 HydrophobicContact CE-CB 3.64Å; M341-F465 HydrophobicContact CE-CD2 4.12Å; M341-F465 HydrophobicContact CE-CG 4.4Å; M341-Y468 HydrophobicContact CE-CD2 4.34Å
342	S	90.7	Very high	90	Very high	14 Å²	14	44.4 Å²	44.4	10%	0.098	22%	0.218	C	C	.	.			trans	-153.8	100.7	168.6	179.7	0	0	0	0	110.4	M338 K344 L345 T346	M338-S342 CarbonylContact O-C 3.6Å; M338-S342 PolarHBondContact O-N 3.14Å; S342-K344 PolarHBondContact O-N 3.04Å; S342-L345 PolarHBondContact O-N 3.07Å; S342-L345 PolarHBondContact OG-N 2.89Å; S342-T346 WeakPolarHBondContact O-CB 3.47Å; S342-T346 PolarHBondContact O-N 3.36Å; S342-T346 PolarHBondContact O-OG1 3.29Å
343	W	88.9	Confident	89.6	Confident	89 Å²	89	42.8 Å²	42.8	34%	0.337	21%	0.205	S	C	.	.	H	α-helix	trans	-60.7	-34.4	173.1	70.8	-88.5	0	0	0	111.5	T105 L110 F339 T346 L347	T105-W343 HydrophobicContact CG2-CH2 3.73Å; L110-W343 HydrophobicContact CD1-CH2 4.1Å; L110-W343 HydrophobicContact CD1-CZ2 3.96Å; L110-W343 HydrophobicContact CD2-CH2 4Å; L110-W343 HydrophobicContact CD2-CZ2 4.07Å; F339-W343 HydrophobicContact CD1-CB 4.08Å; F339-W343 PolarHBondContact O-N 3.12Å; W343-T346 PolarHBondContact O-N 3.41Å; W343-L347 HydrophobicContact CE3-CD1 3.85Å; W343-L347 HydrophobicContact CE3-CG 4.4Å; W343-L347 HydrophobicContact CZ3-CD1 3.75Å; W343-L347 WeakPolarHBondContact O-CG 3.37Å; W343-L347 PolarHBondContact O-N 3.33Å
344	K	88.3	Confident	89.1	Confident	22 Å²	22	43.1 Å²	43.1	10%	0.096	20%	0.204	C	C	.	.	H	α-helix	trans	-59.9	-51.2	175.7	-66.8	-174.4	171.7	-175.5	0	112.1	L102 S342 T346 L347 V348 Y447 L451	L102-K344 WeakPolarHBondContact CD1-O 3.31Å; S342-K344 PolarHBondContact O-N 3.04Å; K344-T346 VanDerWaalsContact C-N 3.32Å; K344-T346 PolarHBondContact O-N 3.18Å; K344-L347 PolarHBondContact O-N 3.04Å; K344-V348 PolarHBondContact O-N 3.2Å; K344-Y447 HydrophobicContact CB-CE1 4.14Å; K344-L451 HydrophobicContact CB-CD1 4.37Å; K344-L451 HydrophobicContact CD-CD2 4.03Å
345	L	88.9	Confident	88.5	Confident	0 Å²	0	48.9 Å²	48.9	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-65.8	-36.5	176.1	-74.2	167.1	0	0	0	112	S342 L347 V348 T349 V444 Y447 L451 L457 L462 F465	S342-L345 PolarHBondContact O-N 3.07Å; S342-L345 PolarHBondContact OG-N 2.89Å; L345-L347 PolarHBondContact O-N 2.92Å; L345-V348 WeakPolarHBondContact O-CB 3.32Å; L345-V348 PolarHBondContact O-N 2.92Å; L345-T349 PolarHBondContact O-N 3.22Å; L345-T349 PolarHBondContact O-OG1 3.5Å; L345-V444 HydrophobicContact CD2-CG1 4.36Å; L345-Y447 HydrophobicContact CD2-CD1 3.81Å; L345-L451 HydrophobicContact CD1-CD1 4Å; L345-L451 HydrophobicContact CD2-CD1 4.16Å; L345-L451 HydrophobicContact CG-CD1 3.66Å; L345-L457 HydrophobicContact CD1-CD2 3.47Å; L345-L457 VanDerWaalsContact CD1-CD2 3.47Å; L345-L462 HydrophobicContact CD1-CD1 4.25Å; L345-F465 HydrophobicContact CB-CD1 4.08Å; L345-F465 HydrophobicContact CB-CD2 4.08Å; L345-F465 HydrophobicContact CB-CE1 3.64Å; L345-F465 HydrophobicContact CB-CE2 3.62Å; L345-F465 HydrophobicContact CB-CG 4.3Å; L345-F465 HydrophobicContact CB-CZ 3.4Å; L345-F465 VanDerWaalsContact CB-CZ 3.4Å; L345-F465 HydrophobicContact CD1-CD1 4.21Å; L345-F465 HydrophobicContact CD1-CD2 4.38Å; L345-F465 HydrophobicContact CD1-CG 4.12Å
346	T	91.1	Very high	88.2	Confident	4 Å²	4	47.6 Å²	47.6	3%	0.025	22%	0.222	C	C	.	.	H	α-helix	trans	-59.4	-37	176.6	-49.8	0	0	0	0	111.4	M338 F339 S342 W343 K344 T349 V350	M338-T346 HydrophobicContact CB-CG2 4.18Å; M338-T346 PolarHBondContact O-OG1 3.46Å; M338-T346 VanDerWaalsContact O-OG1 3.12Å; F339-T346 HydrophobicContact CD1-CG2 3.82Å; F339-T346 HydrophobicContact CD2-CG2 3.74Å; F339-T346 HydrophobicContact CE1-CG2 3.69Å; F339-T346 HydrophobicContact CE2-CG2 3.6Å; F339-T346 HydrophobicContact CG-CG2 3.84Å; F339-T346 HydrophobicContact CZ-CG2 3.57Å; F339-T346 PolarHBondContact N-OG1 3.1Å; S342-T346 WeakPolarHBondContact O-CB 3.47Å; S342-T346 PolarHBondContact O-N 3.36Å; S342-T346 PolarHBondContact O-OG1 3.29Å; W343-T346 PolarHBondContact O-N 3.41Å; K344-T346 VanDerWaalsContact C-N 3.32Å; K344-T346 PolarHBondContact O-N 3.18Å; T346-T349 PolarHBondContact O-N 3.45Å; T346-V350 HydrophobicContact CG2-CG2 4.4Å; T346-V350 WeakPolarHBondContact O-CB 3.42Å; T346-V350 VanDerWaalsContact O-CG2 3.23Å; T346-V350 WeakPolarHBondContact O-CG2 3.36Å; T346-V350 PolarHBondContact O-N 2.98Å
347	L	87.7	Confident	87.7	Confident	17 Å²	17	45.2 Å²	45.2	9%	0.089	22%	0.219	C	C	.	.	H	α-helix	trans	-65	-40.9	172.6	-67	-175.2	0	0	0	112.7	L98 L101 L102 W343 K344 L345 T349 V350 M351	L98-L347 HydrophobicContact CD2-CD2 3.96Å; L101-L347 HydrophobicContact CD2-CD1 3.76Å; L101-L347 HydrophobicContact CG-CD1 4.3Å; L102-L347 HydrophobicContact CD1-CB 4.47Å; W343-L347 HydrophobicContact CE3-CD1 3.85Å; W343-L347 HydrophobicContact CE3-CG 4.4Å; W343-L347 HydrophobicContact CZ3-CD1 3.75Å; W343-L347 WeakPolarHBondContact O-CG 3.37Å; W343-L347 PolarHBondContact O-N 3.33Å; K344-L347 PolarHBondContact O-N 3.04Å; L345-L347 PolarHBondContact O-N 2.92Å; L347-T349 PolarHBondContact O-N 2.83Å; L347-V350 PolarHBondContact O-N 3.41Å; L347-M351 HydrophobicContact CB-CE 4.05Å; L347-M351 WeakPolarHBondContact O-CB 3.2Å; L347-M351 WeakPolarHBondContact O-CE 3.37Å; L347-M351 VanDerWaalsContact O-CG 3.27Å; L347-M351 WeakPolarHBondContact O-CG 3.47Å; L347-M351 PolarHBondContact O-N 3.46Å
348	V	88.8	Confident	87.2	Confident	23 Å²	23	45 Å²	45	14%	0.139	22%	0.219	C	C	.	.	H	α-helix	trans	-59.6	-46.2	174.8	-178.8	0	0	0	0	110.9	L102 K344 L345 M351 G352 V444 Y447	L102-V348 HydrophobicContact CD1-CG2 3.61Å; K344-V348 PolarHBondContact O-N 3.2Å; L345-V348 WeakPolarHBondContact O-CB 3.32Å; L345-V348 PolarHBondContact O-N 2.92Å; V348-M351 WeakPolarHBondContact O-CB 3.21Å; V348-M351 PolarHBondContact O-N 3.38Å; V348-G352 PolarHBondContact O-N 2.88Å; V348-V444 HydrophobicContact CB-CG2 4.42Å; V348-V444 HydrophobicContact CG1-CG2 3.89Å; V348-Y447 HydrophobicContact CG2-CD1 3.88Å; V348-Y447 HydrophobicContact CG2-CE1 4.43Å; V348-Y447 HydrophobicContact CG2-CG 4.45Å
349	T	89.3	Confident	86.8	Confident	2 Å²	2	45.6 Å²	45.6	1%	0.012	22%	0.223	C	C	.	.	H	α-helix	trans	-62.9	-45.6	176.4	-52.2	0	0	0	0	112.2	M338 L345 T346 L347 M351 G352 F353 F465 M469	M338-T349 HydrophobicContact CE-CG2 4.13Å; L345-T349 PolarHBondContact O-N 3.22Å; L345-T349 PolarHBondContact O-OG1 3.5Å; T346-T349 PolarHBondContact O-N 3.45Å; L347-T349 PolarHBondContact O-N 2.83Å; T349-M351 PolarHBondContact O-N 2.96Å; T349-G352 PolarHBondContact O-N 2.78Å; T349-G352 VanDerWaalsContact O-N 3.09Å; T349-F353 HydrophobicContact CG2-CD2 4.1Å; T349-F353 HydrophobicContact CG2-CE2 3.55Å; T349-F353 HydrophobicContact CG2-CZ 4.2Å; T349-F353 WeakPolarHBondContact O-CD2 3.29Å; T349-F353 PolarHBondContact O-N 2.92Å; T349-F465 WeakPolarHBondContact OG1-CE1 3.21Å; T349-M469 HydrophobicContact CG2-CB 4.5Å; T349-M469 HydrophobicContact CG2-CG 3.72Å; T349-M469 HydrophobicContact CG2-SD 4.1Å
350	V	86.9	Confident	86.5	Confident	60 Å²	60	42.9 Å²	42.9	36%	0.364	22%	0.216	S	C	.	.	H	α-helix	trans	-64.4	-28.4	177.9	169.1	0	0	0	0	112.2	L98 T346 L347 P354	L98-V350 HydrophobicContact CD1-CG1 4.02Å; T346-V350 HydrophobicContact CG2-CG2 4.4Å; T346-V350 WeakPolarHBondContact O-CB 3.42Å; T346-V350 VanDerWaalsContact O-CG2 3.23Å; T346-V350 WeakPolarHBondContact O-CG2 3.36Å; T346-V350 PolarHBondContact O-N 2.98Å; L347-V350 PolarHBondContact O-N 3.41Å; V350-P354 WeakPolarHBondContact O-CD 3.18Å
351	M	85.3	Confident	86.1	Confident	27 Å²	27	35.7 Å²	35.7	13%	0.133	19%	0.19	C	C	.	.	H	α-helix	trans	-69.2	-32.7	172.5	-80	-173.9	-102.6	0	0	113.2	T95 L98 A99 L102 L347 V348 T349	T95-M351 HydrophobicContact CG2-CB 3.7Å; T95-M351 HydrophobicContact CG2-CG 3.77Å; T95-M351 HydrophobicContact CG2-SD 4.18Å; T95-M351 VanDerWaalsContact O-SD 3.4Å; L98-M351 HydrophobicContact CB-CE 3.84Å; L98-M351 HydrophobicContact CB-CG 3.65Å; L98-M351 HydrophobicContact CB-SD 3.76Å; L98-M351 HydrophobicContact CD1-CG 4Å; L98-M351 HydrophobicContact CG-CG 4.48Å; A99-M351 HydrophobicContact CB-SD 3.76Å; A99-M351 PolarHBondContact N-SD 3.04Å; L102-M351 HydrophobicContact CD1-CE 4.15Å; L347-M351 HydrophobicContact CB-CE 4.05Å; L347-M351 WeakPolarHBondContact O-CB 3.2Å; L347-M351 WeakPolarHBondContact O-CE 3.37Å; L347-M351 VanDerWaalsContact O-CG 3.27Å; L347-M351 WeakPolarHBondContact O-CG 3.47Å; L347-M351 PolarHBondContact O-N 3.46Å; V348-M351 WeakPolarHBondContact O-CB 3.21Å; V348-M351 PolarHBondContact O-N 3.38Å; T349-M351 PolarHBondContact O-N 2.96Å
352	G	85.2	Confident	85.8	Confident	13 Å²	13	37.5 Å²	37.5	13%	0.134	20%	0.2	C	C	.	.	H	α-helix	trans	-75.9	-40.4	179.7	0	0	0	0	0	114.7	V348 T349 F355 I356	V348-G352 PolarHBondContact O-N 2.88Å; T349-G352 PolarHBondContact O-N 2.78Å; T349-G352 VanDerWaalsContact O-N 3.09Å; G352-F355 WeakPolarHBondContact O-CB 3.44Å; G352-F355 PolarHBondContact O-N 3.06Å; G352-I356 PolarHBondContact O-N 3.45Å
353	F	83.8	Confident	85.5	Confident	41 Å²	41	40.6 Å²	40.6	18%	0.18	21%	0.21	C	C	.	.	H	α-helix	trans	-54.2	-43.2	-176.8	-80	-57.9	0	0	0	115.1	T349 F355 I356 A357 L472 F476	T349-F353 HydrophobicContact CG2-CD2 4.1Å; T349-F353 HydrophobicContact CG2-CE2 3.55Å; T349-F353 HydrophobicContact CG2-CZ 4.2Å; T349-F353 WeakPolarHBondContact O-CD2 3.29Å; T349-F353 PolarHBondContact O-N 2.92Å; F353-F355 VanDerWaalsContact C-N 3.26Å; F353-F355 PolarHBondContact O-N 2.83Å; F353-I356 PolarHBondContact O-N 3.32Å; F353-A357 WeakPolarHBondContact O-CB 3.49Å; F353-A357 PolarHBondContact O-N 3.28Å; F353-L472 HydrophobicContact CE2-CD2 3.86Å; F353-L472 HydrophobicContact CE2-CG 4.21Å; F353-L472 HydrophobicContact CZ-CD2 4.2Å; F353-L472 HydrophobicContact CZ-CG 4.08Å; F353-F476 HydrophobicContact CD1-CD2 4.11Å; F353-F476 HydrophobicContact CD1-CE2 4.36Å; F353-F476 HydrophobicContact CD2-CE2 4.11Å; F353-F476 AromaticContact CE1-CD2 3.66Å; F353-F476 HydrophobicContact CE1-CD2 3.66Å; F353-F476 HydrophobicContact CE1-CE2 4.08Å; F353-F476 HydrophobicContact CE2-CD2 4.18Å; F353-F476 AromaticContact CE2-CE2 3.76Å; F353-F476 HydrophobicContact CE2-CE2 3.76Å; F353-F476 HydrophobicContact CG-CE2 4.4Å; F353-F476 AromaticContact CZ-CD2 3.7Å; F353-F476 HydrophobicContact CZ-CD2 3.7Å; F353-F476 AromaticContact CZ-CE2 3.77Å; F353-F476 HydrophobicContact CZ-CE2 3.77Å
354	P	81.4	Confident	85.1	Confident	22 Å²	22	38 Å²	38	14%	0.143	21%	0.211	C	C	.	.	H	α-helix	trans	-55.6	-34.9	173.7	-31.2	37.5	0	0	0	115	M91 V350 L358	M91-P354 HydrophobicContact CB-CB 4.2Å; M91-P354 HydrophobicContact CE-CB 3.92Å; M91-P354 HydrophobicContact CE-CG 4.26Å; M91-P354 HydrophobicContact CG-CB 4.13Å; M91-P354 HydrophobicContact SD-CB 3.78Å; M91-P354 HydrophobicContact SD-CG 4.07Å; V350-P354 WeakPolarHBondContact O-CD 3.18Å; P354-L358 WeakPolarHBondContact O-CB 3.44Å; P354-L358 PolarHBondContact O-N 3.36Å
355	F	83	Confident	84.8	Confident	120 Å²	120	42.3 Å²	42.3	53%	0.526	23%	0.232	S	C	.	.	H	α-helix	trans	-72.2	-47.5	-180	-178.2	-102.5	0	0	0	111	G352 F353 A357 L358 V359 S436	G352-F355 WeakPolarHBondContact O-CB 3.44Å; G352-F355 PolarHBondContact O-N 3.06Å; F353-F355 VanDerWaalsContact C-N 3.26Å; F353-F355 PolarHBondContact O-N 2.83Å; F355-A357 VanDerWaalsContact C-N 3.35Å; F355-A357 PolarHBondContact O-N 3.16Å; F355-L358 WeakPolarHBondContact O-CB 3.37Å; F355-L358 PolarHBondContact O-N 2.94Å; F355-V359 HydrophobicContact CE1-CG2 4.47Å; F355-V359 PolarHBondContact O-N 2.92Å; F355-V359 VanDerWaalsContact O-N 3.09Å; F355-S436 WeakPolarHBondContact CE1-OG 3.22Å
356	I	85.2	Confident	84.6	Confident	35 Å²	35	48.4 Å²	48.4	18%	0.179	26%	0.256	C	S	.	.	H	α-helix	trans	-57.9	-48.7	174.3	-60.6	168.8	0	0	0	110	G352 F353 L358 V359 S360 L440	G352-I356 PolarHBondContact O-N 3.45Å; F353-I356 PolarHBondContact O-N 3.32Å; I356-L358 VanDerWaalsContact C-N 3.29Å; I356-L358 PolarHBondContact O-N 2.85Å; I356-V359 WeakPolarHBondContact O-CB 3.33Å; I356-V359 PolarHBondContact O-N 3.01Å; I356-S360 PolarHBondContact O-N 2.79Å; I356-S360 PolarHBondContact O-OG 3.36Å; I356-L440 HydrophobicContact CD1-CD2 3.95Å
357	A	82.2	Confident	84.3	Confident	57 Å²	57	52.2 Å²	52.2	47%	0.471	27%	0.27	S	S	.	.	H	α-helix	trans	-62.2	-32.3	179.1	0	0	0	0	0	113.6	F353 F355 K361	F353-A357 WeakPolarHBondContact O-CB 3.49Å; F353-A357 PolarHBondContact O-N 3.28Å; F355-A357 VanDerWaalsContact C-N 3.35Å; F355-A357 PolarHBondContact O-N 3.16Å; A357-K361 WeakPolarHBondContact O-CB 3.14Å; A357-K361 PolarHBondContact O-N 3Å
358	L	82.1	Confident	84	Confident	32 Å²	32	59.1 Å²	59.1	17%	0.168	30%	0.299	C	S	.	.	H	α-helix	trans	-67.6	-46.2	174.3	175.7	65.8	0	0	0	111.4	L88 P354 F355 I356 K361 L362	L88-L358 HydrophobicContact CB-CD1 4.46Å; L88-L358 HydrophobicContact CD1-CD1 4.2Å; L88-L358 HydrophobicContact CD1-CD2 3.7Å; L88-L358 HydrophobicContact CG-CD1 4.46Å; L88-L358 HydrophobicContact CG-CD2 3.81Å; P354-L358 WeakPolarHBondContact O-CB 3.44Å; P354-L358 PolarHBondContact O-N 3.36Å; F355-L358 WeakPolarHBondContact O-CB 3.37Å; F355-L358 PolarHBondContact O-N 2.94Å; I356-L358 VanDerWaalsContact C-N 3.29Å; I356-L358 PolarHBondContact O-N 2.85Å; L358-K361 PolarHBondContact O-N 2.93Å; L358-L362 HydrophobicContact CD1-CD1 4.24Å; L358-L362 HydrophobicContact CD1-CG 4.32Å; L358-L362 HydrophobicContact CG-CD1 4.22Å; L358-L362 WeakPolarHBondContact O-CG 3.37Å; L358-L362 PolarHBondContact O-N 2.74Å
359	V	84.7	Confident	83.9	Confident	14 Å²	14	64 Å²	64	9%	0.085	32%	0.319	C	S	.	.	H	α-helix	trans	-56.5	-52.6	174.9	171.7	0	0	0	0	109.9	F355 I356 K361 L362 Y363 S432	F355-V359 HydrophobicContact CE1-CG2 4.47Å; F355-V359 PolarHBondContact O-N 2.92Å; F355-V359 VanDerWaalsContact O-N 3.09Å; I356-V359 WeakPolarHBondContact O-CB 3.33Å; I356-V359 PolarHBondContact O-N 3.01Å; V359-K361 VanDerWaalsContact C-N 3.27Å; V359-K361 PolarHBondContact O-N 2.67Å; V359-L362 PolarHBondContact O-N 2.85Å; V359-Y363 HydrophobicContact CG1-CD2 3.97Å; V359-Y363 HydrophobicContact CG1-CE2 4.15Å; V359-Y363 WeakPolarHBondContact O-CD2 3.47Å; V359-Y363 PolarHBondContact O-N 2.89Å; V359-S432 WeakPolarHBondContact CG1-OG 3.42Å
360	S	84.1	Confident	83.9	Confident	37 Å²	37	64.1 Å²	64.1	26%	0.259	32%	0.32	S	S	.	.	H	α-helix	trans	-59.6	-35.1	178.2	-53.6	0	0	0	0	113.3	I356 G364 Y429	I356-S360 PolarHBondContact O-N 2.79Å; I356-S360 PolarHBondContact O-OG 3.36Å; S360-G364 WeakPolarHBondContact O-CA 3.34Å; S360-G364 PolarHBondContact O-N 3.32Å; S360-Y429 PolarHBondContact OG-OH 3.22Å
361	K	82.2	Confident	83.8	Confident	63 Å²	63	63.4 Å²	63.4	27%	0.274	32%	0.315	S	S	.	.	H	α-helix	trans	-66.2	-49.1	176.3	-169.2	-170.4	173.4	-165.8	0	112.1	T84 A357 L358 V359 G364 E365	T84-K361 HydrophobicContact CG2-CD 4.45Å; T84-K361 PolarHBondContact OG1-NZ 3Å; A357-K361 WeakPolarHBondContact O-CB 3.14Å; A357-K361 PolarHBondContact O-N 3Å; L358-K361 PolarHBondContact O-N 2.93Å; V359-K361 VanDerWaalsContact C-N 3.27Å; V359-K361 PolarHBondContact O-N 2.67Å; K361-G364 PolarHBondContact O-N 3.42Å; K361-E365 WeakPolarHBondContact CE-OE1 3.23Å; K361-E365 IonicContact NZ-OE1 3.81Å; K361-E365 PolarHBondContact NZ-OE1 3.05Å; K361-E365 PolarHBondContact O-N 3.27Å; K361-E365 VanDerWaalsContact O-N 3.11Å
362	L	82.8	Confident	83.9	Confident	95 Å²	95	67.4 Å²	67.4	50%	0.497	33%	0.332	S	S	.	.	H	α-helix	trans	-62.5	-47.6	-175.3	-69.2	171.4	0	0	0	111.6	T84 L358 V359	T84-L362 HydrophobicContact CG2-CD2 4.38Å; L358-L362 HydrophobicContact CD1-CD1 4.24Å; L358-L362 HydrophobicContact CD1-CG 4.32Å; L358-L362 HydrophobicContact CG-CD1 4.22Å; L358-L362 WeakPolarHBondContact O-CG 3.37Å; L358-L362 PolarHBondContact O-N 2.74Å; V359-L362 PolarHBondContact O-N 2.85Å
363	Y	84.5	Confident	84.1	Confident	79 Å²	79	70.2 Å²	70.2	31%	0.31	34%	0.342	S	S	.	.	H	α-helix	trans	-70.6	-37.7	175.7	-75.9	-80.1	0	0	0	112.4	V359 E365 Y366 Y367 C428 Y429	V359-Y363 HydrophobicContact CG1-CD2 3.97Å; V359-Y363 HydrophobicContact CG1-CE2 4.15Å; V359-Y363 WeakPolarHBondContact O-CD2 3.47Å; V359-Y363 PolarHBondContact O-N 2.89Å; Y363-E365 PolarHBondContact O-N 2.97Å; Y363-Y366 PolarHBondContact O-N 3.45Å; Y363-Y367 VanDerWaalsContact O-CB 3.3Å; Y363-Y367 WeakPolarHBondContact O-CB 3.43Å; Y363-Y367 PolarHBondContact O-N 3.47Å; Y363-C428 HydrophobicContact CE1-CB 3.72Å; Y363-Y429 HydrophobicContact CD2-CD2 4.18Å; Y363-Y429 HydrophobicContact CG-CD2 4.06Å; Y363-Y429 HydrophobicContact CG-CG 4.42Å
364	G	80.9	Confident	84.5	Confident	34 Å²	34	68.8 Å²	68.8	35%	0.351	34%	0.336	S	S	.	.	H	α-helix	trans	-63.4	-39.9	-177.4	0	0	0	0	0	114.2	S360 K361 K368	S360-G364 WeakPolarHBondContact O-CA 3.34Å; S360-G364 PolarHBondContact O-N 3.32Å; K361-G364 PolarHBondContact O-N 3.42Å; G364-K368 VanDerWaalsContact O-CB 3.22Å; G364-K368 WeakPolarHBondContact O-CB 3.2Å; G364-K368 PolarHBondContact O-N 2.87Å
365	E	81.2	Confident	84.7	Confident	114 Å²	114	73.1 Å²	73.1	53%	0.533	36%	0.355	S	S	.	.	H	α-helix	trans	-64.8	-42.2	175.9	-73.6	-178.5	-178.9	0	0	111.7	K361 Y363 K369	K361-E365 WeakPolarHBondContact CE-OE1 3.23Å; K361-E365 IonicContact NZ-OE1 3.81Å; K361-E365 PolarHBondContact NZ-OE1 3.05Å; K361-E365 PolarHBondContact O-N 3.27Å; K361-E365 VanDerWaalsContact O-N 3.11Å; Y363-E365 PolarHBondContact O-N 2.97Å; E365-K369 PolarHBondContact O-N 3.34Å
366	Y	85.3	Confident	85	Confident	127 Å²	127	69.5 Å²	69.5	50%	0.498	34%	0.342	S	S	.	.	H	α-helix	trans	-67.5	-46.9	176.7	-179	-109.7	0	0	0	112.4	Y363 K368 K369 L370 A425	Y363-Y366 PolarHBondContact O-N 3.45Å; Y366-K368 VanDerWaalsContact C-N 3.3Å; Y366-K368 PolarHBondContact O-N 2.68Å; Y366-K369 PolarHBondContact O-N 3.39Å; Y366-L370 PolarHBondContact O-N 3.49Å; Y366-A425 HydrophobicContact CD1-CB 4.01Å; Y366-A425 HydrophobicContact CE1-CB 3.87Å
367	Y	84.8	Confident	85.4	Confident	84 Å²	84	68.6 Å²	68.6	33%	0.329	34%	0.338	S	S	.	.	H	α-helix	trans	-59.5	-40.7	177.2	-172.8	-89.7	0	0	0	111.9	Y363 L370 T371 Q422 Y426	Y363-Y367 VanDerWaalsContact O-CB 3.3Å; Y363-Y367 WeakPolarHBondContact O-CB 3.43Å; Y363-Y367 PolarHBondContact O-N 3.47Å; Y367-L370 PolarHBondContact O-N 3.06Å; Y367-T371 PolarHBondContact O-N 3.17Å; Y367-T371 PolarHBondContact O-OG1 3.06Å; Y367-Q422 HydrophobicContact CD2-CG 3.97Å; Y367-Q422 HydrophobicContact CE2-CG 3.36Å; Y367-Q422 VanDerWaalsContact CZ-NE2 3.28Å; Y367-Q422 PolarHBondContact OH-NE2 3.38Å; Y367-Y426 HydrophobicContact CE2-CD2 4.25Å
368	K	80.9	Confident	85.8	Confident	162 Å²	162	68.2 Å²	68.2	70%	0.704	33%	0.328	S	S	*	.	H	α-helix	trans	-62.9	-41.7	176.1	-176.4	-178.5	178.3	-175.5	0	112.5	G364 Y366 L370 T371 K372	G364-K368 VanDerWaalsContact O-CB 3.22Å; G364-K368 WeakPolarHBondContact O-CB 3.2Å; G364-K368 PolarHBondContact O-N 2.87Å; Y366-K368 VanDerWaalsContact C-N 3.3Å; Y366-K368 PolarHBondContact O-N 2.68Å; K368-L370 VanDerWaalsContact C-N 3.35Å; K368-T371 PolarHBondContact O-N 2.97Å; K368-K372 PolarHBondContact O-N 2.87Å; K368-K372 VanDerWaalsContact O-N 3.1Å
369	K	87.2	Confident	85.9	Confident	125 Å²	125	69.6 Å²	69.6	54%	0.543	34%	0.344	S	S	.	.	H	α-helix	trans	-57.8	-50.6	175.4	-177.9	-179.4	177.8	-179.3	0	110.2	E365 Y366 T371 K372 E373	E365-K369 PolarHBondContact O-N 3.34Å; Y366-K369 PolarHBondContact O-N 3.39Å; K369-T371 VanDerWaalsContact C-N 3.33Å; K369-T371 PolarHBondContact O-N 3.28Å; K369-K372 WeakPolarHBondContact O-CB 3.16Å; K369-K372 PolarHBondContact O-N 3.04Å; K369-K372 VanDerWaalsContact O-N 3.08Å; K369-E373 WeakPolarHBondContact CE-OE1 3.25Å; K369-E373 PolarHBondContact O-N 3.43Å; K369-E373 VanDerWaalsContact O-N 3.14Å
370	L	87.9	Confident	86.2	Confident	6 Å²	6	73.1 Å²	73.1	3%	0.031	36%	0.36	C	S	.	.	H	α-helix	trans	-66.6	-33.9	-177.3	-170.1	54.5	0	0	0	112.8	Y366 Y367 K368 E373 V374 L418 K421 Q422	Y366-L370 PolarHBondContact O-N 3.49Å; Y367-L370 PolarHBondContact O-N 3.06Å; K368-L370 VanDerWaalsContact C-N 3.35Å; L370-E373 PolarHBondContact O-N 3.06Å; L370-V374 WeakPolarHBondContact O-CG2 3.34Å; L370-V374 PolarHBondContact O-N 3.42Å; L370-L418 HydrophobicContact CD1-CB 4.18Å; L370-L418 HydrophobicContact CD1-CD2 3.85Å; L370-K421 HydrophobicContact CD2-CB 3.66Å; L370-Q422 VanDerWaalsContact CD2-CA 3.5Å; L370-Q422 HydrophobicContact CD2-CB 3.75Å; L370-Q422 VanDerWaalsContact CD2-N 3.31Å; L370-Q422 HydrophobicContact CG-CB 4.1Å
371	T	86.1	Confident	86.6	Confident	44 Å²	44	71.4 Å²	71.4	27%	0.27	35%	0.348	S	S	.	.	H	α-helix	trans	-64.4	-36.8	171.7	-53.8	0	0	0	0	112	Y367 K368 K369 Q375 Q422	Y367-T371 PolarHBondContact O-N 3.17Å; Y367-T371 PolarHBondContact O-OG1 3.06Å; K368-T371 PolarHBondContact O-N 2.97Å; K369-T371 VanDerWaalsContact C-N 3.33Å; K369-T371 PolarHBondContact O-N 3.28Å; T371-Q375 VanDerWaalsContact O-CG 3.32Å; T371-Q375 WeakPolarHBondContact O-CG 3.5Å; T371-Q375 PolarHBondContact O-N 2.97Å; T371-Q375 VanDerWaalsContact O-N 3.1Å; T371-Q422 PolarHBondContact OG1-NE2 3Å
372	K	86.3	Confident	87	Confident	112 Å²	112	72.2 Å²	72.2	49%	0.487	36%	0.355	S	S	.	.	H	α-helix	trans	-61.5	-47.5	172.6	-169.9	-171.2	179.7	-167.5	0	110.1	V167 D168 K368 K369 V374 Q375 T376	V167-K372 PolarHBondContact O-NZ 2.87Å; D168-K372 IonicContact OD1-NZ 3.97Å; D168-K372 PolarHBondContact OD1-NZ 3.26Å; K368-K372 PolarHBondContact O-N 2.87Å; K368-K372 VanDerWaalsContact O-N 3.1Å; K369-K372 WeakPolarHBondContact O-CB 3.16Å; K369-K372 PolarHBondContact O-N 3.04Å; K369-K372 VanDerWaalsContact O-N 3.08Å; K372-V374 PolarHBondContact O-N 2.82Å; K372-Q375 PolarHBondContact O-N 3.39Å; K372-T376 PolarHBondContact O-N 3.02Å; K372-T376 PolarHBondContact O-OG1 3.34Å
373	E	90.5	Very high	87.3	Confident	72 Å²	72	74.7 Å²	74.7	34%	0.336	36%	0.362	S	S	.	.	H	α-helix	trans	-59.4	-44.5	178.8	-66.9	170.8	-164.1	0	0	112.4	K369 L370 Q375 T376 V377 L418	K369-E373 WeakPolarHBondContact CE-OE1 3.25Å; K369-E373 PolarHBondContact O-N 3.43Å; K369-E373 VanDerWaalsContact O-N 3.14Å; L370-E373 PolarHBondContact O-N 3.06Å; E373-Q375 PolarHBondContact O-N 3.49Å; E373-T376 PolarHBondContact O-N 3.11Å; E373-V377 WeakPolarHBondContact O-CG2 3.48Å; E373-V377 PolarHBondContact O-N 3.47Å; E373-V377 VanDerWaalsContact O-N 3.13Å; E373-L418 HydrophobicContact CB-CD1 4.09Å
374	V	92	Very high	87.7	Confident	11 Å²	11	72.2 Å²	72.2	7%	0.067	36%	0.355	C	S	.	.	H	α-helix	trans	-60.8	-43.2	175.8	168.1	0	0	0	0	112	L370 K372 V377 L378 M415 L418 N419	L370-V374 WeakPolarHBondContact O-CG2 3.34Å; L370-V374 PolarHBondContact O-N 3.42Å; K372-V374 PolarHBondContact O-N 2.82Å; V374-V377 PolarHBondContact O-N 3.06Å; V374-L378 WeakPolarHBondContact O-CB 3.37Å; V374-L378 PolarHBondContact O-N 3.01Å; V374-M415 HydrophobicContact CG1-CG 4.14Å; V374-L418 HydrophobicContact CG2-CB 3.54Å; V374-L418 HydrophobicContact CG2-CD1 4.34Å; V374-N419 WeakPolarHBondContact CG1-OD1 3.31Å; V374-N419 WeakPolarHBondContact CG2-OD1 3.31Å
375	Q	85.4	Confident	88.3	Confident	113 Å²	113	71.8 Å²	71.8	53%	0.528	35%	0.348	S	S	.	.	H	α-helix	trans	-65.7	-37.8	178.3	-70.9	-68.1	-29.2	0	0	112.3	T371 K372 E373 L378 A379	T371-Q375 VanDerWaalsContact O-CG 3.32Å; T371-Q375 WeakPolarHBondContact O-CG 3.5Å; T371-Q375 PolarHBondContact O-N 2.97Å; T371-Q375 VanDerWaalsContact O-N 3.1Å; K372-Q375 PolarHBondContact O-N 3.39Å; E373-Q375 PolarHBondContact O-N 3.49Å; Q375-L378 PolarHBondContact O-N 2.96Å; Q375-A379 PolarHBondContact O-N 3.35Å
376	T	89.1	Confident	88.7	Confident	43 Å²	43	73.1 Å²	73.1	26%	0.264	35%	0.354	S	S	.	.	H	α-helix	trans	-61.6	-48	174.3	-55.3	0	0	0	0	111.5	V167 K372 E373 L378 A379 E380	V167-T376 HydrophobicContact CG1-CG2 4.29Å; K372-T376 PolarHBondContact O-N 3.02Å; K372-T376 PolarHBondContact O-OG1 3.34Å; E373-T376 PolarHBondContact O-N 3.11Å; T376-L378 VanDerWaalsContact C-N 3.31Å; T376-L378 PolarHBondContact O-N 2.7Å; T376-A379 PolarHBondContact O-N 2.92Å; T376-E380 PolarHBondContact O-N 3.43Å; T376-E380 VanDerWaalsContact O-N 3.08Å
377	V	92.9	Very high	88.9	Confident	17 Å²	17	73.8 Å²	73.8	10%	0.103	36%	0.362	C	S	.	.	H	α-helix	trans	-66.1	-34.2	179.2	179.3	0	0	0	0	111.7	E373 V374 E380 A381 V414 M415 L418	E373-V377 WeakPolarHBondContact O-CG2 3.48Å; E373-V377 PolarHBondContact O-N 3.47Å; E373-V377 VanDerWaalsContact O-N 3.13Å; V374-V377 PolarHBondContact O-N 3.06Å; V377-E380 PolarHBondContact O-N 3.44Å; V377-A381 PolarHBondContact O-N 3.35Å; V377-V414 HydrophobicContact CG1-CB 4.17Å; V377-V414 HydrophobicContact CG1-CG1 4.15Å; V377-V414 HydrophobicContact CG2-CG1 4.22Å; V377-M415 HydrophobicContact CG1-CB 3.94Å; V377-L418 HydrophobicContact CG2-CD1 3.83Å
378	L	91.8	Very high	89.4	Confident	49 Å²	49	71.2 Å²	71.2	26%	0.257	36%	0.355	S	S	.	.	H	α-helix	trans	-65.3	-40.5	173.2	179.9	60.7	0	0	0	112	V374 Q375 T376 A381 N382 M415	V374-L378 WeakPolarHBondContact O-CB 3.37Å; V374-L378 PolarHBondContact O-N 3.01Å; Q375-L378 PolarHBondContact O-N 2.96Å; T376-L378 VanDerWaalsContact C-N 3.31Å; T376-L378 PolarHBondContact O-N 2.7Å; L378-A381 PolarHBondContact O-N 3.05Å; L378-N382 WeakPolarHBondContact O-CB 3.18Å; L378-N382 VanDerWaalsContact O-CG 3.28Å; L378-N382 PolarHBondContact O-N 3.07Å; L378-M415 HydrophobicContact CB-SD 4.26Å; L378-M415 HydrophobicContact CD1-SD 4.1Å
379	A	84.1	Confident	90	Very high	61 Å²	61	69.6 Å²	69.6	50%	0.504	35%	0.353	S	S	.	.	H	α-helix	trans	-63.1	-41.7	175.3	0	0	0	0	0	111.9	Q375 T376 N382 K383	Q375-A379 PolarHBondContact O-N 3.35Å; T376-A379 PolarHBondContact O-N 2.92Å; A379-N382 PolarHBondContact O-N 3.5Å; A379-K383 PolarHBondContact O-N 3.28Å
380	E	90.5	Very high	90	Very high	87 Å²	87	69 Å²	69	41%	0.407	36%	0.364	S	S	.	.	H	α-helix	trans	-61.6	-41.8	172.7	-69.9	-179.4	-158.1	0	0	112.6	T376 V377 K383 V384 K411	T376-E380 PolarHBondContact O-N 3.43Å; T376-E380 VanDerWaalsContact O-N 3.08Å; V377-E380 PolarHBondContact O-N 3.44Å; E380-K383 PolarHBondContact O-N 2.87Å; E380-V384 PolarHBondContact O-N 3.5Å; E380-K411 HydrophobicContact CB-CD 4.5Å; E380-K411 IonicContact OE2-NZ 2.84Å; E380-K411 PolarHBondContact OE2-NZ 2.91Å
381	A	93.2	Very high	90.3	Very high	1 Å²	1	69.7 Å²	69.7	1%	0.008	37%	0.373	C	S	.	.	H	α-helix	trans	-65	-43.3	177.1	0	0	0	0	0	111.6	V377 L378 K383 V384 A385 Y408 K411	V377-A381 PolarHBondContact O-N 3.35Å; L378-A381 PolarHBondContact O-N 3.05Å; A381-K383 VanDerWaalsContact C-N 3.33Å; A381-K383 PolarHBondContact O-N 3.43Å; A381-V384 PolarHBondContact O-N 2.96Å; A381-A385 PolarHBondContact O-N 3.16Å; A381-A385 VanDerWaalsContact O-N 3.09Å; A381-Y408 HydrophobicContact CB-CD2 4.17Å; A381-Y408 HydrophobicContact CB-CE2 3.82Å; A381-Y408 WeakPolarHBondContact O-CD2 3.33Å; A381-Y408 WeakPolarHBondContact O-CE2 3.21Å; A381-K411 HydrophobicContact CB-CB 3.89Å
382	N	90.3	Very high	90.7	Very high	81 Å²	81	71.8 Å²	71.8	43%	0.433	38%	0.381	S	S	.	.	H	α-helix	trans	-62	-38.8	176.8	-73.9	-13.3	0	0	0	112	L378 A379 V384 A385 E386	L378-N382 WeakPolarHBondContact O-CB 3.18Å; L378-N382 VanDerWaalsContact O-CG 3.28Å; L378-N382 PolarHBondContact O-N 3.07Å; A379-N382 PolarHBondContact O-N 3.5Å; N382-V384 PolarHBondContact O-N 3.46Å; N382-A385 PolarHBondContact O-N 2.9Å; N382-E386 WeakPolarHBondContact O-CB 3.3Å; N382-E386 PolarHBondContact O-N 3.36Å
383	K	88.6	Confident	91	Very high	147 Å²	147	77.2 Å²	77.2	64%	0.639	40%	0.399	S	S	*	.	H	α-helix	trans	-59.4	-43.8	175.5	-175.8	173.4	-179.9	173.7	0	112.3	A379 E380 A381 A385 E386 E387	A379-K383 PolarHBondContact O-N 3.28Å; E380-K383 PolarHBondContact O-N 2.87Å; A381-K383 VanDerWaalsContact C-N 3.33Å; A381-K383 PolarHBondContact O-N 3.43Å; K383-A385 VanDerWaalsContact C-N 3.34Å; K383-A385 PolarHBondContact O-N 3.06Å; K383-E386 PolarHBondContact O-N 3.31Å; K383-E387 WeakPolarHBondContact O-CB 3.29Å; K383-E387 PolarHBondContact O-N 3.07Å
384	V	93	Very high	91.3	Very high	27 Å²	27	77.7 Å²	77.7	16%	0.164	41%	0.407	C	S	.	.	H	α-helix	trans	-63.1	-41	175.3	175.6	0	0	0	0	111.3	E380 A381 N382 T388	E380-V384 PolarHBondContact O-N 3.5Å; A381-V384 PolarHBondContact O-N 2.96Å; N382-V384 PolarHBondContact O-N 3.46Å; V384-T388 VanDerWaalsContact O-CB 3.27Å; V384-T388 WeakPolarHBondContact O-CB 3.22Å; V384-T388 PolarHBondContact O-N 3.34Å; V384-T388 PolarHBondContact O-OG1 2.94Å
385	A	94	Very high	91.6	Very high	25 Å²	25	78 Å²	78	21%	0.207	41%	0.409	C	S	.	.	H	α-helix	trans	-65.9	-43.2	177.6	0	0	0	0	0	112.2	A381 N382 K383 T388 I389 Y408	A381-A385 PolarHBondContact O-N 3.16Å; A381-A385 VanDerWaalsContact O-N 3.09Å; N382-A385 PolarHBondContact O-N 2.9Å; K383-A385 VanDerWaalsContact C-N 3.34Å; K383-A385 PolarHBondContact O-N 3.06Å; A385-T388 PolarHBondContact O-N 3.49Å; A385-I389 VanDerWaalsContact O-CB 3.29Å; A385-I389 WeakPolarHBondContact O-CB 3.43Å; A385-I389 WeakPolarHBondContact O-CD1 3.22Å; A385-I389 WeakPolarHBondContact O-CG1 3.38Å; A385-I389 PolarHBondContact O-N 3.42Å; A385-Y408 HydrophobicContact CB-CD2 4.15Å; A385-Y408 HydrophobicContact CB-CE2 3.98Å
386	E	88.9	Confident	92.1	Very high	142 Å²	142	79.9 Å²	79.9	66%	0.664	41%	0.411	S	S	*	.	H	α-helix	trans	-61.6	-49.4	177.3	-177.2	174.8	-170.8	0	0	111.8	N382 K383 T388 I389 S390	N382-E386 WeakPolarHBondContact O-CB 3.3Å; N382-E386 PolarHBondContact O-N 3.36Å; K383-E386 PolarHBondContact O-N 3.31Å; E386-T388 PolarHBondContact O-N 3.15Å; E386-I389 PolarHBondContact O-N 3.16Å; E386-S390 WeakPolarHBondContact O-CB 3.36Å; E386-S390 PolarHBondContact O-N 3.47Å
387	E	90.6	Very high	92.5	Very high	141 Å²	141	82 Å²	82	66%	0.659	43%	0.428	S	S	*	.	H	α-helix	trans	-59.9	-46.1	177.5	-173.7	172.7	-179.5	0	0	111.5	K383 G391	K383-E387 WeakPolarHBondContact O-CB 3.29Å; K383-E387 PolarHBondContact O-N 3.07Å; E387-G391 WeakPolarHBondContact O-CA 3.42Å; E387-G391 PolarHBondContact O-N 3.42Å
388	T	93.4	Very high	92.7	Very high	30 Å²	30	88.8 Å²	88.8	18%	0.184	46%	0.456	C	S	.	.	H	α-helix	trans	-65.9	-42.3	179.5	-61.6	0	0	0	0	112.7	V384 A385 E386 G391 M392 V395 E404	V384-T388 VanDerWaalsContact O-CB 3.27Å; V384-T388 WeakPolarHBondContact O-CB 3.22Å; V384-T388 PolarHBondContact O-N 3.34Å; V384-T388 PolarHBondContact O-OG1 2.94Å; A385-T388 PolarHBondContact O-N 3.49Å; E386-T388 PolarHBondContact O-N 3.15Å; T388-G391 CarbonylContact O-C 3.57Å; T388-M392 WeakPolarHBondContact O-CA 3.27Å; T388-M392 PolarHBondContact O-N 3.18Å; T388-V395 HydrophobicContact CG2-CG2 4.1Å; T388-E404 HydrophobicContact CG2-CB 3.68Å; T388-E404 HydrophobicContact CG2-CG 4.13Å
389	I	94	Very high	92.9	Very high	127 Å²	127	90.2 Å²	90.2	65%	0.651	48%	0.475	S	S	*	.	H	α-helix	trans	-73.7	-41.6	-178.5	-68.8	167.3	0	0	0	110.7	A385 E386 M392	A385-I389 VanDerWaalsContact O-CB 3.29Å; A385-I389 WeakPolarHBondContact O-CB 3.43Å; A385-I389 WeakPolarHBondContact O-CD1 3.22Å; A385-I389 WeakPolarHBondContact O-CG1 3.38Å; A385-I389 PolarHBondContact O-N 3.42Å; E386-I389 PolarHBondContact O-N 3.16Å; I389-M392 VanDerWaalsContact O-CB 3.22Å; I389-M392 WeakPolarHBondContact O-CB 2.96Å; I389-M392 PolarHBondContact O-N 3.29Å
390	S	88.1	Confident	93.5	Very high	112 Å²	112	89.7 Å²	89.7	78%	0.783	46%	0.463	S	S	*	.	H	α-helix	trans	-62.1	-44.8	173.2	-171.9	0	0	0	0	110.9	E386 M392	E386-S390 WeakPolarHBondContact O-CB 3.36Å; E386-S390 PolarHBondContact O-N 3.47Å; S390-M392 VanDerWaalsContact C-N 3.26Å; S390-M392 PolarHBondContact O-N 2.57Å
391	G	93.1	Very high	93.7	Very high	22 Å²	22	88.3 Å²	88.3	23%	0.227	46%	0.457	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.8	11.3	175.9	0	0	0	0	0	115.7	E387 T388 R393 T394 V395	E387-G391 WeakPolarHBondContact O-CA 3.42Å; E387-G391 PolarHBondContact O-N 3.42Å; T388-G391 CarbonylContact O-C 3.57Å; G391-R393 PolarHBondContact O-N 3.44Å; G391-T394 WeakPolarHBondContact O-CA 3.41Å; G391-T394 VanDerWaalsContact O-CB 3.22Å; G391-T394 WeakPolarHBondContact O-CB 3.31Å; G391-T394 PolarHBondContact O-N 2.84Å; G391-V395 PolarHBondContact O-N 3.5Å
392	M	94.4	Very high	93.9	Very high	88 Å²	88	92.7 Å²	92.7	43%	0.433	49%	0.487	S	S	.	.	H	α-helix	trans	-57.1	-31.5	-166.7	-178.4	57.1	141.4	0	0	114.3	T388 I389 S390 T394 V395 R396	T388-M392 WeakPolarHBondContact O-CA 3.27Å; T388-M392 PolarHBondContact O-N 3.18Å; I389-M392 VanDerWaalsContact O-CB 3.22Å; I389-M392 WeakPolarHBondContact O-CB 2.96Å; I389-M392 PolarHBondContact O-N 3.29Å; S390-M392 VanDerWaalsContact C-N 3.26Å; S390-M392 PolarHBondContact O-N 2.57Å; M392-T394 VanDerWaalsContact C-N 3.34Å; M392-V395 PolarHBondContact O-N 3.09Å; M392-V395 HydrophobicContact SD-CB 4.47Å; M392-R396 WeakPolarHBondContact O-CB 3.31Å; M392-R396 VanDerWaalsContact O-CG 3.3Å; M392-R396 WeakPolarHBondContact O-CG 3.3Å; M392-R396 PolarHBondContact O-N 3.03Å; M392-R396 HydrophobicContact SD-CG 4.16Å
393	R	93.8	Very high	94.1	Very high	226 Å²	226	97.3 Å²	97.3	85%	0.853	50%	0.499	S	S	*	.	H	α-helix	trans	-62.7	-41.3	172.8	-69.3	-173.2	-175.5	-179.7	2.9	112.1	G391 S397	G391-R393 PolarHBondContact O-N 3.44Å; R393-S397 WeakPolarHBondContact O-CB 3.2Å; R393-S397 PolarHBondContact O-N 3.45Å; R393-S397 PolarHBondContact O-OG 3.2Å
394	T	96.7	Very high	94.5	Very high	82 Å²	82	92.5 Å²	92.5	50%	0.503	48%	0.478	S	S	.	.	H	α-helix	trans	-66.9	-46.8	175.5	-48.4	0	0	0	0	110.6	G391 M392 R396 S397 F398	G391-T394 WeakPolarHBondContact O-CA 3.41Å; G391-T394 VanDerWaalsContact O-CB 3.22Å; G391-T394 WeakPolarHBondContact O-CB 3.31Å; G391-T394 PolarHBondContact O-N 2.84Å; M392-T394 VanDerWaalsContact C-N 3.34Å; T394-R396 VanDerWaalsContact C-N 3.26Å; T394-R396 PolarHBondContact O-N 3.04Å; T394-S397 WeakPolarHBondContact CA-OG 3.16Å; T394-S397 PolarHBondContact O-N 3.48Å; T394-S397 VanDerWaalsContact O-N 3.12Å; T394-S397 PolarHBondContact O-OG 2.91Å; T394-F398 HydrophobicContact CG2-CD2 3.7Å; T394-F398 HydrophobicContact CG2-CE2 3.84Å; T394-F398 WeakPolarHBondContact O-CD2 3.45Å; T394-F398 PolarHBondContact O-N 2.81Å
395	V	97	Very high	94.6	Very high	18 Å²	18	93.9 Å²	93.9	11%	0.109	49%	0.493	C	S	.	.	H	α-helix	trans	-58.2	-41.2	178.1	-176.7	0	0	0	0	111	T388 G391 M392 A399 N400 E401 E404	T388-V395 HydrophobicContact CG2-CG2 4.1Å; G391-V395 PolarHBondContact O-N 3.5Å; M392-V395 PolarHBondContact O-N 3.09Å; M392-V395 HydrophobicContact SD-CB 4.47Å; V395-A399 PolarHBondContact O-N 3.12Å; V395-A399 VanDerWaalsContact O-N 3.17Å; V395-N400 PolarHBondContact O-N 2.74Å; V395-E401 HydrophobicContact CG1-CG 4.22Å; V395-E404 HydrophobicContact CG1-CG 4.2Å; V395-E404 HydrophobicContact CG2-CG 4.48Å
396	R	96.4	Very high	94.7	Very high	151 Å²	151	97.7 Å²	97.7	57%	0.57	51%	0.51	S	S	*	.	H	α-helix	trans	-68.4	-43.2	172.7	-70.3	-56.3	-165.4	161.9	2.6	113.5	M392 T394 F398 A399 E401	M392-R396 WeakPolarHBondContact O-CB 3.31Å; M392-R396 VanDerWaalsContact O-CG 3.3Å; M392-R396 WeakPolarHBondContact O-CG 3.3Å; M392-R396 PolarHBondContact O-N 3.03Å; M392-R396 HydrophobicContact SD-CG 4.16Å; T394-R396 VanDerWaalsContact C-N 3.26Å; T394-R396 PolarHBondContact O-N 3.04Å; R396-F398 PolarHBondContact O-N 2.97Å; R396-A399 PolarHBondContact O-N 3.29Å; R396-A399 VanDerWaalsContact O-N 3.14Å; R396-E401 WeakPolarHBondContact CD-OE1 3.43Å; R396-E401 IonicContact CZ-OE1 3.39Å; R396-E401 IonicContact NE-OE1 2.66Å; R396-E401 IonicContact NH1-OE1 3.25Å; R396-E401 PolarHBondContact NH1-OE1 3.37Å
397	S	97.4	Very high	95	Very high	89 Å²	89	93.2 Å²	93.2	62%	0.622	49%	0.494	S	S	*	.	H	α-helix	trans	-67.4	-26.3	-178.8	68.7	0	0	0	0	113.1	R393 T394	R393-S397 WeakPolarHBondContact O-CB 3.2Å; R393-S397 PolarHBondContact O-N 3.45Å; R393-S397 PolarHBondContact O-OG 3.2Å; T394-S397 WeakPolarHBondContact CA-OG 3.16Å; T394-S397 PolarHBondContact O-N 3.48Å; T394-S397 VanDerWaalsContact O-N 3.12Å; T394-S397 PolarHBondContact O-OG 2.91Å
398	F	97.3	Very high	95.3	Very high	159 Å²	159	90.3 Å²	90.3	70%	0.697	48%	0.478	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.1	6	174.2	-72.5	-82.5	0	0	0	113.8	T394 R396 N400	T394-F398 HydrophobicContact CG2-CD2 3.7Å; T394-F398 HydrophobicContact CG2-CE2 3.84Å; T394-F398 WeakPolarHBondContact O-CD2 3.45Å; T394-F398 PolarHBondContact O-N 2.81Å; R396-F398 PolarHBondContact O-N 2.97Å; F398-N400 PolarHBondContact O-N 2.62Å
399	A	96.4	Very high	95.5	Very high	79 Å²	79	95.2 Å²	95.2	65%	0.653	49%	0.494	S	S	*	.	T	Hydrogen-bonded Turn	trans	48	40.9	179.5	0	0	0	0	0	114.1	V395 R396 E401	V395-A399 PolarHBondContact O-N 3.12Å; V395-A399 VanDerWaalsContact O-N 3.17Å; R396-A399 PolarHBondContact O-N 3.29Å; R396-A399 VanDerWaalsContact O-N 3.14Å; A399-E401 VanDerWaalsContact CA-OE2 3.27Å; A399-E401 WeakPolarHBondContact CA-OE2 3.43Å
400	N	95.7	Very high	95.6	Very high	49 Å²	49	91.7 Å²	91.7	26%	0.262	48%	0.484	S	S	.	.			trans	-105.9	13.9	-169.3	-166.9	53.1	0	0	0	113.2	V395 F398 S402 R403 E404	V395-N400 PolarHBondContact O-N 2.74Å; F398-N400 PolarHBondContact O-N 2.62Å; N400-S402 VanDerWaalsContact C-N 3.32Å; N400-S402 PolarHBondContact O-N 2.89Å; N400-R403 WeakPolarHBondContact O-CB 3.25Å; N400-R403 PolarHBondContact O-N 3.41Å; N400-R403 WeakPolarHBondContact OD1-CB 3.2Å; N400-R403 WeakPolarHBondContact OD1-CD 3.39Å; N400-E404 PolarHBondContact ND2-OE1 3.34Å; N400-E404 PolarHBondContact O-N 3.32Å
401	E	96.5	Very high	95.9	Very high	59 Å²	59	89.7 Å²	89.7	28%	0.276	46%	0.461	S	S	.	.	H	α-helix	trans	-55.2	-44.4	-172.7	-56.9	92.7	140.6	0	0	112.5	V395 R396 A399 R403 E404 A405	V395-E401 HydrophobicContact CG1-CG 4.22Å; R396-E401 WeakPolarHBondContact CD-OE1 3.43Å; R396-E401 IonicContact CZ-OE1 3.39Å; R396-E401 IonicContact NE-OE1 2.66Å; R396-E401 IonicContact NH1-OE1 3.25Å; R396-E401 PolarHBondContact NH1-OE1 3.37Å; A399-E401 VanDerWaalsContact CA-OE2 3.27Å; A399-E401 WeakPolarHBondContact CA-OE2 3.43Å; E401-R403 VanDerWaalsContact C-N 3.28Å; E401-R403 PolarHBondContact O-N 3.36Å; E401-E404 PolarHBondContact O-N 2.84Å; E401-A405 WeakPolarHBondContact O-CB 3.44Å; E401-A405 PolarHBondContact O-N 3.02Å
402	S	96.6	Very high	96.1	Very high	92 Å²	92	90.9 Å²	90.9	64%	0.643	46%	0.462	S	S	*	.	H	α-helix	trans	-64.8	-31.3	-179.9	-57.1	0	0	0	0	112.8	N400 N406	N400-S402 VanDerWaalsContact C-N 3.32Å; N400-S402 PolarHBondContact O-N 2.89Å; S402-N406 WeakPolarHBondContact O-CB 3.21Å; S402-N406 PolarHBondContact O-N 2.86Å; S402-N406 VanDerWaalsContact O-N 3.07Å; S402-N406 PolarHBondContact O-ND2 3.44Å; S402-N406 VanDerWaalsContact O-ND2 3.1Å
403	R	95.1	Very high	96.2	Very high	178 Å²	178	90 Å²	90	67%	0.672	46%	0.459	S	S	*	.	H	α-helix	trans	-75	-43.1	-180	-171.3	177.5	179.9	134.4	-1.7	111.1	N400 E401 N406 S407	N400-R403 WeakPolarHBondContact O-CB 3.25Å; N400-R403 PolarHBondContact O-N 3.41Å; N400-R403 WeakPolarHBondContact OD1-CB 3.2Å; N400-R403 WeakPolarHBondContact OD1-CD 3.39Å; E401-R403 VanDerWaalsContact C-N 3.28Å; E401-R403 PolarHBondContact O-N 3.36Å; R403-N406 PolarHBondContact O-N 3.46Å; R403-S407 WeakPolarHBondContact O-CB 3.32Å; R403-S407 PolarHBondContact O-N 2.66Å
404	E	95.9	Very high	96.3	Very high	46 Å²	46	82.7 Å²	82.7	22%	0.215	44%	0.439	C	S	.	.	H	α-helix	trans	-68.9	-38.4	176.8	-59.7	-43.8	133.7	0	0	111.8	T388 V395 N400 E401 N406 S407 Y408	T388-E404 HydrophobicContact CG2-CB 3.68Å; T388-E404 HydrophobicContact CG2-CG 4.13Å; V395-E404 HydrophobicContact CG1-CG 4.2Å; V395-E404 HydrophobicContact CG2-CG 4.48Å; N400-E404 PolarHBondContact ND2-OE1 3.34Å; N400-E404 PolarHBondContact O-N 3.32Å; E401-E404 PolarHBondContact O-N 2.84Å; E404-N406 VanDerWaalsContact C-N 3.32Å; E404-N406 PolarHBondContact O-N 3.27Å; E404-S407 WeakPolarHBondContact O-CB 3.43Å; E404-S407 PolarHBondContact O-N 3.14Å; E404-Y408 PolarHBondContact O-N 3.17Å
405	A	95.4	Very high	96.2	Very high	57 Å²	57	80.5 Å²	80.5	47%	0.471	42%	0.424	S	S	.	.	H	α-helix	trans	-58.1	-43.5	170.5	0	0	0	0	0	112.1	E401 Y409	E401-A405 WeakPolarHBondContact O-CB 3.44Å; E401-A405 PolarHBondContact O-N 3.02Å; A405-Y409 VanDerWaalsContact O-CB 3.32Å; A405-Y409 WeakPolarHBondContact O-CB 3.23Å; A405-Y409 PolarHBondContact O-N 3.22Å
406	N	96.6	Very high	96.2	Very high	104 Å²	104	84.8 Å²	84.8	56%	0.556	44%	0.441	S	S	*	.	H	α-helix	trans	-68.3	-35.3	175.9	-75.7	-25.4	0	0	0	113	S402 R403 E404 Y409 A410	S402-N406 WeakPolarHBondContact O-CB 3.21Å; S402-N406 PolarHBondContact O-N 2.86Å; S402-N406 VanDerWaalsContact O-N 3.07Å; S402-N406 PolarHBondContact O-ND2 3.44Å; S402-N406 VanDerWaalsContact O-ND2 3.1Å; R403-N406 PolarHBondContact O-N 3.46Å; E404-N406 VanDerWaalsContact C-N 3.32Å; E404-N406 PolarHBondContact O-N 3.27Å; N406-Y409 PolarHBondContact O-N 3.17Å; N406-A410 WeakPolarHBondContact O-CB 3.22Å; N406-A410 PolarHBondContact O-N 3.09Å
407	S	94.8	Very high	96.2	Very high	49 Å²	49	83.7 Å²	83.7	34%	0.343	44%	0.442	S	S	.	.	H	α-helix	trans	-61.2	-49.3	174.9	-172.7	0	0	0	0	111.3	R403 E404 A410 K411	R403-S407 WeakPolarHBondContact O-CB 3.32Å; R403-S407 PolarHBondContact O-N 2.66Å; E404-S407 WeakPolarHBondContact O-CB 3.43Å; E404-S407 PolarHBondContact O-N 3.14Å; S407-A410 PolarHBondContact O-N 3.13Å; S407-K411 PolarHBondContact O-N 3.46Å
408	Y	96.3	Very high	96	Very high	79 Å²	79	80.4 Å²	80.4	31%	0.31	42%	0.418	S	S	.	.	H	α-helix	trans	-62.7	-44.7	174.4	-177.9	-109.6	0	0	0	111.9	A381 A385 E404 A410 K411 L412	A381-Y408 HydrophobicContact CB-CD2 4.17Å; A381-Y408 HydrophobicContact CB-CE2 3.82Å; A381-Y408 WeakPolarHBondContact O-CD2 3.33Å; A381-Y408 WeakPolarHBondContact O-CE2 3.21Å; A385-Y408 HydrophobicContact CB-CD2 4.15Å; A385-Y408 HydrophobicContact CB-CE2 3.98Å; E404-Y408 PolarHBondContact O-N 3.17Å; Y408-A410 VanDerWaalsContact C-N 3.32Å; Y408-A410 PolarHBondContact O-N 3.35Å; Y408-K411 PolarHBondContact O-N 2.97Å; Y408-K411 VanDerWaalsContact O-N 3.17Å; Y408-L412 HydrophobicContact CD1-CD1 3.92Å; Y408-L412 HydrophobicContact CD1-CG 4.36Å; Y408-L412 HydrophobicContact CE1-CD1 3.49Å; Y408-L412 VanDerWaalsContact CE1-CD1 3.49Å; Y408-L412 HydrophobicContact CE1-CD2 4.45Å; Y408-L412 HydrophobicContact CE1-CG 4.05Å; Y408-L412 PolarHBondContact O-N 3.18Å
409	Y	97.1	Very high	95.8	Very high	134 Å²	134	75.5 Å²	75.5	53%	0.525	40%	0.399	S	S	.	.	H	α-helix	trans	-60.1	-38.4	176.6	179.2	-111	0	0	0	113	A405 N406 K411 L412 L413	A405-Y409 VanDerWaalsContact O-CB 3.32Å; A405-Y409 WeakPolarHBondContact O-CB 3.23Å; A405-Y409 PolarHBondContact O-N 3.22Å; N406-Y409 PolarHBondContact O-N 3.17Å; Y409-K411 VanDerWaalsContact C-N 3.35Å; Y409-K411 PolarHBondContact O-N 2.97Å; Y409-L412 PolarHBondContact O-N 3.31Å; Y409-L413 HydrophobicContact CD1-CD1 4.06Å; Y409-L413 HydrophobicContact CD1-CG 4.45Å; Y409-L413 HydrophobicContact CE1-CD1 3.56Å; Y409-L413 HydrophobicContact CE1-CG 4.02Å; Y409-L413 HydrophobicContact CE2-CG 4.36Å; Y409-L413 PolarHBondContact O-N 3Å
410	A	96.5	Very high	95.7	Very high	53 Å²	53	77.6 Å²	77.6	44%	0.438	39%	0.393	S	S	.	.	H	α-helix	trans	-62.4	-39.5	175.8	0	0	0	0	0	112.3	N406 S407 Y408 L413 V414	N406-A410 WeakPolarHBondContact O-CB 3.22Å; N406-A410 PolarHBondContact O-N 3.09Å; S407-A410 PolarHBondContact O-N 3.13Å; Y408-A410 VanDerWaalsContact C-N 3.32Å; Y408-A410 PolarHBondContact O-N 3.35Å; A410-L413 PolarHBondContact O-N 3.17Å; A410-V414 PolarHBondContact O-N 3.25Å
411	K	95.1	Very high	95.7	Very high	70 Å²	70	80.9 Å²	80.9	30%	0.304	41%	0.405	S	S	.	.	H	α-helix	trans	-65.5	-42	172.8	-67	-68.8	-172.1	174.6	0	111.8	E380 A381 S407 Y408 Y409 L413 V414 M415	E380-K411 HydrophobicContact CB-CD 4.5Å; E380-K411 IonicContact OE2-NZ 2.84Å; E380-K411 PolarHBondContact OE2-NZ 2.91Å; A381-K411 HydrophobicContact CB-CB 3.89Å; S407-K411 PolarHBondContact O-N 3.46Å; Y408-K411 PolarHBondContact O-N 2.97Å; Y408-K411 VanDerWaalsContact O-N 3.17Å; Y409-K411 VanDerWaalsContact C-N 3.35Å; Y409-K411 PolarHBondContact O-N 2.97Å; K411-L413 VanDerWaalsContact C-N 3.31Å; K411-L413 PolarHBondContact O-N 3.29Å; K411-V414 PolarHBondContact O-N 3.43Å; K411-M415 PolarHBondContact O-N 2.86Å; K411-M415 VanDerWaalsContact O-N 3.11Å
412	L	96.3	Very high	95.3	Very high	47 Å²	47	79.4 Å²	79.4	25%	0.246	40%	0.398	C	S	.	.	H	α-helix	trans	-62.2	-34	175	-68.1	-178.1	0	0	0	113.2	Y408 Y409 M415 F416	Y408-L412 HydrophobicContact CD1-CD1 3.92Å; Y408-L412 HydrophobicContact CD1-CG 4.36Å; Y408-L412 HydrophobicContact CE1-CD1 3.49Å; Y408-L412 VanDerWaalsContact CE1-CD1 3.49Å; Y408-L412 HydrophobicContact CE1-CD2 4.45Å; Y408-L412 HydrophobicContact CE1-CG 4.05Å; Y408-L412 PolarHBondContact O-N 3.18Å; Y409-L412 PolarHBondContact O-N 3.31Å; L412-M415 HydrophobicContact CD2-CE 3.75Å; L412-M415 HydrophobicContact CD2-SD 4.47Å; L412-M415 WeakPolarHBondContact O-CB 3.45Å; L412-M415 PolarHBondContact O-N 3.21Å; L412-F416 WeakPolarHBondContact O-CB 3.45Å; L412-F416 PolarHBondContact O-N 3.33Å
413	L	97	Very high	95.1	Very high	69 Å²	69	77.9 Å²	77.9	36%	0.361	39%	0.391	S	S	.	.	H	α-helix	trans	-64.3	-38.1	174.7	-79.5	175.1	0	0	0	112.6	Y409 A410 K411 F416 Q417	Y409-L413 HydrophobicContact CD1-CD1 4.06Å; Y409-L413 HydrophobicContact CD1-CG 4.45Å; Y409-L413 HydrophobicContact CE1-CD1 3.56Å; Y409-L413 HydrophobicContact CE1-CG 4.02Å; Y409-L413 HydrophobicContact CE2-CG 4.36Å; Y409-L413 PolarHBondContact O-N 3Å; A410-L413 PolarHBondContact O-N 3.17Å; K411-L413 VanDerWaalsContact C-N 3.31Å; K411-L413 PolarHBondContact O-N 3.29Å; L413-F416 PolarHBondContact O-N 3.12Å; L413-Q417 WeakPolarHBondContact O-CG 3.45Å; L413-Q417 PolarHBondContact O-N 3.49Å; L413-Q417 VanDerWaalsContact O-N 3.11Å
414	V	96.1	Very high	95.1	Very high	73 Å²	73	75.1 Å²	75.1	44%	0.442	39%	0.389	S	S	.	.	H	α-helix	trans	-64.8	-47	173.6	179.2	0	0	0	0	110.2	V377 A410 K411 F416 Q417 L418	V377-V414 HydrophobicContact CG1-CB 4.17Å; V377-V414 HydrophobicContact CG1-CG1 4.15Å; V377-V414 HydrophobicContact CG2-CG1 4.22Å; A410-V414 PolarHBondContact O-N 3.25Å; K411-V414 PolarHBondContact O-N 3.43Å; V414-F416 VanDerWaalsContact C-N 3.27Å; V414-F416 PolarHBondContact O-N 3.39Å; V414-Q417 PolarHBondContact O-N 2.84Å; V414-Q417 VanDerWaalsContact O-N 3.14Å; V414-L418 PolarHBondContact O-N 2.77Å
415	M	95.3	Very high	94.8	Very high	36 Å²	36	73.2 Å²	73.2	18%	0.177	38%	0.381	C	S	.	.	H	α-helix	trans	-56.9	-40.9	174.7	-170.8	-170.6	68.6	0	0	111.7	V374 V377 L378 K411 L412 Q417 L418 N419	V374-M415 HydrophobicContact CG1-CG 4.14Å; V377-M415 HydrophobicContact CG1-CB 3.94Å; L378-M415 HydrophobicContact CB-SD 4.26Å; L378-M415 HydrophobicContact CD1-SD 4.1Å; K411-M415 PolarHBondContact O-N 2.86Å; K411-M415 VanDerWaalsContact O-N 3.11Å; L412-M415 HydrophobicContact CD2-CE 3.75Å; L412-M415 HydrophobicContact CD2-SD 4.47Å; L412-M415 WeakPolarHBondContact O-CB 3.45Å; L412-M415 PolarHBondContact O-N 3.21Å; M415-Q417 PolarHBondContact O-N 3.05Å; M415-L418 PolarHBondContact O-N 2.89Å; M415-N419 WeakPolarHBondContact O-CB 3.43Å; M415-N419 PolarHBondContact O-N 3.02Å; M415-N419 PolarHBondContact O-ND2 3.24Å
416	F	96.4	Very high	94.5	Very high	108 Å²	108	76 Å²	76	47%	0.474	38%	0.38	S	S	.	.	H	α-helix	trans	-64.4	-36.7	177.6	-179.6	-125	0	0	0	113.1	L412 L413 V414 N419 K420	L412-F416 WeakPolarHBondContact O-CB 3.45Å; L412-F416 PolarHBondContact O-N 3.33Å; L413-F416 PolarHBondContact O-N 3.12Å; V414-F416 VanDerWaalsContact C-N 3.27Å; V414-F416 PolarHBondContact O-N 3.39Å; F416-N419 PolarHBondContact O-N 3.5Å; F416-K420 HydrophobicContact CE1-CD 4.3Å; F416-K420 VanDerWaalsContact CE1-CE 3.4Å; F416-K420 HydrophobicContact CZ-CD 4.4Å; F416-K420 WeakPolarHBondContact O-CG 3.27Å; F416-K420 PolarHBondContact O-N 3Å
417	Q	95.7	Very high	94.3	Very high	127 Å²	127	73.8 Å²	73.8	59%	0.593	38%	0.376	S	S	*	.	H	α-helix	trans	-66.8	-37.9	174.1	-69	-174	18.5	0	0	112.5	L413 V414 M415 K421	L413-Q417 WeakPolarHBondContact O-CG 3.45Å; L413-Q417 PolarHBondContact O-N 3.49Å; L413-Q417 VanDerWaalsContact O-N 3.11Å; V414-Q417 PolarHBondContact O-N 2.84Å; V414-Q417 VanDerWaalsContact O-N 3.14Å; M415-Q417 PolarHBondContact O-N 3.05Å; Q417-K421 PolarHBondContact O-N 2.9Å
418	L	93.3	Very high	94.1	Very high	21 Å²	21	73.7 Å²	73.7	11%	0.11	38%	0.376	C	S	.	.	H	α-helix	trans	-68.1	-45.1	173.7	-63.8	174.9	0	0	0	111.2	L370 E373 V374 V377 V414 M415 K420 K421 Q422	L370-L418 HydrophobicContact CD1-CB 4.18Å; L370-L418 HydrophobicContact CD1-CD2 3.85Å; E373-L418 HydrophobicContact CB-CD1 4.09Å; V374-L418 HydrophobicContact CG2-CB 3.54Å; V374-L418 HydrophobicContact CG2-CD1 4.34Å; V377-L418 HydrophobicContact CG2-CD1 3.83Å; V414-L418 PolarHBondContact O-N 2.77Å; M415-L418 PolarHBondContact O-N 2.89Å; L418-K420 VanDerWaalsContact C-N 3.28Å; L418-K420 PolarHBondContact O-N 3.4Å; L418-K421 WeakPolarHBondContact O-CB 3.45Å; L418-K421 PolarHBondContact O-N 3.2Å; L418-Q422 PolarHBondContact O-N 3.09Å
419	N	92.9	Very high	93.7	Very high	56 Å²	56	73.3 Å²	73.3	30%	0.299	37%	0.374	S	S	.	.	H	α-helix	trans	-59	-35.8	175.1	-77.2	-23.7	0	0	0	112.6	V374 M415 F416 Q422 A423	V374-N419 WeakPolarHBondContact CG1-OD1 3.31Å; V374-N419 WeakPolarHBondContact CG2-OD1 3.31Å; M415-N419 WeakPolarHBondContact O-CB 3.43Å; M415-N419 PolarHBondContact O-N 3.02Å; M415-N419 PolarHBondContact O-ND2 3.24Å; F416-N419 PolarHBondContact O-N 3.5Å; N419-Q422 PolarHBondContact O-N 3.39Å; N419-A423 WeakPolarHBondContact O-CB 3.38Å; N419-A423 PolarHBondContact O-N 3.02Å
420	K	96.1	Very high	93.3	Very high	123 Å²	123	70.2 Å²	70.2	54%	0.535	37%	0.365	S	S	.	.	H	α-helix	trans	-60.8	-46.3	171.6	-83.1	176.9	170.4	174.9	0	112.4	F416 L418 Q422 A423 L424	F416-K420 HydrophobicContact CE1-CD 4.3Å; F416-K420 VanDerWaalsContact CE1-CE 3.4Å; F416-K420 HydrophobicContact CZ-CD 4.4Å; F416-K420 WeakPolarHBondContact O-CG 3.27Å; F416-K420 PolarHBondContact O-N 3Å; L418-K420 VanDerWaalsContact C-N 3.28Å; L418-K420 PolarHBondContact O-N 3.4Å; K420-Q422 VanDerWaalsContact C-N 3.27Å; K420-Q422 PolarHBondContact O-N 2.96Å; K420-A423 PolarHBondContact O-N 3.2Å; K420-L424 PolarHBondContact O-N 3.34Å
421	K	94	Very high	93.1	Very high	118 Å²	118	76.2 Å²	76.2	51%	0.513	38%	0.377	S	S	.	.	H	α-helix	trans	-62.3	-37.5	174.8	-67.1	174	-177.8	175.7	0	111	L370 Q417 L418 L424 A425	L370-K421 HydrophobicContact CD2-CB 3.66Å; Q417-K421 PolarHBondContact O-N 2.9Å; L418-K421 WeakPolarHBondContact O-CB 3.45Å; L418-K421 PolarHBondContact O-N 3.2Å; K421-L424 PolarHBondContact O-N 3Å; K421-A425 WeakPolarHBondContact O-CB 3.44Å; K421-A425 PolarHBondContact O-N 2.64Å
422	Q	89.8	Confident	92.9	Very high	27 Å²	27	74.2 Å²	74.2	13%	0.126	37%	0.371	C	S	.	.	H	α-helix	trans	-69.9	-41.3	-179.9	-173.1	174.6	-15.9	0	0	111.9	Y367 L370 T371 L418 N419 K420 A425 Y426	Y367-Q422 HydrophobicContact CD2-CG 3.97Å; Y367-Q422 HydrophobicContact CE2-CG 3.36Å; Y367-Q422 VanDerWaalsContact CZ-NE2 3.28Å; Y367-Q422 PolarHBondContact OH-NE2 3.38Å; L370-Q422 VanDerWaalsContact CD2-CA 3.5Å; L370-Q422 HydrophobicContact CD2-CB 3.75Å; L370-Q422 VanDerWaalsContact CD2-N 3.31Å; L370-Q422 HydrophobicContact CG-CB 4.1Å; T371-Q422 PolarHBondContact OG1-NE2 3Å; L418-Q422 PolarHBondContact O-N 3.09Å; N419-Q422 PolarHBondContact O-N 3.39Å; K420-Q422 VanDerWaalsContact C-N 3.27Å; K420-Q422 PolarHBondContact O-N 2.96Å; Q422-A425 PolarHBondContact O-N 3.08Å; Q422-Y426 VanDerWaalsContact O-CB 3.31Å; Q422-Y426 WeakPolarHBondContact O-CB 3.33Å; Q422-Y426 PolarHBondContact O-N 3.44Å
423	A	92.4	Very high	92.4	Very high	61 Å²	61	72.7 Å²	72.7	50%	0.504	36%	0.364	S	S	.	.	H	α-helix	trans	-63.1	-41.8	173.8	0	0	0	0	0	111.8	N419 K420 Y426 A427	N419-A423 WeakPolarHBondContact O-CB 3.38Å; N419-A423 PolarHBondContact O-N 3.02Å; K420-A423 PolarHBondContact O-N 3.2Å; A423-Y426 PolarHBondContact O-N 3.29Å; A423-A427 WeakPolarHBondContact O-CB 2.91Å; A423-A427 PolarHBondContact O-N 3.27Å
424	L	93.6	Very high	92.1	Very high	119 Å²	119	72.5 Å²	72.5	62%	0.623	37%	0.368	S	S	*	.	H	α-helix	trans	-66.2	-44.6	175.6	-173.3	148.1	0	0	0	111.7	K420 K421 Y426 A427 C428	K420-L424 PolarHBondContact O-N 3.34Å; K421-L424 PolarHBondContact O-N 3Å; L424-Y426 VanDerWaalsContact C-N 3.3Å; L424-Y426 PolarHBondContact O-N 2.89Å; L424-A427 PolarHBondContact O-N 3.43Å; L424-C428 PolarHBondContact O-N 3.27Å; L424-C428 PolarHBondContact O-SG 3.48Å; L424-C428 VanDerWaalsContact O-SG 3.39Å
425	A	89.8	Confident	91.9	Very high	7 Å²	7	73 Å²	73	6%	0.058	37%	0.367	C	S	.	.	H	α-helix	trans	-59.6	-41.1	175.2	0	0	0	0	0	112.2	Y366 K421 Q422 Y429	Y366-A425 HydrophobicContact CD1-CB 4.01Å; Y366-A425 HydrophobicContact CE1-CB 3.87Å; K421-A425 WeakPolarHBondContact O-CB 3.44Å; K421-A425 PolarHBondContact O-N 2.64Å; Q422-A425 PolarHBondContact O-N 3.08Å; A425-Y429 WeakPolarHBondContact O-CB 3.36Å; A425-Y429 PolarHBondContact O-N 3.25Å
426	Y	89.4	Confident	91.7	Very high	115 Å²	115	71.7 Å²	71.7	45%	0.451	36%	0.362	S	S	.	.	H	α-helix	trans	-65.6	-43.5	174.8	-176.4	-104.1	0	0	0	112.5	Y367 Q422 A423 L424 C428 Y429 M430	Y367-Y426 HydrophobicContact CE2-CD2 4.25Å; Q422-Y426 VanDerWaalsContact O-CB 3.31Å; Q422-Y426 WeakPolarHBondContact O-CB 3.33Å; Q422-Y426 PolarHBondContact O-N 3.44Å; A423-Y426 PolarHBondContact O-N 3.29Å; L424-Y426 VanDerWaalsContact C-N 3.3Å; L424-Y426 PolarHBondContact O-N 2.89Å; Y426-C428 PolarHBondContact O-N 3.01Å; Y426-Y429 HydrophobicContact CD2-CD1 4.38Å; Y426-Y429 WeakPolarHBondContact O-CB 3.48Å; Y426-Y429 PolarHBondContact O-N 3.38Å; Y426-M430 HydrophobicContact CD1-CG 4.02Å; Y426-M430 HydrophobicContact CD2-CG 4.32Å; Y426-M430 HydrophobicContact CE1-CG 3.57Å; Y426-M430 HydrophobicContact CE1-SD 4.38Å; Y426-M430 HydrophobicContact CE2-CG 3.9Å; Y426-M430 HydrophobicContact CE2-SD 3.97Å; Y426-M430 HydrophobicContact CG-CG 4.37Å; Y426-M430 WeakPolarHBondContact O-CG 3.45Å; Y426-M430 PolarHBondContact O-N 3.1Å
427	A	91.7	Very high	91.3	Very high	57 Å²	57	71 Å²	71	47%	0.471	36%	0.36	S	S	.	.	H	α-helix	trans	-60.9	-44.7	177.3	0	0	0	0	0	111.6	A423 L424 W431	A423-A427 WeakPolarHBondContact O-CB 2.91Å; A423-A427 PolarHBondContact O-N 3.27Å; L424-A427 PolarHBondContact O-N 3.43Å; A427-W431 VanDerWaalsContact O-CB 3.27Å; A427-W431 WeakPolarHBondContact O-CB 3.38Å; A427-W431 PolarHBondContact O-N 3.41Å
428	C	90.9	Very high	91.1	Very high	48 Å²	48	69.6 Å²	69.6	32%	0.324	36%	0.356	S	S	.	.	H	α-helix	trans	-63.1	-41.2	173.9	-65.8	0	0	0	0	112.4	Y363 L424 Y426 S432	Y363-C428 HydrophobicContact CE1-CB 3.72Å; L424-C428 PolarHBondContact O-N 3.27Å; L424-C428 PolarHBondContact O-SG 3.48Å; L424-C428 VanDerWaalsContact O-SG 3.39Å; Y426-C428 PolarHBondContact O-N 3.01Å; C428-S432 VanDerWaalsContact O-CB 3.31Å; C428-S432 WeakPolarHBondContact O-CB 3.45Å; C428-S432 PolarHBondContact O-N 3.1Å
429	Y	88.6	Confident	91	Very high	70 Å²	70	71.4 Å²	71.4	28%	0.275	37%	0.374	S	S	.	.	H	α-helix	trans	-61	-51.6	176	167.7	-113.6	0	0	0	112.2	S360 Y363 A425 Y426 S432 S433	S360-Y429 PolarHBondContact OG-OH 3.22Å; Y363-Y429 HydrophobicContact CD2-CD2 4.18Å; Y363-Y429 HydrophobicContact CG-CD2 4.06Å; Y363-Y429 HydrophobicContact CG-CG 4.42Å; A425-Y429 WeakPolarHBondContact O-CB 3.36Å; A425-Y429 PolarHBondContact O-N 3.25Å; Y426-Y429 HydrophobicContact CD2-CD1 4.38Å; Y426-Y429 WeakPolarHBondContact O-CB 3.48Å; Y426-Y429 PolarHBondContact O-N 3.38Å; Y429-S432 PolarHBondContact O-N 3.19Å; Y429-S433 WeakPolarHBondContact CD2-OG 3.27Å; Y429-S433 WeakPolarHBondContact CE2-OG 3.21Å; Y429-S433 WeakPolarHBondContact O-CB 3.27Å; Y429-S433 PolarHBondContact O-N 3.2Å; Y429-S433 PolarHBondContact O-OG 3.24Å
430	M	89.4	Confident	90.9	Very high	69 Å²	69	69.6 Å²	69.6	34%	0.34	37%	0.365	S	S	.	.	H	α-helix	trans	-60.9	-47.2	179.5	-71.6	-56.5	-60.5	0	0	111	Y426 S432 S433 C434	Y426-M430 HydrophobicContact CD1-CG 4.02Å; Y426-M430 HydrophobicContact CD2-CG 4.32Å; Y426-M430 HydrophobicContact CE1-CG 3.57Å; Y426-M430 HydrophobicContact CE1-SD 4.38Å; Y426-M430 HydrophobicContact CE2-CG 3.9Å; Y426-M430 HydrophobicContact CE2-SD 3.97Å; Y426-M430 HydrophobicContact CG-CG 4.37Å; Y426-M430 WeakPolarHBondContact O-CG 3.45Å; Y426-M430 PolarHBondContact O-N 3.1Å; M430-S432 PolarHBondContact O-N 2.99Å; M430-S433 PolarHBondContact O-N 3.41Å; M430-C434 WeakPolarHBondContact O-CB 3.27Å; M430-C434 PolarHBondContact O-N 3.45Å; M430-C434 PolarHBondContact O-SG 2.97Å; M430-C434 VanDerWaalsContact O-SG 3.33Å
431	W	92.3	Very high	90.7	Very high	180 Å²	180	66.2 Å²	66.2	68%	0.682	35%	0.351	S	S	*	.	H	α-helix	trans	-59	-47.4	177.7	-178.8	71.9	0	0	0	112.3	A427 S433 I435	A427-W431 VanDerWaalsContact O-CB 3.27Å; A427-W431 WeakPolarHBondContact O-CB 3.38Å; A427-W431 PolarHBondContact O-N 3.41Å; W431-S433 VanDerWaalsContact C-N 3.31Å; W431-S433 PolarHBondContact O-N 2.75Å; W431-I435 HydrophobicContact CD2-CD1 3.93Å; W431-I435 HydrophobicContact CG-CD1 4.33Å; W431-I435 HydrophobicContact CH2-CD1 4.28Å; W431-I435 HydrophobicContact CZ2-CD1 3.56Å; W431-I435 WeakPolarHBondContact O-CB 3.33Å; W431-I435 WeakPolarHBondContact O-CG1 3.42Å; W431-I435 PolarHBondContact O-N 3.22Å; W431-I435 VanDerWaalsContact O-N 3.11Å
432	S	89.3	Confident	90.7	Very high	28 Å²	28	64.9 Å²	64.9	20%	0.196	35%	0.352	C	S	.	.	H	α-helix	trans	-65.9	-32.8	177.8	-169.1	0	0	0	0	112.7	V359 C428 Y429 M430 S436	V359-S432 WeakPolarHBondContact CG1-OG 3.42Å; C428-S432 VanDerWaalsContact O-CB 3.31Å; C428-S432 WeakPolarHBondContact O-CB 3.45Å; C428-S432 PolarHBondContact O-N 3.1Å; Y429-S432 PolarHBondContact O-N 3.19Å; M430-S432 PolarHBondContact O-N 2.99Å; S432-S436 WeakPolarHBondContact O-CB 3.38Å; S432-S436 PolarHBondContact O-N 3.3Å; S432-S436 PolarHBondContact O-OG 2.98Å
433	S	87.6	Confident	90.8	Very high	14 Å²	14	65.6 Å²	65.6	10%	0.098	36%	0.362	C	S	.	.	H	α-helix	trans	-75.6	-51.1	-179.6	-55.4	0	0	0	0	111.2	Y429 M430 W431 I435 S436 E437	Y429-S433 WeakPolarHBondContact CD2-OG 3.27Å; Y429-S433 WeakPolarHBondContact CE2-OG 3.21Å; Y429-S433 WeakPolarHBondContact O-CB 3.27Å; Y429-S433 PolarHBondContact O-N 3.2Å; Y429-S433 PolarHBondContact O-OG 3.24Å; M430-S433 PolarHBondContact O-N 3.41Å; W431-S433 VanDerWaalsContact C-N 3.31Å; W431-S433 PolarHBondContact O-N 2.75Å; S433-I435 VanDerWaalsContact C-N 3.28Å; S433-I435 PolarHBondContact O-N 2.69Å; S433-S436 WeakPolarHBondContact O-CB 3.46Å; S433-S436 PolarHBondContact O-N 3.04Å; S433-E437 WeakPolarHBondContact O-CB 3.43Å; S433-E437 PolarHBondContact O-N 3.37Å
434	C	89.8	Confident	90.7	Very high	65 Å²	65	62.7 Å²	62.7	44%	0.439	34%	0.338	S	S	.	.	H	α-helix	trans	-56.1	-40.7	175.4	-68.3	0	0	0	0	112.1	M430 L438	M430-C434 WeakPolarHBondContact O-CB 3.27Å; M430-C434 PolarHBondContact O-N 3.45Å; M430-C434 PolarHBondContact O-SG 2.97Å; M430-C434 VanDerWaalsContact O-SG 3.33Å; C434-L438 VanDerWaalsContact O-CB 3.23Å; C434-L438 WeakPolarHBondContact O-CB 3.47Å; C434-L438 PolarHBondContact O-N 3.26Å
435	I	92.3	Very high	90.7	Very high	83 Å²	83	61.9 Å²	61.9	43%	0.426	33%	0.334	S	S	.	.	H	α-helix	trans	-66.3	-39.4	175.9	-75.2	177.2	0	0	0	111.6	W431 S433 A439	W431-I435 HydrophobicContact CD2-CD1 3.93Å; W431-I435 HydrophobicContact CG-CD1 4.33Å; W431-I435 HydrophobicContact CH2-CD1 4.28Å; W431-I435 HydrophobicContact CZ2-CD1 3.56Å; W431-I435 WeakPolarHBondContact O-CB 3.33Å; W431-I435 WeakPolarHBondContact O-CG1 3.42Å; W431-I435 PolarHBondContact O-N 3.22Å; W431-I435 VanDerWaalsContact O-N 3.11Å; S433-I435 VanDerWaalsContact C-N 3.28Å; S433-I435 PolarHBondContact O-N 2.69Å; I435-A439 WeakPolarHBondContact O-CB 3.24Å; I435-A439 PolarHBondContact O-N 3.18Å
436	S	89.7	Confident	90.8	Very high	9 Å²	9	70.5 Å²	70.5	6%	0.063	37%	0.367	C	S	.	.	H	α-helix	trans	-68.4	-38.1	179.9	-58.2	0	0	0	0	112.1	F355 S432 S433 L440	F355-S436 WeakPolarHBondContact CE1-OG 3.22Å; S432-S436 WeakPolarHBondContact O-CB 3.38Å; S432-S436 PolarHBondContact O-N 3.3Å; S432-S436 PolarHBondContact O-OG 2.98Å; S433-S436 WeakPolarHBondContact O-CB 3.46Å; S433-S436 PolarHBondContact O-N 3.04Å; S436-L440 PolarHBondContact O-N 2.78Å
437	E	89.2	Confident	90.8	Very high	93 Å²	93	66.3 Å²	66.3	44%	0.435	35%	0.35	S	S	.	.	H	α-helix	trans	-68.3	-51.2	175.2	-176.4	166.7	-140.4	0	0	111.4	S433 A439 L440 E441	S433-E437 WeakPolarHBondContact O-CB 3.43Å; S433-E437 PolarHBondContact O-N 3.37Å; E437-A439 VanDerWaalsContact C-N 3.28Å; E437-A439 PolarHBondContact O-N 3.03Å; E437-L440 WeakPolarHBondContact O-CA 3.44Å; E437-L440 WeakPolarHBondContact O-CB 3.3Å; E437-L440 PolarHBondContact O-N 3.15Å; E437-E441 PolarHBondContact O-N 3.22Å
438	L	91.3	Very high	90.9	Very high	99 Å²	99	63.6 Å²	63.6	52%	0.518	33%	0.328	S	S	.	.	H	α-helix	trans	-59.5	-37.2	175.8	-177.2	65.2	0	0	0	112.3	C434 L440 E441 V442	C434-L438 VanDerWaalsContact O-CB 3.23Å; C434-L438 WeakPolarHBondContact O-CB 3.47Å; C434-L438 PolarHBondContact O-N 3.26Å; L438-L440 VanDerWaalsContact C-N 3.31Å; L438-L440 PolarHBondContact O-N 3.28Å; L438-E441 PolarHBondContact O-N 3.17Å; L438-V442 HydrophobicContact CD1-CG2 4.44Å; L438-V442 WeakPolarHBondContact O-CB 3.44Å; L438-V442 VanDerWaalsContact O-CG2 3.29Å; L438-V442 WeakPolarHBondContact O-CG2 3.25Å; L438-V442 PolarHBondContact O-N 3.1Å
439	A	91.6	Very high	90.8	Very high	58 Å²	58	62.4 Å²	62.4	48%	0.479	32%	0.323	S	S	.	.	H	α-helix	trans	-64.2	-36.2	174.4	0	0	0	0	0	112.2	I435 E437 A443	I435-A439 WeakPolarHBondContact O-CB 3.24Å; I435-A439 PolarHBondContact O-N 3.18Å; E437-A439 VanDerWaalsContact C-N 3.28Å; E437-A439 PolarHBondContact O-N 3.03Å; A439-A443 VanDerWaalsContact O-CB 3.3Å; A439-A443 WeakPolarHBondContact O-CB 3.23Å; A439-A443 PolarHBondContact O-N 3.39Å
440	L	91.1	Very high	90.9	Very high	19 Å²	19	62.8 Å²	62.8	10%	0.099	33%	0.327	C	S	.	.	H	α-helix	trans	-69.8	-42.9	174.5	-175.3	56.9	0	0	0	111.7	I356 S436 E437 L438 A443 V444	I356-L440 HydrophobicContact CD1-CD2 3.95Å; S436-L440 PolarHBondContact O-N 2.78Å; E437-L440 WeakPolarHBondContact O-CA 3.44Å; E437-L440 WeakPolarHBondContact O-CB 3.3Å; E437-L440 PolarHBondContact O-N 3.15Å; L438-L440 VanDerWaalsContact C-N 3.31Å; L438-L440 PolarHBondContact O-N 3.28Å; L440-A443 PolarHBondContact O-N 3.29Å; L440-V444 HydrophobicContact CD1-CG2 4.31Å; L440-V444 WeakPolarHBondContact O-CB 3.46Å; L440-V444 WeakPolarHBondContact O-CG2 3.32Å; L440-V444 PolarHBondContact O-N 3.24Å
441	E	91.9	Very high	90.9	Very high	52 Å²	52	59.6 Å²	59.6	24%	0.243	31%	0.312	C	S	.	.	H	α-helix	trans	-56.8	-49.8	173.8	-71.6	179.4	-176.8	0	0	111.8	E437 L438 A443 V444 L445 F466 M469 L470	E437-E441 PolarHBondContact O-N 3.22Å; L438-E441 PolarHBondContact O-N 3.17Å; E441-A443 PolarHBondContact O-N 3.45Å; E441-V444 PolarHBondContact O-N 3.01Å; E441-L445 WeakPolarHBondContact O-CB 3.47Å; E441-L445 PolarHBondContact O-N 3.47Å; E441-F466 HydrophobicContact CB-CE2 3.89Å; E441-F466 HydrophobicContact CB-CZ 4.15Å; E441-F466 HydrophobicContact CG-CE2 3.98Å; E441-F466 HydrophobicContact CG-CZ 3.96Å; E441-M469 HydrophobicContact CB-CE 4.44Å; E441-M469 HydrophobicContact CG-CE 3.91Å; E441-L470 WeakPolarHBondContact OE1-CD2 3.19Å
442	V	93.3	Very high	90.8	Very high	89 Å²	89	52.9 Å²	52.9	54%	0.539	29%	0.291	S	S	.	.	H	α-helix	trans	-63.6	-40.3	178.5	171.1	0	0	0	0	111.2	L438 L445 Y446	L438-V442 HydrophobicContact CD1-CG2 4.44Å; L438-V442 WeakPolarHBondContact O-CB 3.44Å; L438-V442 VanDerWaalsContact O-CG2 3.29Å; L438-V442 WeakPolarHBondContact O-CG2 3.25Å; L438-V442 PolarHBondContact O-N 3.1Å; V442-L445 PolarHBondContact O-N 3.45Å; V442-Y446 VanDerWaalsContact O-CB 3.26Å; V442-Y446 WeakPolarHBondContact O-CB 3.33Å; V442-Y446 PolarHBondContact O-N 3.07Å
443	A	90.7	Very high	90.8	Very high	42 Å²	42	58.8 Å²	58.8	35%	0.347	32%	0.319	S	S	.	.	H	α-helix	trans	-64.2	-42.6	176.6	0	0	0	0	0	112.4	A439 L440 E441 Y447	A439-A443 VanDerWaalsContact O-CB 3.3Å; A439-A443 WeakPolarHBondContact O-CB 3.23Å; A439-A443 PolarHBondContact O-N 3.39Å; L440-A443 PolarHBondContact O-N 3.29Å; E441-A443 PolarHBondContact O-N 3.45Å; A443-Y447 WeakPolarHBondContact O-CB 3.3Å; A443-Y447 PolarHBondContact O-N 3.28Å
444	V	91.8	Very high	90.8	Very high	0 Å²	0	60.8 Å²	60.8	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-68.6	-38.4	176.6	167.9	0	0	0	0	111.4	L345 V348 L440 E441 G448 F465 M469	L345-V444 HydrophobicContact CD2-CG1 4.36Å; V348-V444 HydrophobicContact CB-CG2 4.42Å; V348-V444 HydrophobicContact CG1-CG2 3.89Å; L440-V444 HydrophobicContact CD1-CG2 4.31Å; L440-V444 WeakPolarHBondContact O-CB 3.46Å; L440-V444 WeakPolarHBondContact O-CG2 3.32Å; L440-V444 PolarHBondContact O-N 3.24Å; E441-V444 PolarHBondContact O-N 3.01Å; V444-G448 VanDerWaalsContact O-CA 3.29Å; V444-G448 WeakPolarHBondContact O-CA 3.45Å; V444-G448 PolarHBondContact O-N 3.3Å; V444-F465 HydrophobicContact CG1-CD1 3.82Å; V444-F465 HydrophobicContact CG1-CE1 3.8Å; V444-M469 HydrophobicContact CB-CE 4.47Å; V444-M469 HydrophobicContact CB-SD 4.02Å; V444-M469 HydrophobicContact CG1-CE 4.42Å; V444-M469 HydrophobicContact CG1-SD 3.99Å; V444-M469 HydrophobicContact CG2-SD 3.73Å
445	L	92.3	Very high	90.6	Very high	103 Å²	103	65.1 Å²	65.1	54%	0.539	35%	0.35	S	S	.	.	H	α-helix	trans	-68.6	-40.5	175.8	-173.3	64.3	0	0	0	112	E441 V442 G449 L462	E441-L445 WeakPolarHBondContact O-CB 3.47Å; E441-L445 PolarHBondContact O-N 3.47Å; V442-L445 PolarHBondContact O-N 3.45Å; L445-G449 PolarHBondContact O-N 3.45Å; L445-L462 HydrophobicContact CD1-CD2 4.42Å
446	Y	92.6	Very high	90.2	Very high	188 Å²	188	66.2 Å²	66.2	74%	0.737	35%	0.353	S	S	*	.	H	α-helix	trans	-65.7	-54	177.4	179.7	-97.5	0	0	0	111.8	V442 G448 G449 H450	V442-Y446 VanDerWaalsContact O-CB 3.26Å; V442-Y446 WeakPolarHBondContact O-CB 3.33Å; V442-Y446 PolarHBondContact O-N 3.07Å; Y446-G448 VanDerWaalsContact C-N 3.35Å; Y446-G448 PolarHBondContact O-N 3.05Å; Y446-G449 PolarHBondContact O-N 3.36Å; Y446-H450 PolarHBondContact O-N 3.33Å
447	Y	90.5	Very high	90.2	Very high	27 Å²	27	66.7 Å²	66.7	11%	0.106	36%	0.355	C	S	.	.	H	α-helix	trans	-69.4	-34.5	179.6	-170.1	-109.2	0	0	0	112.1	L102 E106 K344 L345 V348 A443 H450 L451	L102-Y447 HydrophobicContact CD1-CE1 4.13Å; L102-Y447 HydrophobicContact CD2-CE1 4.18Å; L102-Y447 HydrophobicContact CD2-CE2 3.95Å; L102-Y447 HydrophobicContact CG-CE1 4.48Å; E106-Y447 VanDerWaalsContact OE1-CE2 3.26Å; E106-Y447 WeakPolarHBondContact OE1-CE2 3.38Å; E106-Y447 PolarHBondContact OE1-OH 3.25Å; K344-Y447 HydrophobicContact CB-CE1 4.14Å; L345-Y447 HydrophobicContact CD2-CD1 3.81Å; V348-Y447 HydrophobicContact CG2-CD1 3.88Å; V348-Y447 HydrophobicContact CG2-CE1 4.43Å; V348-Y447 HydrophobicContact CG2-CG 4.45Å; A443-Y447 WeakPolarHBondContact O-CB 3.3Å; A443-Y447 PolarHBondContact O-N 3.28Å; Y447-H450 WeakPolarHBondContact O-CB 3.42Å; Y447-H450 PolarHBondContact O-N 3.48Å; Y447-L451 HydrophobicContact CD1-CD1 4.07Å; Y447-L451 HydrophobicContact CD1-CG 4.42Å; Y447-L451 HydrophobicContact CE1-CD1 3.74Å; Y447-L451 HydrophobicContact CE1-CD2 4.32Å; Y447-L451 HydrophobicContact CE1-CG 4.04Å; Y447-L451 WeakPolarHBondContact O-CG 3.5Å; Y447-L451 PolarHBondContact O-N 3.45Å
448	G	91.9	Very high	90.2	Very high	0 Å²	0	64.8 Å²	64.8	0%	0	35%	0.352	C	S	.	.	H	α-helix	trans	-65.4	-40.9	173.5	0	0	0	0	0	112.6	V444 Y446 H450 L451 V452	V444-G448 VanDerWaalsContact O-CA 3.29Å; V444-G448 WeakPolarHBondContact O-CA 3.45Å; V444-G448 PolarHBondContact O-N 3.3Å; Y446-G448 VanDerWaalsContact C-N 3.35Å; Y446-G448 PolarHBondContact O-N 3.05Å; G448-H450 VanDerWaalsContact C-N 3.33Å; G448-H450 PolarHBondContact O-N 3.15Å; G448-L451 PolarHBondContact O-N 2.7Å; G448-V452 WeakPolarHBondContact O-CG2 3.36Å; G448-V452 PolarHBondContact O-N 3.45Å
449	G	90.6	Very high	90	Very high	22 Å²	22	61.6 Å²	61.6	23%	0.227	34%	0.338	C	S	.	.	H	α-helix	trans	-59.7	-41.7	171.3	0	0	0	0	0	112.3	L445 Y446 L451 V452 L453	L445-G449 PolarHBondContact O-N 3.45Å; Y446-G449 PolarHBondContact O-N 3.36Å; G449-L451 PolarHBondContact O-N 3.33Å; G449-V452 PolarHBondContact O-N 3.4Å; G449-L453 WeakPolarHBondContact O-CG 3.33Å; G449-L453 PolarHBondContact O-N 3.03Å
450	H	89.6	Confident	89.8	Confident	78 Å²	78	58.9 Å²	58.9	36%	0.361	32%	0.315	S	S	.	.	H	α-helix	trans	-61.1	-40	172.7	177.2	-110.3	0	0	0	112.8	Y446 Y447 G448 V452 L453 T454	Y446-H450 PolarHBondContact O-N 3.33Å; Y447-H450 WeakPolarHBondContact O-CB 3.42Å; Y447-H450 PolarHBondContact O-N 3.48Å; G448-H450 VanDerWaalsContact C-N 3.33Å; G448-H450 PolarHBondContact O-N 3.15Å; H450-V452 VanDerWaalsContact C-N 3.34Å; H450-V452 PolarHBondContact O-N 3.1Å; H450-L453 PolarHBondContact O-N 3.24Å; H450-T454 WeakPolarHBondContact O-CG2 3.41Å; H450-T454 PolarHBondContact O-N 3.46Å; H450-T454 VanDerWaalsContact O-N 3.1Å; H450-T454 PolarHBondContact O-OG1 3.13Å
451	L	88.8	Confident	89.8	Confident	2 Å²	2	58.2 Å²	58.2	1%	0.01	31%	0.313	C	S	.	.	H	α-helix	trans	-67.8	-30.5	174.5	-68.3	173.8	0	0	0	113.3	K344 L345 Y447 G448 G449 T454 D455 Q456 L457	K344-L451 HydrophobicContact CB-CD1 4.37Å; K344-L451 HydrophobicContact CD-CD2 4.03Å; L345-L451 HydrophobicContact CD1-CD1 4Å; L345-L451 HydrophobicContact CD2-CD1 4.16Å; L345-L451 HydrophobicContact CG-CD1 3.66Å; Y447-L451 HydrophobicContact CD1-CD1 4.07Å; Y447-L451 HydrophobicContact CD1-CG 4.42Å; Y447-L451 HydrophobicContact CE1-CD1 3.74Å; Y447-L451 HydrophobicContact CE1-CD2 4.32Å; Y447-L451 HydrophobicContact CE1-CG 4.04Å; Y447-L451 WeakPolarHBondContact O-CG 3.5Å; Y447-L451 PolarHBondContact O-N 3.45Å; G448-L451 PolarHBondContact O-N 2.7Å; G449-L451 PolarHBondContact O-N 3.33Å; L451-T454 WeakPolarHBondContact CA-OG1 3.48Å; L451-T454 PolarHBondContact O-OG1 3.03Å; L451-D455 PolarHBondContact O-N 3.07Å; L451-Q456 HydrophobicContact CB-CB 4.36Å; L451-Q456 HydrophobicContact CD2-CB 4Å; L451-Q456 PolarHBondContact O-N 2.85Å; L451-L457 HydrophobicContact CB-CB 4.18Å; L451-L457 PolarHBondContact O-N 3.29Å
452	V	91.1	Very high	89.8	Confident	40 Å²	40	56.6 Å²	56.6	24%	0.242	31%	0.306	C	S	.	.	H	α-helix	trans	-72.6	-42.9	172.6	175.7	0	0	0	0	111	G448 G449 H450 T454 D455 L457 L462	G448-V452 WeakPolarHBondContact O-CG2 3.36Å; G448-V452 PolarHBondContact O-N 3.45Å; G449-V452 PolarHBondContact O-N 3.4Å; H450-V452 VanDerWaalsContact C-N 3.34Å; H450-V452 PolarHBondContact O-N 3.1Å; V452-T454 PolarHBondContact O-N 3.15Å; V452-D455 PolarHBondContact O-N 2.92Å; V452-L457 WeakPolarHBondContact CA-O 3.19Å; V452-L457 HydrophobicContact CG2-CB 4.31Å; V452-L457 WeakPolarHBondContact CG2-O 3.12Å; V452-L462 HydrophobicContact CG2-CB 3.96Å; V452-L462 HydrophobicContact CG2-CD2 3.89Å
453	L	89.8	Confident	89.8	Confident	151 Å²	151	55.5 Å²	55.5	79%	0.791	30%	0.297	S	S	*	.	H	α-helix	trans	-66.2	-15.9	176.2	-70.2	172.1	0	0	0	114	G449 H450	G449-L453 WeakPolarHBondContact O-CG 3.33Å; G449-L453 PolarHBondContact O-N 3.03Å; H450-L453 PolarHBondContact O-N 3.24Å
454	T	87.4	Confident	89.9	Confident	56 Å²	56	53.7 Å²	53.7	34%	0.344	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.3	17.1	177.4	53.5	0	0	0	0	113	H450 L451 V452 Q456	H450-T454 WeakPolarHBondContact O-CG2 3.41Å; H450-T454 PolarHBondContact O-N 3.46Å; H450-T454 VanDerWaalsContact O-N 3.1Å; H450-T454 PolarHBondContact O-OG1 3.13Å; L451-T454 WeakPolarHBondContact CA-OG1 3.48Å; L451-T454 PolarHBondContact O-OG1 3.03Å; V452-T454 PolarHBondContact O-N 3.15Å; T454-Q456 PolarHBondContact O-N 3.34Å; T454-Q456 PolarHBondContact OG1-NE2 3Å
455	D	85.2	Confident	90	Very high	156 Å²	156	53.7 Å²	53.7	83%	0.834	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.2	20	179.4	-65.2	-49.5	0	0	0	115.1	L451 V452	L451-D455 PolarHBondContact O-N 3.07Å; V452-D455 PolarHBondContact O-N 2.92Å
456	Q	84.6	Confident	90.1	Very high	106 Å²	106	51.4 Å²	51.4	50%	0.495	27%	0.267	S	S	.	.	S	Bend	trans	-85.7	-13.4	177.2	-70.3	177.1	54.4	0	0	113	L451 T454	L451-Q456 HydrophobicContact CB-CB 4.36Å; L451-Q456 HydrophobicContact CD2-CB 4Å; L451-Q456 PolarHBondContact O-N 2.85Å; T454-Q456 PolarHBondContact O-N 3.34Å; T454-Q456 PolarHBondContact OG1-NE2 3Å
457	L	89.1	Confident	90.1	Very high	20 Å²	20	44.4 Å²	44.4	11%	0.105	24%	0.242	C	C	.	.	S	Bend	trans	-151.8	143.3	-179.6	-171.6	64	0	0	0	110.5	M341 L345 L451 V452 L462	M341-L457 HydrophobicContact CG-CD1 4.21Å; L345-L457 HydrophobicContact CD1-CD2 3.47Å; L345-L457 VanDerWaalsContact CD1-CD2 3.47Å; L451-L457 HydrophobicContact CB-CB 4.18Å; L451-L457 PolarHBondContact O-N 3.29Å; V452-L457 WeakPolarHBondContact CA-O 3.19Å; V452-L457 HydrophobicContact CG2-CB 4.31Å; V452-L457 WeakPolarHBondContact CG2-O 3.12Å; L457-L462 HydrophobicContact CD2-CB 4Å; L457-L462 HydrophobicContact CD2-CD1 4.37Å
458	S	89.4	Confident	90.3	Very high	53 Å²	53	43.1 Å²	43.1	37%	0.371	24%	0.237	S	C	.	.			trans	-78.3	159.2	172.6	72.1	0	0	0	0	112.1	D231 G460 G461 L462	D231-S458 WeakPolarHBondContact OD1-CB 3.31Å; D231-S458 PolarHBondContact OD1-OG 3.01Å; D231-S458 WeakPolarHBondContact OD2-CB 3.43Å; D231-S458 PolarHBondContact OD2-OG 3.42Å; S458-G460 VanDerWaalsContact C-N 3.34Å; S458-G460 PolarHBondContact O-N 2.97Å; S458-G461 CarbonylContact O-C 3.56Å; S458-G461 WeakPolarHBondContact O-CA 3.34Å; S458-G461 PolarHBondContact O-N 2.85Å; S458-G461 PolarHBondContact OG-N 3.41Å; S458-L462 PolarHBondContact O-N 3.48Å
459	S	87.5	Confident	90.4	Very high	32 Å²	32	43.6 Å²	43.6	22%	0.224	24%	0.239	C	C	.	.	H	α-helix	trans	-59.8	-41.1	176.6	59.5	0	0	0	0	113.1	D231 L462 I463	D231-S459 PolarHBondContact OD1-OG 3.08Å; D231-S459 VanDerWaalsContact OD1-OG 3.11Å; S459-L462 PolarHBondContact O-N 2.98Å; S459-I463 WeakPolarHBondContact O-CG1 3.3Å; S459-I463 PolarHBondContact O-N 2.97Å; S459-I463 VanDerWaalsContact O-N 3.17Å
460	G	87.8	Confident	90.5	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-70.9	-30.4	172.3	0	0	0	0	0	112.9	G227 D231 S458 I463 S464	G227-G460 WeakPolarHBondContact CA-O 3.37Å; G227-G460 WeakPolarHBondContact O-CA 3.42Å; D231-G460 WeakPolarHBondContact OD1-CA 3.49Å; D231-G460 PolarHBondContact OD1-N 2.97Å; S458-G460 VanDerWaalsContact C-N 3.34Å; S458-G460 PolarHBondContact O-N 2.97Å; G460-I463 PolarHBondContact O-N 2.99Å; G460-S464 WeakPolarHBondContact O-CB 3.08Å; G460-S464 PolarHBondContact O-N 3.13Å; G460-S464 PolarHBondContact O-OG 2.65Å
461	G	90.3	Very high	90.6	Very high	6 Å²	6	44.7 Å²	44.7	6%	0.062	24%	0.24	C	C	.	.	H	α-helix	trans	-61.2	-45.6	169.6	0	0	0	0	0	111.9	M341 S458 I463 S464 F465	M341-G461 WeakPolarHBondContact CE-O 3.48Å; S458-G461 CarbonylContact O-C 3.56Å; S458-G461 WeakPolarHBondContact O-CA 3.34Å; S458-G461 PolarHBondContact O-N 2.85Å; S458-G461 PolarHBondContact OG-N 3.41Å; G461-I463 PolarHBondContact O-N 3.1Å; G461-S464 PolarHBondContact O-N 3.33Å; G461-F465 WeakPolarHBondContact O-CB 3.49Å; G461-F465 PolarHBondContact O-N 3.19Å
462	L	92.3	Very high	90.8	Very high	18 Å²	18	44.9 Å²	44.9	9%	0.094	24%	0.241	C	C	.	.	H	α-helix	trans	-60.9	-44.1	175.1	178.5	56.4	0	0	0	112.1	L345 L445 V452 L457 S458 S459 F465 F466	L345-L462 HydrophobicContact CD1-CD1 4.25Å; L445-L462 HydrophobicContact CD1-CD2 4.42Å; V452-L462 HydrophobicContact CG2-CB 3.96Å; V452-L462 HydrophobicContact CG2-CD2 3.89Å; L457-L462 HydrophobicContact CD2-CB 4Å; L457-L462 HydrophobicContact CD2-CD1 4.37Å; S458-L462 PolarHBondContact O-N 3.48Å; S459-L462 PolarHBondContact O-N 2.98Å; L462-F465 WeakPolarHBondContact O-CB 3.27Å; L462-F465 PolarHBondContact O-N 2.95Å; L462-F466 PolarHBondContact O-N 3.41Å
463	I	92.1	Very high	90.8	Very high	66 Å²	66	43.8 Å²	43.8	34%	0.338	24%	0.238	S	C	.	.	H	α-helix	trans	-71.3	-37.1	-179.6	-64.7	165	0	0	0	111.6	I230 S459 G460 G461 F465 F466 I467	I230-I463 HydrophobicContact CD1-CB 4.14Å; I230-I463 HydrophobicContact CD1-CD1 3.69Å; I230-I463 HydrophobicContact CD1-CG2 3.63Å; I230-I463 HydrophobicContact CG2-CD1 3.94Å; S459-I463 WeakPolarHBondContact O-CG1 3.3Å; S459-I463 PolarHBondContact O-N 2.97Å; S459-I463 VanDerWaalsContact O-N 3.17Å; G460-I463 PolarHBondContact O-N 2.99Å; G461-I463 PolarHBondContact O-N 3.1Å; I463-F465 VanDerWaalsContact C-N 3.26Å; I463-F465 PolarHBondContact O-N 3.39Å; I463-F466 PolarHBondContact O-N 2.76Å; I463-I467 HydrophobicContact CG2-CD1 4.05Å; I463-I467 WeakPolarHBondContact O-CG1 3.38Å; I463-I467 PolarHBondContact O-N 3.12Å
464	S	93.6	Very high	90.8	Very high	3 Å²	3	41.9 Å²	41.9	2%	0.021	23%	0.225	C	C	.	.	H	α-helix	trans	-57.1	-43	169.2	-57.1	0	0	0	0	111.1	P223 G227 G460 G461 I467 Y468	P223-S464 PolarHBondContact O-OG 3.29Å; P223-S464 VanDerWaalsContact O-OG 3.12Å; G227-S464 WeakPolarHBondContact CA-OG 3.47Å; G227-S464 PolarHBondContact N-OG 3.41Å; G460-S464 WeakPolarHBondContact O-CB 3.08Å; G460-S464 PolarHBondContact O-N 3.13Å; G460-S464 PolarHBondContact O-OG 2.65Å; G461-S464 PolarHBondContact O-N 3.33Å; S464-I467 PolarHBondContact O-N 3.21Å; S464-Y468 WeakPolarHBondContact O-CB 3.42Å; S464-Y468 WeakPolarHBondContact O-CD2 3.24Å; S464-Y468 PolarHBondContact O-N 2.9Å
465	F	94.7	Very high	91	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-63.6	-45	-179.7	-170	-86.3	0	0	0	111.2	M338 M341 L345 T349 V444 G461 L462 I463 Y468 M469	M338-F465 HydrophobicContact CB-CD2 4.39Å; M338-F465 HydrophobicContact CB-CE2 3.83Å; M338-F465 HydrophobicContact CE-CD2 4.49Å; M338-F465 HydrophobicContact CE-CE1 3.78Å; M338-F465 HydrophobicContact CE-CE2 3.74Å; M338-F465 HydrophobicContact CE-CZ 3.31Å; M338-F465 HydrophobicContact CG-CD2 4.35Å; M338-F465 HydrophobicContact CG-CE2 4.05Å; M341-F465 HydrophobicContact CE-CB 3.64Å; M341-F465 HydrophobicContact CE-CD2 4.12Å; M341-F465 HydrophobicContact CE-CG 4.4Å; L345-F465 HydrophobicContact CB-CD1 4.08Å; L345-F465 HydrophobicContact CB-CD2 4.08Å; L345-F465 HydrophobicContact CB-CE1 3.64Å; L345-F465 HydrophobicContact CB-CE2 3.62Å; L345-F465 HydrophobicContact CB-CG 4.3Å; L345-F465 HydrophobicContact CB-CZ 3.4Å; L345-F465 VanDerWaalsContact CB-CZ 3.4Å; L345-F465 HydrophobicContact CD1-CD1 4.21Å; L345-F465 HydrophobicContact CD1-CD2 4.38Å; L345-F465 HydrophobicContact CD1-CG 4.12Å; T349-F465 WeakPolarHBondContact OG1-CE1 3.21Å; V444-F465 HydrophobicContact CG1-CD1 3.82Å; V444-F465 HydrophobicContact CG1-CE1 3.8Å; G461-F465 WeakPolarHBondContact O-CB 3.49Å; G461-F465 PolarHBondContact O-N 3.19Å; L462-F465 WeakPolarHBondContact O-CB 3.27Å; L462-F465 PolarHBondContact O-N 2.95Å; I463-F465 VanDerWaalsContact C-N 3.26Å; I463-F465 PolarHBondContact O-N 3.39Å; F465-Y468 PolarHBondContact O-N 3.34Å; F465-M469 WeakPolarHBondContact O-CB 3.34Å; F465-M469 PolarHBondContact O-N 3.46Å
466	F	92.9	Very high	91.1	Very high	55 Å²	55	36.6 Å²	36.6	24%	0.241	19%	0.191	C	C	.	.	H	α-helix	trans	-61.1	-45.9	178.4	-167.6	-99.6	0	0	0	111.7	E441 L462 I463 M469 L470	E441-F466 HydrophobicContact CB-CE2 3.89Å; E441-F466 HydrophobicContact CB-CZ 4.15Å; E441-F466 HydrophobicContact CG-CE2 3.98Å; E441-F466 HydrophobicContact CG-CZ 3.96Å; L462-F466 PolarHBondContact O-N 3.41Å; I463-F466 PolarHBondContact O-N 2.76Å; F466-M469 HydrophobicContact CD2-CE 3.65Å; F466-M469 HydrophobicContact CE2-CE 3.61Å; F466-M469 HydrophobicContact CG-CE 4.47Å; F466-M469 HydrophobicContact CZ-CE 4.4Å; F466-M469 WeakPolarHBondContact O-CB 3.49Å; F466-M469 PolarHBondContact O-N 3.01Å; F466-L470 HydrophobicContact CD1-CD1 4.02Å; F466-L470 HydrophobicContact CE1-CD1 3.74Å; F466-L470 HydrophobicContact CE1-CG 4.3Å; F466-L470 WeakPolarHBondContact O-CG 3.22Å; F466-L470 PolarHBondContact O-N 3.33Å; F466-L470 VanDerWaalsContact O-N 3.11Å
467	I	94	Very high	91.1	Very high	41 Å²	41	38.4 Å²	38.4	21%	0.21	20%	0.199	C	C	.	.	H	α-helix	trans	-63.4	-43.9	175.6	-62.1	166.3	0	0	0	111	P223 Y226 I463 S464 M469 L470 E471	P223-I467 HydrophobicContact CB-CB 4.04Å; P223-I467 HydrophobicContact CB-CG2 3.73Å; P223-I467 HydrophobicContact CG-CG2 3.73Å; Y226-I467 HydrophobicContact CD2-CD1 4.08Å; Y226-I467 HydrophobicContact CG-CD1 4.06Å; I463-I467 HydrophobicContact CG2-CD1 4.05Å; I463-I467 WeakPolarHBondContact O-CG1 3.38Å; I463-I467 PolarHBondContact O-N 3.12Å; S464-I467 PolarHBondContact O-N 3.21Å; I467-M469 VanDerWaalsContact C-N 3.27Å; I467-M469 PolarHBondContact O-N 3.11Å; I467-L470 PolarHBondContact O-N 3.06Å; I467-E471 HydrophobicContact CG2-CG 4.35Å; I467-E471 WeakPolarHBondContact O-CB 3.35Å; I467-E471 WeakPolarHBondContact O-CG 3.42Å; I467-E471 PolarHBondContact O-N 3.3Å
468	Y	94.6	Very high	91.1	Very high	1 Å²	1	39.1 Å²	39.1	0%	0.004	21%	0.206	C	C	.	.	H	α-helix	trans	-60.4	-34.9	175.1	-80.5	-54.9	0	0	0	113.1	A220 P223 L224 F334 F337 M338 M341 S464 F465 L472	A220-Y468 VanDerWaalsContact O-CE1 3.3Å; A220-Y468 WeakPolarHBondContact O-CE1 3.4Å; A220-Y468 PolarHBondContact O-OH 2.95Å; P223-Y468 HydrophobicContact CB-CD1 3.77Å; P223-Y468 HydrophobicContact CB-CD2 3.95Å; P223-Y468 HydrophobicContact CB-CE1 3.65Å; P223-Y468 HydrophobicContact CB-CE2 3.82Å; P223-Y468 HydrophobicContact CB-CG 3.91Å; P223-Y468 HydrophobicContact CG-CD1 3.69Å; P223-Y468 HydrophobicContact CG-CE1 3.56Å; P223-Y468 HydrophobicContact CG-CG 4.29Å; L224-Y468 HydrophobicContact CB-CE2 4.34Å; L224-Y468 WeakPolarHBondContact CB-OH 3.45Å; L224-Y468 PolarHBondContact N-OH 3.3Å; F334-Y468 HydrophobicContact CB-CD1 4.23Å; F334-Y468 AromaticContact CD1-CD1 3.52Å; F334-Y468 HydrophobicContact CD1-CD1 3.52Å; F334-Y468 AromaticContact CD1-CE1 3.73Å; F334-Y468 HydrophobicContact CD1-CE1 3.73Å; F334-Y468 HydrophobicContact CE1-CD1 4.16Å; F334-Y468 HydrophobicContact CE1-CE1 4.23Å; F334-Y468 HydrophobicContact CG-CD1 4.14Å; F337-Y468 HydrophobicContact CB-CD2 4.43Å; F337-Y468 HydrophobicContact CB-CE1 4.09Å; F337-Y468 HydrophobicContact CB-CE2 3.87Å; F337-Y468 HydrophobicContact CD2-CE1 4.43Å; F337-Y468 HydrophobicContact CG-CE1 4.41Å; F337-Y468 HydrophobicContact CG-CE2 4.48Å; F337-Y468 AromaticContact CG-CZ 3.92Å; M338-Y468 HydrophobicContact CG-CG 4.26Å; M341-Y468 HydrophobicContact CE-CD2 4.34Å; S464-Y468 WeakPolarHBondContact O-CB 3.42Å; S464-Y468 WeakPolarHBondContact O-CD2 3.24Å; S464-Y468 PolarHBondContact O-N 2.9Å; F465-Y468 PolarHBondContact O-N 3.34Å; Y468-L472 WeakPolarHBondContact O-CB 3.5Å; Y468-L472 PolarHBondContact O-N 3.02Å
469	M	93	Very high	91	Very high	9 Å²	9	39 Å²	39	4%	0.044	20%	0.2	C	C	.	.	H	α-helix	trans	-66.6	-45.6	176.6	174.6	-176.3	77.4	0	0	111.9	M338 T349 E441 V444 F465 F466 I467 L472 G473	M338-M469 HydrophobicContact CE-CB 4.03Å; T349-M469 HydrophobicContact CG2-CB 4.5Å; T349-M469 HydrophobicContact CG2-CG 3.72Å; T349-M469 HydrophobicContact CG2-SD 4.1Å; E441-M469 HydrophobicContact CB-CE 4.44Å; E441-M469 HydrophobicContact CG-CE 3.91Å; V444-M469 HydrophobicContact CB-CE 4.47Å; V444-M469 HydrophobicContact CB-SD 4.02Å; V444-M469 HydrophobicContact CG1-CE 4.42Å; V444-M469 HydrophobicContact CG1-SD 3.99Å; V444-M469 HydrophobicContact CG2-SD 3.73Å; F465-M469 WeakPolarHBondContact O-CB 3.34Å; F465-M469 PolarHBondContact O-N 3.46Å; F466-M469 HydrophobicContact CD2-CE 3.65Å; F466-M469 HydrophobicContact CE2-CE 3.61Å; F466-M469 HydrophobicContact CG-CE 4.47Å; F466-M469 HydrophobicContact CZ-CE 4.4Å; F466-M469 WeakPolarHBondContact O-CB 3.49Å; F466-M469 PolarHBondContact O-N 3.01Å; I467-M469 VanDerWaalsContact C-N 3.27Å; I467-M469 PolarHBondContact O-N 3.11Å; M469-L472 PolarHBondContact O-N 3Å; M469-G473 PolarHBondContact O-N 3.21Å
470	L	92.1	Very high	90.8	Very high	66 Å²	66	40.5 Å²	40.5	35%	0.346	22%	0.215	S	C	.	.	H	α-helix	trans	-61.7	-50.2	177.4	-65.5	175.3	0	0	0	111.3	E441 F466 I467 L472 G473 E474	E441-L470 WeakPolarHBondContact OE1-CD2 3.19Å; F466-L470 HydrophobicContact CD1-CD1 4.02Å; F466-L470 HydrophobicContact CE1-CD1 3.74Å; F466-L470 HydrophobicContact CE1-CG 4.3Å; F466-L470 WeakPolarHBondContact O-CG 3.22Å; F466-L470 PolarHBondContact O-N 3.33Å; F466-L470 VanDerWaalsContact O-N 3.11Å; I467-L470 PolarHBondContact O-N 3.06Å; L470-L472 VanDerWaalsContact C-N 3.26Å; L470-L472 PolarHBondContact O-N 3.11Å; L470-G473 WeakPolarHBondContact O-CA 3.14Å; L470-G473 PolarHBondContact O-N 3.38Å; L470-E474 PolarHBondContact O-N 3.17Å
471	E	93	Very high	90.6	Very high	57 Å²	57	43.6 Å²	43.6	27%	0.266	24%	0.236	S	C	.	.	H	α-helix	trans	-60.9	-32.2	177.2	-73.9	-86.4	-179.8	0	0	112.9	F334 I467 C475	F334-E471 HydrophobicContact CD2-CB 4.08Å; F334-E471 HydrophobicContact CE1-CB 4.41Å; F334-E471 HydrophobicContact CE2-CB 3.55Å; F334-E471 HydrophobicContact CZ-CB 3.73Å; F334-E471 HydrophobicContact CZ-CG 4.33Å; I467-E471 HydrophobicContact CG2-CG 4.35Å; I467-E471 WeakPolarHBondContact O-CB 3.35Å; I467-E471 WeakPolarHBondContact O-CG 3.42Å; I467-E471 PolarHBondContact O-N 3.3Å; E471-C475 PolarHBondContact O-N 3.03Å; E471-C475 VanDerWaalsContact O-N 3.12Å; E471-C475 PolarHBondContact O-SG 3.22Å
472	L	92.6	Very high	90.3	Very high	7 Å²	7	43.6 Å²	43.6	4%	0.037	24%	0.235	C	C	.	.	H	α-helix	trans	-71	-36	172.2	-178.8	61.3	0	0	0	111.9	F334 I335 M338 F353 Y468 M469 L470 C475 F476	F334-L472 HydrophobicContact CB-CB 4.49Å; F334-L472 HydrophobicContact CD2-CB 4.46Å; I335-L472 HydrophobicContact CD1-CD1 4.12Å; I335-L472 HydrophobicContact CG1-CD1 3.93Å; I335-L472 HydrophobicContact CG1-CD2 3.89Å; M338-L472 HydrophobicContact CE-CD2 4.42Å; M338-L472 HydrophobicContact SD-CD2 3.77Å; F353-L472 HydrophobicContact CE2-CD2 3.86Å; F353-L472 HydrophobicContact CE2-CG 4.21Å; F353-L472 HydrophobicContact CZ-CD2 4.2Å; F353-L472 HydrophobicContact CZ-CG 4.08Å; Y468-L472 WeakPolarHBondContact O-CB 3.5Å; Y468-L472 PolarHBondContact O-N 3.02Å; M469-L472 PolarHBondContact O-N 3Å; L470-L472 VanDerWaalsContact C-N 3.26Å; L470-L472 PolarHBondContact O-N 3.11Å; L472-C475 WeakPolarHBondContact O-CB 3.17Å; L472-C475 PolarHBondContact O-N 3.31Å; L472-F476 HydrophobicContact CD1-CD2 4.21Å; L472-F476 HydrophobicContact CD1-CE2 3.73Å; L472-F476 HydrophobicContact CD1-CZ 4.28Å; L472-F476 HydrophobicContact CD2-CE2 4.2Å; L472-F476 HydrophobicContact CG-CD2 4.08Å; L472-F476 HydrophobicContact CG-CE2 3.7Å; L472-F476 WeakPolarHBondContact O-CD2 3.08Å; L472-F476 PolarHBondContact O-N 3.03Å; L472-F476 VanDerWaalsContact O-N 3.08Å
473	G	89.9	Confident	89.6	Confident	16 Å²	16	49.8 Å²	49.8	17%	0.165	26%	0.258	C	S	.	.	H	α-helix	trans	-57.6	-53.6	170.1	0	0	0	0	0	112.2	M469 L470 C475 F476 E477	M469-G473 PolarHBondContact O-N 3.21Å; L470-G473 WeakPolarHBondContact O-CA 3.14Å; L470-G473 PolarHBondContact O-N 3.38Å; G473-C475 PolarHBondContact O-N 2.87Å; G473-F476 PolarHBondContact O-N 3.37Å; G473-E477 PolarHBondContact O-N 3.45Å
474	E	90.1	Very high	88.8	Confident	111 Å²	111	50.7 Å²	50.7	52%	0.519	27%	0.267	S	S	.	.	H	α-helix	trans	-56.4	-37.7	175.3	-69.7	-165.2	-171.7	0	0	112.5	L470 E477 S478	L470-E474 PolarHBondContact O-N 3.17Å; E474-E477 PolarHBondContact O-N 3.32Å; E474-S478 VanDerWaalsContact O-CB 3.23Å; E474-S478 WeakPolarHBondContact O-CB 3.4Å; E474-S478 PolarHBondContact O-N 2.66Å; E474-S478 PolarHBondContact O-OG 2.83Å
475	C	91.3	Very high	88	Confident	7 Å²	7	50.9 Å²	50.9	5%	0.047	27%	0.269	C	S	.	.	H	α-helix	trans	-63.9	-40.6	175.6	-74.5	0	0	0	0	112.2	E471 L472 G473 I479	E471-C475 PolarHBondContact O-N 3.03Å; E471-C475 VanDerWaalsContact O-N 3.12Å; E471-C475 PolarHBondContact O-SG 3.22Å; L472-C475 WeakPolarHBondContact O-CB 3.17Å; L472-C475 PolarHBondContact O-N 3.31Å; G473-C475 PolarHBondContact O-N 2.87Å; C475-I479 WeakPolarHBondContact O-CD1 3.47Å; C475-I479 VanDerWaalsContact O-CG1 3.25Å; C475-I479 WeakPolarHBondContact O-CG1 3.43Å; C475-I479 PolarHBondContact O-N 3.43Å
476	F	87.9	Confident	87.3	Confident	94 Å²	94	52.3 Å²	52.3	41%	0.412	28%	0.277	S	S	.	.	H	α-helix	trans	-69.1	-42.1	176	-77.3	-59.5	0	0	0	112.5	F353 L472 G473 S478 I479 A480	F353-F476 HydrophobicContact CD1-CD2 4.11Å; F353-F476 HydrophobicContact CD1-CE2 4.36Å; F353-F476 HydrophobicContact CD2-CE2 4.11Å; F353-F476 AromaticContact CE1-CD2 3.66Å; F353-F476 HydrophobicContact CE1-CD2 3.66Å; F353-F476 HydrophobicContact CE1-CE2 4.08Å; F353-F476 HydrophobicContact CE2-CD2 4.18Å; F353-F476 AromaticContact CE2-CE2 3.76Å; F353-F476 HydrophobicContact CE2-CE2 3.76Å; F353-F476 HydrophobicContact CG-CE2 4.4Å; F353-F476 AromaticContact CZ-CD2 3.7Å; F353-F476 HydrophobicContact CZ-CD2 3.7Å; F353-F476 AromaticContact CZ-CE2 3.77Å; F353-F476 HydrophobicContact CZ-CE2 3.77Å; L472-F476 HydrophobicContact CD1-CD2 4.21Å; L472-F476 HydrophobicContact CD1-CE2 3.73Å; L472-F476 HydrophobicContact CD1-CZ 4.28Å; L472-F476 HydrophobicContact CD2-CE2 4.2Å; L472-F476 HydrophobicContact CG-CD2 4.08Å; L472-F476 HydrophobicContact CG-CE2 3.7Å; L472-F476 WeakPolarHBondContact O-CD2 3.08Å; L472-F476 PolarHBondContact O-N 3.03Å; L472-F476 VanDerWaalsContact O-N 3.08Å; G473-F476 PolarHBondContact O-N 3.37Å; F476-S478 VanDerWaalsContact C-N 3.35Å; F476-S478 PolarHBondContact O-N 2.93Å; F476-I479 PolarHBondContact O-N 2.86Å; F476-A480 WeakPolarHBondContact O-CB 3.49Å; F476-A480 PolarHBondContact O-N 3.39Å
477	E	85.6	Confident	86.6	Confident	145 Å²	145	53.3 Å²	53.3	68%	0.678	28%	0.283	S	S	*	.	H	α-helix	trans	-62.6	-42.4	175.1	-169.9	-174.9	-177.5	0	0	111.5	G473 E474 I479 A480 S481	G473-E477 PolarHBondContact O-N 3.45Å; E474-E477 PolarHBondContact O-N 3.32Å; E477-I479 VanDerWaalsContact C-N 3.32Å; E477-I479 PolarHBondContact O-N 3.27Å; E477-A480 PolarHBondContact O-N 3.49Å; E477-S481 PolarHBondContact O-N 3.35Å; E477-S481 PolarHBondContact O-OG 2.9Å
478	S	88.9	Confident	85.9	Confident	34 Å²	34	56.7 Å²	56.7	24%	0.238	30%	0.298	C	S	.	.	H	α-helix	trans	-58.3	-41.6	173	-65	0	0	0	0	112.2	S327 E474 F476 S481 V482	S327-S478 WeakPolarHBondContact OG-CB 3.49Å; E474-S478 VanDerWaalsContact O-CB 3.23Å; E474-S478 WeakPolarHBondContact O-CB 3.4Å; E474-S478 PolarHBondContact O-N 2.66Å; E474-S478 PolarHBondContact O-OG 2.83Å; F476-S478 VanDerWaalsContact C-N 3.35Å; F476-S478 PolarHBondContact O-N 2.93Å; S478-S481 WeakPolarHBondContact CA-OG 3.49Å; S478-S481 PolarHBondContact O-OG 2.94Å; S478-V482 WeakPolarHBondContact O-CB 3.47Å; S478-V482 WeakPolarHBondContact O-CG2 3.49Å; S478-V482 PolarHBondContact O-N 3.41Å; S478-V482 VanDerWaalsContact O-N 3.09Å
479	I	88	Confident	85.5	Confident	50 Å²	50	56.7 Å²	56.7	26%	0.256	30%	0.298	S	S	.	.	H	α-helix	trans	-70	-35.7	177.1	-70.3	164.7	0	0	0	111.3	F324 V328 C475 F476 E477	F324-I479 HydrophobicContact CD2-CG1 4.41Å; F324-I479 HydrophobicContact CD2-CG2 4.4Å; F324-I479 HydrophobicContact CE2-CG2 4.22Å; V328-I479 HydrophobicContact CG2-CD1 4.07Å; C475-I479 WeakPolarHBondContact O-CD1 3.47Å; C475-I479 VanDerWaalsContact O-CG1 3.25Å; C475-I479 WeakPolarHBondContact O-CG1 3.43Å; C475-I479 PolarHBondContact O-N 3.43Å; F476-I479 PolarHBondContact O-N 2.86Å; E477-I479 VanDerWaalsContact C-N 3.32Å; E477-I479 PolarHBondContact O-N 3.27Å
480	A	82.6	Confident	85.1	Confident	64 Å²	64	56.4 Å²	56.4	53%	0.529	30%	0.297	S	S	.	.	H	α-helix	trans	-67.5	-44.1	177.1	0	0	0	0	0	112.2	F476 E477 Y483	F476-A480 WeakPolarHBondContact O-CB 3.49Å; F476-A480 PolarHBondContact O-N 3.39Å; E477-A480 PolarHBondContact O-N 3.49Å; A480-Y483 PolarHBondContact O-N 2.86Å
481	S	82.4	Confident	84.7	Confident	65 Å²	65	54.5 Å²	54.5	46%	0.455	29%	0.294	S	S	.	.	H	α-helix	trans	-68	-34.7	177.2	54.3	0	0	0	0	113	E477 S478 Y483 T484 G485	E477-S481 PolarHBondContact O-N 3.35Å; E477-S481 PolarHBondContact O-OG 2.9Å; S478-S481 WeakPolarHBondContact CA-OG 3.49Å; S478-S481 PolarHBondContact O-OG 2.94Å; S481-Y483 PolarHBondContact O-N 2.87Å; S481-T484 PolarHBondContact O-N 3.15Å; S481-T484 PolarHBondContact O-OG1 3.01Å; S481-G485 PolarHBondContact O-N 3.07Å
482	V	85.9	Confident	84.4	Confident	6 Å²	6	52 Å²	52	4%	0.036	28%	0.282	C	S	.	.	H	α-helix	trans	-52.9	-40.7	171.3	154.5	0	0	0	0	112.5	N320 V323 F324 S478 T484 G485 L486	N320-V482 HydrophobicContact CB-CB 4.44Å; N320-V482 HydrophobicContact CB-CG1 4.21Å; N320-V482 HydrophobicContact CB-CG2 4.19Å; N320-V482 VanDerWaalsContact O-CG2 3.32Å; N320-V482 WeakPolarHBondContact O-CG2 3.49Å; V323-V482 HydrophobicContact CB-CG2 3.78Å; V323-V482 HydrophobicContact CG1-CG2 3.61Å; F324-V482 HydrophobicContact CB-CG1 3.86Å; F324-V482 HydrophobicContact CB-CG2 4.2Å; F324-V482 HydrophobicContact CD2-CG1 3.97Å; F324-V482 HydrophobicContact CG-CG1 4.25Å; S478-V482 WeakPolarHBondContact O-CB 3.47Å; S478-V482 WeakPolarHBondContact O-CG2 3.49Å; S478-V482 PolarHBondContact O-N 3.41Å; S478-V482 VanDerWaalsContact O-N 3.09Å; V482-T484 PolarHBondContact O-N 3.21Å; V482-G485 PolarHBondContact O-N 3.25Å; V482-L486 WeakPolarHBondContact O-CB 3.39Å; V482-L486 PolarHBondContact O-N 3.43Å
483	Y	77.1	Confident	84.2	Confident	148 Å²	148	51.6 Å²	51.6	58%	0.58	28%	0.28	S	S	*	.	H	α-helix	trans	-62.5	-43.7	-173.9	179.7	-96.3	0	0	0	112.1	A480 S481 M487	A480-Y483 PolarHBondContact O-N 2.86Å; S481-Y483 PolarHBondContact O-N 2.87Å; Y483-M487 HydrophobicContact CD1-CG 4.4Å; Y483-M487 HydrophobicContact CE1-CG 4.01Å; Y483-M487 HydrophobicContact CE2-CE 4.38Å; Y483-M487 HydrophobicContact CE2-CG 4.29Å; Y483-M487 HydrophobicContact CE2-SD 4.42Å; Y483-M487 VanDerWaalsContact O-CG 3.27Å; Y483-M487 WeakPolarHBondContact O-CG 3.07Å; Y483-M487 PolarHBondContact O-N 3.07Å; Y483-M487 VanDerWaalsContact O-N 3.07Å
484	T	73.8	Confident	84.1	Confident	85 Å²	85	54.1 Å²	54.1	52%	0.521	29%	0.288	S	S	.	.	H	α-helix	trans	-68.9	-46	-178.8	55.8	0	0	0	0	111.4	S481 V482 L486 M487 Q488	S481-T484 PolarHBondContact O-N 3.15Å; S481-T484 PolarHBondContact O-OG1 3.01Å; V482-T484 PolarHBondContact O-N 3.21Å; T484-L486 VanDerWaalsContact C-N 3.35Å; T484-L486 PolarHBondContact O-N 2.89Å; T484-M487 PolarHBondContact O-N 3.37Å; T484-Q488 WeakPolarHBondContact O-CG 3.4Å; T484-Q488 PolarHBondContact O-N 3.1Å
485	G	77.8	Confident	83.9	Confident	7 Å²	7	53.3 Å²	53.3	7%	0.072	28%	0.282	C	S	.	.	H	α-helix	trans	-65.1	-35	177.2	0	0	0	0	0	113.4	N320 S481 V482 G489	N320-G485 VanDerWaalsContact ND2-C 3.27Å; N320-G485 WeakPolarHBondContact ND2-CA 3.43Å; S481-G485 PolarHBondContact O-N 3.07Å; V482-G485 PolarHBondContact O-N 3.25Å; G485-G489 PolarHBondContact O-N 2.98Å
486	L	80.7	Confident	83.9	Confident	31 Å²	31	53 Å²	53	16%	0.162	28%	0.28	C	S	.	.	H	α-helix	trans	-67.5	-43.3	175.1	-172.1	66.5	0	0	0	111.8	L191 I317 N320 V482 T484 Q488 G489 V490	L191-L486 HydrophobicContact CD2-CD1 4.07Å; I317-L486 HydrophobicContact CG2-CD1 3.91Å; N320-L486 HydrophobicContact CB-CB 4.49Å; V482-L486 WeakPolarHBondContact O-CB 3.39Å; V482-L486 PolarHBondContact O-N 3.43Å; T484-L486 VanDerWaalsContact C-N 3.35Å; T484-L486 PolarHBondContact O-N 2.89Å; L486-Q488 VanDerWaalsContact C-N 3.35Å; L486-G489 PolarHBondContact O-N 3.48Å; L486-V490 WeakPolarHBondContact O-CB 3.35Å; L486-V490 VanDerWaalsContact O-CG2 3.31Å; L486-V490 WeakPolarHBondContact O-CG2 3.48Å; L486-V490 PolarHBondContact O-N 3.49Å
487	M	78	Confident	84	Confident	76 Å²	76	49 Å²	49	37%	0.374	26%	0.263	S	S	.	.	H	α-helix	trans	-63.8	-39.3	176.3	-68.6	-62.2	101.4	0	0	112	Y483 T484 V490 G491	Y483-M487 HydrophobicContact CD1-CG 4.4Å; Y483-M487 HydrophobicContact CE1-CG 4.01Å; Y483-M487 HydrophobicContact CE2-CE 4.38Å; Y483-M487 HydrophobicContact CE2-CG 4.29Å; Y483-M487 HydrophobicContact CE2-SD 4.42Å; Y483-M487 VanDerWaalsContact O-CG 3.27Å; Y483-M487 WeakPolarHBondContact O-CG 3.07Å; Y483-M487 PolarHBondContact O-N 3.07Å; Y483-M487 VanDerWaalsContact O-N 3.07Å; T484-M487 PolarHBondContact O-N 3.37Å; M487-V490 PolarHBondContact O-N 3.4Å; M487-G491 PolarHBondContact O-N 3.46Å
488	Q	79.4	Confident	84.3	Confident	112 Å²	112	46.5 Å²	46.5	52%	0.523	25%	0.251	S	S	.	.	H	α-helix	trans	-62.4	-48.5	173.2	-73.2	176.4	-8.1	0	0	111.9	L316 T484 L486 V490 G491 A492	L316-Q488 HydrophobicContact CD1-CB 4.08Å; T484-Q488 WeakPolarHBondContact O-CG 3.4Å; T484-Q488 PolarHBondContact O-N 3.1Å; L486-Q488 VanDerWaalsContact C-N 3.35Å; Q488-V490 VanDerWaalsContact C-N 3.34Å; Q488-V490 PolarHBondContact O-N 3.38Å; Q488-G491 PolarHBondContact O-N 2.84Å; Q488-A492 PolarHBondContact O-N 2.98Å
489	G	84.5	Confident	84.4	Confident	0 Å²	0	45.5 Å²	45.5	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-60.1	-41.3	177.3	0	0	0	0	0	112.8	I317 G485 L486 A492 A493	I317-G489 WeakPolarHBondContact CD1-O 3.35Å; G485-G489 PolarHBondContact O-N 2.98Å; L486-G489 PolarHBondContact O-N 3.48Å; G489-A492 PolarHBondContact O-N 3.33Å; G489-A493 WeakPolarHBondContact O-CB 3.5Å; G489-A493 PolarHBondContact O-N 2.92Å
490	V	85.1	Confident	84.5	Confident	4 Å²	4	43.8 Å²	43.8	2%	0.024	23%	0.234	C	C	.	.	H	α-helix	trans	-61.1	-44.8	174	165.8	0	0	0	0	111.6	T190 L191 L486 M487 Q488 A492 A493 E494	T190-V490 HydrophobicContact CG2-CG1 4.43Å; L191-V490 HydrophobicContact CD1-CG2 3.89Å; L191-V490 HydrophobicContact CG-CG2 3.94Å; L486-V490 WeakPolarHBondContact O-CB 3.35Å; L486-V490 VanDerWaalsContact O-CG2 3.31Å; L486-V490 WeakPolarHBondContact O-CG2 3.48Å; L486-V490 PolarHBondContact O-N 3.49Å; M487-V490 PolarHBondContact O-N 3.4Å; Q488-V490 VanDerWaalsContact C-N 3.34Å; Q488-V490 PolarHBondContact O-N 3.38Å; V490-A492 VanDerWaalsContact C-N 3.31Å; V490-A492 PolarHBondContact O-N 2.96Å; V490-A493 WeakPolarHBondContact O-CB 3.42Å; V490-A493 PolarHBondContact O-N 3.42Å; V490-A493 VanDerWaalsContact O-N 3.07Å; V490-E494 HydrophobicContact CG1-CG 4.5Å; V490-E494 VanDerWaalsContact CG1-OE1 3.26Å; V490-E494 WeakPolarHBondContact CG1-OE1 3.4Å; V490-E494 WeakPolarHBondContact O-CG 3.25Å; V490-E494 PolarHBondContact O-N 3.44Å
491	G	83.6	Confident	84.9	Confident	26 Å²	26	44.2 Å²	44.2	27%	0.268	23%	0.227	S	C	.	.	H	α-helix	trans	-63	-35.2	177.3	0	0	0	0	0	113.3	M487 Q488 K495	M487-G491 PolarHBondContact O-N 3.46Å; Q488-G491 PolarHBondContact O-N 2.84Å; G491-K495 WeakPolarHBondContact O-CG 3.49Å
492	A	86.6	Confident	85.3	Confident	3 Å²	3	43.3 Å²	43.3	3%	0.025	21%	0.213	C	C	.	.	H	α-helix	trans	-69.4	-38.2	170.5	0	0	0	0	0	112	D309 Q312 V313 Q488 G489 V490 K495 V496	D309-A492 HydrophobicContact CB-CB 4.14Å; Q312-A492 HydrophobicContact CB-CB 4.06Å; Q312-A492 HydrophobicContact CG-CB 4.16Å; V313-A492 HydrophobicContact CG2-CB 3.79Å; Q488-A492 PolarHBondContact O-N 2.98Å; G489-A492 PolarHBondContact O-N 3.33Å; V490-A492 VanDerWaalsContact C-N 3.31Å; V490-A492 PolarHBondContact O-N 2.96Å; A492-K495 PolarHBondContact O-N 3.17Å; A492-V496 WeakPolarHBondContact O-CG2 3.42Å; A492-V496 PolarHBondContact O-N 3.06Å
493	A	88.8	Confident	85.5	Confident	0 Å²	0	51.7 Å²	51.7	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-66.5	-38.8	179	0	0	0	0	0	112.6	T190 V313 I317 G489 V490 V496 F497	T190-A493 HydrophobicContact CG2-CB 3.59Å; V313-A493 HydrophobicContact CG1-CB 4.23Å; V313-A493 VanDerWaalsContact CG2-CA 3.4Å; V313-A493 HydrophobicContact CG2-CB 3.76Å; V313-A493 VanDerWaalsContact CG2-N 3.26Å; I317-A493 HydrophobicContact CD1-CB 4.06Å; G489-A493 WeakPolarHBondContact O-CB 3.5Å; G489-A493 PolarHBondContact O-N 2.92Å; V490-A493 WeakPolarHBondContact O-CB 3.42Å; V490-A493 PolarHBondContact O-N 3.42Å; V490-A493 VanDerWaalsContact O-N 3.07Å; A493-V496 PolarHBondContact O-N 3.35Å; A493-F497 HydrophobicContact CB-CD2 4.41Å; A493-F497 HydrophobicContact CB-CE2 4.13Å; A493-F497 WeakPolarHBondContact O-CB 3.46Å; A493-F497 WeakPolarHBondContact O-CD2 3.32Å; A493-F497 VanDerWaalsContact O-CG 3.23Å; A493-F497 WeakPolarHBondContact O-CG 3.43Å; A493-F497 PolarHBondContact O-N 3.03Å
494	E	87.8	Confident	86.1	Confident	68 Å²	68	46.2 Å²	46.2	32%	0.318	23%	0.232	S	C	.	.	H	α-helix	trans	-59.1	-46.3	175.7	-75.7	167	-169.3	0	0	110.8	S187 T190 V490 F497 E498	S187-E494 PolarHBondContact OG-OE1 2.97Å; S187-E494 VanDerWaalsContact OG-OE1 3.12Å; T190-E494 HydrophobicContact CG2-CG 3.85Å; T190-E494 PolarHBondContact OG1-OE1 3.36Å; V490-E494 HydrophobicContact CG1-CG 4.5Å; V490-E494 VanDerWaalsContact CG1-OE1 3.26Å; V490-E494 WeakPolarHBondContact CG1-OE1 3.4Å; V490-E494 WeakPolarHBondContact O-CG 3.25Å; V490-E494 PolarHBondContact O-N 3.44Å; E494-F497 PolarHBondContact O-N 3.25Å; E494-E498 PolarHBondContact O-N 3.42Å
495	K	86.6	Confident	86.7	Confident	94 Å²	94	48.4 Å²	48.4	41%	0.409	23%	0.234	S	C	.	.	H	α-helix	trans	-68.6	-38.8	177.7	-58.9	178.7	-164.2	-178.1	0	113.5	G491 A492 F497 E498 Y499	G491-K495 WeakPolarHBondContact O-CG 3.49Å; A492-K495 PolarHBondContact O-N 3.17Å; K495-F497 VanDerWaalsContact C-N 3.34Å; K495-E498 PolarHBondContact O-N 3.42Å; K495-Y499 PolarHBondContact O-N 3.29Å
496	V	91.1	Very high	87.1	Confident	1 Å²	1	49.7 Å²	49.7	1%	0.006	24%	0.238	C	C	.	.	H	α-helix	trans	-64.5	-39.9	173.6	166.6	0	0	0	0	110.9	L282 D309 T310 V313 A492 A493 L500	L282-V496 HydrophobicContact CD2-CG1 4.4Å; D309-V496 HydrophobicContact CB-CG2 3.68Å; T310-V496 HydrophobicContact CG2-CG1 4.32Å; T310-V496 HydrophobicContact CG2-CG2 4.15Å; V313-V496 HydrophobicContact CG2-CG2 4.36Å; A492-V496 WeakPolarHBondContact O-CG2 3.42Å; A492-V496 PolarHBondContact O-N 3.06Å; A493-V496 PolarHBondContact O-N 3.35Å; V496-L500 WeakPolarHBondContact O-CB 3.38Å; V496-L500 PolarHBondContact O-N 3.07Å
497	F	90.4	Very high	86.9	Confident	10 Å²	10	50.8 Å²	50.8	4%	0.044	25%	0.247	C	C	.	.	H	α-helix	trans	-73.8	-31.5	177.9	-66.2	-35.5	0	0	0	113.2	T190 R193 L194 Y197 A493 E494 K495 Y499 L500 D501	T190-F497 HydrophobicContact CG2-CD2 3.92Å; T190-F497 HydrophobicContact CG2-CE2 3.87Å; R193-F497 HydrophobicContact CB-CE2 4.29Å; R193-F497 HydrophobicContact CG-CE2 4.26Å; R193-F497 HydrophobicContact CG-CZ 4.16Å; L194-F497 HydrophobicContact CD1-CZ 4.24Å; Y197-F497 HydrophobicContact CD2-CE1 4.42Å; Y197-F497 AromaticContact CE2-CE1 3.93Å; Y197-F497 HydrophobicContact CE2-CE1 3.93Å; Y197-F497 HydrophobicContact CE2-CZ 4.39Å; A493-F497 HydrophobicContact CB-CD2 4.41Å; A493-F497 HydrophobicContact CB-CE2 4.13Å; A493-F497 WeakPolarHBondContact O-CB 3.46Å; A493-F497 WeakPolarHBondContact O-CD2 3.32Å; A493-F497 VanDerWaalsContact O-CG 3.23Å; A493-F497 WeakPolarHBondContact O-CG 3.43Å; A493-F497 PolarHBondContact O-N 3.03Å; E494-F497 PolarHBondContact O-N 3.25Å; K495-F497 VanDerWaalsContact C-N 3.34Å; F497-Y499 VanDerWaalsContact C-N 3.29Å; F497-Y499 PolarHBondContact O-N 3.11Å; F497-L500 HydrophobicContact CD1-CD2 3.86Å; F497-L500 HydrophobicContact CE1-CD2 4.18Å; F497-L500 PolarHBondContact O-N 3.42Å; F497-L500 VanDerWaalsContact O-N 3.15Å; F497-D501 VanDerWaalsContact O-CB 3.24Å; F497-D501 WeakPolarHBondContact O-CB 3.42Å; F497-D501 PolarHBondContact O-N 3.07Å
498	E	90.5	Very high	86.8	Confident	92 Å²	92	50.3 Å²	50.3	43%	0.43	26%	0.255	S	S	.	.	H	α-helix	trans	-52.3	-48.7	170.9	-175.5	174.8	-161.2	0	0	110.7	K182 E494 K495 R502	K182-E498 IonicContact NZ-OE1 2.7Å; K182-E498 PolarHBondContact NZ-OE1 3.43Å; E494-E498 PolarHBondContact O-N 3.42Å; K495-E498 PolarHBondContact O-N 3.42Å; E498-R502 WeakPolarHBondContact O-CB 3.34Å; E498-R502 PolarHBondContact O-N 3.12Å
499	Y	90.9	Very high	86.8	Confident	14 Å²	14	51 Å²	51	6%	0.055	26%	0.263	C	S	.	.	H	α-helix	trans	-74.4	-31.7	177.6	-75.5	14.6	0	0	0	113.4	T285 L286 F293 N297 I302 R305 K495 F497 D501	T285-Y499 WeakPolarHBondContact CG2-O 3.28Å; L286-Y499 HydrophobicContact CD2-CD2 3.98Å; F293-Y499 HydrophobicContact CE2-CD1 4.5Å; F293-Y499 HydrophobicContact CE2-CE1 4.11Å; F293-Y499 HydrophobicContact CZ-CD1 4.4Å; F293-Y499 HydrophobicContact CZ-CD2 4.2Å; F293-Y499 HydrophobicContact CZ-CE1 4.12Å; F293-Y499 AromaticContact CZ-CE2 3.91Å; F293-Y499 HydrophobicContact CZ-CE2 3.91Å; F293-Y499 HydrophobicContact CZ-CG 4.43Å; F293-Y499 AromaticContact CZ-CZ 3.86Å; N297-Y499 PolarHBondContact OD1-OH 3.35Å; I302-Y499 HydrophobicContact CG1-CE2 4.17Å; R305-Y499 HydrophobicContact CB-CD2 4.18Å; R305-Y499 HydrophobicContact CB-CE2 4.19Å; R305-Y499 HydrophobicContact CG-CD2 3.88Å; R305-Y499 HydrophobicContact CG-CE2 3.55Å; K495-Y499 PolarHBondContact O-N 3.29Å; F497-Y499 VanDerWaalsContact C-N 3.29Å; F497-Y499 PolarHBondContact O-N 3.11Å; Y499-D501 VanDerWaalsContact C-N 3.3Å; Y499-D501 PolarHBondContact O-N 3.01Å
500	L	91.1	Very high	86.8	Confident	14 Å²	14	51.9 Å²	51.9	7%	0.073	27%	0.272	C	S	.	.	H	α-helix	trans	-72.4	-25.1	179.2	-159.3	67.9	0	0	0	113.1	Y197 R281 L282 V496 F497	Y197-L500 VanDerWaalsContact OH-CD2 3.28Å; Y197-L500 WeakPolarHBondContact OH-CD2 3.49Å; R281-L500 HydrophobicContact CB-CD1 4.1Å; R281-L500 HydrophobicContact CG-CD1 3.83Å; L282-L500 HydrophobicContact CB-CD1 4.15Å; L282-L500 HydrophobicContact CD1-CD1 4.46Å; V496-L500 WeakPolarHBondContact O-CB 3.38Å; V496-L500 PolarHBondContact O-N 3.07Å; F497-L500 HydrophobicContact CD1-CD2 3.86Å; F497-L500 HydrophobicContact CE1-CD2 4.18Å; F497-L500 PolarHBondContact O-N 3.42Å; F497-L500 VanDerWaalsContact O-N 3.15Å
501	D	90.6	Very high	87	Confident	72 Å²	72	57.5 Å²	57.5	39%	0.385	31%	0.306	S	S	.	.	H	α-helix	trans	-101	-16.6	-178.2	-65.9	-12.6	0	0	0	113.3	R193 F497 Y499 K503	R193-D501 IonicContact CZ-OD1 2.62Å; R193-D501 VanDerWaalsContact CZ-OD1 3.23Å; R193-D501 IonicContact CZ-OD2 2.67Å; R193-D501 VanDerWaalsContact CZ-OD2 3.27Å; R193-D501 IonicContact NH1-OD1 2.66Å; R193-D501 PolarHBondContact NH1-OD1 3.24Å; R193-D501 IonicContact NH1-OD2 2.57Å; R193-D501 PolarHBondContact NH1-OD2 3.46Å; R193-D501 IonicContact NH2-OD1 3.43Å; R193-D501 PolarHBondContact NH2-OD1 3.04Å; R193-D501 IonicContact NH2-OD2 3.53Å; R193-D501 PolarHBondContact NH2-OD2 3.11Å; F497-D501 VanDerWaalsContact O-CB 3.24Å; F497-D501 WeakPolarHBondContact O-CB 3.42Å; F497-D501 PolarHBondContact O-N 3.07Å; Y499-D501 VanDerWaalsContact C-N 3.3Å; Y499-D501 PolarHBondContact O-N 3.01Å; D501-K503 PolarHBondContact O-N 3.29Å
502	R	90.3	Very high	87.3	Confident	46 Å²	46	59.3 Å²	59.3	17%	0.174	31%	0.308	C	S	.	.			trans	-56	108	174.3	-168.7	-175.8	-169.5	-74.2	6	109.6	Q289 E290 F293 E296 E498	Q289-R502 PolarHBondContact NE2-O 3.47Å; Q289-R502 VanDerWaalsContact OE1-CD 3.26Å; Q289-R502 PolarHBondContact OE1-O 2.72Å; E290-R502 VanDerWaalsContact CD-NH1 3.26Å; E290-R502 IonicContact OE1-CZ 3.99Å; E290-R502 VanDerWaalsContact OE1-CZ 3.28Å; E290-R502 IonicContact OE1-NH1 3.81Å; E290-R502 PolarHBondContact OE1-NH1 3.12Å; E290-R502 IonicContact OE1-NH2 2.85Å; E290-R502 PolarHBondContact OE1-NH2 3.01Å; E290-R502 IonicContact OE2-CZ 2.95Å; E290-R502 IonicContact OE2-NH1 3.63Å; E290-R502 PolarHBondContact OE2-NH1 2.95Å; E290-R502 IonicContact OE2-NH2 2.86Å; F293-R502 VanDerWaalsContact CD2-NE 3.25Å; E296-R502 IonicContact OE2-NH2 2.82Å; E498-R502 WeakPolarHBondContact O-CB 3.34Å; E498-R502 PolarHBondContact O-N 3.12Å
503	K	90.3	Very high	87.4	Confident	182 Å²	182	61.1 Å²	61.1	79%	0.791	32%	0.323	S	S	*	.			trans	-75.3	137.5	163	-62.6	-174.1	-179.3	-176.4	0	107.9	D501	D501-K503 PolarHBondContact O-N 3.29Å
504	P	89.7	Confident	87.5	Confident	34 Å²	34	63 Å²	63	22%	0.221	34%	0.335	C	S	.	.			trans	-57.5	139.9	174.8	22.8	-32.8	0	0	0	110.9	T288 E290 P507	T288-P504 WeakPolarHBondContact O-CB 3.31Å; T288-P504 WeakPolarHBondContact O-CG 3.31Å; E290-P504 WeakPolarHBondContact OE2-CA 3.18Å; E290-P504 WeakPolarHBondContact OE2-CB 3.32Å; P504-P507 HydrophobicContact CG-CB 4.02Å
505	K	86.9	Confident	87.3	Confident	131 Å²	131	68.4 Å²	68.4	57%	0.57	37%	0.366	S	S	*	.	S	Bend	trans	-68.3	-30.8	175.3	-62.2	173.2	-169.4	165.2	0	110.9	E290 E296	E290-K505 WeakPolarHBondContact OE1-CB 3.35Å; E290-K505 WeakPolarHBondContact OE1-CD 3.37Å; E290-K505 VanDerWaalsContact OE1-CG 3.25Å; E290-K505 WeakPolarHBondContact OE1-CG 3.4Å; E290-K505 PolarHBondContact OE1-N 3.45Å; E290-K505 PolarHBondContact OE2-N 2.92Å; E296-K505 IonicContact OE1-NZ 3.87Å; E296-K505 PolarHBondContact OE1-NZ 3.47Å; E296-K505 IonicContact OE2-NZ 3.21Å; E296-K505 PolarHBondContact OE2-NZ 2.98Å
506	H	86.1	Confident	87.2	Confident	33 Å²	33	68.4 Å²	68.4	15%	0.153	38%	0.378	C	S	.	.	S	Bend	trans	-123.2	86.2	176.6	179.9	35.4	0	0	0	108.6	E290 N571 L574	E290-H506 HydrophobicContact CB-CB 4.08Å; H506-N571 PolarHBondContact CD2-O 3.34Å; H506-N571 PolarHBondContact CE1-OD1 3.09Å; H506-N571 VanDerWaalsContact CE1-OD1 3.32Å; H506-N571 PolarHBondContact NE2-O 3.33Å; H506-N571 PolarHBondContact NE2-OD1 3.29Å; H506-L574 VanDerWaalsContact CE1-CD2 3.44Å; H506-L574 WeakPolarHBondContact CE1-CD2 3.48Å
507	P	75.8	Confident	87.1	Confident	54 Å²	54	68.9 Å²	68.9	35%	0.351	38%	0.381	S	S	.	.			trans	-74.5	141	179.5	31	-34.6	0	0	0	111.1	P504 D509	P504-P507 HydrophobicContact CG-CB 4.02Å; P507-D509 HydrophobicContact CB-CB 4.49Å; P507-D509 WeakPolarHBondContact CB-OD2 3.25Å; P507-D509 PolarHBondContact O-N 3.29Å
508	A	77.4	Confident	87.1	Confident	66 Å²	66	72.9 Å²	72.9	55%	0.545	41%	0.407	S	S	.	.			trans	-77.6	45.3	176.5	0	0	0	0	0	112.9	G510 H592	A508-G510 VanDerWaalsContact C-N 3.28Å; A508-G510 PolarHBondContact O-N 3.37Å; A508-H592 HydrophobicContact CB-CB 4.05Å
509	D	79.6	Confident	87.1	Confident	128 Å²	128	68.5 Å²	68.5	68%	0.684	39%	0.386	S	S	*	.			trans	-83.7	5.5	-170.9	-69.9	-16	0	0	0	114	P507	P507-D509 HydrophobicContact CB-CB 4.49Å; P507-D509 WeakPolarHBondContact CB-OD2 3.25Å; P507-D509 PolarHBondContact O-N 3.29Å
510	G	83.4	Confident	87.3	Confident	18 Å²	18	70.2 Å²	70.2	19%	0.186	40%	0.396	C	S	.	.			trans	-60.2	141.4	179.1	0	0	0	0	0	112.9	A508 E589 Q591	A508-G510 VanDerWaalsContact C-N 3.28Å; A508-G510 PolarHBondContact O-N 3.37Å; G510-E589 CarbonylContact C-O 3.58Å; G510-E589 VanDerWaalsContact CA-O 3.23Å; G510-E589 WeakPolarHBondContact CA-O 3.31Å; G510-Q591 VanDerWaalsContact O-CA 3.25Å; G510-Q591 WeakPolarHBondContact O-CA 3.25Å
511	T	89.6	Confident	87.6	Confident	122 Å²	122	69.5 Å²	69.5	75%	0.748	39%	0.393	S	S	*	.			trans	-117.5	-7	-173.9	55.9	0	0	0	0	113.7	A513 E589	T511-A513 PolarHBondContact O-N 3.45Å; T511-E589 PolarHBondContact N-O 2.93Å
512	E	89.1	Confident	87.9	Confident	63 Å²	63	68 Å²	68	29%	0.294	38%	0.383	S	S	.	.	B	Isolated β-bridge	trans	-76.1	120.8	-178	-74.2	-77.6	-178.3	0	0	111.6	K585 E589 F590 Q591	E512-K585 HydrophobicContact CG-CD 4.3Å; E512-K585 IonicContact OE1-NZ 2.72Å; E512-K585 PolarHBondContact OE1-NZ 2.84Å; E512-K585 IonicContact OE2-NZ 2.68Å; E512-K585 PolarHBondContact OE2-NZ 3.45Å; E512-E589 WeakPolarHBondContact CB-O 3.43Å; E512-E589 HydrophobicContact CG-CB 4.44Å; E512-E589 PolarHBondContact N-O 3.02Å; E512-F590 HydrophobicContact CB-CD1 4.09Å; E512-F590 HydrophobicContact CB-CG 4.39Å; E512-F590 WeakPolarHBondContact O-CA 3.48Å; E512-F590 WeakPolarHBondContact O-CD1 3.34Å; E512-Q591 PolarHBondContact O-N 3.22Å
513	A	90.2	Very high	88.2	Confident	42 Å²	42	65.9 Å²	65.9	35%	0.347	38%	0.375	S	S	.	.			trans	-142.6	68.8	176.9	0	0	0	0	0	110.4	T511 Y594	T511-A513 PolarHBondContact O-N 3.45Å; A513-Y594 HydrophobicContact CB-CD2 3.9Å; A513-Y594 HydrophobicContact CB-CG 3.93Å
514	P	89.8	Confident	88.5	Confident	40 Å²	40	61.6 Å²	61.6	26%	0.26	36%	0.356	S	S	.	.			trans	-64.8	147	-177.1	25	-33.4	0	0	0	112.7	S516 F590 Y594	P514-S516 PolarHBondContact O-N 3.27Å; P514-F590 HydrophobicContact CG-CE1 3.96Å; P514-Y594 HydrophobicContact CG-CE1 4.16Å; P514-Y594 WeakPolarHBondContact O-CE2 3.42Å; P514-Y594 VanDerWaalsContact O-CZ 3.32Å; P514-Y594 PolarHBondContact O-OH 2.9Å
515	N	83.2	Confident	88.7	Confident	180 Å²	180	64.9 Å²	64.9	96%	0.963	37%	0.372	S	S	*	.	S	Bend	trans	-65	-22.9	-178.9	-66.6	-29.1	0	0	0	113.6
516	S	85.3	Confident	89.2	Confident	94 Å²	94	58.7 Å²	58.7	66%	0.657	35%	0.345	S	S	*	.			trans	-127.1	136.8	179.5	56.5	0	0	0	0	110.5	P514	P514-S516 PolarHBondContact O-N 3.27Å
517	C	89	Confident	89.6	Confident	11 Å²	11	58.8 Å²	58.8	7%	0.074	35%	0.348	C	S	.	.			trans	-127.2	124.3	170.4	168.1	0	0	0	0	107.5	D583 Y594 K598 R679	C517-D583 VanDerWaalsContact CA-OD2 3.22Å; C517-D583 WeakPolarHBondContact CA-OD2 3.45Å; C517-D583 PolarHBondContact SG-OD2 2.88Å; C517-D583 VanDerWaalsContact SG-OD2 3.37Å; C517-Y594 WeakPolarHBondContact CB-OH 3.39Å; C517-K598 HydrophobicContact CB-CD 4.44Å; C517-K598 HydrophobicContact CB-CG 4.27Å; C517-R679 HydrophobicContact CB-CG 4.12Å; C517-R679 PolarHBondContact O-NE 2.85Å
518	T	89.5	Confident	90.6	Very high	95 Å²	95	56.4 Å²	56.4	58%	0.583	33%	0.332	S	S	*	.			trans	-84.8	-25.2	174.4	37.5	0	0	0	0	112	P548 D583	T518-P548 WeakPolarHBondContact O-CB 3.43Å; T518-P548 VanDerWaalsContact O-CG 3.29Å; T518-P548 WeakPolarHBondContact O-CG 3.45Å; T518-D583 PolarHBondContact N-OD2 3.11Å; T518-D583 PolarHBondContact OG1-OD1 3.48Å; T518-D583 PolarHBondContact OG1-OD2 3.34Å
519	G	91.1	Very high	91.3	Very high	0 Å²	0	53.5 Å²	53.5	0%	0	31%	0.308	C	S	.	.			trans	86.6	16.8	177.1	0	0	0	0	0	114.6	V521 D583 T710	G519-V521 PolarHBondContact O-N 3.38Å; G519-D583 PolarHBondContact N-OD1 2.82Å; G519-D583 PolarHBondContact N-OD2 2.99Å; G519-T710 WeakPolarHBondContact O-CB 3.46Å; G519-T710 WeakPolarHBondContact O-CG2 3.43Å; G519-T710 PolarHBondContact O-OG1 2.96Å
520	L	95.3	Very high	92	Very high	49 Å²	49	50 Å²	50	26%	0.257	29%	0.286	S	S	.	.			trans	-71.4	120.2	174.2	178.2	70.7	0	0	0	109	T545 P548 L582 D583	L520-T545 HydrophobicContact CD1-CG2 3.72Å; L520-P548 HydrophobicContact CB-CG 4.3Å; L520-L582 CarbonylContact O-C 3.48Å; L520-L582 WeakPolarHBondContact O-CA 3.46Å; L520-D583 PolarHBondContact N-OD1 3.44Å; L520-D583 PolarHBondContact O-N 3.25Å
521	V	96.8	Very high	92.2	Very high	0 Å²	0	52 Å²	52	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	131.3	178.5	178.8	0	0	0	0	110	G519 F523 T545 L546 L569 L581 L582 V680	G519-V521 PolarHBondContact O-N 3.38Å; V521-F523 HydrophobicContact CG1-CD2 4.25Å; V521-F523 HydrophobicContact CG1-CE2 3.94Å; V521-T545 CarbonylContact O-C 3.41Å; V521-T545 WeakPolarHBondContact O-CA 3.33Å; V521-L546 HydrophobicContact CB-CB 4.06Å; V521-L546 HydrophobicContact CB-CD1 3.95Å; V521-L546 HydrophobicContact CB-CG 4.08Å; V521-L546 HydrophobicContact CG1-CD1 4.08Å; V521-L546 HydrophobicContact CG1-CG 4.39Å; V521-L546 HydrophobicContact CG2-CD1 4.41Å; V521-L546 PolarHBondContact N-O 3.27Å; V521-L546 PolarHBondContact O-N 3.18Å; V521-L569 HydrophobicContact CB-CD1 4.5Å; V521-L569 HydrophobicContact CG1-CD1 3.55Å; V521-L569 HydrophobicContact CG1-CD2 4.21Å; V521-L569 HydrophobicContact CG2-CD1 4.07Å; V521-L581 WeakPolarHBondContact CA-O 3.5Å; V521-L582 HydrophobicContact CG2-CD1 3.93Å; V521-V680 HydrophobicContact CG2-CG1 4.26Å; V521-V680 HydrophobicContact CG2-CG2 3.96Å
522	E	96.8	Very high	92.1	Very high	39 Å²	39	49.9 Å²	49.9	18%	0.182	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	128.5	177.3	-57	-175.6	92.2	0	0	111.6	K524 T545 V580 L581	E522-K524 HydrophobicContact CB-CG 4.45Å; E522-K524 WeakPolarHBondContact OE1-CE 3.23Å; E522-K524 IonicContact OE1-NZ 3.16Å; E522-K524 PolarHBondContact OE1-NZ 3.14Å; E522-K524 VanDerWaalsContact OE1-NZ 3.16Å; E522-K524 VanDerWaalsContact OE2-CE 3.26Å; E522-K524 WeakPolarHBondContact OE2-CE 3.37Å; E522-K524 IonicContact OE2-NZ 2.68Å; E522-K524 PolarHBondContact OE2-NZ 3.19Å; E522-T545 HydrophobicContact CG-CG2 4.09Å; E522-V580 CarbonylContact O-C 3.39Å; E522-V580 WeakPolarHBondContact O-CA 3.41Å; E522-L581 HydrophobicContact CB-CB 4.26Å; E522-L581 HydrophobicContact CB-CD1 4.39Å; E522-L581 PolarHBondContact N-O 3.2Å; E522-L581 PolarHBondContact O-N 3.11Å
523	F	97.1	Very high	92.1	Very high	3 Å²	3	55.8 Å²	55.8	1%	0.013	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	124.4	163.8	-75.1	-112.2	0	0	0	107.3	V521 V526 S543 F544 C565 L568 L569 V580	V521-F523 HydrophobicContact CG1-CD2 4.25Å; V521-F523 HydrophobicContact CG1-CE2 3.94Å; F523-V526 HydrophobicContact CB-CG2 4.07Å; F523-V526 HydrophobicContact CD1-CB 4.25Å; F523-V526 HydrophobicContact CD1-CG1 4.41Å; F523-V526 HydrophobicContact CD1-CG2 3.89Å; F523-V526 HydrophobicContact CG-CG2 4.39Å; F523-S543 VanDerWaalsContact O-CA 3.25Å; F523-S543 WeakPolarHBondContact O-CA 3.48Å; F523-F544 HydrophobicContact CB-CD1 4.11Å; F523-F544 HydrophobicContact CB-CE1 4.1Å; F523-F544 HydrophobicContact CB-CG 4.34Å; F523-F544 HydrophobicContact CB-CZ 4.3Å; F523-F544 HydrophobicContact CD1-CE1 4.08Å; F523-F544 HydrophobicContact CD1-CZ 4.01Å; F523-F544 HydrophobicContact CD2-CD2 4.02Å; F523-F544 HydrophobicContact CD2-CE1 4.03Å; F523-F544 AromaticContact CD2-CE2 3.35Å; F523-F544 HydrophobicContact CD2-CE2 3.35Å; F523-F544 AromaticContact CD2-CZ 3.36Å; F523-F544 HydrophobicContact CD2-CZ 3.36Å; F523-F544 HydrophobicContact CE1-CZ 4.2Å; F523-F544 AromaticContact CE2-CE2 3.69Å; F523-F544 HydrophobicContact CE2-CE2 3.69Å; F523-F544 AromaticContact CE2-CZ 3.58Å; F523-F544 HydrophobicContact CE2-CZ 3.58Å; F523-F544 HydrophobicContact CG-CD1 4.3Å; F523-F544 HydrophobicContact CG-CD2 4.48Å; F523-F544 AromaticContact CG-CE1 3.8Å; F523-F544 HydrophobicContact CG-CE1 3.8Å; F523-F544 AromaticContact CG-CE2 3.99Å; F523-F544 HydrophobicContact CG-CE2 3.99Å; F523-F544 AromaticContact CG-CZ 3.62Å; F523-F544 HydrophobicContact CG-CZ 3.62Å; F523-F544 HydrophobicContact CZ-CZ 4.01Å; F523-F544 PolarHBondContact N-O 3.48Å; F523-F544 PolarHBondContact O-N 3.2Å; F523-C565 HydrophobicContact CE1-CB 3.99Å; F523-C565 HydrophobicContact CZ-CB 4.1Å; F523-C565 WeakPolarHBondContact CZ-O 2.87Å; F523-L568 HydrophobicContact CE1-CB 4.49Å; F523-L569 HydrophobicContact CZ-CB 4.22Å; F523-V580 HydrophobicContact CD1-CG2 3.71Å; F523-V580 HydrophobicContact CD2-CG1 4.28Å; F523-V580 HydrophobicContact CE1-CG1 4.25Å; F523-V580 HydrophobicContact CE1-CG2 3.57Å; F523-V580 HydrophobicContact CE2-CG1 3.91Å; F523-V580 HydrophobicContact CG-CG2 4.29Å; F523-V580 HydrophobicContact CZ-CG1 3.88Å; F523-V580 HydrophobicContact CZ-CG2 4.06Å
524	K	96.2	Very high	91.9	Very high	91 Å²	91	56.9 Å²	56.9	40%	0.396	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	108	-179.7	-67.2	-178.8	-176.1	163.9	0	110.1	E522 V526 G578 Q579 L581	E522-K524 HydrophobicContact CB-CG 4.45Å; E522-K524 WeakPolarHBondContact OE1-CE 3.23Å; E522-K524 IonicContact OE1-NZ 3.16Å; E522-K524 PolarHBondContact OE1-NZ 3.14Å; E522-K524 VanDerWaalsContact OE1-NZ 3.16Å; E522-K524 VanDerWaalsContact OE2-CE 3.26Å; E522-K524 WeakPolarHBondContact OE2-CE 3.37Å; E522-K524 IonicContact OE2-NZ 2.68Å; E522-K524 PolarHBondContact OE2-NZ 3.19Å; K524-V526 VanDerWaalsContact C-N 3.27Å; K524-V526 PolarHBondContact O-N 3.41Å; K524-G578 CarbonylContact O-C 3.59Å; K524-G578 WeakPolarHBondContact O-CA 3.43Å; K524-Q579 PolarHBondContact N-O 3.01Å; K524-Q579 PolarHBondContact O-N 3.08Å; K524-L581 HydrophobicContact CD-CD1 3.76Å
525	D	95.3	Very high	91.9	Very high	104 Å²	104	63.3 Å²	63.3	56%	0.556	33%	0.333	S	S	*	.	E	Extended strand (participates in β ladder)	trans	51.1	39.6	177.5	-158	28.8	0	0	0	114.7	T527 G541 V542 S543 G578	D525-T527 PolarHBondContact O-N 3.4Å; D525-G541 WeakPolarHBondContact OD1-CA 3.43Å; D525-V542 PolarHBondContact N-O 3.37Å; D525-S543 WeakPolarHBondContact CA-OG 3.49Å; D525-S543 PolarHBondContact N-OG 3.31Å; D525-G578 WeakPolarHBondContact O-CA 3.37Å
526	V	96.4	Very high	92.1	Very high	0 Å²	0	58.8 Å²	58.8	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	120.3	-168.4	177	0	0	0	0	111.7	F523 K524 L539 G541 V542 L568 P575 G577 Q579 V580	F523-V526 HydrophobicContact CB-CG2 4.07Å; F523-V526 HydrophobicContact CD1-CB 4.25Å; F523-V526 HydrophobicContact CD1-CG1 4.41Å; F523-V526 HydrophobicContact CD1-CG2 3.89Å; F523-V526 HydrophobicContact CG-CG2 4.39Å; K524-V526 VanDerWaalsContact C-N 3.27Å; K524-V526 PolarHBondContact O-N 3.41Å; V526-L539 HydrophobicContact CG1-CD1 4.18Å; V526-G541 PolarHBondContact O-N 2.89Å; V526-G541 VanDerWaalsContact O-N 3.11Å; V526-V542 HydrophobicContact CB-CB 4.45Å; V526-V542 PolarHBondContact N-O 3.06Å; V526-V542 PolarHBondContact O-N 2.9Å; V526-L568 HydrophobicContact CG1-CD1 3.68Å; V526-P575 HydrophobicContact CG1-CB 4.03Å; V526-G577 WeakPolarHBondContact CA-O 3.25Å; V526-Q579 WeakPolarHBondContact CG2-O 3.41Å; V526-V580 HydrophobicContact CG2-CG2 3.98Å
527	T	95.4	Very high	92.4	Very high	36 Å²	36	57.8 Å²	57.8	22%	0.221	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	132.5	175.3	-58.8	0	0	0	0	109.6	D525 L539 G541 Q576 G577	D525-T527 PolarHBondContact O-N 3.4Å; T527-L539 VanDerWaalsContact CA-O 3.32Å; T527-L539 WeakPolarHBondContact CA-O 3.38Å; T527-L539 WeakPolarHBondContact CG2-O 3.03Å; T527-G541 PolarHBondContact OG1-N 3.42Å; T527-G541 VanDerWaalsContact OG1-N 3.09Å; T527-Q576 PolarHBondContact O-N 3.07Å; T527-G577 PolarHBondContact N-O 2.64Å; T527-G577 PolarHBondContact O-N 3.39Å
528	F	95.4	Very high	92.6	Very high	3 Å²	3	58.8 Å²	58.8	1%	0.013	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157	136.1	-171.6	176.2	-106.7	0	0	0	113.4	Y530 V538 L539 L568 Y573 L574	F528-Y530 HydrophobicContact CE1-CD1 4.11Å; F528-Y530 AromaticContact CE1-CD2 3.96Å; F528-Y530 HydrophobicContact CE1-CD2 3.96Å; F528-Y530 HydrophobicContact CE1-CE1 4Å; F528-Y530 AromaticContact CE1-CE2 3.85Å; F528-Y530 HydrophobicContact CE1-CE2 3.85Å; F528-Y530 HydrophobicContact CE1-CG 4.08Å; F528-Y530 AromaticContact CE1-CZ 3.86Å; F528-Y530 HydrophobicContact CZ-CD1 4.01Å; F528-Y530 HydrophobicContact CZ-CE1 4.15Å; F528-Y530 HydrophobicContact CZ-CG 4.22Å; F528-V538 WeakPolarHBondContact O-CA 3.35Å; F528-V538 PolarHBondContact O-N 2.86Å; F528-L539 HydrophobicContact CB-CB 4.21Å; F528-L539 HydrophobicContact CB-CD1 4.27Å; F528-L539 HydrophobicContact CB-CG 4.38Å; F528-L539 PolarHBondContact N-O 3.24Å; F528-L539 PolarHBondContact O-N 3.46Å; F528-L568 HydrophobicContact CB-CD1 4Å; F528-L568 HydrophobicContact CD1-CD1 4.36Å; F528-L568 HydrophobicContact CD2-CD2 3.87Å; F528-L568 HydrophobicContact CE2-CD2 4.07Å; F528-L568 HydrophobicContact CG-CD1 4.05Å; F528-L568 HydrophobicContact CG-CD2 4.18Å; F528-L568 HydrophobicContact CG-CG 4.47Å; F528-Y573 HydrophobicContact CE2-CG 4.13Å; F528-Y573 HydrophobicContact CZ-CD1 4.1Å; F528-Y573 HydrophobicContact CZ-CD2 4.23Å; F528-Y573 AromaticContact CZ-CG 3.78Å; F528-Y573 HydrophobicContact CZ-CG 3.78Å; F528-L574 WeakPolarHBondContact CD2-O 3.43Å
529	A	93.6	Very high	92.9	Very high	5 Å²	5	54.3 Å²	54.3	4%	0.041	28%	0.277	C	S	.	.			trans	-127.9	147.4	166.1	0	0	0	0	0	109.6	T536	A529-T536 VanDerWaalsContact CB-O 3.31Å; A529-T536 WeakPolarHBondContact CB-O 3.4Å
530	Y	92.5	Very high	93.1	Very high	54 Å²	54	58.5 Å²	58.5	21%	0.212	30%	0.295	C	S	.	.			trans	-70.1	143.4	176	-75.3	-87	0	0	0	110.9	F528 T532 R533 V538 S564 Y573	F528-Y530 HydrophobicContact CE1-CD1 4.11Å; F528-Y530 AromaticContact CE1-CD2 3.96Å; F528-Y530 HydrophobicContact CE1-CD2 3.96Å; F528-Y530 HydrophobicContact CE1-CE1 4Å; F528-Y530 AromaticContact CE1-CE2 3.85Å; F528-Y530 HydrophobicContact CE1-CE2 3.85Å; F528-Y530 HydrophobicContact CE1-CG 4.08Å; F528-Y530 AromaticContact CE1-CZ 3.86Å; F528-Y530 HydrophobicContact CZ-CD1 4.01Å; F528-Y530 HydrophobicContact CZ-CE1 4.15Å; F528-Y530 HydrophobicContact CZ-CG 4.22Å; Y530-T532 PolarHBondContact O-N 2.91Å; Y530-T532 VanDerWaalsContact O-N 3.12Å; Y530-R533 CarbonylContact O-C 3.53Å; Y530-R533 WeakPolarHBondContact O-CA 3.37Å; Y530-R533 PolarHBondContact O-N 3.36Å; Y530-V538 HydrophobicContact CD2-CG2 3.97Å; Y530-V538 HydrophobicContact CE2-CG2 4.23Å; Y530-S564 WeakPolarHBondContact CE2-OG 3.46Å; Y530-S564 PolarHBondContact OH-OG 2.96Å; Y530-Y573 AromaticContact CD1-CE1 3.9Å; Y530-Y573 HydrophobicContact CD1-CE1 3.9Å; Y530-Y573 HydrophobicContact CD1-CE2 4.48Å; Y530-Y573 AromaticContact CD1-CZ 3.88Å; Y530-Y573 HydrophobicContact CE1-CE1 4.12Å; Y530-Y573 AromaticContact CE1-CE2 3.88Å; Y530-Y573 HydrophobicContact CE1-CE2 3.88Å; Y530-Y573 AromaticContact CE1-CZ 3.63Å
531	P	88.7	Confident	93	Very high	61 Å²	61	57.4 Å²	57.4	40%	0.396	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.9	-28.8	177.9	-29.8	38.7	0	0	0	114.7	A292 E296 R533	A292-P531 HydrophobicContact CB-CB 4.39Å; A292-P531 HydrophobicContact CB-CG 3.85Å; E296-P531 WeakPolarHBondContact OE1-CB 3.12Å; P531-R533 VanDerWaalsContact C-N 3.28Å; P531-R533 PolarHBondContact O-N 3.4Å
532	T	86.7	Confident	92.9	Very high	77 Å²	77	57.4 Å²	57.4	47%	0.472	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74	-14.3	174.9	53.7	0	0	0	0	113.9	D295 E296 Y530	D295-T532 HydrophobicContact CB-CG2 4.36Å; E296-T532 HydrophobicContact CG-CG2 4.02Å; Y530-T532 PolarHBondContact O-N 2.91Å; Y530-T532 VanDerWaalsContact O-N 3.12Å
533	R	89.1	Confident	92.8	Very high	187 Å²	187	58.6 Å²	58.6	71%	0.706	31%	0.308	S	S	*	.			trans	-144.9	64.2	179.9	-63.5	-172.7	-178.3	175.1	1.7	111.2	Y530 P531 E535 T536	Y530-R533 CarbonylContact O-C 3.53Å; Y530-R533 WeakPolarHBondContact O-CA 3.37Å; Y530-R533 PolarHBondContact O-N 3.36Å; P531-R533 VanDerWaalsContact C-N 3.28Å; P531-R533 PolarHBondContact O-N 3.4Å; R533-E535 PolarHBondContact O-N 3.49Å; R533-T536 PolarHBondContact O-N 3.41Å
534	P	87.3	Confident	92.8	Very high	66 Å²	66	58.7 Å²	58.7	43%	0.429	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.6	-23	-171.9	28.4	-35.7	0	0	0	113.6	T536	P534-T536 PolarHBondContact O-N 2.91Å
535	E	88.4	Confident	92.7	Very high	175 Å²	175	55.8 Å²	55.8	82%	0.818	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.4	2.5	179.1	-54.9	-62.2	155.6	0	0	113.8	R533	R533-E535 PolarHBondContact O-N 3.49Å
536	T	89.1	Confident	92.7	Very high	84 Å²	84	50.8 Å²	50.8	52%	0.515	27%	0.272	S	S	.	.	S	Bend	trans	-132.5	95.3	-175.5	-56.8	0	0	0	0	111.6	A529 R533 P534 V538	A529-T536 VanDerWaalsContact CB-O 3.31Å; A529-T536 WeakPolarHBondContact CB-O 3.4Å; R533-T536 PolarHBondContact O-N 3.41Å; P534-T536 PolarHBondContact O-N 2.91Å; T536-V538 PolarHBondContact O-N 3.31Å; T536-V538 VanDerWaalsContact O-N 3.12Å
537	D	90.2	Very high	92.6	Very high	73 Å²	73	56.7 Å²	56.7	39%	0.39	29%	0.294	S	S	.	.			trans	-58.8	112.8	170.5	-58.8	-25	0	0	0	110.5	K540	D537-K540 HydrophobicContact CB-CD 4.38Å; D537-K540 HydrophobicContact CB-CG 3.81Å; D537-K540 VanDerWaalsContact O-CE 3.23Å; D537-K540 WeakPolarHBondContact O-CE 3.42Å
538	V	93.9	Very high	92.4	Very high	33 Å²	33	58.1 Å²	58.1	20%	0.2	30%	0.304	C	S	.	.	S	Bend	trans	-83.9	-36.4	176.2	179.6	0	0	0	0	110.8	F528 Y530 T536 G733	F528-V538 WeakPolarHBondContact O-CA 3.35Å; F528-V538 PolarHBondContact O-N 2.86Å; Y530-V538 HydrophobicContact CD2-CG2 3.97Å; Y530-V538 HydrophobicContact CE2-CG2 4.23Å; T536-V538 PolarHBondContact O-N 3.31Å; T536-V538 VanDerWaalsContact O-N 3.12Å; V538-G733 WeakPolarHBondContact O-CA 3.28Å
539	L	95.1	Very high	92	Very high	0 Å²	0	59.5 Å²	59.5	0%	0	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	140.4	172	-54	180	0	0	0	109.4	V526 T527 F528 V542 L568	V526-L539 HydrophobicContact CG1-CD1 4.18Å; T527-L539 VanDerWaalsContact CA-O 3.32Å; T527-L539 WeakPolarHBondContact CA-O 3.38Å; T527-L539 WeakPolarHBondContact CG2-O 3.03Å; F528-L539 HydrophobicContact CB-CB 4.21Å; F528-L539 HydrophobicContact CB-CD1 4.27Å; F528-L539 HydrophobicContact CB-CG 4.38Å; F528-L539 PolarHBondContact N-O 3.24Å; F528-L539 PolarHBondContact O-N 3.46Å; L539-V542 HydrophobicContact CB-CG2 3.97Å; L539-V542 HydrophobicContact CD2-CG2 4.15Å; L539-L568 HydrophobicContact CD1-CD1 3.6Å
540	K	94.8	Very high	91.9	Very high	89 Å²	89	62.2 Å²	62.2	39%	0.387	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	87.3	-171.2	-65.6	170.9	-177.5	163	0	110.5	D537 G733 Q734	D537-K540 HydrophobicContact CB-CD 4.38Å; D537-K540 HydrophobicContact CB-CG 3.81Å; D537-K540 VanDerWaalsContact O-CE 3.23Å; D537-K540 WeakPolarHBondContact O-CE 3.42Å; K540-G733 PolarHBondContact N-O 2.83Å; K540-Q734 HydrophobicContact CB-CG 3.94Å
541	G	93.6	Very high	91.8	Very high	25 Å²	25	60.3 Å²	60.3	26%	0.258	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	67.3	32.7	-179.5	0	0	0	0	0	114.8	D525 V526 T527 S543	D525-G541 WeakPolarHBondContact OD1-CA 3.43Å; V526-G541 PolarHBondContact O-N 2.89Å; V526-G541 VanDerWaalsContact O-N 3.11Å; T527-G541 PolarHBondContact OG1-N 3.42Å; T527-G541 VanDerWaalsContact OG1-N 3.09Å; G541-S543 PolarHBondContact O-N 3.3Å; G541-S543 PolarHBondContact O-OG 2.85Å
542	V	94.8	Very high	92	Very high	1 Å²	1	57.4 Å²	57.4	1%	0.006	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	123.1	-175.9	172.6	0	0	0	0	110.9	D525 V526 L539 F544 G733 V735	D525-V542 PolarHBondContact N-O 3.37Å; V526-V542 HydrophobicContact CB-CB 4.45Å; V526-V542 PolarHBondContact N-O 3.06Å; V526-V542 PolarHBondContact O-N 2.9Å; L539-V542 HydrophobicContact CB-CG2 3.97Å; L539-V542 HydrophobicContact CD2-CG2 4.15Å; V542-F544 HydrophobicContact CG1-CD1 3.64Å; V542-F544 HydrophobicContact CG1-CE1 3.53Å; V542-G733 WeakPolarHBondContact CG2-O 3.21Å; V542-V735 HydrophobicContact CG1-CG2 4.02Å
543	S	95.9	Very high	92.3	Very high	63 Å²	63	53.7 Å²	53.7	44%	0.441	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	121.6	-179.3	-59.1	0	0	0	0	112	F523 D525 G541	F523-S543 VanDerWaalsContact O-CA 3.25Å; F523-S543 WeakPolarHBondContact O-CA 3.48Å; D525-S543 WeakPolarHBondContact CA-OG 3.49Å; D525-S543 PolarHBondContact N-OG 3.31Å; G541-S543 PolarHBondContact O-N 3.3Å; G541-S543 PolarHBondContact O-OG 2.85Å
544	F	95.5	Very high	92.5	Very high	6 Å²	6	44.8 Å²	44.8	3%	0.026	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-162.4	172	174.4	62.5	-98.5	0	0	0	112.2	F523 V542 L546 C565 I728 V735	F523-F544 HydrophobicContact CB-CD1 4.11Å; F523-F544 HydrophobicContact CB-CE1 4.1Å; F523-F544 HydrophobicContact CB-CG 4.34Å; F523-F544 HydrophobicContact CB-CZ 4.3Å; F523-F544 HydrophobicContact CD1-CE1 4.08Å; F523-F544 HydrophobicContact CD1-CZ 4.01Å; F523-F544 HydrophobicContact CD2-CD2 4.02Å; F523-F544 HydrophobicContact CD2-CE1 4.03Å; F523-F544 AromaticContact CD2-CE2 3.35Å; F523-F544 HydrophobicContact CD2-CE2 3.35Å; F523-F544 AromaticContact CD2-CZ 3.36Å; F523-F544 HydrophobicContact CD2-CZ 3.36Å; F523-F544 HydrophobicContact CE1-CZ 4.2Å; F523-F544 AromaticContact CE2-CE2 3.69Å; F523-F544 HydrophobicContact CE2-CE2 3.69Å; F523-F544 AromaticContact CE2-CZ 3.58Å; F523-F544 HydrophobicContact CE2-CZ 3.58Å; F523-F544 HydrophobicContact CG-CD1 4.3Å; F523-F544 HydrophobicContact CG-CD2 4.48Å; F523-F544 AromaticContact CG-CE1 3.8Å; F523-F544 HydrophobicContact CG-CE1 3.8Å; F523-F544 AromaticContact CG-CE2 3.99Å; F523-F544 HydrophobicContact CG-CE2 3.99Å; F523-F544 AromaticContact CG-CZ 3.62Å; F523-F544 HydrophobicContact CG-CZ 3.62Å; F523-F544 HydrophobicContact CZ-CZ 4.01Å; F523-F544 PolarHBondContact N-O 3.48Å; F523-F544 PolarHBondContact O-N 3.2Å; V542-F544 HydrophobicContact CG1-CD1 3.64Å; V542-F544 HydrophobicContact CG1-CE1 3.53Å; F544-L546 HydrophobicContact CD2-CD2 3.89Å; F544-L546 HydrophobicContact CD2-CG 4.4Å; F544-L546 HydrophobicContact CE2-CD2 3.76Å; F544-L546 HydrophobicContact CE2-CG 4.16Å; F544-C565 HydrophobicContact CZ-CB 4.41Å; F544-I728 HydrophobicContact CB-CD1 3.64Å; F544-I728 HydrophobicContact CD1-CD1 4.37Å; F544-I728 HydrophobicContact CD1-CG2 4.49Å; F544-I728 HydrophobicContact CD2-CD1 3.55Å; F544-I728 HydrophobicContact CE2-CD1 4.28Å; F544-I728 HydrophobicContact CG-CD1 3.61Å; F544-V735 HydrophobicContact CD1-CG2 4.33Å
545	T	95.6	Very high	92.6	Very high	29 Å²	29	42.4 Å²	42.4	18%	0.178	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	134.7	-178.6	-48.6	0	0	0	0	110.2	L520 V521 E522 R547	L520-T545 HydrophobicContact CD1-CG2 3.72Å; V521-T545 CarbonylContact O-C 3.41Å; V521-T545 WeakPolarHBondContact O-CA 3.33Å; E522-T545 HydrophobicContact CG-CG2 4.09Å; T545-R547 HydrophobicContact CG2-CG 4.29Å
546	L	95.3	Very high	92.7	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	124.1	167.8	-40.8	177.7	0	0	0	107.7	V521 F544 T552 L569 T710 L712	V521-L546 HydrophobicContact CB-CB 4.06Å; V521-L546 HydrophobicContact CB-CD1 3.95Å; V521-L546 HydrophobicContact CB-CG 4.08Å; V521-L546 HydrophobicContact CG1-CD1 4.08Å; V521-L546 HydrophobicContact CG1-CG 4.39Å; V521-L546 HydrophobicContact CG2-CD1 4.41Å; V521-L546 PolarHBondContact N-O 3.27Å; V521-L546 PolarHBondContact O-N 3.18Å; F544-L546 HydrophobicContact CD2-CD2 3.89Å; F544-L546 HydrophobicContact CD2-CG 4.4Å; F544-L546 HydrophobicContact CE2-CD2 3.76Å; F544-L546 HydrophobicContact CE2-CG 4.16Å; L546-T552 HydrophobicContact CD2-CG2 3.49Å; L546-T552 VanDerWaalsContact CD2-CG2 3.49Å; L546-L569 HydrophobicContact CD1-CD2 4.38Å; L546-T710 HydrophobicContact CB-CG2 3.57Å; L546-L712 HydrophobicContact CD1-CB 3.99Å; L546-L712 HydrophobicContact CD1-CD1 4.21Å; L546-L712 HydrophobicContact CD1-CD2 4.21Å; L546-L712 HydrophobicContact CD1-CG 4.37Å; L546-L712 HydrophobicContact CD2-CD1 4.05Å
547	R	93.3	Very high	92.5	Very high	123 Å²	123	32.7 Å²	32.7	46%	0.464	19%	0.189	S	C	.	.			trans	-99.9	149.1	-174.5	-61.6	177.6	-179.7	-85	3.9	111.5	T545 G549 E550	T545-R547 HydrophobicContact CG2-CG 4.29Å; R547-G549 PolarHBondContact O-N 3.47Å; R547-E550 HydrophobicContact CB-CB 4.28Å; R547-E550 HydrophobicContact CB-CG 4.1Å; R547-E550 WeakPolarHBondContact CD-OE1 3.3Å; R547-E550 WeakPolarHBondContact CD-OE2 3.44Å; R547-E550 PolarHBondContact O-N 3.34Å
548	P	91.8	Very high	92.2	Very high	67 Å²	67	34.2 Å²	34.2	44%	0.435	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.9	129	172.9	-25.8	36	0	0	0	112.7	T518 L520 E550 T710	T518-P548 WeakPolarHBondContact O-CB 3.43Å; T518-P548 VanDerWaalsContact O-CG 3.29Å; T518-P548 WeakPolarHBondContact O-CG 3.45Å; L520-P548 HydrophobicContact CB-CG 4.3Å; P548-E550 VanDerWaalsContact C-N 3.27Å; P548-E550 PolarHBondContact O-N 3.17Å; P548-T710 WeakPolarHBondContact CA-OG1 3.4Å
549	G	87.6	Confident	91.7	Very high	32 Å²	32	36.4 Å²	36.4	33%	0.33	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	76.6	4	179.5	0	0	0	0	0	115.4	R547 H709	R547-G549 PolarHBondContact O-N 3.47Å; G549-H709 WeakPolarHBondContact CA-O 3.41Å; G549-H709 PolarHBondContact N-O 3.46Å
550	E	90.3	Very high	91.3	Very high	61 Å²	61	36.6 Å²	36.6	29%	0.285	24%	0.235	S	C	.	.			trans	-102.6	140.9	173.6	-71.4	-179.7	-167.4	0	0	111.6	R547 P548 V711 D725	R547-E550 HydrophobicContact CB-CB 4.28Å; R547-E550 HydrophobicContact CB-CG 4.1Å; R547-E550 WeakPolarHBondContact CD-OE1 3.3Å; R547-E550 WeakPolarHBondContact CD-OE2 3.44Å; R547-E550 PolarHBondContact O-N 3.34Å; P548-E550 VanDerWaalsContact C-N 3.27Å; P548-E550 PolarHBondContact O-N 3.17Å; E550-V711 PolarHBondContact O-N 3.14Å; E550-D725 HydrophobicContact CB-CB 4.38Å; E550-D725 HydrophobicContact CG-CB 4.44Å
551	V	91	Very high	91.1	Very high	14 Å²	14	32.6 Å²	32.6	9%	0.085	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	113.2	168.7	-177.5	0	0	0	0	109.1	M706 V713 A724 D725 N726	V551-M706 HydrophobicContact CB-CE 4.33Å; V551-M706 HydrophobicContact CG1-CE 3.57Å; V551-M706 HydrophobicContact CG2-CB 3.82Å; V551-M706 HydrophobicContact CG2-CE 3.73Å; V551-M706 HydrophobicContact CG2-CG 4.23Å; V551-M706 HydrophobicContact CG2-SD 4.32Å; V551-V713 HydrophobicContact CG1-CG2 4.07Å; V551-A724 HydrophobicContact CG1-CB 4.13Å; V551-D725 WeakPolarHBondContact CB-OD2 3.26Å; V551-D725 PolarHBondContact N-OD2 3.32Å; V551-D725 PolarHBondContact O-N 3.3Å; V551-N726 PolarHBondContact O-N 3.05Å
552	T	93.2	Very high	91	Very high	0 Å²	0	32 Å²	32	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	121.1	173.7	-67.1	0	0	0	0	111.6	L546 V711 V713 N726 I728	L546-T552 HydrophobicContact CD2-CG2 3.49Å; L546-T552 VanDerWaalsContact CD2-CG2 3.49Å; T552-V711 PolarHBondContact N-O 3.39Å; T552-V713 PolarHBondContact O-N 3.38Å; T552-N726 CarbonylContact C-O 3.55Å; T552-N726 WeakPolarHBondContact CA-O 3.34Å; T552-N726 WeakPolarHBondContact CG2-ND2 3.45Å; T552-N726 PolarHBondContact OG1-ND2 3Å; T552-I728 HydrophobicContact CG2-CD1 3.51Å; T552-I728 HydrophobicContact CG2-CG1 3.98Å
553	A	92.3	Very high	90.8	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	130.8	174.8	0	0	0	0	0	111.7	V555 V713 V721 A724 N726 I727 I728	A553-V555 HydrophobicContact CB-CG2 4.37Å; A553-V713 CarbonylContact C-O 3.53Å; A553-V713 WeakPolarHBondContact CA-O 2.94Å; A553-V721 HydrophobicContact CB-CG1 4.27Å; A553-A724 HydrophobicContact CB-CB 3.57Å; A553-N726 PolarHBondContact N-O 2.86Å; A553-I727 HydrophobicContact CB-CG1 4.37Å; A553-I727 WeakPolarHBondContact O-CA 3.34Å; A553-I728 PolarHBondContact O-N 3.47Å
554	L	92.8	Very high	90.7	Very high	0 Å²	0	32 Å²	32	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	113.4	175.8	-160.9	64	0	0	0	109.8	K562 C565 L712 V713 I714 I728 I730	L554-K562 HydrophobicContact CD2-CB 4Å; L554-K562 HydrophobicContact CD2-CG 4.44Å; L554-K562 HydrophobicContact CG-CB 4.39Å; L554-K562 HydrophobicContact CG-CG 4.35Å; L554-C565 HydrophobicContact CD2-CB 4.18Å; L554-L712 HydrophobicContact CB-CD1 4.18Å; L554-V713 PolarHBondContact N-O 2.95Å; L554-I714 HydrophobicContact CB-CG1 4.29Å; L554-I714 HydrophobicContact CD2-CG1 4.36Å; L554-I728 HydrophobicContact CD1-CB 3.86Å; L554-I728 HydrophobicContact CD1-CG2 3.82Å; L554-I730 HydrophobicContact CD1-CD1 3.67Å; L554-I730 HydrophobicContact CD1-CG1 3.89Å; L554-I730 HydrophobicContact CD2-CD1 4.25Å; L554-I730 HydrophobicContact CG-CD1 4.22Å
555	V	90.9	Very high	90.6	Very high	16 Å²	16	31.8 Å²	31.8	10%	0.097	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	150.3	-169.2	-175.9	0	0	0	0	110	A553 V721 I727 I728 V729 I730 Y751 L754	A553-V555 HydrophobicContact CB-CG2 4.37Å; V555-V721 HydrophobicContact CG2-CG1 3.68Å; V555-V721 HydrophobicContact CG2-CG2 3.97Å; V555-I727 HydrophobicContact CB-CG2 4.39Å; V555-I727 HydrophobicContact CG2-CG2 3.84Å; V555-I728 PolarHBondContact N-O 3.06Å; V555-V729 CarbonylContact O-C 3.13Å; V555-V729 VanDerWaalsContact O-CA 3.31Å; V555-V729 WeakPolarHBondContact O-CA 3.26Å; V555-I730 PolarHBondContact O-N 3.44Å; V555-Y751 HydrophobicContact CG1-CD2 4.44Å; V555-Y751 HydrophobicContact CG1-CE2 4.47Å; V555-L754 HydrophobicContact CG1-CD1 4.17Å
556	G	89.2	Confident	90.6	Very high	7 Å²	7	30.6 Å²	30.6	7%	0.072	20%	0.202	C	C	.	.			trans	156.3	167	177.3	0	0	0	0	0	112.7	K562 I730	G556-K562 PolarHBondContact O-NZ 3.11Å; G556-I730 WeakPolarHBondContact CA-O 3.3Å
557	P	85.6	Confident	90.5	Very high	48 Å²	48	31.6 Å²	31.6	31%	0.312	21%	0.209	S	C	.	.	S	Bend	trans	-60.6	163	178.2	24.8	-32.4	0	0	0	112.7	G559 S560 K562	P557-G559 PolarHBondContact O-N 3.07Å; P557-S560 WeakPolarHBondContact O-CB 3.47Å; P557-S560 PolarHBondContact O-N 3.42Å; P557-S560 PolarHBondContact O-OG 2.76Å; P557-K562 PolarHBondContact O-NZ 3.36Å
558	S	84.6	Confident	90.6	Very high	105 Å²	105	25.8 Å²	25.8	73%	0.734	19%	0.187	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.9	137.7	172.7	-58.1	0	0	0	0	110.4	S560	S558-S560 VanDerWaalsContact C-N 3.33Å
559	G	82.9	Confident	90.8	Very high	79 Å²	79	22.6 Å²	22.6	81%	0.814	17%	0.167	S	C	*	.	T	Hydrogen-bonded Turn	trans	78.3	5	-175.3	0	0	0	0	0	115.7	P557 G561	P557-G559 PolarHBondContact O-N 3.07Å; G559-G561 VanDerWaalsContact C-N 3.25Å; G559-G561 PolarHBondContact O-N 3.44Å
560	S	87.3	Confident	91.1	Very high	3 Å²	3	21.4 Å²	21.4	2%	0.021	15%	0.152	C	C	.	.	S	Bend	trans	-72.9	-11.1	178.8	75	0	0	0	0	115.4	P557 S558 I730 G733	P557-S560 WeakPolarHBondContact O-CB 3.47Å; P557-S560 PolarHBondContact O-N 3.42Å; P557-S560 PolarHBondContact O-OG 2.76Å; S558-S560 VanDerWaalsContact C-N 3.33Å; S560-I730 WeakPolarHBondContact CB-O 3.46Å; S560-I730 WeakPolarHBondContact O-CG2 3.19Å; S560-I730 PolarHBondContact OG-O 3.11Å; S560-G733 WeakPolarHBondContact O-CA 3.44Å; S560-G733 PolarHBondContact O-N 2.95Å
561	G	89.3	Confident	91.2	Very high	6 Å²	6	19.4 Å²	19.4	6%	0.062	14%	0.143	C	C	.	.	S	Bend	trans	113.1	-0.3	177	0	0	0	0	0	116.1	G559 S563 S564 C565	G559-G561 VanDerWaalsContact C-N 3.25Å; G559-G561 PolarHBondContact O-N 3.44Å; G561-S563 PolarHBondContact O-N 3.17Å; G561-S564 WeakPolarHBondContact O-CA 3.43Å; G561-S564 VanDerWaalsContact O-CB 3.25Å; G561-S564 WeakPolarHBondContact O-CB 3.41Å; G561-S564 PolarHBondContact O-N 2.95Å; G561-C565 PolarHBondContact O-N 3.2Å; G561-C565 VanDerWaalsContact O-N 3.15Å
562	K	91.6	Very high	91.3	Very high	13 Å²	13	21.6 Å²	21.6	6%	0.057	15%	0.152	C	C	.	.	H	α-helix	trans	-48.4	-56.5	-174.5	-51.7	-168.3	-60.9	-82.9	0	114.2	L554 G556 P557 S564 C565 V566 I714 H716	L554-K562 HydrophobicContact CD2-CB 4Å; L554-K562 HydrophobicContact CD2-CG 4.44Å; L554-K562 HydrophobicContact CG-CB 4.39Å; L554-K562 HydrophobicContact CG-CG 4.35Å; G556-K562 PolarHBondContact O-NZ 3.11Å; P557-K562 PolarHBondContact O-NZ 3.36Å; K562-S564 PolarHBondContact O-N 2.94Å; K562-C565 WeakPolarHBondContact O-CB 3.48Å; K562-C565 PolarHBondContact O-N 3.34Å; K562-C565 VanDerWaalsContact O-N 3.16Å; K562-V566 PolarHBondContact O-N 3.41Å; K562-I714 HydrophobicContact CB-CD1 4.04Å; K562-I714 HydrophobicContact CB-CG1 4.39Å; K562-I714 HydrophobicContact CB-CG2 4.13Å; K562-I714 HydrophobicContact CD-CG2 4.05Å; K562-H716 VanDerWaalsContact CE-NE2 3.35Å; K562-H716 WeakPolarHBondContact CE-NE2 3.31Å; K562-H716 PolarHBondContact NZ-NE2 2.84Å
563	S	91.1	Very high	91.4	Very high	57 Å²	57	22.7 Å²	22.7	40%	0.399	16%	0.156	S	C	.	.	H	α-helix	trans	-69.1	-20.3	-179.9	-44.7	0	0	0	0	113	G561 V566 S567	G561-S563 PolarHBondContact O-N 3.17Å; S563-V566 PolarHBondContact O-N 3.09Å; S563-S567 PolarHBondContact O-N 3.36Å; S563-S567 PolarHBondContact O-OG 3.46Å
564	S	93.8	Very high	91.3	Very high	7 Å²	7	26.1 Å²	26.1	5%	0.049	17%	0.174	C	C	.	.	H	α-helix	trans	-72.3	-35.1	172.7	-48.7	0	0	0	0	111.4	Y530 G561 K562 V566 S567 L568	Y530-S564 WeakPolarHBondContact CE2-OG 3.46Å; Y530-S564 PolarHBondContact OH-OG 2.96Å; G561-S564 WeakPolarHBondContact O-CA 3.43Å; G561-S564 VanDerWaalsContact O-CB 3.25Å; G561-S564 WeakPolarHBondContact O-CB 3.41Å; G561-S564 PolarHBondContact O-N 2.95Å; K562-S564 PolarHBondContact O-N 2.94Å; S564-V566 VanDerWaalsContact C-N 3.32Å; S564-V566 PolarHBondContact O-N 2.95Å; S564-S567 PolarHBondContact O-N 3.06Å; S564-L568 WeakPolarHBondContact O-CG 3.38Å; S564-L568 PolarHBondContact O-N 2.9Å
565	C	94.4	Very high	91.3	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-60.2	-42.5	170	-60.2	0	0	0	0	111.5	F523 F544 L554 G561 K562 L568 L569	F523-C565 HydrophobicContact CE1-CB 3.99Å; F523-C565 HydrophobicContact CZ-CB 4.1Å; F523-C565 WeakPolarHBondContact CZ-O 2.87Å; F544-C565 HydrophobicContact CZ-CB 4.41Å; L554-C565 HydrophobicContact CD2-CB 4.18Å; G561-C565 PolarHBondContact O-N 3.2Å; G561-C565 VanDerWaalsContact O-N 3.15Å; K562-C565 WeakPolarHBondContact O-CB 3.48Å; K562-C565 PolarHBondContact O-N 3.34Å; K562-C565 VanDerWaalsContact O-N 3.16Å; C565-L568 PolarHBondContact O-N 3.43Å; C565-L569 WeakPolarHBondContact O-CB 3.45Å; C565-L569 PolarHBondContact O-N 2.94Å
566	V	94.1	Very high	91.3	Very high	5 Å²	5	32.4 Å²	32.4	3%	0.03	21%	0.206	C	C	.	.	H	α-helix	trans	-63	-45.3	174.7	167.9	0	0	0	0	111.5	K562 S563 S564 L568 L569 E570 L601 I682 L712 I714	K562-V566 PolarHBondContact O-N 3.41Å; S563-V566 PolarHBondContact O-N 3.09Å; S564-V566 VanDerWaalsContact C-N 3.32Å; S564-V566 PolarHBondContact O-N 2.95Å; V566-L568 VanDerWaalsContact C-N 3.26Å; V566-L568 PolarHBondContact O-N 2.84Å; V566-L569 PolarHBondContact O-N 3.22Å; V566-L569 VanDerWaalsContact O-N 3.13Å; V566-E570 PolarHBondContact O-N 2.92Å; V566-L601 HydrophobicContact CG1-CD1 3.79Å; V566-L601 HydrophobicContact CG1-CD2 4.08Å; V566-I682 HydrophobicContact CB-CG2 4.37Å; V566-I682 HydrophobicContact CG1-CD1 4.17Å; V566-I682 HydrophobicContact CG1-CG2 3.9Å; V566-I682 HydrophobicContact CG2-CG2 3.55Å; V566-L712 HydrophobicContact CG2-CD2 3.93Å; V566-I714 HydrophobicContact CG2-CD1 3.55Å; V566-I714 HydrophobicContact CG2-CG1 4.31Å
567	S	94.4	Very high	91.5	Very high	21 Å²	21	33.3 Å²	33.3	15%	0.147	22%	0.215	C	C	.	.	H	α-helix	trans	-61.1	-33.6	178.5	-54.3	0	0	0	0	113.1	S563 S564 F572	S563-S567 PolarHBondContact O-N 3.36Å; S563-S567 PolarHBondContact O-OG 3.46Å; S564-S567 PolarHBondContact O-N 3.06Å; S567-F572 WeakPolarHBondContact O-CB 3.5Å; S567-F572 PolarHBondContact O-N 2.69Å
568	L	94.8	Very high	91.9	Very high	1 Å²	1	32.8 Å²	32.8	1%	0.005	22%	0.219	C	C	.	.	H	α-helix	trans	-76.3	-35.5	174.4	-68.1	173.1	0	0	0	112.4	F523 V526 F528 L539 S564 C565 V566 N571 Y573 P575 V580	F523-L568 HydrophobicContact CE1-CB 4.49Å; V526-L568 HydrophobicContact CG1-CD1 3.68Å; F528-L568 HydrophobicContact CB-CD1 4Å; F528-L568 HydrophobicContact CD1-CD1 4.36Å; F528-L568 HydrophobicContact CD2-CD2 3.87Å; F528-L568 HydrophobicContact CE2-CD2 4.07Å; F528-L568 HydrophobicContact CG-CD1 4.05Å; F528-L568 HydrophobicContact CG-CD2 4.18Å; F528-L568 HydrophobicContact CG-CG 4.47Å; L539-L568 HydrophobicContact CD1-CD1 3.6Å; S564-L568 WeakPolarHBondContact O-CG 3.38Å; S564-L568 PolarHBondContact O-N 2.9Å; C565-L568 PolarHBondContact O-N 3.43Å; V566-L568 VanDerWaalsContact C-N 3.26Å; V566-L568 PolarHBondContact O-N 2.84Å; L568-N571 WeakPolarHBondContact O-CA 3.49Å; L568-N571 PolarHBondContact O-N 3.47Å; L568-Y573 WeakPolarHBondContact CD2-O 3.37Å; L568-P575 HydrophobicContact CD2-CB 4.48Å; L568-V580 HydrophobicContact CB-CG2 4.13Å
569	L	95.1	Very high	92.4	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-68.2	-38	176.7	-179.2	53.1	0	0	0	112.4	V521 F523 L546 C565 V566 N571 V580 V587 I599 V680 I682 L712	V521-L569 HydrophobicContact CB-CD1 4.5Å; V521-L569 HydrophobicContact CG1-CD1 3.55Å; V521-L569 HydrophobicContact CG1-CD2 4.21Å; V521-L569 HydrophobicContact CG2-CD1 4.07Å; F523-L569 HydrophobicContact CZ-CB 4.22Å; L546-L569 HydrophobicContact CD1-CD2 4.38Å; C565-L569 WeakPolarHBondContact O-CB 3.45Å; C565-L569 PolarHBondContact O-N 2.94Å; V566-L569 PolarHBondContact O-N 3.22Å; V566-L569 VanDerWaalsContact O-N 3.13Å; L569-N571 PolarHBondContact O-N 3.28Å; L569-V580 HydrophobicContact CD1-CG1 4.18Å; L569-V587 HydrophobicContact CD1-CG1 4.38Å; L569-I599 HydrophobicContact CD1-CD1 3.91Å; L569-I599 HydrophobicContact CG-CD1 4.17Å; L569-V680 HydrophobicContact CD2-CG1 4.42Å; L569-I682 HydrophobicContact CB-CD1 4.47Å; L569-I682 HydrophobicContact CD2-CD1 3.72Å; L569-I682 HydrophobicContact CD2-CG1 4.31Å; L569-I682 HydrophobicContact CG-CD1 4.07Å; L569-L712 HydrophobicContact CD2-CD2 4.18Å
570	E	93.9	Very high	93	Very high	7 Å²	7	29.3 Å²	29.3	3%	0.033	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.2	4.9	169.3	-67.7	-74.7	163.7	0	0	112.7	V566 F572 H596 I599 L601 I682	V566-E570 PolarHBondContact O-N 2.92Å; E570-F572 HydrophobicContact CB-CD1 3.8Å; E570-F572 HydrophobicContact CB-CD2 3.92Å; E570-F572 HydrophobicContact CB-CE1 3.66Å; E570-F572 HydrophobicContact CB-CE2 3.76Å; E570-F572 HydrophobicContact CB-CG 3.95Å; E570-F572 HydrophobicContact CB-CZ 3.64Å; E570-F572 HydrophobicContact CG-CE2 4.18Å; E570-F572 HydrophobicContact CG-CZ 4.08Å; E570-F572 WeakPolarHBondContact O-CD1 3.38Å; E570-F572 PolarHBondContact O-N 3.46Å; E570-F572 VanDerWaalsContact O-N 3.07Å; E570-H596 PolarHBondContact O-CE1 3.23Å; E570-H596 IonicContact OE2-CE1 3.14Å; E570-H596 PolarHBondContact OE2-CE1 3.38Å; E570-H596 IonicContact OE2-ND1 2.76Å; E570-H596 PolarHBondContact OE2-ND1 3.35Å; E570-I599 VanDerWaalsContact OE1-CG2 3.26Å; E570-I599 WeakPolarHBondContact OE1-CG2 3.18Å; E570-L601 HydrophobicContact CG-CD2 4.46Å; E570-L601 WeakPolarHBondContact OE1-CB 3.36Å; E570-I682 HydrophobicContact CG-CD1 4.22Å
571	N	93.9	Very high	93.4	Very high	18 Å²	18	29.5 Å²	29.5	10%	0.096	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	55.2	26.4	179.4	-171.8	34.4	0	0	0	113.9	H506 L568 L569 Y573 V587 L595	H506-N571 PolarHBondContact CD2-O 3.34Å; H506-N571 PolarHBondContact CE1-OD1 3.09Å; H506-N571 VanDerWaalsContact CE1-OD1 3.32Å; H506-N571 PolarHBondContact NE2-O 3.33Å; H506-N571 PolarHBondContact NE2-OD1 3.29Å; L568-N571 WeakPolarHBondContact O-CA 3.49Å; L568-N571 PolarHBondContact O-N 3.47Å; L569-N571 PolarHBondContact O-N 3.28Å; N571-Y573 VanDerWaalsContact C-N 3.28Å; N571-Y573 PolarHBondContact O-N 2.87Å; N571-V587 HydrophobicContact CB-CB 4.4Å; N571-V587 HydrophobicContact CB-CG2 4.17Å; N571-L595 HydrophobicContact CB-CD2 3.64Å
572	F	93.2	Very high	93.7	Very high	61 Å²	61	29.2 Å²	29.2	27%	0.268	17%	0.168	S	C	.	.	S	Bend	trans	-71.5	-25.7	177.8	-63.2	-19	0	0	0	112.4	I291 S567 E570 H596	I291-F572 HydrophobicContact CB-CB 4.45Å; I291-F572 HydrophobicContact CD1-CB 3.61Å; I291-F572 HydrophobicContact CD1-CD1 3.31Å; I291-F572 HydrophobicContact CD1-CD2 3.7Å; I291-F572 HydrophobicContact CD1-CE1 3.75Å; I291-F572 HydrophobicContact CD1-CE2 4.12Å; I291-F572 HydrophobicContact CD1-CG 3.26Å; I291-F572 HydrophobicContact CD1-CZ 4.14Å; S567-F572 WeakPolarHBondContact O-CB 3.5Å; S567-F572 PolarHBondContact O-N 2.69Å; E570-F572 HydrophobicContact CB-CD1 3.8Å; E570-F572 HydrophobicContact CB-CD2 3.92Å; E570-F572 HydrophobicContact CB-CE1 3.66Å; E570-F572 HydrophobicContact CB-CE2 3.76Å; E570-F572 HydrophobicContact CB-CG 3.95Å; E570-F572 HydrophobicContact CB-CZ 3.64Å; E570-F572 HydrophobicContact CG-CE2 4.18Å; E570-F572 HydrophobicContact CG-CZ 4.08Å; E570-F572 WeakPolarHBondContact O-CD1 3.38Å; E570-F572 PolarHBondContact O-N 3.46Å; E570-F572 VanDerWaalsContact O-N 3.07Å; F572-H596 AromaticContact CE1-CE1 3.71Å
573	Y	93.5	Very high	93.8	Very high	22 Å²	22	31 Å²	31	9%	0.086	18%	0.178	C	C	.	.	S	Bend	trans	-137.5	158.8	172.7	-47.5	-99	0	0	0	109.5	A292 D295 F528 Y530 L568 N571	A292-Y573 HydrophobicContact CB-CD1 4.17Å; A292-Y573 HydrophobicContact CB-CE1 3.99Å; D295-Y573 PolarHBondContact OD2-OH 2.87Å; F528-Y573 HydrophobicContact CE2-CG 4.13Å; F528-Y573 HydrophobicContact CZ-CD1 4.1Å; F528-Y573 HydrophobicContact CZ-CD2 4.23Å; F528-Y573 AromaticContact CZ-CG 3.78Å; F528-Y573 HydrophobicContact CZ-CG 3.78Å; Y530-Y573 AromaticContact CD1-CE1 3.9Å; Y530-Y573 HydrophobicContact CD1-CE1 3.9Å; Y530-Y573 HydrophobicContact CD1-CE2 4.48Å; Y530-Y573 AromaticContact CD1-CZ 3.88Å; Y530-Y573 HydrophobicContact CE1-CE1 4.12Å; Y530-Y573 AromaticContact CE1-CE2 3.88Å; Y530-Y573 HydrophobicContact CE1-CE2 3.88Å; Y530-Y573 AromaticContact CE1-CZ 3.63Å; L568-Y573 WeakPolarHBondContact CD2-O 3.37Å; N571-Y573 VanDerWaalsContact C-N 3.28Å; N571-Y573 PolarHBondContact O-N 2.87Å
574	L	91.4	Very high	93.8	Very high	73 Å²	73	30.4 Å²	30.4	38%	0.382	18%	0.18	S	C	.	.			trans	-92.1	142.8	169.9	-69.8	173.3	0	0	0	110.7	H506 F528 N588	H506-L574 VanDerWaalsContact CE1-CD2 3.44Å; H506-L574 WeakPolarHBondContact CE1-CD2 3.48Å; F528-L574 WeakPolarHBondContact CD2-O 3.43Å; L574-N588 HydrophobicContact CD2-CB 3.71Å
575	P	92.7	Very high	93.8	Very high	35 Å²	35	33.6 Å²	33.6	23%	0.227	19%	0.193	C	C	.	.			trans	-67.8	148.6	168	31.8	-35	0	0	0	110.6	V526 L568	V526-P575 HydrophobicContact CG1-CB 4.03Å; L568-P575 HydrophobicContact CD2-CB 4.48Å
576	Q	91.6	Very high	93.8	Very high	112 Å²	112	34.3 Å²	34.3	52%	0.523	20%	0.198	S	C	.	.	S	Bend	trans	-80.2	-29.8	175.5	-68.2	167.3	-49	0	0	111.9	T527	T527-Q576 PolarHBondContact O-N 3.07Å
577	G	91.6	Very high	93.8	Very high	27 Å²	27	34.4 Å²	34.4	28%	0.278	20%	0.199	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	156.5	174.2	0	0	0	0	0	110.4	V526 T527	V526-G577 WeakPolarHBondContact CA-O 3.25Å; T527-G577 PolarHBondContact N-O 2.64Å; T527-G577 PolarHBondContact O-N 3.39Å
578	G	94	Very high	93.6	Very high	37 Å²	37	36.8 Å²	36.8	38%	0.381	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	72.4	-170.6	-171.9	0	0	0	0	0	113.4	K524 D525	K524-G578 CarbonylContact O-C 3.59Å; K524-G578 WeakPolarHBondContact O-CA 3.43Å; D525-G578 WeakPolarHBondContact O-CA 3.37Å
579	Q	95.2	Very high	93.5	Very high	106 Å²	106	41.1 Å²	41.1	50%	0.495	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	148.3	-178.9	-66.4	-177.1	-13.5	0	0	111.8	K524 V526 L581	K524-Q579 PolarHBondContact N-O 3.01Å; K524-Q579 PolarHBondContact O-N 3.08Å; V526-Q579 WeakPolarHBondContact CG2-O 3.41Å; Q579-L581 HydrophobicContact CB-CD2 4.09Å
580	V	96.1	Very high	93.4	Very high	4 Å²	4	41.4 Å²	41.4	2%	0.024	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	124.8	165.9	-176	0	0	0	0	107.8	E522 F523 V526 L568 L569 P586 V587	E522-V580 CarbonylContact O-C 3.39Å; E522-V580 WeakPolarHBondContact O-CA 3.41Å; F523-V580 HydrophobicContact CD1-CG2 3.71Å; F523-V580 HydrophobicContact CD2-CG1 4.28Å; F523-V580 HydrophobicContact CE1-CG1 4.25Å; F523-V580 HydrophobicContact CE1-CG2 3.57Å; F523-V580 HydrophobicContact CE2-CG1 3.91Å; F523-V580 HydrophobicContact CG-CG2 4.29Å; F523-V580 HydrophobicContact CZ-CG1 3.88Å; F523-V580 HydrophobicContact CZ-CG2 4.06Å; V526-V580 HydrophobicContact CG2-CG2 3.98Å; L568-V580 HydrophobicContact CB-CG2 4.13Å; L569-V580 HydrophobicContact CD1-CG1 4.18Å; V580-P586 WeakPolarHBondContact O-CA 3.38Å; V580-V587 HydrophobicContact CB-CG1 4.43Å; V580-V587 HydrophobicContact CB-CG2 4.07Å; V580-V587 HydrophobicContact CG1-CG1 3.96Å; V580-V587 HydrophobicContact CG1-CG2 4.35Å; V580-V587 PolarHBondContact O-N 3.31Å
581	L	95.9	Very high	93.3	Very high	7 Å²	7	44.8 Å²	44.8	4%	0.037	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	143.1	-174.6	-50.5	174.9	0	0	0	111.2	V521 E522 K524 Q579 K585 P586	V521-L581 WeakPolarHBondContact CA-O 3.5Å; E522-L581 HydrophobicContact CB-CB 4.26Å; E522-L581 HydrophobicContact CB-CD1 4.39Å; E522-L581 PolarHBondContact N-O 3.2Å; E522-L581 PolarHBondContact O-N 3.11Å; K524-L581 HydrophobicContact CD-CD1 3.76Å; Q579-L581 HydrophobicContact CB-CD2 4.09Å; L581-K585 CarbonylContact C-O 3.54Å; L581-K585 WeakPolarHBondContact CA-O 3.38Å; L581-P586 HydrophobicContact CD2-CB 4.25Å; L581-P586 HydrophobicContact CD2-CG 3.8Å
582	L	95.4	Very high	93.1	Very high	1 Å²	1	48.1 Å²	48.1	1%	0.005	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	123.7	164.7	177.3	66.8	0	0	0	108.3	L520 V521 G584 K585 V587 F590 L595 V680	L520-L582 CarbonylContact O-C 3.48Å; L520-L582 WeakPolarHBondContact O-CA 3.46Å; V521-L582 HydrophobicContact CG2-CD1 3.93Å; L582-G584 PolarHBondContact O-N 2.88Å; L582-G584 VanDerWaalsContact O-N 3.1Å; L582-K585 PolarHBondContact N-O 2.95Å; L582-K585 PolarHBondContact O-N 3.3Å; L582-V587 HydrophobicContact CB-CG1 4.28Å; L582-F590 HydrophobicContact CB-CE2 3.91Å; L582-F590 HydrophobicContact CB-CZ 4.13Å; L582-F590 HydrophobicContact CD2-CE2 4.41Å; L582-F590 HydrophobicContact CD2-CZ 4.23Å; L582-F590 HydrophobicContact CG-CZ 4.31Å; L582-L595 HydrophobicContact CD2-CD1 3.96Å; L582-V680 HydrophobicContact CD1-CG2 4.02Å
583	D	93.8	Very high	92.9	Very high	50 Å²	50	50.4 Å²	50.4	27%	0.267	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	48.3	35.6	-174.9	-63	-30.9	0	0	0	113.5	C517 T518 G519 L520	C517-D583 VanDerWaalsContact CA-OD2 3.22Å; C517-D583 WeakPolarHBondContact CA-OD2 3.45Å; C517-D583 PolarHBondContact SG-OD2 2.88Å; C517-D583 VanDerWaalsContact SG-OD2 3.37Å; T518-D583 PolarHBondContact N-OD2 3.11Å; T518-D583 PolarHBondContact OG1-OD1 3.48Å; T518-D583 PolarHBondContact OG1-OD2 3.34Å; G519-D583 PolarHBondContact N-OD1 2.82Å; G519-D583 PolarHBondContact N-OD2 2.99Å; L520-D583 PolarHBondContact N-OD1 3.44Å; L520-D583 PolarHBondContact O-N 3.25Å
584	G	92.1	Very high	92.9	Very high	44 Å²	44	50.6 Å²	50.6	45%	0.454	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	85.5	-4.4	179.3	0	0	0	0	0	116.1	L582	L582-G584 PolarHBondContact O-N 2.88Å; L582-G584 VanDerWaalsContact O-N 3.1Å
585	K	93.4	Very high	93	Very high	74 Å²	74	47.1 Å²	47.1	32%	0.322	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	143.9	174.8	-66.2	-168.6	-179.2	-170.5	0	112	E512 L581 L582 F590	E512-K585 HydrophobicContact CG-CD 4.3Å; E512-K585 IonicContact OE1-NZ 2.72Å; E512-K585 PolarHBondContact OE1-NZ 2.84Å; E512-K585 IonicContact OE2-NZ 2.68Å; E512-K585 PolarHBondContact OE2-NZ 3.45Å; L581-K585 CarbonylContact C-O 3.54Å; L581-K585 WeakPolarHBondContact CA-O 3.38Å; L582-K585 PolarHBondContact N-O 2.95Å; L582-K585 PolarHBondContact O-N 3.3Å; K585-F590 HydrophobicContact CB-CE2 3.78Å; K585-F590 HydrophobicContact CB-CZ 3.87Å
586	P	94.1	Very high	92.9	Very high	16 Å²	16	46.8 Å²	46.8	10%	0.104	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.6	135.7	175.3	-25.6	35.2	0	0	0	113.8	V580 L581 N588 E589 F590	V580-P586 WeakPolarHBondContact O-CA 3.38Å; L581-P586 HydrophobicContact CD2-CB 4.25Å; L581-P586 HydrophobicContact CD2-CG 3.8Å; P586-N588 WeakPolarHBondContact CB-OD1 3.32Å; P586-N588 PolarHBondContact O-N 3.26Å; P586-N588 VanDerWaalsContact O-N 3.1Å; P586-E589 HydrophobicContact CB-CG 4.19Å; P586-E589 HydrophobicContact CG-CG 4.44Å; P586-E589 PolarHBondContact O-N 3.02Å; P586-F590 VanDerWaalsContact O-CD2 3.31Å; P586-F590 WeakPolarHBondContact O-CD2 3.15Å
587	V	93.1	Very high	92.9	Very high	6 Å²	6	43 Å²	43	4%	0.036	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-24.7	-178.2	-66.1	0	0	0	0	113.7	L569 N571 V580 L582	L569-V587 HydrophobicContact CD1-CG1 4.38Å; N571-V587 HydrophobicContact CB-CB 4.4Å; N571-V587 HydrophobicContact CB-CG2 4.17Å; V580-V587 HydrophobicContact CB-CG1 4.43Å; V580-V587 HydrophobicContact CB-CG2 4.07Å; V580-V587 HydrophobicContact CG1-CG1 3.96Å; V580-V587 HydrophobicContact CG1-CG2 4.35Å; V580-V587 PolarHBondContact O-N 3.31Å; L582-V587 HydrophobicContact CB-CG1 4.28Å
588	N	90.5	Very high	93	Very high	72 Å²	72	44.5 Å²	44.5	39%	0.385	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.3	-9.5	177.9	64.2	-46.2	0	0	0	114.7	L574 P586	L574-N588 HydrophobicContact CD2-CB 3.71Å; P586-N588 WeakPolarHBondContact CB-OD1 3.32Å; P586-N588 PolarHBondContact O-N 3.26Å; P586-N588 VanDerWaalsContact O-N 3.1Å
589	E	92.5	Very high	93	Very high	91 Å²	91	42.8 Å²	42.8	43%	0.425	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.9	-19	174.3	-68.6	178.1	-171.5	0	0	112.7	G510 T511 E512 P586	G510-E589 CarbonylContact C-O 3.58Å; G510-E589 VanDerWaalsContact CA-O 3.23Å; G510-E589 WeakPolarHBondContact CA-O 3.31Å; T511-E589 PolarHBondContact N-O 2.93Å; E512-E589 WeakPolarHBondContact CB-O 3.43Å; E512-E589 HydrophobicContact CG-CB 4.44Å; E512-E589 PolarHBondContact N-O 3.02Å; P586-E589 HydrophobicContact CB-CG 4.19Å; P586-E589 HydrophobicContact CG-CG 4.44Å; P586-E589 PolarHBondContact O-N 3.02Å
590	F	92.8	Very high	92.9	Very high	7 Å²	7	38.1 Å²	38.1	3%	0.031	20%	0.202	C	C	.	.	B	Isolated β-bridge	trans	-73.6	145.8	179.3	-69.3	-89.5	0	0	0	113	E512 P514 L582 K585 P586 H592 Y594 L595	E512-F590 HydrophobicContact CB-CD1 4.09Å; E512-F590 HydrophobicContact CB-CG 4.39Å; E512-F590 WeakPolarHBondContact O-CA 3.48Å; E512-F590 WeakPolarHBondContact O-CD1 3.34Å; P514-F590 HydrophobicContact CG-CE1 3.96Å; L582-F590 HydrophobicContact CB-CE2 3.91Å; L582-F590 HydrophobicContact CB-CZ 4.13Å; L582-F590 HydrophobicContact CD2-CE2 4.41Å; L582-F590 HydrophobicContact CD2-CZ 4.23Å; L582-F590 HydrophobicContact CG-CZ 4.31Å; K585-F590 HydrophobicContact CB-CE2 3.78Å; K585-F590 HydrophobicContact CB-CZ 3.87Å; P586-F590 VanDerWaalsContact O-CD2 3.31Å; P586-F590 WeakPolarHBondContact O-CD2 3.15Å; F590-H592 PolarHBondContact O-N 2.81Å; F590-Y594 AromaticContact CD1-CD1 3.73Å; F590-Y594 HydrophobicContact CD1-CD1 3.73Å; F590-Y594 AromaticContact CD1-CE1 3.72Å; F590-Y594 HydrophobicContact CD1-CE1 3.72Å; F590-Y594 HydrophobicContact CE1-CD1 4.43Å; F590-Y594 AromaticContact CE1-CE1 3.95Å; F590-Y594 HydrophobicContact CE1-CE1 3.95Å; F590-L595 HydrophobicContact CB-CB 4.26Å; F590-L595 HydrophobicContact CB-CD1 4.34Å; F590-L595 HydrophobicContact CD2-CD1 4.48Å; F590-L595 HydrophobicContact CG-CD1 4.45Å
591	Q	92.7	Very high	92.7	Very high	77 Å²	77	40.8 Å²	40.8	36%	0.36	22%	0.215	S	C	.	.			trans	-60.4	130.1	166.9	-178.8	-175.7	-13	0	0	109.6	G510 E512 D593 Y594 L595	G510-Q591 VanDerWaalsContact O-CA 3.25Å; G510-Q591 WeakPolarHBondContact O-CA 3.25Å; E512-Q591 PolarHBondContact O-N 3.22Å; Q591-D593 PolarHBondContact NE2-OD2 3.35Å; Q591-D593 PolarHBondContact O-N 3.48Å; Q591-Y594 WeakPolarHBondContact O-CA 3.08Å; Q591-Y594 WeakPolarHBondContact O-CB 3.47Å; Q591-Y594 PolarHBondContact O-N 3.01Å; Q591-L595 PolarHBondContact O-N 3Å
592	H	89.9	Confident	92.5	Very high	89 Å²	89	40.5 Å²	40.5	41%	0.412	21%	0.214	S	C	.	.	H	α-helix	trans	-52.3	-49.4	-177.4	176.7	81.7	0	0	0	113.3	A508 F590 Y594 L595 H596	A508-H592 HydrophobicContact CB-CB 4.05Å; F590-H592 PolarHBondContact O-N 2.81Å; H592-Y594 VanDerWaalsContact C-N 3.25Å; H592-Y594 PolarHBondContact O-N 3.18Å; H592-L595 PolarHBondContact O-N 3.42Å; H592-H596 AromaticContact CE1-CD2 3.2Å; H592-H596 PolarHBondContact CE1-CD2 2.87Å; H592-H596 AromaticContact CE1-NE2 3.12Å; H592-H596 PolarHBondContact CE1-NE2 2.8Å; H592-H596 AromaticContact CG-CD2 3.79Å; H592-H596 AromaticContact ND1-CD2 3.26Å; H592-H596 PolarHBondContact ND1-CD2 3.23Å; H592-H596 VanDerWaalsContact ND1-CD2 3.26Å; H592-H596 AromaticContact ND1-NE2 3.14Å; H592-H596 PolarHBondContact ND1-NE2 3.42Å; H592-H596 VanDerWaalsContact ND1-NE2 3.14Å; H592-H596 AromaticContact NE2-CD2 3.7Å; H592-H596 PolarHBondContact O-CD2 3.09Å; H592-H596 PolarHBondContact O-N 3.45Å
593	D	89.7	Confident	92.1	Very high	109 Å²	109	41.6 Å²	41.6	58%	0.583	23%	0.226	S	C	*	.	H	α-helix	trans	-60.9	-35.5	178.1	-51.9	-45.8	0	0	0	112.4	Q591 S597	Q591-D593 PolarHBondContact NE2-OD2 3.35Å; Q591-D593 PolarHBondContact O-N 3.48Å; D593-S597 WeakPolarHBondContact O-CB 3.41Å; D593-S597 PolarHBondContact O-N 3.17Å
594	Y	92.2	Very high	91.7	Very high	25 Å²	25	43.6 Å²	43.6	10%	0.098	23%	0.233	C	C	.	.	H	α-helix	trans	-70	-49	176.4	176.7	-91.1	0	0	0	110.5	A513 P514 C517 F590 Q591 H592 H596 S597 K598	A513-Y594 HydrophobicContact CB-CD2 3.9Å; A513-Y594 HydrophobicContact CB-CG 3.93Å; P514-Y594 HydrophobicContact CG-CE1 4.16Å; P514-Y594 WeakPolarHBondContact O-CE2 3.42Å; P514-Y594 VanDerWaalsContact O-CZ 3.32Å; P514-Y594 PolarHBondContact O-OH 2.9Å; C517-Y594 WeakPolarHBondContact CB-OH 3.39Å; F590-Y594 AromaticContact CD1-CD1 3.73Å; F590-Y594 HydrophobicContact CD1-CD1 3.73Å; F590-Y594 AromaticContact CD1-CE1 3.72Å; F590-Y594 HydrophobicContact CD1-CE1 3.72Å; F590-Y594 HydrophobicContact CE1-CD1 4.43Å; F590-Y594 AromaticContact CE1-CE1 3.95Å; F590-Y594 HydrophobicContact CE1-CE1 3.95Å; Q591-Y594 WeakPolarHBondContact O-CA 3.08Å; Q591-Y594 WeakPolarHBondContact O-CB 3.47Å; Q591-Y594 PolarHBondContact O-N 3.01Å; H592-Y594 VanDerWaalsContact C-N 3.25Å; H592-Y594 PolarHBondContact O-N 3.18Å; Y594-H596 PolarHBondContact O-N 2.86Å; Y594-S597 WeakPolarHBondContact O-CA 3.15Å; Y594-S597 WeakPolarHBondContact O-CB 3.41Å; Y594-S597 PolarHBondContact O-N 3.47Å; Y594-S597 PolarHBondContact O-OG 2.88Å; Y594-K598 HydrophobicContact CD1-CG 4.39Å; Y594-K598 HydrophobicContact CE1-CG 3.85Å; Y594-K598 HydrophobicContact CE2-CD 4.42Å; Y594-K598 HydrophobicContact CE2-CG 4.15Å; Y594-K598 PolarHBondContact O-N 3.38Å
595	L	93.4	Very high	91.3	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-55.9	-53.1	-180	-172.2	68.4	0	0	0	111.2	N571 L582 F590 Q591 H592 S597 K598 I599	N571-L595 HydrophobicContact CB-CD2 3.64Å; L582-L595 HydrophobicContact CD2-CD1 3.96Å; F590-L595 HydrophobicContact CB-CB 4.26Å; F590-L595 HydrophobicContact CB-CD1 4.34Å; F590-L595 HydrophobicContact CD2-CD1 4.48Å; F590-L595 HydrophobicContact CG-CD1 4.45Å; Q591-L595 PolarHBondContact O-N 3Å; H592-L595 PolarHBondContact O-N 3.42Å; L595-S597 PolarHBondContact O-N 3.49Å; L595-K598 CarbonylContact O-C 3.6Å; L595-K598 PolarHBondContact O-N 3.01Å; L595-I599 HydrophobicContact CD1-CD1 3.61Å; L595-I599 HydrophobicContact CD1-CG1 4.17Å; L595-I599 HydrophobicContact CG-CD1 4.1Å; L595-I599 PolarHBondContact O-N 3.32Å
596	H	92	Very high	90.8	Very high	28 Å²	28	47.1 Å²	47.1	13%	0.13	24%	0.241	C	C	.	.	H	α-helix	trans	-79.5	8.5	178.2	-54.7	-73.5	0	0	0	114.3	E570 F572 H592 Y594 R676	E570-H596 PolarHBondContact O-CE1 3.23Å; E570-H596 IonicContact OE2-CE1 3.14Å; E570-H596 PolarHBondContact OE2-CE1 3.38Å; E570-H596 IonicContact OE2-ND1 2.76Å; E570-H596 PolarHBondContact OE2-ND1 3.35Å; F572-H596 AromaticContact CE1-CE1 3.71Å; H592-H596 AromaticContact CE1-CD2 3.2Å; H592-H596 PolarHBondContact CE1-CD2 2.87Å; H592-H596 AromaticContact CE1-NE2 3.12Å; H592-H596 PolarHBondContact CE1-NE2 2.8Å; H592-H596 AromaticContact CG-CD2 3.79Å; H592-H596 AromaticContact ND1-CD2 3.26Å; H592-H596 PolarHBondContact ND1-CD2 3.23Å; H592-H596 VanDerWaalsContact ND1-CD2 3.26Å; H592-H596 AromaticContact ND1-NE2 3.14Å; H592-H596 PolarHBondContact ND1-NE2 3.42Å; H592-H596 VanDerWaalsContact ND1-NE2 3.14Å; H592-H596 AromaticContact NE2-CD2 3.7Å; H592-H596 PolarHBondContact O-CD2 3.09Å; H592-H596 PolarHBondContact O-N 3.45Å; Y594-H596 PolarHBondContact O-N 2.86Å; H596-R676 PolarHBondContact O-NH1 2.77Å
597	S	90.8	Very high	90.5	Very high	33 Å²	33	50.2 Å²	50.2	23%	0.231	26%	0.259	C	S	.	.	H	α-helix	trans	-92.4	-26.2	159.1	82.6	0	0	0	0	112.2	D593 Y594 L595	D593-S597 WeakPolarHBondContact O-CB 3.41Å; D593-S597 PolarHBondContact O-N 3.17Å; Y594-S597 WeakPolarHBondContact O-CA 3.15Å; Y594-S597 WeakPolarHBondContact O-CB 3.41Å; Y594-S597 PolarHBondContact O-N 3.47Å; Y594-S597 PolarHBondContact O-OG 2.88Å; L595-S597 PolarHBondContact O-N 3.49Å
598	K	92.9	Very high	90.4	Very high	58 Å²	58	50 Å²	50	25%	0.252	26%	0.258	S	S	.	.	H	α-helix	trans	-99.4	-26.3	-178.8	-56.6	-46.8	175.3	-158.7	0	113.2	C517 Y594 L595 P678 R679 V680	C517-K598 HydrophobicContact CB-CD 4.44Å; C517-K598 HydrophobicContact CB-CG 4.27Å; Y594-K598 HydrophobicContact CD1-CG 4.39Å; Y594-K598 HydrophobicContact CE1-CG 3.85Å; Y594-K598 HydrophobicContact CE2-CD 4.42Å; Y594-K598 HydrophobicContact CE2-CG 4.15Å; Y594-K598 PolarHBondContact O-N 3.38Å; L595-K598 CarbonylContact O-C 3.6Å; L595-K598 PolarHBondContact O-N 3.01Å; K598-P678 CarbonylContact O-C 3.58Å; K598-P678 WeakPolarHBondContact O-CB 3.26Å; K598-R679 PolarHBondContact O-N 2.99Å; K598-V680 PolarHBondContact O-N 3.43Å
599	I	94.1	Very high	90.5	Very high	2 Å²	2	50.5 Å²	50.5	1%	0.01	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	136.5	173	-46.2	-173.8	0	0	0	108.1	L569 E570 L595 V680 I682	L569-I599 HydrophobicContact CD1-CD1 3.91Å; L569-I599 HydrophobicContact CG-CD1 4.17Å; E570-I599 VanDerWaalsContact OE1-CG2 3.26Å; E570-I599 WeakPolarHBondContact OE1-CG2 3.18Å; L595-I599 HydrophobicContact CD1-CD1 3.61Å; L595-I599 HydrophobicContact CD1-CG1 4.17Å; L595-I599 HydrophobicContact CG-CD1 4.1Å; L595-I599 PolarHBondContact O-N 3.32Å; I599-V680 WeakPolarHBondContact CA-O 3.31Å; I599-V680 HydrophobicContact CG1-CB 4.22Å; I599-V680 HydrophobicContact CG2-CB 4.27Å; I599-V680 HydrophobicContact CG2-CG1 4.35Å; I599-I682 HydrophobicContact CG2-CD1 3.74Å; I599-I682 HydrophobicContact CG2-CG1 4.14Å
600	A	92.9	Very high	90.5	Very high	8 Å²	8	49.4 Å²	49.4	7%	0.066	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	128.3	172.1	0	0	0	0	0	111.8	A673 P678 V680 L681 I682	A600-A673 HydrophobicContact CB-CB 3.94Å; A600-P678 HydrophobicContact CB-CB 3.71Å; A600-P678 HydrophobicContact CB-CG 3.78Å; A600-V680 PolarHBondContact N-O 3.33Å; A600-L681 HydrophobicContact CB-CD1 4.4Å; A600-I682 PolarHBondContact O-N 2.89Å
601	L	92.6	Very high	90.5	Very high	59 Å²	59	54.8 Å²	54.8	31%	0.309	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	128.7	177.2	175.6	61.1	0	0	0	112.4	V566 E570 I682 D684	V566-L601 HydrophobicContact CG1-CD1 3.79Å; V566-L601 HydrophobicContact CG1-CD2 4.08Å; E570-L601 HydrophobicContact CG-CD2 4.46Å; E570-L601 WeakPolarHBondContact OE1-CB 3.36Å; L601-I682 HydrophobicContact CD1-CB 3.86Å; L601-I682 HydrophobicContact CD1-CG2 3.6Å; L601-D684 HydrophobicContact CD1-CB 4.49Å
602	V	91.2	Very high	90.6	Very high	1 Å²	1	52.4 Å²	52.4	1%	0.006	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	102.4	159.6	-173.4	0	0	0	0	107.6	A669 I670 A673 I682 L683 D684 A686	V602-A669 HydrophobicContact CG1-CB 4.39Å; V602-I670 HydrophobicContact CG1-CG1 3.93Å; V602-I670 HydrophobicContact CG2-CG1 4.18Å; V602-A673 HydrophobicContact CG2-CB 3.71Å; V602-I682 PolarHBondContact N-O 3.29Å; V602-L683 HydrophobicContact CB-CD2 3.91Å; V602-L683 HydrophobicContact CG2-CD2 3.88Å; V602-D684 PolarHBondContact O-N 2.84Å; V602-A686 HydrophobicContact CB-CB 4.14Å; V602-A686 HydrophobicContact CG1-CB 3.66Å
603	G	88.6	Confident	90.9	Very high	25 Å²	25	48.1 Å²	48.1	26%	0.258	25%	0.254	S	S	.	.			trans	-80.3	159.9	179.3	0	0	0	0	0	113.9	E605 D684	G603-E605 PolarHBondContact O-N 3.33Å; G603-D684 CarbonylContact C-O 3.6Å
604	Q	84.6	Confident	91.1	Very high	92 Å²	92	46.3 Å²	46.3	43%	0.43	24%	0.241	S	C	.	.	S	Bend	trans	-51.8	-51.2	-177.8	-176.9	179.9	32.1	0	0	112.7	P606 Q666 D684 E685	Q604-P606 WeakPolarHBondContact O-CD 3.46Å; Q604-Q666 PolarHBondContact O-NE2 3.25Å; Q604-D684 WeakPolarHBondContact CA-O 3.46Å; Q604-D684 PolarHBondContact N-O 3.2Å; Q604-E685 HydrophobicContact CB-CB 4.13Å; Q604-E685 HydrophobicContact CG-CB 3.85Å; Q604-E685 PolarHBondContact NE2-OE1 2.91Å; Q604-E685 PolarHBondContact NE2-OE2 2.96Å
605	E	83	Confident	91.2	Very high	173 Å²	173	48.1 Å²	48.1	81%	0.808	25%	0.253	S	S	*	.	S	Bend	trans	-102.9	93.7	171.9	-68	-161.1	165.7	0	0	111.1	G603 V607	G603-E605 PolarHBondContact O-N 3.33Å; E605-V607 PolarHBondContact O-N 3.14Å; E605-V607 VanDerWaalsContact O-N 3.11Å
606	P	83.1	Confident	91.3	Very high	18 Å²	18	48.1 Å²	48.1	12%	0.117	25%	0.253	C	S	.	.			trans	-69.5	109.5	-178.2	27.1	-37.1	0	0	0	112.3	Q604 K665 Q666 A669	Q604-P606 WeakPolarHBondContact O-CD 3.46Å; P606-K665 HydrophobicContact CG-CB 3.78Å; P606-Q666 HydrophobicContact CG-CB 4.39Å; P606-Q666 HydrophobicContact CG-CG 3.68Å; P606-A669 HydrophobicContact CB-CB 3.47Å; P606-A669 VanDerWaalsContact CB-CB 3.47Å; P606-A669 HydrophobicContact CG-CB 4.5Å
607	V	88	Confident	91.5	Very high	82 Å²	82	46.9 Å²	46.9	50%	0.497	25%	0.247	S	C	.	.			trans	-76.6	126.6	171.4	-175.1	0	0	0	0	110.3	E605 R672	E605-V607 PolarHBondContact O-N 3.14Å; E605-V607 VanDerWaalsContact O-N 3.11Å; V607-R672 PolarHBondContact O-NH1 2.9Å; V607-R672 PolarHBondContact O-NH2 3.36Å
608	L	91.6	Very high	91.7	Very high	1 Å²	1	46.2 Å²	46.2	1%	0.005	24%	0.242	C	C	.	.			trans	-111.3	144.5	168.6	-57.7	-178.7	0	0	0	109.9	N616 V653 K656 G657 L660 K665 V668	L608-N616 WeakPolarHBondContact CA-OD1 3.4Å; L608-N616 HydrophobicContact CD2-CB 4.38Å; L608-V653 HydrophobicContact CB-CG2 3.97Å; L608-V653 HydrophobicContact CD1-CG1 4.43Å; L608-V653 HydrophobicContact CD1-CG2 4.43Å; L608-K656 CarbonylContact O-C 3.59Å; L608-K656 VanDerWaalsContact O-CA 3.3Å; L608-K656 WeakPolarHBondContact O-CA 3.46Å; L608-G657 PolarHBondContact O-N 2.84Å; L608-L660 HydrophobicContact CD1-CD1 3.89Å; L608-K665 HydrophobicContact CD1-CB 4.27Å; L608-K665 HydrophobicContact CD1-CG 4.18Å; L608-V668 HydrophobicContact CD1-CB 4.13Å; L608-V668 HydrophobicContact CD1-CG1 4Å; L608-V668 HydrophobicContact CD2-CB 4.29Å; L608-V668 HydrophobicContact CD2-CG1 3.76Å
609	F	92	Very high	91.7	Very high	82 Å²	82	47.3 Å²	47.3	36%	0.36	25%	0.245	S	C	.	.			trans	-85	152.8	177.8	-61.7	-78.3	0	0	0	111	R611 N616 Y619 V653	F609-R611 HydrophobicContact CB-CG 4.26Å; F609-R611 PolarHBondContact O-N 2.69Å; F609-N616 PolarHBondContact N-OD1 3.03Å; F609-N616 PolarHBondContact O-ND2 3.22Å; F609-N616 PolarHBondContact O-OD1 3.16Å; F609-Y619 AromaticContact CD2-CD2 3.71Å; F609-Y619 HydrophobicContact CD2-CD2 3.71Å; F609-Y619 HydrophobicContact CD2-CE1 4.43Å; F609-Y619 AromaticContact CD2-CE2 3.45Å; F609-Y619 HydrophobicContact CD2-CE2 3.45Å; F609-Y619 VanDerWaalsContact CD2-CE2 3.45Å; F609-Y619 HydrophobicContact CD2-CG 4.3Å; F609-Y619 AromaticContact CD2-CZ 3.86Å; F609-Y619 HydrophobicContact CE2-CD1 4.09Å; F609-Y619 AromaticContact CE2-CD2 3.91Å; F609-Y619 HydrophobicContact CE2-CD2 3.91Å; F609-Y619 AromaticContact CE2-CE1 3.66Å; F609-Y619 HydrophobicContact CE2-CE1 3.66Å; F609-Y619 AromaticContact CE2-CE2 3.46Å; F609-Y619 HydrophobicContact CE2-CE2 3.46Å; F609-Y619 VanDerWaalsContact CE2-CE2 3.46Å; F609-Y619 HydrophobicContact CE2-CG 4.2Å; F609-Y619 AromaticContact CE2-CZ 3.32Å; F609-Y619 HydrophobicContact CG-CE2 4.16Å; F609-Y619 HydrophobicContact CZ-CE1 4.2Å; F609-Y619 HydrophobicContact CZ-CE2 4.16Å; F609-Y619 AromaticContact CZ-CZ 3.73Å; F609-V653 WeakPolarHBondContact O-CG2 3.35Å
610	A	92.4	Very high	91.3	Very high	68 Å²	68	50.1 Å²	50.1	56%	0.562	28%	0.275	S	S	*	.	S	Bend	trans	-69.5	72.1	176.2	0	0	0	0	0	112	G654	A610-G654 WeakPolarHBondContact CA-O 3.47Å
611	R	93.2	Very high	91.1	Very high	120 Å²	120	52.9 Å²	52.9	45%	0.453	29%	0.288	S	S	.	.	S	Bend	trans	-143.4	-177.9	-179.1	-56.2	-174.1	-179.5	179.6	1	108.9	F609 D615 S652 V653	F609-R611 HydrophobicContact CB-CG 4.26Å; F609-R611 PolarHBondContact O-N 2.69Å; R611-D615 HydrophobicContact CB-CB 3.76Å; R611-S652 WeakPolarHBondContact O-CA 3.26Å; R611-V653 PolarHBondContact O-N 2.88Å; R611-V653 VanDerWaalsContact O-N 3.08Å
612	T	94.6	Very high	90.7	Very high	27 Å²	27	55.2 Å²	55.2	17%	0.166	31%	0.309	C	S	.	.	B	Isolated β-bridge	trans	-65.6	164.1	173.1	69.9	0	0	0	0	111.7	K614 D615 N616 T651	T612-K614 VanDerWaalsContact C-N 3.28Å; T612-K614 PolarHBondContact OG1-N 3.38Å; T612-D615 WeakPolarHBondContact CB-OD2 3.27Å; T612-D615 WeakPolarHBondContact CG2-OD2 3.47Å; T612-D615 PolarHBondContact N-OD2 3.3Å; T612-D615 PolarHBondContact O-N 3.17Å; T612-D615 PolarHBondContact OG1-N 3.34Å; T612-D615 PolarHBondContact OG1-OD2 3.02Å; T612-N616 PolarHBondContact O-N 3.32Å; T612-N616 VanDerWaalsContact O-N 3.13Å; T612-N616 PolarHBondContact O-ND2 2.91Å; T612-T651 CarbonylContact C-O 3.48Å; T612-T651 VanDerWaalsContact CA-O 3.3Å; T612-T651 WeakPolarHBondContact CA-O 3.44Å
613	I	95.3	Very high	90.3	Very high	0 Å²	0	63.3 Å²	63.3	0%	0	35%	0.353	C	S	.	.	H	α-helix	trans	-61.3	-41.4	171.3	-67.9	170.6	0	0	0	110	D615 N616 I617 I642 L645 Y649 T651 V653 V668	I613-D615 PolarHBondContact O-N 3.42Å; I613-N616 PolarHBondContact O-N 3.47Å; I613-I617 HydrophobicContact CG2-CD1 3.9Å; I613-I617 HydrophobicContact CG2-CG1 4.42Å; I613-I617 WeakPolarHBondContact O-CG1 3.25Å; I613-I617 PolarHBondContact O-N 3.46Å; I613-I642 HydrophobicContact CD1-CG1 4.24Å; I613-I642 HydrophobicContact CD1-CG2 4.36Å; I613-I642 HydrophobicContact CG2-CD1 3.7Å; I613-I642 HydrophobicContact CG2-CG1 4.07Å; I613-I642 HydrophobicContact CG2-CG2 4.38Å; I613-L645 HydrophobicContact CD1-CD1 3.39Å; I613-Y649 HydrophobicContact CG2-CD1 4.37Å; I613-Y649 PolarHBondContact N-O 3.47Å; I613-T651 PolarHBondContact N-O 3.2Å; I613-V653 HydrophobicContact CD1-CG1 4.38Å; I613-V653 HydrophobicContact CG1-CG1 3.47Å; I613-V653 VanDerWaalsContact CG1-CG1 3.47Å; I613-V668 HydrophobicContact CG2-CG2 4.24Å
614	K	95.2	Very high	90.3	Very high	71 Å²	71	63.6 Å²	63.6	31%	0.309	35%	0.349	S	S	.	.	H	α-helix	trans	-52.4	-53.6	173.5	-176.7	-175.4	175.6	-173.6	0	112	T612 N616 I617 S618 M626 V629 Y649	T612-K614 VanDerWaalsContact C-N 3.28Å; T612-K614 PolarHBondContact OG1-N 3.38Å; K614-N616 PolarHBondContact O-N 3.46Å; K614-I617 PolarHBondContact O-N 3.24Å; K614-I617 VanDerWaalsContact O-N 3.15Å; K614-S618 PolarHBondContact O-N 2.89Å; K614-S618 PolarHBondContact O-OG 3.05Å; K614-M626 HydrophobicContact CD-SD 3.92Å; K614-M626 HydrophobicContact CG-SD 4.2Å; K614-V629 HydrophobicContact CG-CG1 4.41Å; K614-Y649 PolarHBondContact N-O 2.97Å
615	D	94.5	Very high	90.7	Very high	63 Å²	63	61.6 Å²	61.6	34%	0.337	35%	0.345	S	S	.	.	H	α-helix	trans	-67.2	-23.5	-178	-55.2	-41.4	0	0	0	113.5	R611 T612 I613 Y619	R611-D615 HydrophobicContact CB-CB 3.76Å; T612-D615 WeakPolarHBondContact CB-OD2 3.27Å; T612-D615 WeakPolarHBondContact CG2-OD2 3.47Å; T612-D615 PolarHBondContact N-OD2 3.3Å; T612-D615 PolarHBondContact O-N 3.17Å; T612-D615 PolarHBondContact OG1-N 3.34Å; T612-D615 PolarHBondContact OG1-OD2 3.02Å; I613-D615 PolarHBondContact O-N 3.42Å; D615-Y619 PolarHBondContact O-N 3.36Å
616	N	94.9	Very high	91.2	Very high	0 Å²	0	56.8 Å²	56.8	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-77.5	-39.6	173	-87	-81	0	0	0	111.4	L608 F609 T612 I613 K614 Y619 V668 R672	L608-N616 WeakPolarHBondContact CA-OD1 3.4Å; L608-N616 HydrophobicContact CD2-CB 4.38Å; F609-N616 PolarHBondContact N-OD1 3.03Å; F609-N616 PolarHBondContact O-ND2 3.22Å; F609-N616 PolarHBondContact O-OD1 3.16Å; T612-N616 PolarHBondContact O-N 3.32Å; T612-N616 VanDerWaalsContact O-N 3.13Å; T612-N616 PolarHBondContact O-ND2 2.91Å; I613-N616 PolarHBondContact O-N 3.47Å; K614-N616 PolarHBondContact O-N 3.46Å; N616-Y619 WeakPolarHBondContact O-CB 3.29Å; N616-V668 HydrophobicContact CB-CG1 4.19Å; N616-R672 WeakPolarHBondContact O-CD 3.45Å; N616-R672 WeakPolarHBondContact O-CG 3.46Å
617	I	95.5	Very high	91.8	Very high	1 Å²	1	62.7 Å²	62.7	1%	0.005	35%	0.35	C	S	.	.	H	α-helix	trans	-67.3	-49.4	175.7	-64.7	171.1	0	0	0	110	I613 K614 Y619 V629 A633 I642 Y649 V668 A671 I675	I613-I617 HydrophobicContact CG2-CD1 3.9Å; I613-I617 HydrophobicContact CG2-CG1 4.42Å; I613-I617 WeakPolarHBondContact O-CG1 3.25Å; I613-I617 PolarHBondContact O-N 3.46Å; K614-I617 PolarHBondContact O-N 3.24Å; K614-I617 VanDerWaalsContact O-N 3.15Å; I617-Y619 PolarHBondContact O-N 3.49Å; I617-Y619 VanDerWaalsContact O-N 3.14Å; I617-V629 HydrophobicContact CB-CG1 4.19Å; I617-V629 HydrophobicContact CD1-CG1 4.04Å; I617-V629 HydrophobicContact CG2-CG1 4.08Å; I617-A633 HydrophobicContact CD1-CB 4.21Å; I617-I642 HydrophobicContact CD1-CD1 4.35Å; I617-Y649 HydrophobicContact CD1-CD1 4.45Å; I617-Y649 HydrophobicContact CD1-CE1 4.16Å; I617-V668 HydrophobicContact CG1-CG1 4.07Å; I617-A671 HydrophobicContact CD1-CB 4.1Å; I617-A671 HydrophobicContact CG1-CB 4.02Å; I617-A671 HydrophobicContact CG2-CB 4.17Å; I617-I675 HydrophobicContact CG2-CB 4.46Å; I617-I675 HydrophobicContact CG2-CD1 3.89Å; I617-I675 HydrophobicContact CG2-CG2 4.33Å; I617-I675 WeakPolarHBondContact O-CG2 3.43Å
618	S	94.6	Very high	92	Very high	19 Å²	19	62.7 Å²	62.7	13%	0.133	35%	0.345	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.9	15.3	179.2	61	0	0	0	0	114.5	K614 G620 L621	K614-S618 PolarHBondContact O-N 2.89Å; K614-S618 PolarHBondContact O-OG 3.05Å; S618-G620 PolarHBondContact O-N 2.96Å; S618-L621 PolarHBondContact O-N 2.98Å
619	Y	92.9	Very high	92.2	Very high	81 Å²	81	62.6 Å²	62.6	32%	0.318	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.3	121.7	-171.2	-173.2	-93.7	0	0	0	112.8	F609 D615 N616 I617 L621 R676	F609-Y619 AromaticContact CD2-CD2 3.71Å; F609-Y619 HydrophobicContact CD2-CD2 3.71Å; F609-Y619 HydrophobicContact CD2-CE1 4.43Å; F609-Y619 AromaticContact CD2-CE2 3.45Å; F609-Y619 HydrophobicContact CD2-CE2 3.45Å; F609-Y619 VanDerWaalsContact CD2-CE2 3.45Å; F609-Y619 HydrophobicContact CD2-CG 4.3Å; F609-Y619 AromaticContact CD2-CZ 3.86Å; F609-Y619 HydrophobicContact CE2-CD1 4.09Å; F609-Y619 AromaticContact CE2-CD2 3.91Å; F609-Y619 HydrophobicContact CE2-CD2 3.91Å; F609-Y619 AromaticContact CE2-CE1 3.66Å; F609-Y619 HydrophobicContact CE2-CE1 3.66Å; F609-Y619 AromaticContact CE2-CE2 3.46Å; F609-Y619 HydrophobicContact CE2-CE2 3.46Å; F609-Y619 VanDerWaalsContact CE2-CE2 3.46Å; F609-Y619 HydrophobicContact CE2-CG 4.2Å; F609-Y619 AromaticContact CE2-CZ 3.32Å; F609-Y619 HydrophobicContact CG-CE2 4.16Å; F609-Y619 HydrophobicContact CZ-CE1 4.2Å; F609-Y619 HydrophobicContact CZ-CE2 4.16Å; F609-Y619 AromaticContact CZ-CZ 3.73Å; D615-Y619 PolarHBondContact O-N 3.36Å; N616-Y619 WeakPolarHBondContact O-CB 3.29Å; I617-Y619 PolarHBondContact O-N 3.49Å; I617-Y619 VanDerWaalsContact O-N 3.14Å; Y619-L621 VanDerWaalsContact C-N 3.34Å; Y619-R676 PolarHBondContact O-NH2 2.72Å
620	G	85.9	Confident	92.4	Very high	61 Å²	61	60.8 Å²	60.8	63%	0.629	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.6	13.9	-179	0	0	0	0	0	114.7	S618	S618-G620 PolarHBondContact O-N 2.96Å
621	L	89.1	Confident	92.3	Very high	67 Å²	67	63 Å²	63	35%	0.351	34%	0.339	S	S	.	.			trans	-112.7	147.5	168.3	-62.3	175.4	0	0	0	109.9	S618 Y619 V624 I675 R676	S618-L621 PolarHBondContact O-N 2.98Å; Y619-L621 VanDerWaalsContact C-N 3.34Å; L621-V624 HydrophobicContact CB-CG2 3.38Å; L621-V624 HydrophobicContact CD1-CG2 4.01Å; L621-V624 HydrophobicContact CG-CG2 4.35Å; L621-I675 HydrophobicContact CD1-CG1 4.42Å; L621-I675 HydrophobicContact CD1-CG2 3.93Å; L621-R676 HydrophobicContact CD1-CG 4.24Å; L621-R676 HydrophobicContact CD2-CG 4.48Å
622	S	84.9	Confident	92.3	Very high	108 Å²	108	57.6 Å²	57.6	76%	0.755	32%	0.32	S	S	*	.	S	Bend	trans	-102	147.6	174.8	-55.9	0	0	0	0	110.5	V624	S622-V624 VanDerWaalsContact C-N 3.27Å; S622-V624 PolarHBondContact O-N 2.8Å; S622-V624 VanDerWaalsContact O-N 3.12Å
623	D	82.1	Confident	92.2	Very high	171 Å²	171	56.3 Å²	56.3	91%	0.914	31%	0.312	S	S	*	.	S	Bend	trans	51.5	35.9	170.9	-55.2	-35.6	0	0	0	116.4	S625	D623-S625 PolarHBondContact O-N 3.09Å
624	V	89.6	Confident	91.9	Very high	30 Å²	30	60.1 Å²	60.1	18%	0.182	34%	0.335	C	S	.	.			trans	-71.4	123.3	176.7	-173.8	0	0	0	0	111	L621 S622 M628 V629 I675	L621-V624 HydrophobicContact CB-CG2 3.38Å; L621-V624 HydrophobicContact CD1-CG2 4.01Å; L621-V624 HydrophobicContact CG-CG2 4.35Å; S622-V624 VanDerWaalsContact C-N 3.27Å; S622-V624 PolarHBondContact O-N 2.8Å; S622-V624 VanDerWaalsContact O-N 3.12Å; V624-M628 HydrophobicContact CG1-CB 4.06Å; V624-M628 HydrophobicContact CG1-CE 3.94Å; V624-V629 HydrophobicContact CG1-CG2 3.84Å; V624-I675 HydrophobicContact CG1-CD1 3.64Å; V624-I675 HydrophobicContact CG1-CG1 4.43Å
625	S	93.3	Very high	91.5	Very high	50 Å²	50	62.7 Å²	62.7	35%	0.35	35%	0.346	S	S	.	.			trans	-65.4	148.7	174.2	76.3	0	0	0	0	112	D623 E627 M628 V629	D623-S625 PolarHBondContact O-N 3.09Å; S625-E627 PolarHBondContact O-N 2.88Å; S625-M628 PolarHBondContact O-N 3.34Å; S625-M628 VanDerWaalsContact O-N 3.17Å; S625-M628 PolarHBondContact OG-N 3.36Å; S625-V629 PolarHBondContact O-N 3.27Å
626	M	93.4	Very high	91.2	Very high	73 Å²	73	59.7 Å²	59.7	36%	0.36	33%	0.331	S	S	.	.	H	α-helix	trans	-62.4	-30	178.6	-168.7	60	-163.6	0	0	112.1	K614 V629 V630 Y649	K614-M626 HydrophobicContact CD-SD 3.92Å; K614-M626 HydrophobicContact CG-SD 4.2Å; M626-V629 HydrophobicContact CE-CG1 4.34Å; M626-V629 PolarHBondContact O-N 3.03Å; M626-V629 HydrophobicContact SD-CB 4.22Å; M626-V629 HydrophobicContact SD-CG1 4.4Å; M626-V630 HydrophobicContact CE-CG2 4.07Å; M626-V630 WeakPolarHBondContact O-CG2 3.48Å; M626-V630 PolarHBondContact O-N 3.5Å; M626-Y649 HydrophobicContact CE-CD1 3.71Å; M626-Y649 HydrophobicContact CE-CD2 3.45Å; M626-Y649 VanDerWaalsContact CE-CD2 3.45Å; M626-Y649 HydrophobicContact CE-CE1 4.22Å; M626-Y649 HydrophobicContact CE-CE2 4Å; M626-Y649 HydrophobicContact CE-CG 3.29Å
627	E	94.1	Very high	90.8	Very high	142 Å²	142	60.8 Å²	60.8	66%	0.664	34%	0.337	S	S	*	.	H	α-helix	trans	-61.1	-43.1	175.4	-64	173.8	-179.6	0	0	112.1	S625 V629 V630 Q631	S625-E627 PolarHBondContact O-N 2.88Å; E627-V629 VanDerWaalsContact C-N 3.35Å; E627-V629 PolarHBondContact O-N 3.27Å; E627-V630 PolarHBondContact O-N 3.01Å; E627-Q631 WeakPolarHBondContact O-CB 3.33Å; E627-Q631 VanDerWaalsContact O-CG 3.27Å; E627-Q631 WeakPolarHBondContact O-CG 3.3Å; E627-Q631 PolarHBondContact O-N 3.04Å
628	M	93.5	Very high	90.6	Very high	81 Å²	81	60.8 Å²	60.8	40%	0.399	34%	0.336	S	S	.	.	H	α-helix	trans	-65.6	-37.7	175.2	-71.5	-168.7	-68.7	0	0	112.1	V624 S625 Q631 A632 I675	V624-M628 HydrophobicContact CG1-CB 4.06Å; V624-M628 HydrophobicContact CG1-CE 3.94Å; S625-M628 PolarHBondContact O-N 3.34Å; S625-M628 VanDerWaalsContact O-N 3.17Å; S625-M628 PolarHBondContact OG-N 3.36Å; M628-Q631 PolarHBondContact O-N 3.29Å; M628-A632 WeakPolarHBondContact O-CB 3.49Å; M628-A632 PolarHBondContact O-N 3.3Å; M628-I675 HydrophobicContact CB-CD1 4.4Å
629	V	95.3	Very high	90.6	Very high	0 Å²	0	62.3 Å²	62.3	0%	0	34%	0.341	C	S	.	.	H	α-helix	trans	-63.4	-42.9	174.6	178.1	0	0	0	0	111.1	K614 I617 V624 S625 M626 E627 A633 Y649 I675	K614-V629 HydrophobicContact CG-CG1 4.41Å; I617-V629 HydrophobicContact CB-CG1 4.19Å; I617-V629 HydrophobicContact CD1-CG1 4.04Å; I617-V629 HydrophobicContact CG2-CG1 4.08Å; V624-V629 HydrophobicContact CG1-CG2 3.84Å; S625-V629 PolarHBondContact O-N 3.27Å; M626-V629 HydrophobicContact CE-CG1 4.34Å; M626-V629 PolarHBondContact O-N 3.03Å; M626-V629 HydrophobicContact SD-CB 4.22Å; M626-V629 HydrophobicContact SD-CG1 4.4Å; E627-V629 VanDerWaalsContact C-N 3.35Å; E627-V629 PolarHBondContact O-N 3.27Å; V629-A633 VanDerWaalsContact O-CB 3.27Å; V629-A633 WeakPolarHBondContact O-CB 3.46Å; V629-A633 PolarHBondContact O-N 3.28Å; V629-Y649 HydrophobicContact CG1-CD1 3.93Å; V629-Y649 HydrophobicContact CG1-CE1 3.88Å; V629-I675 HydrophobicContact CB-CD1 4.49Å; V629-I675 HydrophobicContact CG2-CD1 3.94Å
630	V	95.3	Very high	90.5	Very high	43 Å²	43	63.1 Å²	63.1	26%	0.261	35%	0.351	S	S	.	.	H	α-helix	trans	-64.4	-50.3	175.4	171.4	0	0	0	0	110.7	M626 E627 A632 A633 T634 Y649	M626-V630 HydrophobicContact CE-CG2 4.07Å; M626-V630 WeakPolarHBondContact O-CG2 3.48Å; M626-V630 PolarHBondContact O-N 3.5Å; E627-V630 PolarHBondContact O-N 3.01Å; V630-A632 PolarHBondContact O-N 3.09Å; V630-A633 CarbonylContact O-C 3.51Å; V630-A633 WeakPolarHBondContact O-CB 3.42Å; V630-A633 PolarHBondContact O-N 3.29Å; V630-A633 VanDerWaalsContact O-N 3.12Å; V630-T634 PolarHBondContact O-N 2.98Å; V630-T634 PolarHBondContact O-OG1 3.19Å; V630-T634 VanDerWaalsContact O-OG1 3.05Å; V630-Y649 HydrophobicContact CG2-CE2 4.07Å
631	Q	91.6	Very high	90.7	Very high	116 Å²	116	61.1 Å²	61.1	54%	0.542	33%	0.325	S	S	.	.	H	α-helix	trans	-57.7	-44.4	179	-72.8	174.1	16.3	0	0	112.6	E627 M628 T634 K635	E627-Q631 WeakPolarHBondContact O-CB 3.33Å; E627-Q631 VanDerWaalsContact O-CG 3.27Å; E627-Q631 WeakPolarHBondContact O-CG 3.3Å; E627-Q631 PolarHBondContact O-N 3.04Å; M628-Q631 PolarHBondContact O-N 3.29Å; Q631-T634 PolarHBondContact O-N 2.66Å; Q631-K635 WeakPolarHBondContact O-CB 3.41Å; Q631-K635 WeakPolarHBondContact O-CG 2.98Å; Q631-K635 PolarHBondContact O-N 2.9Å
632	A	91.9	Very high	90.9	Very high	6 Å²	6	57.9 Å²	57.9	5%	0.05	31%	0.309	C	S	.	.	H	α-helix	trans	-64.9	-39.9	176.4	0	0	0	0	0	112.2	M628 V630 A636 I675	M628-A632 WeakPolarHBondContact O-CB 3.49Å; M628-A632 PolarHBondContact O-N 3.3Å; V630-A632 PolarHBondContact O-N 3.09Å; A632-A636 WeakPolarHBondContact O-CB 3.4Å; A632-A636 PolarHBondContact O-N 3.18Å; A632-A636 VanDerWaalsContact O-N 3.07Å; A632-I675 HydrophobicContact CB-CB 3.71Å; A632-I675 HydrophobicContact CB-CD1 4.22Å; A632-I675 HydrophobicContact CB-CG1 4.06Å
633	A	93.1	Very high	91.4	Very high	0 Å²	0	56.4 Å²	56.4	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-66.2	-40.3	174.6	0	0	0	0	0	112.6	I617 V629 V630 A636 N637 A638 H639 I642 Y649	I617-A633 HydrophobicContact CD1-CB 4.21Å; V629-A633 VanDerWaalsContact O-CB 3.27Å; V629-A633 WeakPolarHBondContact O-CB 3.46Å; V629-A633 PolarHBondContact O-N 3.28Å; V630-A633 CarbonylContact O-C 3.51Å; V630-A633 WeakPolarHBondContact O-CB 3.42Å; V630-A633 PolarHBondContact O-N 3.29Å; V630-A633 VanDerWaalsContact O-N 3.12Å; A633-A636 CarbonylContact O-C 3.51Å; A633-A636 PolarHBondContact O-N 3.06Å; A633-N637 PolarHBondContact O-N 3.18Å; A633-A638 HydrophobicContact CB-CB 4.18Å; A633-A638 WeakPolarHBondContact O-CA 3.27Å; A633-A638 WeakPolarHBondContact O-CB 3.48Å; A633-A638 PolarHBondContact O-N 3.23Å; A633-H639 HydrophobicContact CB-CB 4.5Å; A633-H639 PolarHBondContact O-N 3.32Å; A633-I642 HydrophobicContact CB-CD1 4.21Å; A633-Y649 HydrophobicContact CB-CE1 3.92Å; A633-Y649 WeakPolarHBondContact CB-OH 3.43Å
634	T	90.1	Very high	91.9	Very high	79 Å²	79	53.6 Å²	53.6	49%	0.485	28%	0.284	S	S	.	.	H	α-helix	trans	-64.3	-45.3	175.3	-55.4	0	0	0	0	110.7	V630 Q631 A636 N637	V630-T634 PolarHBondContact O-N 2.98Å; V630-T634 PolarHBondContact O-OG1 3.19Å; V630-T634 VanDerWaalsContact O-OG1 3.05Å; Q631-T634 PolarHBondContact O-N 2.66Å; T634-A636 PolarHBondContact O-N 2.99Å; T634-N637 PolarHBondContact O-N 3.05Å
635	K	86.1	Confident	92.1	Very high	125 Å²	125	54 Å²	54	54%	0.543	29%	0.285	S	S	.	.	H	α-helix	trans	-59.7	-27.1	173.5	-73.9	-176.3	178.9	-169.7	0	113.5	Q631 L674 A701 I705	Q631-K635 WeakPolarHBondContact O-CB 3.41Å; Q631-K635 WeakPolarHBondContact O-CG 2.98Å; Q631-K635 PolarHBondContact O-N 2.9Å; K635-L674 HydrophobicContact CB-CD1 3.98Å; K635-A701 VanDerWaalsContact O-CB 3.25Å; K635-A701 WeakPolarHBondContact O-CB 3.45Å; K635-I705 HydrophobicContact CB-CD1 4.4Å; K635-I705 HydrophobicContact CD-CD1 4.43Å
636	A	87.8	Confident	91.9	Very high	1 Å²	1	58 Å²	58	1%	0.008	31%	0.31	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.6	10.1	176.4	0	0	0	0	0	114.2	A632 A633 T634 A638 R667 I670 A671	A632-A636 WeakPolarHBondContact O-CB 3.4Å; A632-A636 PolarHBondContact O-N 3.18Å; A632-A636 VanDerWaalsContact O-N 3.07Å; A633-A636 CarbonylContact O-C 3.51Å; A633-A636 PolarHBondContact O-N 3.06Å; T634-A636 PolarHBondContact O-N 2.99Å; A636-A638 HydrophobicContact CB-CB 4.34Å; A636-A638 PolarHBondContact O-N 3.19Å; A636-A638 VanDerWaalsContact O-N 3.13Å; A636-R667 WeakPolarHBondContact CB-O 3.45Å; A636-R667 WeakPolarHBondContact O-CD 3.4Å; A636-R667 WeakPolarHBondContact O-CG 3.37Å; A636-I670 HydrophobicContact CB-CB 4.09Å; A636-I670 HydrophobicContact CB-CG2 3.79Å; A636-A671 HydrophobicContact CB-CB 3.76Å
637	N	87.9	Confident	91.9	Very high	23 Å²	23	61.8 Å²	61.8	12%	0.123	32%	0.324	C	S	.	.	T	Hydrogen-bonded Turn	trans	53.1	27.7	-171.5	-169.3	30.1	0	0	0	113.7	A633 T634 R667 I697 V698	A633-N637 PolarHBondContact O-N 3.18Å; T634-N637 PolarHBondContact O-N 3.05Å; N637-R667 VanDerWaalsContact O-CD 3.23Å; N637-R667 WeakPolarHBondContact O-CD 3.4Å; N637-R667 PolarHBondContact O-NH1 3.5Å; N637-I697 HydrophobicContact CB-CG2 3.99Å; N637-I697 VanDerWaalsContact CG-CG2 3.46Å; N637-I697 VanDerWaalsContact ND2-CG2 3.3Å; N637-I697 WeakPolarHBondContact ND2-CG2 3.29Å; N637-V698 HydrophobicContact CB-CG2 3.99Å
638	A	90.9	Very high	91.9	Very high	0 Å²	0	55.9 Å²	55.9	0%	0	30%	0.301	C	S	.	.			trans	-95.8	-28	-175.5	0	0	0	0	0	113	A633 A636 D640 F641 I642 R667	A633-A638 HydrophobicContact CB-CB 4.18Å; A633-A638 WeakPolarHBondContact O-CA 3.27Å; A633-A638 WeakPolarHBondContact O-CB 3.48Å; A633-A638 PolarHBondContact O-N 3.23Å; A636-A638 HydrophobicContact CB-CB 4.34Å; A636-A638 PolarHBondContact O-N 3.19Å; A636-A638 VanDerWaalsContact O-N 3.13Å; A638-D640 PolarHBondContact O-N 2.98Å; A638-F641 HydrophobicContact CB-CD1 4.43Å; A638-F641 HydrophobicContact CB-CE1 3.79Å; A638-F641 WeakPolarHBondContact O-CD1 3.41Å; A638-F641 WeakPolarHBondContact O-CE1 3.44Å; A638-F641 PolarHBondContact O-N 3.21Å; A638-I642 HydrophobicContact CB-CD1 3.75Å; A638-I642 WeakPolarHBondContact O-CD1 3.49Å; A638-I642 WeakPolarHBondContact O-CG1 3.36Å; A638-I642 PolarHBondContact O-N 3.25Å; A638-I642 VanDerWaalsContact O-N 3.07Å; A638-R667 HydrophobicContact CB-CB 4.05Å
639	H	93.8	Very high	92	Very high	51 Å²	51	52.9 Å²	52.9	24%	0.236	29%	0.286	C	S	.	.	H	α-helix	trans	-51.9	-49.8	-172.2	-178.2	71.1	0	0	0	113.3	A633 F641 I642 T643 Y649	A633-H639 HydrophobicContact CB-CB 4.5Å; A633-H639 PolarHBondContact O-N 3.32Å; H639-F641 PolarHBondContact O-N 3.49Å; H639-I642 PolarHBondContact O-N 3.48Å; H639-I642 VanDerWaalsContact O-N 3.1Å; H639-T643 WeakPolarHBondContact O-CG2 3.36Å; H639-T643 PolarHBondContact O-N 3.42Å; H639-T643 PolarHBondContact O-OG1 3.34Å; H639-Y649 AromaticContact ND1-CE2 3.9Å; H639-Y649 AromaticContact ND1-CZ 3.83Å; H639-Y649 PolarHBondContact ND1-OH 3.19Å
640	D	90.4	Very high	92	Very high	99 Å²	99	57.8 Å²	57.8	53%	0.529	31%	0.312	S	S	.	.	H	α-helix	trans	-65.3	-44.1	-171.3	-54.7	-12.8	0	0	0	112.3	A638 I642 T643 T644	A638-D640 PolarHBondContact O-N 2.98Å; D640-I642 VanDerWaalsContact C-N 3.32Å; D640-I642 PolarHBondContact O-N 3.17Å; D640-T643 PolarHBondContact O-N 2.85Å; D640-T643 PolarHBondContact O-OG1 2.92Å; D640-T644 WeakPolarHBondContact O-CG2 3.36Å; D640-T644 PolarHBondContact O-N 2.93Å; D640-T644 PolarHBondContact O-OG1 3.39Å
641	F	90.1	Very high	92	Very high	18 Å²	18	56.7 Å²	56.7	8%	0.079	31%	0.305	C	S	.	.	H	α-helix	trans	-70.3	-33.1	175.2	91.3	-102.5	0	0	0	111.1	A638 H639 T644 L645 L660 Q664 R667 V668	A638-F641 HydrophobicContact CB-CD1 4.43Å; A638-F641 HydrophobicContact CB-CE1 3.79Å; A638-F641 WeakPolarHBondContact O-CD1 3.41Å; A638-F641 WeakPolarHBondContact O-CE1 3.44Å; A638-F641 PolarHBondContact O-N 3.21Å; H639-F641 PolarHBondContact O-N 3.49Å; F641-T644 WeakPolarHBondContact CA-OG1 3.47Å; F641-T644 PolarHBondContact O-N 3.48Å; F641-T644 PolarHBondContact O-OG1 3.34Å; F641-L645 HydrophobicContact CD2-CD1 4.48Å; F641-L645 HydrophobicContact CE2-CD1 4.46Å; F641-L645 WeakPolarHBondContact O-CG 3.43Å; F641-L645 PolarHBondContact O-N 2.83Å; F641-L660 HydrophobicContact CE2-CD2 4.24Å; F641-Q664 HydrophobicContact CD1-CG 4.27Å; F641-Q664 HydrophobicContact CD2-CB 4.46Å; F641-Q664 HydrophobicContact CD2-CG 3.78Å; F641-Q664 HydrophobicContact CE1-CB 4.28Å; F641-Q664 HydrophobicContact CE1-CG 4.14Å; F641-Q664 HydrophobicContact CE2-CB 3.84Å; F641-Q664 HydrophobicContact CE2-CG 3.67Å; F641-Q664 HydrophobicContact CG-CG 4.1Å; F641-Q664 HydrophobicContact CZ-CB 3.73Å; F641-Q664 HydrophobicContact CZ-CG 3.85Å; F641-R667 HydrophobicContact CE1-CB 4.1Å; F641-V668 HydrophobicContact CZ-CG2 3.94Å
642	I	95	Very high	92	Very high	0 Å²	0	53.8 Å²	53.8	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-65	-43.3	177.4	-66.4	164.3	0	0	0	110.5	I613 I617 A633 A638 H639 D640 T644 L645 G648 Y649	I613-I642 HydrophobicContact CD1-CG1 4.24Å; I613-I642 HydrophobicContact CD1-CG2 4.36Å; I613-I642 HydrophobicContact CG2-CD1 3.7Å; I613-I642 HydrophobicContact CG2-CG1 4.07Å; I613-I642 HydrophobicContact CG2-CG2 4.38Å; I617-I642 HydrophobicContact CD1-CD1 4.35Å; A633-I642 HydrophobicContact CB-CD1 4.21Å; A638-I642 HydrophobicContact CB-CD1 3.75Å; A638-I642 WeakPolarHBondContact O-CD1 3.49Å; A638-I642 WeakPolarHBondContact O-CG1 3.36Å; A638-I642 PolarHBondContact O-N 3.25Å; A638-I642 VanDerWaalsContact O-N 3.07Å; H639-I642 PolarHBondContact O-N 3.48Å; H639-I642 VanDerWaalsContact O-N 3.1Å; D640-I642 VanDerWaalsContact C-N 3.32Å; D640-I642 PolarHBondContact O-N 3.17Å; I642-T644 VanDerWaalsContact C-N 3.3Å; I642-T644 PolarHBondContact O-N 3.5Å; I642-L645 WeakPolarHBondContact O-CB 3.41Å; I642-L645 PolarHBondContact O-N 2.81Å; I642-L645 VanDerWaalsContact O-N 3.17Å; I642-G648 VanDerWaalsContact O-CA 3.29Å; I642-G648 WeakPolarHBondContact O-CA 3.42Å; I642-Y649 HydrophobicContact CD1-CD1 4.43Å; I642-Y649 HydrophobicContact CD1-CE1 3.92Å; I642-Y649 HydrophobicContact CG2-CD1 3.77Å; I642-Y649 HydrophobicContact CG2-CD2 3.65Å; I642-Y649 HydrophobicContact CG2-CE1 3.94Å; I642-Y649 HydrophobicContact CG2-CE2 3.81Å; I642-Y649 HydrophobicContact CG2-CG 3.62Å
643	T	94.3	Very high	91.9	Very high	76 Å²	76	53.6 Å²	53.6	47%	0.466	30%	0.296	S	S	.	.	H	α-helix	trans	-69.5	-25.2	-179.7	54.9	0	0	0	0	113.5	H639 D640 L645	H639-T643 WeakPolarHBondContact O-CG2 3.36Å; H639-T643 PolarHBondContact O-N 3.42Å; H639-T643 PolarHBondContact O-OG1 3.34Å; D640-T643 PolarHBondContact O-N 2.85Å; D640-T643 PolarHBondContact O-OG1 2.92Å; T643-L645 VanDerWaalsContact C-N 3.3Å
644	T	93.3	Very high	91.6	Very high	113 Å²	113	54.2 Å²	54.2	69%	0.693	30%	0.303	S	S	*	.	H	α-helix	trans	-76	-12.1	172.1	56.3	0	0	0	0	114.3	D640 F641 I642	D640-T644 WeakPolarHBondContact O-CG2 3.36Å; D640-T644 PolarHBondContact O-N 2.93Å; D640-T644 PolarHBondContact O-OG1 3.39Å; F641-T644 WeakPolarHBondContact CA-OG1 3.47Å; F641-T644 PolarHBondContact O-N 3.48Å; F641-T644 PolarHBondContact O-OG1 3.34Å; I642-T644 VanDerWaalsContact C-N 3.3Å; I642-T644 PolarHBondContact O-N 3.5Å
645	L	93.2	Very high	91.2	Very high	39 Å²	39	57.1 Å²	57.1	20%	0.204	31%	0.311	C	S	.	.	S	Bend	trans	-72.5	145.3	175.2	-65.3	169.5	0	0	0	111.3	I613 F641 I642 T643 K647 G648 T651 L660	I613-L645 HydrophobicContact CD1-CD1 3.39Å; F641-L645 HydrophobicContact CD2-CD1 4.48Å; F641-L645 HydrophobicContact CE2-CD1 4.46Å; F641-L645 WeakPolarHBondContact O-CG 3.43Å; F641-L645 PolarHBondContact O-N 2.83Å; I642-L645 WeakPolarHBondContact O-CB 3.41Å; I642-L645 PolarHBondContact O-N 2.81Å; I642-L645 VanDerWaalsContact O-N 3.17Å; T643-L645 VanDerWaalsContact C-N 3.3Å; L645-K647 PolarHBondContact O-N 3.38Å; L645-G648 PolarHBondContact O-N 3.31Å; L645-T651 HydrophobicContact CB-CG2 4.46Å; L645-T651 WeakPolarHBondContact CB-OG1 3.42Å; L645-T651 HydrophobicContact CD1-CG2 4.14Å; L645-L660 HydrophobicContact CD1-CD2 4.43Å
646	P	88.3	Confident	90.7	Very high	133 Å²	133	57.9 Å²	57.9	86%	0.864	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.7	-17.6	-175.1	-28	35.3	0	0	0	116.7
647	K	93.5	Very high	90.1	Very high	153 Å²	153	57.8 Å²	57.8	67%	0.665	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-123.3	13.6	176	-63.9	-174.3	176.7	-175.3	0	113	L645 Y649 D650	L645-K647 PolarHBondContact O-N 3.38Å; K647-Y649 PolarHBondContact O-N 2.91Å; K647-D650 PolarHBondContact O-N 2.93Å
648	G	94.8	Very high	89.7	Confident	17 Å²	17	63 Å²	63	18%	0.175	34%	0.341	C	S	.	.	G	3₁₀ helix	trans	53.9	-130.8	-177.2	0	0	0	0	0	112.3	I642 L645 D650 T651	I642-G648 VanDerWaalsContact O-CA 3.29Å; I642-G648 WeakPolarHBondContact O-CA 3.42Å; L645-G648 PolarHBondContact O-N 3.31Å; G648-D650 VanDerWaalsContact C-N 3.28Å; G648-D650 PolarHBondContact O-N 3.29Å; G648-T651 VanDerWaalsContact O-CB 3.29Å; G648-T651 WeakPolarHBondContact O-CB 3.49Å; G648-T651 PolarHBondContact O-N 3.01Å; G648-T651 PolarHBondContact O-OG1 3.29Å
649	Y	95.4	Very high	89.3	Confident	19 Å²	19	69.7 Å²	69.7	8%	0.075	37%	0.372	C	S	.	.	G	3₁₀ helix	trans	-67.1	-21.1	176.3	-75	-92.6	0	0	0	114.9	I613 K614 I617 M626 V629 V630 A633 H639 I642 K647 T651	I613-Y649 HydrophobicContact CG2-CD1 4.37Å; I613-Y649 PolarHBondContact N-O 3.47Å; K614-Y649 PolarHBondContact N-O 2.97Å; I617-Y649 HydrophobicContact CD1-CD1 4.45Å; I617-Y649 HydrophobicContact CD1-CE1 4.16Å; M626-Y649 HydrophobicContact CE-CD1 3.71Å; M626-Y649 HydrophobicContact CE-CD2 3.45Å; M626-Y649 VanDerWaalsContact CE-CD2 3.45Å; M626-Y649 HydrophobicContact CE-CE1 4.22Å; M626-Y649 HydrophobicContact CE-CE2 4Å; M626-Y649 HydrophobicContact CE-CG 3.29Å; V629-Y649 HydrophobicContact CG1-CD1 3.93Å; V629-Y649 HydrophobicContact CG1-CE1 3.88Å; V630-Y649 HydrophobicContact CG2-CE2 4.07Å; A633-Y649 HydrophobicContact CB-CE1 3.92Å; A633-Y649 WeakPolarHBondContact CB-OH 3.43Å; H639-Y649 AromaticContact ND1-CE2 3.9Å; H639-Y649 AromaticContact ND1-CZ 3.83Å; H639-Y649 PolarHBondContact ND1-OH 3.19Å; I642-Y649 HydrophobicContact CD1-CD1 4.43Å; I642-Y649 HydrophobicContact CD1-CE1 3.92Å; I642-Y649 HydrophobicContact CG2-CD1 3.77Å; I642-Y649 HydrophobicContact CG2-CD2 3.65Å; I642-Y649 HydrophobicContact CG2-CE1 3.94Å; I642-Y649 HydrophobicContact CG2-CE2 3.81Å; I642-Y649 HydrophobicContact CG2-CG 3.62Å; K647-Y649 PolarHBondContact O-N 2.91Å; Y649-T651 PolarHBondContact O-N 3.2Å
650	D	95.6	Very high	88.9	Confident	102 Å²	102	67.9 Å²	67.9	55%	0.545	36%	0.364	S	S	.	.	G	3₁₀ helix	trans	-85.1	5.7	176.8	-60.7	-43.3	0	0	0	112.4	K647 G648 S652	K647-D650 PolarHBondContact O-N 2.93Å; G648-D650 VanDerWaalsContact C-N 3.28Å; G648-D650 PolarHBondContact O-N 3.29Å; D650-S652 PolarHBondContact O-N 2.92Å
651	T	94.4	Very high	88.7	Confident	20 Å²	20	66.2 Å²	66.2	12%	0.123	36%	0.36	C	S	.	.			trans	-63.8	124.3	170.5	-53.5	0	0	0	0	109.7	T612 I613 L645 G648 Y649	T612-T651 CarbonylContact C-O 3.48Å; T612-T651 VanDerWaalsContact CA-O 3.3Å; T612-T651 WeakPolarHBondContact CA-O 3.44Å; I613-T651 PolarHBondContact N-O 3.2Å; L645-T651 HydrophobicContact CB-CG2 4.46Å; L645-T651 WeakPolarHBondContact CB-OG1 3.42Å; L645-T651 HydrophobicContact CD1-CG2 4.14Å; G648-T651 VanDerWaalsContact O-CB 3.29Å; G648-T651 WeakPolarHBondContact O-CB 3.49Å; G648-T651 PolarHBondContact O-N 3.01Å; G648-T651 PolarHBondContact O-OG1 3.29Å; Y649-T651 PolarHBondContact O-N 3.2Å
652	S	92.8	Very high	88.4	Confident	56 Å²	56	67.1 Å²	67.1	39%	0.392	37%	0.374	S	S	.	.	B	Isolated β-bridge	trans	-75.5	135.8	172.1	-176.8	0	0	0	0	110	R611 D650 Q659	R611-S652 WeakPolarHBondContact O-CA 3.26Å; D650-S652 PolarHBondContact O-N 2.92Å; S652-Q659 PolarHBondContact O-OE1 3.11Å
653	V	89.6	Confident	88	Confident	1 Å²	1	67.3 Å²	67.3	1%	0.006	38%	0.376	C	S	.	.			trans	-89.2	-9	-176	-57.2	0	0	0	0	114.1	L608 F609 R611 I613 G657 L658 Q659 L660	L608-V653 HydrophobicContact CB-CG2 3.97Å; L608-V653 HydrophobicContact CD1-CG1 4.43Å; L608-V653 HydrophobicContact CD1-CG2 4.43Å; F609-V653 WeakPolarHBondContact O-CG2 3.35Å; R611-V653 PolarHBondContact O-N 2.88Å; R611-V653 VanDerWaalsContact O-N 3.08Å; I613-V653 HydrophobicContact CD1-CG1 4.38Å; I613-V653 HydrophobicContact CG1-CG1 3.47Å; I613-V653 VanDerWaalsContact CG1-CG1 3.47Å; V653-G657 CarbonylContact O-C 3.44Å; V653-G657 WeakPolarHBondContact O-CA 3.35Å; V653-L658 PolarHBondContact O-N 3.21Å; V653-Q659 WeakPolarHBondContact O-CB 3.29Å; V653-Q659 PolarHBondContact O-N 2.73Å; V653-Q659 VanDerWaalsContact O-N 3.12Å; V653-L660 HydrophobicContact CB-CD1 4.26Å; V653-L660 HydrophobicContact CB-CG 4.45Å; V653-L660 HydrophobicContact CG1-CD1 3.68Å; V653-L660 HydrophobicContact CG1-CG 4.21Å
654	G	86.5	Confident	87.7	Confident	14 Å²	14	65.8 Å²	65.8	14%	0.144	36%	0.364	C	S	.	.			trans	73.8	-179.3	-175	0	0	0	0	0	114.3	A610 K656 G657	A610-G654 WeakPolarHBondContact CA-O 3.47Å; G654-K656 PolarHBondContact O-N 3.21Å; G654-G657 PolarHBondContact O-N 3.42Å; G654-G657 VanDerWaalsContact O-N 3.15Å
655	E	81.4	Confident	87.5	Confident	140 Å²	140	62.2 Å²	62.2	65%	0.654	34%	0.339	S	S	*	.	G	3₁₀ helix	trans	-61.8	132.8	178.7	-166.1	-177.6	162.5	0	0	111	G657 L658	E655-G657 PolarHBondContact O-N 3.38Å; E655-L658 WeakPolarHBondContact O-CB 3.29Å; E655-L658 WeakPolarHBondContact O-CD1 3.5Å; E655-L658 WeakPolarHBondContact O-CG 3.45Å; E655-L658 PolarHBondContact O-N 2.98Å
656	K	75.6	Confident	87.3	Confident	140 Å²	140	60.4 Å²	60.4	61%	0.609	33%	0.329	S	S	*	.	G	3₁₀ helix	trans	47.9	28	-173.5	-61	-178.3	-177.9	-176.5	0	113.6	L608 G654 L658 K665	L608-K656 CarbonylContact O-C 3.59Å; L608-K656 VanDerWaalsContact O-CA 3.3Å; L608-K656 WeakPolarHBondContact O-CA 3.46Å; G654-K656 PolarHBondContact O-N 3.21Å; K656-L658 VanDerWaalsContact C-N 3.29Å; K656-L658 PolarHBondContact O-N 2.9Å; K656-K665 PolarHBondContact O-NZ 3.46Å
657	G	76.5	Confident	87.4	Confident	0 Å²	0	55.3 Å²	55.3	0%	0	29%	0.293	C	S	.	.	G	3₁₀ helix	trans	64.1	23	-176.8	0	0	0	0	0	115.3	L608 V653 G654 E655 Q659 L660 K665	L608-G657 PolarHBondContact O-N 2.84Å; V653-G657 CarbonylContact O-C 3.44Å; V653-G657 WeakPolarHBondContact O-CA 3.35Å; G654-G657 PolarHBondContact O-N 3.42Å; G654-G657 VanDerWaalsContact O-N 3.15Å; E655-G657 PolarHBondContact O-N 3.38Å; G657-Q659 PolarHBondContact O-N 2.96Å; G657-L660 PolarHBondContact O-N 3.33Å; G657-K665 WeakPolarHBondContact O-CE 3.44Å; G657-K665 PolarHBondContact O-NZ 2.85Å
658	L	78.9	Confident	87.4	Confident	133 Å²	133	48 Å²	48	70%	0.696	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.2	-17.5	-172.6	-81.7	167.1	0	0	0	116.1	V653 E655 K656 L660	V653-L658 PolarHBondContact O-N 3.21Å; E655-L658 WeakPolarHBondContact O-CB 3.29Å; E655-L658 WeakPolarHBondContact O-CD1 3.5Å; E655-L658 WeakPolarHBondContact O-CG 3.45Å; E655-L658 PolarHBondContact O-N 2.98Å; K656-L658 VanDerWaalsContact C-N 3.29Å; K656-L658 PolarHBondContact O-N 2.9Å; L658-L660 VanDerWaalsContact C-N 3.33Å
659	Q	81.3	Confident	87.2	Confident	139 Å²	139	47.3 Å²	47.3	65%	0.65	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.5	-6.7	177.1	-58.6	-170.9	-0.9	0	0	114.2	S652 V653 G657	S652-Q659 PolarHBondContact O-OE1 3.11Å; V653-Q659 WeakPolarHBondContact O-CB 3.29Å; V653-Q659 PolarHBondContact O-N 2.73Å; V653-Q659 VanDerWaalsContact O-N 3.12Å; G657-Q659 PolarHBondContact O-N 2.96Å
660	L	85.7	Confident	87	Confident	13 Å²	13	46.5 Å²	46.5	7%	0.068	25%	0.25	C	S	.	.	S	Bend	trans	-110.1	146.3	178.4	-63.4	-177.4	0	0	0	111.7	L608 F641 L645 V653 G657 L658 Q664 K665 V668	L608-L660 HydrophobicContact CD1-CD1 3.89Å; F641-L660 HydrophobicContact CE2-CD2 4.24Å; L645-L660 HydrophobicContact CD1-CD2 4.43Å; V653-L660 HydrophobicContact CB-CD1 4.26Å; V653-L660 HydrophobicContact CB-CG 4.45Å; V653-L660 HydrophobicContact CG1-CD1 3.68Å; V653-L660 HydrophobicContact CG1-CG 4.21Å; G657-L660 PolarHBondContact O-N 3.33Å; L658-L660 VanDerWaalsContact C-N 3.33Å; L660-Q664 HydrophobicContact CB-CB 3.98Å; L660-Q664 HydrophobicContact CD2-CB 4.45Å; L660-K665 HydrophobicContact CB-CG 3.88Å; L660-K665 WeakPolarHBondContact O-CE 3.38Å; L660-V668 HydrophobicContact CD1-CG2 4.2Å
661	S	87	Confident	86.9	Confident	64 Å²	64	41.6 Å²	41.6	45%	0.448	22%	0.224	S	C	.	.			trans	-66.5	160.7	171.7	78.4	0	0	0	0	111.8	G663 Q664 K665	S661-G663 PolarHBondContact O-N 3.47Å; S661-Q664 WeakPolarHBondContact O-CB 3.45Å; S661-Q664 PolarHBondContact O-N 3Å; S661-Q664 VanDerWaalsContact OG-CG 3.31Å; S661-Q664 WeakPolarHBondContact OG-CG 3.4Å; S661-Q664 PolarHBondContact OG-N 3.39Å; S661-Q664 PolarHBondContact OG-OE1 3.41Å; S661-K665 WeakPolarHBondContact O-CG 3.46Å; S661-K665 PolarHBondContact O-N 3.25Å
662	G	84.3	Confident	86.8	Confident	37 Å²	37	42.9 Å²	42.9	38%	0.381	23%	0.227	S	C	.	.	H	α-helix	trans	-51.1	-53.6	-179.3	0	0	0	0	0	113.1	Q664 K665 Q666	G662-Q664 VanDerWaalsContact C-N 3.33Å; G662-Q664 PolarHBondContact O-N 3.42Å; G662-K665 WeakPolarHBondContact O-CB 3.43Å; G662-K665 PolarHBondContact O-N 2.92Å; G662-K665 VanDerWaalsContact O-N 3.15Å; G662-Q666 PolarHBondContact O-N 3.45Å
663	G	84.8	Confident	86.8	Confident	4 Å²	4	40.5 Å²	40.5	4%	0.041	21%	0.21	C	C	.	.	H	α-helix	trans	-65.6	-27.4	176.4	0	0	0	0	0	115	S661 R667 A689	S661-G663 PolarHBondContact O-N 3.47Å; G663-R667 WeakPolarHBondContact O-CG 3.31Å; G663-R667 PolarHBondContact O-N 3.32Å; G663-R667 VanDerWaalsContact O-N 3.08Å; G663-A689 WeakPolarHBondContact CA-O 3.33Å; G663-A689 PolarHBondContact N-O 3.25Å; G663-A689 VanDerWaalsContact N-O 3.17Å
664	Q	88.6	Confident	86.8	Confident	45 Å²	45	41.3 Å²	41.3	21%	0.21	22%	0.215	C	C	.	.	H	α-helix	trans	-68.8	-42.2	170.4	-74.8	171.3	-18.1	0	0	111.3	F641 L660 S661 G662 R667 V668	F641-Q664 HydrophobicContact CD1-CG 4.27Å; F641-Q664 HydrophobicContact CD2-CB 4.46Å; F641-Q664 HydrophobicContact CD2-CG 3.78Å; F641-Q664 HydrophobicContact CE1-CB 4.28Å; F641-Q664 HydrophobicContact CE1-CG 4.14Å; F641-Q664 HydrophobicContact CE2-CB 3.84Å; F641-Q664 HydrophobicContact CE2-CG 3.67Å; F641-Q664 HydrophobicContact CG-CG 4.1Å; F641-Q664 HydrophobicContact CZ-CB 3.73Å; F641-Q664 HydrophobicContact CZ-CG 3.85Å; L660-Q664 HydrophobicContact CB-CB 3.98Å; L660-Q664 HydrophobicContact CD2-CB 4.45Å; S661-Q664 WeakPolarHBondContact O-CB 3.45Å; S661-Q664 PolarHBondContact O-N 3Å; S661-Q664 VanDerWaalsContact OG-CG 3.31Å; S661-Q664 WeakPolarHBondContact OG-CG 3.4Å; S661-Q664 PolarHBondContact OG-N 3.39Å; S661-Q664 PolarHBondContact OG-OE1 3.41Å; G662-Q664 VanDerWaalsContact C-N 3.33Å; G662-Q664 PolarHBondContact O-N 3.42Å; Q664-R667 PolarHBondContact O-N 2.98Å; Q664-V668 WeakPolarHBondContact O-CG2 3.37Å; Q664-V668 PolarHBondContact O-N 2.88Å
665	K	90.1	Very high	87.1	Confident	37 Å²	37	41.6 Å²	41.6	16%	0.161	21%	0.213	C	C	.	.	H	α-helix	trans	-62.3	-42.9	174.6	-60	-177.2	-161	-159.2	0	111.7	P606 L608 K656 G657 L660 S661 G662 V668 A669	P606-K665 HydrophobicContact CG-CB 3.78Å; L608-K665 HydrophobicContact CD1-CB 4.27Å; L608-K665 HydrophobicContact CD1-CG 4.18Å; K656-K665 PolarHBondContact O-NZ 3.46Å; G657-K665 WeakPolarHBondContact O-CE 3.44Å; G657-K665 PolarHBondContact O-NZ 2.85Å; L660-K665 HydrophobicContact CB-CG 3.88Å; L660-K665 WeakPolarHBondContact O-CE 3.38Å; S661-K665 WeakPolarHBondContact O-CG 3.46Å; S661-K665 PolarHBondContact O-N 3.25Å; G662-K665 WeakPolarHBondContact O-CB 3.43Å; G662-K665 PolarHBondContact O-N 2.92Å; G662-K665 VanDerWaalsContact O-N 3.15Å; K665-V668 PolarHBondContact O-N 3.07Å; K665-A669 WeakPolarHBondContact O-CB 3.23Å; K665-A669 PolarHBondContact O-N 3.36Å
666	Q	88.5	Confident	87.5	Confident	1 Å²	1	38.3 Å²	38.3	1%	0.005	19%	0.194	C	C	.	.	H	α-helix	trans	-58.5	-48.5	175.6	-77.2	-177.6	-30.5	0	0	110.8	Q604 P606 G662 V668 A669 I670 E685 A686 A689 L690	Q604-Q666 PolarHBondContact O-NE2 3.25Å; P606-Q666 HydrophobicContact CG-CB 4.39Å; P606-Q666 HydrophobicContact CG-CG 3.68Å; G662-Q666 PolarHBondContact O-N 3.45Å; Q666-V668 PolarHBondContact O-N 2.95Å; Q666-A669 PolarHBondContact O-N 3.49Å; Q666-A669 VanDerWaalsContact O-N 3.14Å; Q666-I670 VanDerWaalsContact O-CG1 3.3Å; Q666-I670 WeakPolarHBondContact O-CG1 3.27Å; Q666-I670 PolarHBondContact O-N 2.87Å; Q666-E685 PolarHBondContact NE2-O 3.45Å; Q666-A686 PolarHBondContact OE1-O 3.45Å; Q666-A689 VanDerWaalsContact OE1-N 3.15Å; Q666-L690 HydrophobicContact CB-CD1 4.22Å
667	R	90	Very high	88.1	Confident	27 Å²	27	39 Å²	39	10%	0.102	20%	0.2	C	C	.	.	H	α-helix	trans	-60.9	-39.5	176.5	-73.5	-171.6	-78.3	-178.9	-15.4	114.1	A636 N637 A638 F641 G663 Q664 I670 A671 L690 V698	A636-R667 WeakPolarHBondContact CB-O 3.45Å; A636-R667 WeakPolarHBondContact O-CD 3.4Å; A636-R667 WeakPolarHBondContact O-CG 3.37Å; N637-R667 VanDerWaalsContact O-CD 3.23Å; N637-R667 WeakPolarHBondContact O-CD 3.4Å; N637-R667 PolarHBondContact O-NH1 3.5Å; A638-R667 HydrophobicContact CB-CB 4.05Å; F641-R667 HydrophobicContact CE1-CB 4.1Å; G663-R667 WeakPolarHBondContact O-CG 3.31Å; G663-R667 PolarHBondContact O-N 3.32Å; G663-R667 VanDerWaalsContact O-N 3.08Å; Q664-R667 PolarHBondContact O-N 2.98Å; R667-I670 PolarHBondContact O-N 3.14Å; R667-A671 PolarHBondContact O-N 3.02Å; R667-L690 HydrophobicContact CG-CD2 4.24Å; R667-V698 HydrophobicContact CG-CG2 3.89Å
668	V	93.2	Very high	88.8	Confident	0 Å²	0	39.2 Å²	39.2	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-66.3	-38.8	173.8	175.8	0	0	0	0	111.7	L608 I613 N616 I617 F641 L660 Q664 K665 Q666 A671 R672	L608-V668 HydrophobicContact CD1-CB 4.13Å; L608-V668 HydrophobicContact CD1-CG1 4Å; L608-V668 HydrophobicContact CD2-CB 4.29Å; L608-V668 HydrophobicContact CD2-CG1 3.76Å; I613-V668 HydrophobicContact CG2-CG2 4.24Å; N616-V668 HydrophobicContact CB-CG1 4.19Å; I617-V668 HydrophobicContact CG1-CG1 4.07Å; F641-V668 HydrophobicContact CZ-CG2 3.94Å; L660-V668 HydrophobicContact CD1-CG2 4.2Å; Q664-V668 WeakPolarHBondContact O-CG2 3.37Å; Q664-V668 PolarHBondContact O-N 2.88Å; K665-V668 PolarHBondContact O-N 3.07Å; Q666-V668 PolarHBondContact O-N 2.95Å; V668-A671 PolarHBondContact O-N 3.4Å; V668-R672 WeakPolarHBondContact O-CB 3.39Å; V668-R672 PolarHBondContact O-N 3.21Å
669	A	92.1	Very high	89.5	Confident	2 Å²	2	38.5 Å²	38.5	2%	0.017	19%	0.189	C	C	.	.	H	α-helix	trans	-68.6	-35.7	176.6	0	0	0	0	0	112.9	V602 P606 K665 Q666 R672 A673	V602-A669 HydrophobicContact CG1-CB 4.39Å; P606-A669 HydrophobicContact CB-CB 3.47Å; P606-A669 VanDerWaalsContact CB-CB 3.47Å; P606-A669 HydrophobicContact CG-CB 4.5Å; K665-A669 WeakPolarHBondContact O-CB 3.23Å; K665-A669 PolarHBondContact O-N 3.36Å; Q666-A669 PolarHBondContact O-N 3.49Å; Q666-A669 VanDerWaalsContact O-N 3.14Å; A669-R672 WeakPolarHBondContact O-CB 3.44Å; A669-R672 PolarHBondContact O-N 3.01Å; A669-A673 PolarHBondContact O-N 2.91Å
670	I	90.4	Very high	90.1	Very high	1 Å²	1	31.9 Å²	31.9	1%	0.005	16%	0.158	C	C	.	.	H	α-helix	trans	-63.5	-47	171.2	-66.3	164.4	0	0	0	109.8	V602 A636 Q666 R667 R672 A673 L674 V698 L702	V602-I670 HydrophobicContact CG1-CG1 3.93Å; V602-I670 HydrophobicContact CG2-CG1 4.18Å; A636-I670 HydrophobicContact CB-CB 4.09Å; A636-I670 HydrophobicContact CB-CG2 3.79Å; Q666-I670 VanDerWaalsContact O-CG1 3.3Å; Q666-I670 WeakPolarHBondContact O-CG1 3.27Å; Q666-I670 PolarHBondContact O-N 2.87Å; R667-I670 PolarHBondContact O-N 3.14Å; I670-R672 VanDerWaalsContact C-N 3.3Å; I670-R672 PolarHBondContact O-N 3.33Å; I670-A673 WeakPolarHBondContact O-CB 3.3Å; I670-A673 PolarHBondContact O-N 3.5Å; I670-A673 VanDerWaalsContact O-N 3.07Å; I670-L674 HydrophobicContact CG2-CD1 3.8Å; I670-L674 HydrophobicContact CG2-CG 4.12Å; I670-L674 WeakPolarHBondContact O-CG 3.29Å; I670-L674 PolarHBondContact O-N 3.31Å; I670-V698 HydrophobicContact CD1-CG1 3.68Å; I670-L702 HydrophobicContact CG2-CD2 4.18Å
671	A	92.3	Very high	90.5	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-57.9	-41.1	175.1	0	0	0	0	0	112.5	I617 A636 R667 V668 A673 L674 I675	I617-A671 HydrophobicContact CD1-CB 4.1Å; I617-A671 HydrophobicContact CG1-CB 4.02Å; I617-A671 HydrophobicContact CG2-CB 4.17Å; A636-A671 HydrophobicContact CB-CB 3.76Å; R667-A671 PolarHBondContact O-N 3.02Å; V668-A671 PolarHBondContact O-N 3.4Å; A671-A673 VanDerWaalsContact C-N 3.33Å; A671-A673 PolarHBondContact O-N 3.12Å; A671-L674 PolarHBondContact O-N 3.09Å; A671-I675 PolarHBondContact O-N 3.47Å
672	R	93.8	Very high	90.8	Very high	47 Å²	47	28.3 Å²	28.3	18%	0.177	13%	0.134	C	C	.	.	H	α-helix	trans	-62.8	-32.8	174.6	179.3	-179.8	64.8	-167.9	-1.8	113.4	V607 N616 V668 A669 I670	V607-R672 PolarHBondContact O-NH1 2.9Å; V607-R672 PolarHBondContact O-NH2 3.36Å; N616-R672 WeakPolarHBondContact O-CD 3.45Å; N616-R672 WeakPolarHBondContact O-CG 3.46Å; V668-R672 WeakPolarHBondContact O-CB 3.39Å; V668-R672 PolarHBondContact O-N 3.21Å; A669-R672 WeakPolarHBondContact O-CB 3.44Å; A669-R672 PolarHBondContact O-N 3.01Å; I670-R672 VanDerWaalsContact C-N 3.3Å; I670-R672 PolarHBondContact O-N 3.33Å
673	A	91.6	Very high	91	Very high	5 Å²	5	27 Å²	27	4%	0.041	12%	0.118	C	C	.	.	H	α-helix	trans	-74.8	-48.3	172.9	0	0	0	0	0	111.3	A600 V602 A669 I670 A671 I675 R676 P678 L681	A600-A673 HydrophobicContact CB-CB 3.94Å; V602-A673 HydrophobicContact CG2-CB 3.71Å; A669-A673 PolarHBondContact O-N 2.91Å; I670-A673 WeakPolarHBondContact O-CB 3.3Å; I670-A673 PolarHBondContact O-N 3.5Å; I670-A673 VanDerWaalsContact O-N 3.07Å; A671-A673 VanDerWaalsContact C-N 3.33Å; A671-A673 PolarHBondContact O-N 3.12Å; A673-I675 PolarHBondContact O-N 3.45Å; A673-R676 PolarHBondContact O-N 3.04Å; A673-P678 WeakPolarHBondContact O-CD 3.41Å; A673-L681 HydrophobicContact CB-CD1 4.22Å
674	L	90	Very high	91.3	Very high	19 Å²	19	27.8 Å²	27.8	10%	0.099	12%	0.121	C	C	.	.	H	α-helix	trans	-66.5	-33.1	-174.3	-67.5	-179	0	0	0	114	K635 I670 A671 R676 Q677 I705	K635-L674 HydrophobicContact CB-CD1 3.98Å; I670-L674 HydrophobicContact CG2-CD1 3.8Å; I670-L674 HydrophobicContact CG2-CG 4.12Å; I670-L674 WeakPolarHBondContact O-CG 3.29Å; I670-L674 PolarHBondContact O-N 3.31Å; A671-L674 PolarHBondContact O-N 3.09Å; L674-R676 PolarHBondContact O-N 2.71Å; L674-Q677 PolarHBondContact O-N 3.07Å; L674-Q677 VanDerWaalsContact O-N 3.11Å; L674-I705 HydrophobicContact CD1-CD1 3.61Å; L674-I705 HydrophobicContact CD2-CD1 3.77Å; L674-I705 HydrophobicContact CD2-CG2 4.03Å; L674-I705 HydrophobicContact CG-CD1 4.33Å
675	I	92.3	Very high	90.8	Very high	20 Å²	20	27.3 Å²	27.3	10%	0.103	12%	0.119	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-20.1	179.6	-161.1	165.2	0	0	0	113.2	I617 L621 V624 M628 V629 A632 A671 A673 Q677	I617-I675 HydrophobicContact CG2-CB 4.46Å; I617-I675 HydrophobicContact CG2-CD1 3.89Å; I617-I675 HydrophobicContact CG2-CG2 4.33Å; I617-I675 WeakPolarHBondContact O-CG2 3.43Å; L621-I675 HydrophobicContact CD1-CG1 4.42Å; L621-I675 HydrophobicContact CD1-CG2 3.93Å; V624-I675 HydrophobicContact CG1-CD1 3.64Å; V624-I675 HydrophobicContact CG1-CG1 4.43Å; M628-I675 HydrophobicContact CB-CD1 4.4Å; V629-I675 HydrophobicContact CB-CD1 4.49Å; V629-I675 HydrophobicContact CG2-CD1 3.94Å; A632-I675 HydrophobicContact CB-CB 3.71Å; A632-I675 HydrophobicContact CB-CD1 4.22Å; A632-I675 HydrophobicContact CB-CG1 4.06Å; A671-I675 PolarHBondContact O-N 3.47Å; A673-I675 PolarHBondContact O-N 3.45Å; I675-Q677 VanDerWaalsContact C-N 3.32Å
676	R	89.8	Confident	89.8	Confident	71 Å²	71	25.9 Å²	25.9	27%	0.268	11%	0.114	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79	-11.5	176.8	-67.4	179.9	166.6	-110.6	-13.9	113.9	H596 Y619 L621 A673 L674	H596-R676 PolarHBondContact O-NH1 2.77Å; Y619-R676 PolarHBondContact O-NH2 2.72Å; L621-R676 HydrophobicContact CD1-CG 4.24Å; L621-R676 HydrophobicContact CD2-CG 4.48Å; A673-R676 PolarHBondContact O-N 3.04Å; L674-R676 PolarHBondContact O-N 2.71Å
677	Q	88.8	Confident	89	Confident	154 Å²	154	26.6 Å²	26.6	72%	0.72	12%	0.119	S	C	*	.			trans	50.3	54.8	-172.9	-56.7	-179.7	-3.4	0	0	112.5	L674 I675	L674-Q677 PolarHBondContact O-N 3.07Å; L674-Q677 VanDerWaalsContact O-N 3.11Å; I675-Q677 VanDerWaalsContact C-N 3.32Å
678	P	91.8	Very high	88	Confident	5 Å²	5	27.1 Å²	27.1	3%	0.032	13%	0.127	C	C	.	.			trans	-65.3	152.7	-178.1	31.8	-37.8	0	0	0	111.1	K598 A600 A673 L681 H709	K598-P678 CarbonylContact O-C 3.58Å; K598-P678 WeakPolarHBondContact O-CB 3.26Å; A600-P678 HydrophobicContact CB-CB 3.71Å; A600-P678 HydrophobicContact CB-CG 3.78Å; A673-P678 WeakPolarHBondContact O-CD 3.41Å; P678-L681 HydrophobicContact CG-CD1 4.43Å; P678-H709 PolarHBondContact O-CD2 2.97Å; P678-H709 PolarHBondContact O-NE2 3.29Å
679	R	92.8	Very high	86.9	Confident	117 Å²	117	29.7 Å²	29.7	44%	0.442	15%	0.148	S	C	.	.	S	Bend	trans	-86.3	-29.7	169.3	-74	-64.4	-169.3	-159.6	-4.3	113	C517 K598 T710	C517-R679 HydrophobicContact CB-CG 4.12Å; C517-R679 PolarHBondContact O-NE 2.85Å; K598-R679 PolarHBondContact O-N 2.99Å; R679-T710 PolarHBondContact O-N 2.71Å
680	V	94.3	Very high	86	Confident	0 Å²	0	30 Å²	30	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	120.7	176.7	-174	0	0	0	0	108.4	V521 L569 L582 K598 I599 A600 T710	V521-V680 HydrophobicContact CG2-CG1 4.26Å; V521-V680 HydrophobicContact CG2-CG2 3.96Å; L569-V680 HydrophobicContact CD2-CG1 4.42Å; L582-V680 HydrophobicContact CD1-CG2 4.02Å; K598-V680 PolarHBondContact O-N 3.43Å; I599-V680 WeakPolarHBondContact CA-O 3.31Å; I599-V680 HydrophobicContact CG1-CB 4.22Å; I599-V680 HydrophobicContact CG2-CB 4.27Å; I599-V680 HydrophobicContact CG2-CG1 4.35Å; A600-V680 PolarHBondContact N-O 3.33Å; V680-T710 CarbonylContact C-O 3.59Å; V680-T710 WeakPolarHBondContact CA-O 3.35Å; V680-T710 HydrophobicContact CG1-CG2 4.49Å
681	L	93	Very high	85.4	Confident	3 Å²	3	33.9 Å²	33.9	2%	0.016	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	124.6	177.8	-176.2	66	0	0	0	109.5	A600 A673 P678 L683 L702 T710 V711 L712	A600-L681 HydrophobicContact CB-CD1 4.4Å; A673-L681 HydrophobicContact CB-CD1 4.22Å; P678-L681 HydrophobicContact CG-CD1 4.43Å; L681-L683 HydrophobicContact CD1-CD2 4.27Å; L681-L683 HydrophobicContact CD2-CD1 4.35Å; L681-L683 HydrophobicContact CD2-CD2 4.11Å; L681-L683 HydrophobicContact CD2-CG 4.31Å; L681-L683 HydrophobicContact CG-CD2 3.98Å; L681-L683 HydrophobicContact CG-CG 4.16Å; L681-L702 HydrophobicContact CD2-CD2 4.31Å; L681-T710 PolarHBondContact N-O 2.9Å; L681-V711 HydrophobicContact CB-CG1 4.46Å; L681-V711 HydrophobicContact CB-CG2 4.23Å; L681-V711 WeakPolarHBondContact O-CA 3.47Å; L681-L712 PolarHBondContact O-N 3.45Å
682	I	93.5	Very high	84.5	Confident	0 Å²	0	37.6 Å²	37.6	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	122.2	177.1	-50.7	177	0	0	0	108.8	V566 L569 E570 I599 A600 L601 V602 L712	V566-I682 HydrophobicContact CB-CG2 4.37Å; V566-I682 HydrophobicContact CG1-CD1 4.17Å; V566-I682 HydrophobicContact CG1-CG2 3.9Å; V566-I682 HydrophobicContact CG2-CG2 3.55Å; L569-I682 HydrophobicContact CB-CD1 4.47Å; L569-I682 HydrophobicContact CD2-CD1 3.72Å; L569-I682 HydrophobicContact CD2-CG1 4.31Å; L569-I682 HydrophobicContact CG-CD1 4.07Å; E570-I682 HydrophobicContact CG-CD1 4.22Å; I599-I682 HydrophobicContact CG2-CD1 3.74Å; I599-I682 HydrophobicContact CG2-CG1 4.14Å; A600-I682 PolarHBondContact O-N 2.89Å; L601-I682 HydrophobicContact CD1-CB 3.86Å; L601-I682 HydrophobicContact CD1-CG2 3.6Å; V602-I682 PolarHBondContact N-O 3.29Å; I682-L712 WeakPolarHBondContact CA-O 3.3Å; I682-L712 HydrophobicContact CG1-CB 4.47Å; I682-L712 HydrophobicContact CG2-CD2 4.28Å; I682-L712 HydrophobicContact CG2-CG 4.49Å
683	L	90.3	Very high	83.6	Confident	9 Å²	9	42.3 Å²	42.3	5%	0.047	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	99.1	179.1	-58.7	178.9	0	0	0	108.8	V602 L681 A686 L702 V711 L712 V713 I714	V602-L683 HydrophobicContact CB-CD2 3.91Å; V602-L683 HydrophobicContact CG2-CD2 3.88Å; L681-L683 HydrophobicContact CD1-CD2 4.27Å; L681-L683 HydrophobicContact CD2-CD1 4.35Å; L681-L683 HydrophobicContact CD2-CD2 4.11Å; L681-L683 HydrophobicContact CD2-CG 4.31Å; L681-L683 HydrophobicContact CG-CD2 3.98Å; L681-L683 HydrophobicContact CG-CG 4.16Å; L683-A686 HydrophobicContact CB-CB 4.17Å; L683-A686 HydrophobicContact CD2-CB 4.1Å; L683-L702 HydrophobicContact CD1-CD1 4.07Å; L683-V711 HydrophobicContact CD1-CG1 4.18Å; L683-V711 HydrophobicContact CG-CG1 4.49Å; L683-L712 PolarHBondContact N-O 3.01Å; L683-V713 HydrophobicContact CB-CG1 4.27Å; L683-V713 HydrophobicContact CB-CG2 4.45Å; L683-V713 HydrophobicContact CD1-CG2 4.4Å; L683-V713 CarbonylContact O-C 3.06Å; L683-V713 WeakPolarHBondContact O-CA 3.45Å; L683-I714 PolarHBondContact O-N 2.88Å
684	D	89.4	Confident	82.6	Confident	20 Å²	20	42.9 Å²	42.9	11%	0.107	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	101.1	175.3	-166.2	0.7	0	0	0	108.8	L601 V602 G603 Q604 A686 I714	L601-D684 HydrophobicContact CD1-CB 4.49Å; V602-D684 PolarHBondContact O-N 2.84Å; G603-D684 CarbonylContact C-O 3.6Å; Q604-D684 WeakPolarHBondContact CA-O 3.46Å; Q604-D684 PolarHBondContact N-O 3.2Å; D684-A686 PolarHBondContact O-N 2.94Å; D684-I714 HydrophobicContact CB-CB 4.46Å; D684-I714 HydrophobicContact CB-CD1 4.34Å; D684-I714 WeakPolarHBondContact OD1-CB 3.43Å; D684-I714 WeakPolarHBondContact OD1-CG2 3.46Å
685	E	78.3	Confident	81.9	Confident	36 Å²	36	42.9 Å²	42.9	17%	0.168	23%	0.228	C	C	.	.	S	Bend	trans	50	28.2	-176.9	-79.7	-165.9	-152.9	0	0	115.7	Q604 Q666 T687 S688 I714 H716	Q604-E685 HydrophobicContact CB-CB 4.13Å; Q604-E685 HydrophobicContact CG-CB 3.85Å; Q604-E685 PolarHBondContact NE2-OE1 2.91Å; Q604-E685 PolarHBondContact NE2-OE2 2.96Å; Q666-E685 PolarHBondContact NE2-O 3.45Å; E685-T687 PolarHBondContact O-N 3.02Å; E685-S688 WeakPolarHBondContact O-CB 3.28Å; E685-S688 PolarHBondContact O-N 3.2Å; E685-S688 PolarHBondContact O-OG 2.79Å; E685-I714 PolarHBondContact N-O 3.38Å; E685-H716 HydrophobicContact CG-CB 4.25Å; E685-H716 WeakPolarHBondContact OE1-CB 3.5Å; E685-H716 IonicContact OE1-CD2 3.77Å; E685-H716 PolarHBondContact OE1-CD2 2.93Å; E685-H716 IonicContact OE1-CG 3.13Å; E685-H716 IonicContact OE1-ND1 3.93Å; E685-H716 IonicContact OE1-NE2 3.05Å
686	A	70.4	Confident	81.1	Confident	6 Å²	6	47 Å²	47	5%	0.05	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-11.3	-170.5	0	0	0	0	0	116.3	V602 Q666 L683 D684	V602-A686 HydrophobicContact CB-CB 4.14Å; V602-A686 HydrophobicContact CG1-CB 3.66Å; Q666-A686 PolarHBondContact OE1-O 3.45Å; L683-A686 HydrophobicContact CB-CB 4.17Å; L683-A686 HydrophobicContact CD2-CB 4.1Å; D684-A686 PolarHBondContact O-N 2.94Å
687	T	70.8	Confident	80.3	Confident	16 Å²	16	46.7 Å²	46.7	10%	0.098	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108.9	2.5	174.6	67.1	0	0	0	0	114.9	E685 A689 L690 E695 Q699 R717	E685-T687 PolarHBondContact O-N 3.02Å; T687-A689 VanDerWaalsContact C-N 3.34Å; T687-A689 PolarHBondContact O-N 3.39Å; T687-L690 PolarHBondContact O-N 2.82Å; T687-E695 WeakPolarHBondContact CB-OE1 3.39Å; T687-E695 HydrophobicContact CG2-CG 4.19Å; T687-E695 PolarHBondContact OG1-OE1 2.86Å; T687-Q699 HydrophobicContact CG2-CG 4.36Å; T687-R717 PolarHBondContact O-NH2 3.42Å
688	S	70.1	Confident	79.6	Confident	39 Å²	39	39.4 Å²	39.4	27%	0.273	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.6	-28.7	-171	65.3	0	0	0	0	114.8	E685 R717	E685-S688 WeakPolarHBondContact O-CB 3.28Å; E685-S688 PolarHBondContact O-N 3.2Å; E685-S688 PolarHBondContact O-OG 2.79Å; S688-R717 PolarHBondContact O-NH2 2.88Å
689	A	68.6	Low	78.8	Confident	53 Å²	53	39.9 Å²	39.9	44%	0.438	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104.8	12.4	-180	0	0	0	0	0	113.3	G663 Q666 T687	G663-A689 WeakPolarHBondContact CA-O 3.33Å; G663-A689 PolarHBondContact N-O 3.25Å; G663-A689 VanDerWaalsContact N-O 3.17Å; Q666-A689 VanDerWaalsContact OE1-N 3.15Å; T687-A689 VanDerWaalsContact C-N 3.34Å; T687-A689 PolarHBondContact O-N 3.39Å
690	L	73.1	Confident	77.9	Confident	8 Å²	8	39.8 Å²	39.8	4%	0.042	22%	0.222	C	C	.	.	S	Bend	trans	-92.9	140.1	171.3	-79.8	148.1	0	0	0	110.5	Q666 R667 T687 S694 E695 V698	Q666-L690 HydrophobicContact CB-CD1 4.22Å; R667-L690 HydrophobicContact CG-CD2 4.24Å; T687-L690 PolarHBondContact O-N 2.82Å; L690-S694 VanDerWaalsContact CD2-CB 3.43Å; L690-E695 HydrophobicContact CB-CB 4.16Å; L690-V698 HydrophobicContact CD1-CG1 4.49Å; L690-V698 HydrophobicContact CD1-CG2 4.39Å
691	D	77.6	Confident	76.7	Confident	83 Å²	83	41 Å²	41	44%	0.444	23%	0.231	S	C	.	.			trans	-61.6	157.6	164.2	53.7	-78.6	0	0	0	111.1	E693 S694 E695	D691-E693 VanDerWaalsContact C-N 3.29Å; D691-E693 PolarHBondContact O-N 3.06Å; D691-S694 VanDerWaalsContact CG-OG 3.25Å; D691-S694 PolarHBondContact O-N 3.42Å; D691-S694 WeakPolarHBondContact OD1-CB 3.24Å; D691-S694 PolarHBondContact OD1-OG 2.71Å; D691-S694 WeakPolarHBondContact OD2-CB 3.34Å; D691-S694 PolarHBondContact OD2-N 3Å; D691-S694 PolarHBondContact OD2-OG 3.22Å; D691-E695 WeakPolarHBondContact O-CB 3.24Å; D691-E695 PolarHBondContact O-N 3.26Å
692	A	75.3	Confident	75.9	Confident	78 Å²	78	41.1 Å²	41.1	65%	0.645	23%	0.232	S	C	*	.	H	α-helix	trans	-61.7	-33.5	-171.3	0	0	0	0	0	113.9	H696	A692-H696 WeakPolarHBondContact O-CB 3.21Å; A692-H696 PolarHBondContact O-N 2.95Å
693	E	73.7	Confident	75	Confident	147 Å²	147	44.2 Å²	44.2	69%	0.687	25%	0.249	S	C	*	.	H	α-helix	trans	-70.8	-52	176.8	-175.4	176.2	-178.8	0	0	110.8	D691 E695 H696 I697	D691-E693 VanDerWaalsContact C-N 3.29Å; D691-E693 PolarHBondContact O-N 3.06Å; E693-E695 VanDerWaalsContact C-N 3.33Å; E693-E695 PolarHBondContact O-N 3.42Å; E693-H696 PolarHBondContact O-N 3.32Å; E693-H696 VanDerWaalsContact O-N 3.14Å; E693-I697 HydrophobicContact CG-CD1 4.16Å; E693-I697 WeakPolarHBondContact O-CG1 3.5Å; E693-I697 PolarHBondContact O-N 3.23Å; E693-I697 VanDerWaalsContact O-N 3.08Å
694	S	70.5	Confident	74	Confident	16 Å²	16	47.6 Å²	47.6	11%	0.112	27%	0.273	C	S	.	.	H	α-helix	trans	-64.1	-35.6	177.4	-58.4	0	0	0	0	112.5	L690 D691 V698	L690-S694 VanDerWaalsContact CD2-CB 3.43Å; D691-S694 VanDerWaalsContact CG-OG 3.25Å; D691-S694 PolarHBondContact O-N 3.42Å; D691-S694 WeakPolarHBondContact OD1-CB 3.24Å; D691-S694 PolarHBondContact OD1-OG 2.71Å; D691-S694 WeakPolarHBondContact OD2-CB 3.34Å; D691-S694 PolarHBondContact OD2-N 3Å; D691-S694 PolarHBondContact OD2-OG 3.22Å; S694-V698 VanDerWaalsContact O-CB 3.31Å; S694-V698 WeakPolarHBondContact O-CB 3.27Å; S694-V698 WeakPolarHBondContact O-CG2 3.44Å; S694-V698 PolarHBondContact O-N 2.94Å
695	E	75.6	Confident	73.3	Confident	20 Å²	20	47.5 Å²	47.5	9%	0.093	27%	0.273	C	S	.	.	H	α-helix	trans	-59.9	-49.1	170.8	171.4	172.8	-124	0	0	110.6	T687 L690 D691 E693 I697 V698 Q699 R717	T687-E695 WeakPolarHBondContact CB-OE1 3.39Å; T687-E695 HydrophobicContact CG2-CG 4.19Å; T687-E695 PolarHBondContact OG1-OE1 2.86Å; L690-E695 HydrophobicContact CB-CB 4.16Å; D691-E695 WeakPolarHBondContact O-CB 3.24Å; D691-E695 PolarHBondContact O-N 3.26Å; E693-E695 VanDerWaalsContact C-N 3.33Å; E693-E695 PolarHBondContact O-N 3.42Å; E695-I697 VanDerWaalsContact C-N 3.31Å; E695-I697 PolarHBondContact O-N 3.43Å; E695-V698 PolarHBondContact O-N 2.9Å; E695-Q699 HydrophobicContact CG-CG 4.12Å; E695-Q699 WeakPolarHBondContact O-CB 3.41Å; E695-Q699 WeakPolarHBondContact O-CG 3.38Å; E695-Q699 PolarHBondContact O-N 3.28Å; E695-Q699 PolarHBondContact OE1-NE2 3.4Å; E695-R717 WeakPolarHBondContact OE1-CD 3.33Å; E695-R717 IonicContact OE1-CZ 3.28Å; E695-R717 IonicContact OE1-NE 3.42Å; E695-R717 IonicContact OE1-NH1 2.7Å; E695-R717 PolarHBondContact OE1-NH1 3.01Å; E695-R717 VanDerWaalsContact OE1-NH1 3.13Å; E695-R717 IonicContact OE2-CZ 3.94Å; E695-R717 IonicContact OE2-NH1 3.82Å; E695-R717 PolarHBondContact OE2-NH1 3.48Å
696	H	75.5	Confident	73	Confident	105 Å²	105	46.5 Å²	46.5	49%	0.486	27%	0.268	S	S	.	.	H	α-helix	trans	-60.8	-42.6	-177.8	-168.8	-20.5	0	0	0	111.5	A692 E693 Q699 Q700	A692-H696 WeakPolarHBondContact O-CB 3.21Å; A692-H696 PolarHBondContact O-N 2.95Å; E693-H696 PolarHBondContact O-N 3.32Å; E693-H696 VanDerWaalsContact O-N 3.14Å; H696-Q699 PolarHBondContact O-N 2.98Å; H696-Q700 PolarHBondContact CE1-NE2 3.31Å; H696-Q700 VanDerWaalsContact CE1-NE2 3.32Å; H696-Q700 WeakPolarHBondContact O-CG 3.49Å; H696-Q700 PolarHBondContact O-N 2.94Å
697	I	72.4	Confident	73.1	Confident	65 Å²	65	53.8 Å²	53.8	33%	0.333	30%	0.301	S	S	.	.	H	α-helix	trans	-67.9	-43.8	178.8	-59	162.9	0	0	0	110.7	N637 E693 E695 Q700 A701	N637-I697 HydrophobicContact CB-CG2 3.99Å; N637-I697 VanDerWaalsContact CG-CG2 3.46Å; N637-I697 VanDerWaalsContact ND2-CG2 3.3Å; N637-I697 WeakPolarHBondContact ND2-CG2 3.29Å; E693-I697 HydrophobicContact CG-CD1 4.16Å; E693-I697 WeakPolarHBondContact O-CG1 3.5Å; E693-I697 PolarHBondContact O-N 3.23Å; E693-I697 VanDerWaalsContact O-N 3.08Å; E695-I697 VanDerWaalsContact C-N 3.31Å; E695-I697 PolarHBondContact O-N 3.43Å; I697-Q700 PolarHBondContact O-N 3.31Å; I697-A701 PolarHBondContact O-N 2.9Å
698	V	75.1	Confident	73.5	Confident	1 Å²	1	60 Å²	60	1%	0.006	33%	0.329	C	S	.	.	H	α-helix	trans	-63.9	-41.1	176.5	169.2	0	0	0	0	111.3	N637 R667 I670 L690 S694 E695 A701 L702	N637-V698 HydrophobicContact CB-CG2 3.99Å; R667-V698 HydrophobicContact CG-CG2 3.89Å; I670-V698 HydrophobicContact CD1-CG1 3.68Å; L690-V698 HydrophobicContact CD1-CG1 4.49Å; L690-V698 HydrophobicContact CD1-CG2 4.39Å; S694-V698 VanDerWaalsContact O-CB 3.31Å; S694-V698 WeakPolarHBondContact O-CB 3.27Å; S694-V698 WeakPolarHBondContact O-CG2 3.44Å; S694-V698 PolarHBondContact O-N 2.94Å; E695-V698 PolarHBondContact O-N 2.9Å; V698-A701 PolarHBondContact O-N 3.44Å; V698-L702 HydrophobicContact CG1-CD1 3.8Å; V698-L702 HydrophobicContact CG1-CG 4.32Å; V698-L702 WeakPolarHBondContact O-CB 3.37Å; V698-L702 VanDerWaalsContact O-CG 3.28Å; V698-L702 WeakPolarHBondContact O-CG 3.38Å; V698-L702 PolarHBondContact O-N 2.88Å
699	Q	74.9	Confident	74.3	Confident	16 Å²	16	59.4 Å²	59.4	8%	0.075	32%	0.322	C	S	.	.	H	α-helix	trans	-63	-42.7	173.3	-77.1	-167.1	7.8	0	0	112	T687 E695 H696 A701 L702 N703 T720	T687-Q699 HydrophobicContact CG2-CG 4.36Å; E695-Q699 HydrophobicContact CG-CG 4.12Å; E695-Q699 WeakPolarHBondContact O-CB 3.41Å; E695-Q699 WeakPolarHBondContact O-CG 3.38Å; E695-Q699 PolarHBondContact O-N 3.28Å; E695-Q699 PolarHBondContact OE1-NE2 3.4Å; H696-Q699 PolarHBondContact O-N 2.98Å; Q699-A701 PolarHBondContact O-N 3.42Å; Q699-L702 PolarHBondContact O-N 3.3Å; Q699-N703 WeakPolarHBondContact O-CB 3.46Å; Q699-N703 PolarHBondContact O-N 3.19Å; Q699-N703 PolarHBondContact O-ND2 3.49Å; Q699-N703 PolarHBondContact O-OD1 3.22Å; Q699-T720 PolarHBondContact NE2-OG1 3.1Å
700	Q	73.7	Confident	75.5	Confident	114 Å²	114	57 Å²	57	53%	0.533	30%	0.301	S	S	.	.	H	α-helix	trans	-61.4	-43.9	176.4	-83.6	178.9	-25	0	0	111.9	H696 I697 N703 S704	H696-Q700 PolarHBondContact CE1-NE2 3.31Å; H696-Q700 VanDerWaalsContact CE1-NE2 3.32Å; H696-Q700 WeakPolarHBondContact O-CG 3.49Å; H696-Q700 PolarHBondContact O-N 2.94Å; I697-Q700 PolarHBondContact O-N 3.31Å; Q700-N703 PolarHBondContact O-N 2.93Å; Q700-S704 PolarHBondContact O-N 3.26Å
701	A	69.8	Low	76.4	Confident	25 Å²	25	56.6 Å²	56.6	21%	0.207	30%	0.3	C	S	.	.	H	α-helix	trans	-64.9	-44.6	176.8	0	0	0	0	0	111.7	K635 I697 V698 Q699 S704	K635-A701 VanDerWaalsContact O-CB 3.25Å; K635-A701 WeakPolarHBondContact O-CB 3.45Å; I697-A701 PolarHBondContact O-N 2.9Å; V698-A701 PolarHBondContact O-N 3.44Å; Q699-A701 PolarHBondContact O-N 3.42Å; A701-S704 PolarHBondContact O-N 3.15Å; A701-S704 PolarHBondContact O-OG 3.27Å
702	L	74.7	Confident	77.1	Confident	7 Å²	7	52.7 Å²	52.7	4%	0.037	28%	0.279	C	S	.	.	H	α-helix	trans	-62.7	-40.6	175.3	-74.1	171.9	0	0	0	112.3	I670 L681 L683 V698 Q699 S704 I705 M706	I670-L702 HydrophobicContact CG2-CD2 4.18Å; L681-L702 HydrophobicContact CD2-CD2 4.31Å; L683-L702 HydrophobicContact CD1-CD1 4.07Å; V698-L702 HydrophobicContact CG1-CD1 3.8Å; V698-L702 HydrophobicContact CG1-CG 4.32Å; V698-L702 WeakPolarHBondContact O-CB 3.37Å; V698-L702 VanDerWaalsContact O-CG 3.28Å; V698-L702 WeakPolarHBondContact O-CG 3.38Å; V698-L702 PolarHBondContact O-N 2.88Å; Q699-L702 PolarHBondContact O-N 3.3Å; L702-S704 VanDerWaalsContact C-N 3.26Å; L702-S704 PolarHBondContact O-N 3.48Å; L702-I705 CarbonylContact O-C 3.56Å; L702-I705 WeakPolarHBondContact O-CA 3.5Å; L702-I705 WeakPolarHBondContact O-CB 3.48Å; L702-I705 PolarHBondContact O-N 3.06Å; L702-M706 HydrophobicContact CB-SD 4.21Å; L702-M706 WeakPolarHBondContact O-CG 3.5Å; L702-M706 PolarHBondContact O-N 3.37Å
703	N	74.4	Confident	77.9	Confident	64 Å²	64	49.4 Å²	49.4	34%	0.342	25%	0.25	S	S	.	.	H	α-helix	trans	-56.6	-38.7	179.1	-73.3	-13.7	0	0	0	112.5	Q699 Q700 I705 M706	Q699-N703 WeakPolarHBondContact O-CB 3.46Å; Q699-N703 PolarHBondContact O-N 3.19Å; Q699-N703 PolarHBondContact O-ND2 3.49Å; Q699-N703 PolarHBondContact O-OD1 3.22Å; Q700-N703 PolarHBondContact O-N 2.93Å; N703-I705 PolarHBondContact O-N 3.29Å; N703-M706 PolarHBondContact O-N 2.8Å
704	S	69.7	Low	78.6	Confident	81 Å²	81	42.4 Å²	42.4	57%	0.566	22%	0.218	S	C	*	.	H	α-helix	trans	-64.7	-26.8	175.6	75.2	0	0	0	0	113.3	Q700 A701 L702	Q700-S704 PolarHBondContact O-N 3.26Å; A701-S704 PolarHBondContact O-N 3.15Å; A701-S704 PolarHBondContact O-OG 3.27Å; L702-S704 VanDerWaalsContact C-N 3.26Å; L702-S704 PolarHBondContact O-N 3.48Å
705	I	74.2	Confident	78.8	Confident	18 Å²	18	42.1 Å²	42.1	9%	0.092	22%	0.217	C	C	.	.	H	α-helix	trans	-87.9	-38.6	179.4	-60.1	170.6	0	0	0	109.6	K635 L674 L702 N703 Q707 E708 H709	K635-I705 HydrophobicContact CB-CD1 4.4Å; K635-I705 HydrophobicContact CD-CD1 4.43Å; L674-I705 HydrophobicContact CD1-CD1 3.61Å; L674-I705 HydrophobicContact CD2-CD1 3.77Å; L674-I705 HydrophobicContact CD2-CG2 4.03Å; L674-I705 HydrophobicContact CG-CD1 4.33Å; L702-I705 CarbonylContact O-C 3.56Å; L702-I705 WeakPolarHBondContact O-CA 3.5Å; L702-I705 WeakPolarHBondContact O-CB 3.48Å; L702-I705 PolarHBondContact O-N 3.06Å; N703-I705 PolarHBondContact O-N 3.29Å; I705-Q707 PolarHBondContact O-N 3.49Å; I705-Q707 VanDerWaalsContact O-N 3.13Å; I705-E708 PolarHBondContact O-N 2.92Å; I705-H709 WeakPolarHBondContact CG2-ND1 3.3Å; I705-H709 PolarHBondContact O-ND1 3.38Å
706	M	73.4	Confident	78.6	Confident	15 Å²	15	44.9 Å²	44.9	7%	0.074	23%	0.229	C	C	.	.	H	α-helix	trans	-57.5	-28.8	-177.5	-72.6	163.7	109.5	0	0	113.6	V551 L702 N703 E708 H709 V711 V713	V551-M706 HydrophobicContact CB-CE 4.33Å; V551-M706 HydrophobicContact CG1-CE 3.57Å; V551-M706 HydrophobicContact CG2-CB 3.82Å; V551-M706 HydrophobicContact CG2-CE 3.73Å; V551-M706 HydrophobicContact CG2-CG 4.23Å; V551-M706 HydrophobicContact CG2-SD 4.32Å; L702-M706 HydrophobicContact CB-SD 4.21Å; L702-M706 WeakPolarHBondContact O-CG 3.5Å; L702-M706 PolarHBondContact O-N 3.37Å; N703-M706 PolarHBondContact O-N 2.8Å; M706-E708 VanDerWaalsContact C-N 3.29Å; M706-E708 PolarHBondContact O-N 2.87Å; M706-H709 VanDerWaalsContact O-O 3.04Å; M706-V711 HydrophobicContact CB-CG2 4.13Å; M706-V711 HydrophobicContact CE-CB 4.49Å; M706-V711 HydrophobicContact CE-CG1 3.89Å; M706-V711 HydrophobicContact CG-CB 4.37Å; M706-V711 HydrophobicContact CG-CG1 4.27Å; M706-V711 HydrophobicContact CG-CG2 3.87Å; M706-V713 HydrophobicContact CE-CG2 4.03Å
707	Q	72.8	Confident	78.5	Confident	158 Å²	158	43.5 Å²	43.5	74%	0.738	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.1	-21.2	177.9	-66.4	-178.9	-8	0	0	114.3	I705	I705-Q707 PolarHBondContact O-N 3.49Å; I705-Q707 VanDerWaalsContact O-N 3.13Å
708	E	77.9	Confident	78.6	Confident	146 Å²	146	42.2 Å²	42.2	68%	0.682	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	-103.1	-2.1	-177.9	-63.9	-172.3	156.7	0	0	113.6	I705 M706	I705-E708 PolarHBondContact O-N 2.92Å; M706-E708 VanDerWaalsContact C-N 3.29Å; M706-E708 PolarHBondContact O-N 2.87Å
709	H	87.2	Confident	78.6	Confident	28 Å²	28	44.3 Å²	44.3	13%	0.13	23%	0.228	C	C	.	.	S	Bend	trans	-135.3	153.9	-168.3	-58.1	95.9	0	0	0	111.5	G549 P678 I705 M706 V711	G549-H709 WeakPolarHBondContact CA-O 3.41Å; G549-H709 PolarHBondContact N-O 3.46Å; P678-H709 PolarHBondContact O-CD2 2.97Å; P678-H709 PolarHBondContact O-NE2 3.29Å; I705-H709 WeakPolarHBondContact CG2-ND1 3.3Å; I705-H709 PolarHBondContact O-ND1 3.38Å; M706-H709 VanDerWaalsContact O-O 3.04Å; H709-V711 HydrophobicContact CB-CG2 4.16Å; H709-V711 PolarHBondContact O-N 3.44Å
710	T	93.3	Very high	78.7	Confident	1 Å²	1	44.6 Å²	44.6	1%	0.006	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	121.3	166.5	-55.2	0	0	0	0	108.1	G519 L546 P548 R679 V680 L681	G519-T710 WeakPolarHBondContact O-CB 3.46Å; G519-T710 WeakPolarHBondContact O-CG2 3.43Å; G519-T710 PolarHBondContact O-OG1 2.96Å; L546-T710 HydrophobicContact CB-CG2 3.57Å; P548-T710 WeakPolarHBondContact CA-OG1 3.4Å; R679-T710 PolarHBondContact O-N 2.71Å; V680-T710 CarbonylContact C-O 3.59Å; V680-T710 WeakPolarHBondContact CA-O 3.35Å; V680-T710 HydrophobicContact CG1-CG2 4.49Å; L681-T710 PolarHBondContact N-O 2.9Å
711	V	92.1	Very high	79.1	Confident	1 Å²	1	39.4 Å²	39.4	1%	0.006	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	120.8	-176.2	-171.5	0	0	0	0	111.8	E550 T552 L681 L683 M706 H709 V713	E550-V711 PolarHBondContact O-N 3.14Å; T552-V711 PolarHBondContact N-O 3.39Å; L681-V711 HydrophobicContact CB-CG1 4.46Å; L681-V711 HydrophobicContact CB-CG2 4.23Å; L681-V711 WeakPolarHBondContact O-CA 3.47Å; L683-V711 HydrophobicContact CD1-CG1 4.18Å; L683-V711 HydrophobicContact CG-CG1 4.49Å; M706-V711 HydrophobicContact CB-CG2 4.13Å; M706-V711 HydrophobicContact CE-CB 4.49Å; M706-V711 HydrophobicContact CE-CG1 3.89Å; M706-V711 HydrophobicContact CG-CB 4.37Å; M706-V711 HydrophobicContact CG-CG1 4.27Å; M706-V711 HydrophobicContact CG-CG2 3.87Å; H709-V711 HydrophobicContact CB-CG2 4.16Å; H709-V711 PolarHBondContact O-N 3.44Å; V711-V713 HydrophobicContact CG1-CG2 3.87Å
712	L	93.1	Very high	79.8	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	118.1	171.6	179.7	61.1	0	0	0	109	L546 L554 V566 L569 L681 I682 L683	L546-L712 HydrophobicContact CD1-CB 3.99Å; L546-L712 HydrophobicContact CD1-CD1 4.21Å; L546-L712 HydrophobicContact CD1-CD2 4.21Å; L546-L712 HydrophobicContact CD1-CG 4.37Å; L546-L712 HydrophobicContact CD2-CD1 4.05Å; L554-L712 HydrophobicContact CB-CD1 4.18Å; V566-L712 HydrophobicContact CG2-CD2 3.93Å; L569-L712 HydrophobicContact CD2-CD2 4.18Å; L681-L712 PolarHBondContact O-N 3.45Å; I682-L712 WeakPolarHBondContact CA-O 3.3Å; I682-L712 HydrophobicContact CG1-CB 4.47Å; I682-L712 HydrophobicContact CG2-CD2 4.28Å; I682-L712 HydrophobicContact CG2-CG 4.49Å; L683-L712 PolarHBondContact N-O 3.01Å
713	V	91.1	Very high	80.1	Confident	9 Å²	9	48.4 Å²	48.4	6%	0.055	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	118.8	176.7	-167.2	0	0	0	0	110	V551 T552 A553 L554 L683 M706 V711 A715 T720	V551-V713 HydrophobicContact CG1-CG2 4.07Å; T552-V713 PolarHBondContact O-N 3.38Å; A553-V713 CarbonylContact C-O 3.53Å; A553-V713 WeakPolarHBondContact CA-O 2.94Å; L554-V713 PolarHBondContact N-O 2.95Å; L683-V713 HydrophobicContact CB-CG1 4.27Å; L683-V713 HydrophobicContact CB-CG2 4.45Å; L683-V713 HydrophobicContact CD1-CG2 4.4Å; L683-V713 CarbonylContact O-C 3.06Å; L683-V713 WeakPolarHBondContact O-CA 3.45Å; M706-V713 HydrophobicContact CE-CG2 4.03Å; V711-V713 HydrophobicContact CG1-CG2 3.87Å; V713-A715 HydrophobicContact CG1-CB 3.87Å; V713-A715 PolarHBondContact O-N 3.36Å; V713-T720 HydrophobicContact CG1-CG2 3.87Å
714	I	89.8	Confident	80.8	Confident	1 Å²	1	45.7 Å²	45.7	1%	0.005	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	104	161.6	-58.2	176.1	0	0	0	106.2	L554 K562 V566 L683 D684 E685	L554-I714 HydrophobicContact CB-CG1 4.29Å; L554-I714 HydrophobicContact CD2-CG1 4.36Å; K562-I714 HydrophobicContact CB-CD1 4.04Å; K562-I714 HydrophobicContact CB-CG1 4.39Å; K562-I714 HydrophobicContact CB-CG2 4.13Å; K562-I714 HydrophobicContact CD-CG2 4.05Å; V566-I714 HydrophobicContact CG2-CD1 3.55Å; V566-I714 HydrophobicContact CG2-CG1 4.31Å; L683-I714 PolarHBondContact O-N 2.88Å; D684-I714 HydrophobicContact CB-CB 4.46Å; D684-I714 HydrophobicContact CB-CD1 4.34Å; D684-I714 WeakPolarHBondContact OD1-CB 3.43Å; D684-I714 WeakPolarHBondContact OD1-CG2 3.46Å; E685-I714 PolarHBondContact N-O 3.38Å
715	A	74.2	Confident	81.8	Confident	10 Å²	10	46 Å²	46	8%	0.083	23%	0.225	C	C	.	.			trans	-115	118.3	-172.7	0	0	0	0	0	111.6	V713 T720 V721	V713-A715 HydrophobicContact CG1-CB 3.87Å; V713-A715 PolarHBondContact O-N 3.36Å; A715-T720 HydrophobicContact CB-CG2 4.43Å; A715-V721 HydrophobicContact CB-CG2 3.48Å; A715-V721 VanDerWaalsContact CB-CG2 3.48Å
716	H	72.1	Confident	82.7	Confident	77 Å²	77	45.8 Å²	45.8	36%	0.356	22%	0.223	S	C	.	.	S	Bend	trans	-94.2	3.7	164.2	-81.6	-106.2	0	0	0	112.6	K562 E685 Q758	K562-H716 VanDerWaalsContact CE-NE2 3.35Å; K562-H716 WeakPolarHBondContact CE-NE2 3.31Å; K562-H716 PolarHBondContact NZ-NE2 2.84Å; E685-H716 HydrophobicContact CG-CB 4.25Å; E685-H716 WeakPolarHBondContact OE1-CB 3.5Å; E685-H716 IonicContact OE1-CD2 3.77Å; E685-H716 PolarHBondContact OE1-CD2 2.93Å; E685-H716 IonicContact OE1-CG 3.13Å; E685-H716 IonicContact OE1-ND1 3.93Å; E685-H716 IonicContact OE1-NE2 3.05Å; H716-Q758 PolarHBondContact O-NE2 2.81Å
717	R	72.1	Confident	83.6	Confident	77 Å²	77	45 Å²	45	29%	0.291	22%	0.22	S	C	.	.	S	Bend	trans	-111.7	121.9	175.1	-70.3	-172.7	179.1	-161.6	7.1	111.5	T687 S688 E695 S719 T720 V721	T687-R717 PolarHBondContact O-NH2 3.42Å; S688-R717 PolarHBondContact O-NH2 2.88Å; E695-R717 WeakPolarHBondContact OE1-CD 3.33Å; E695-R717 IonicContact OE1-CZ 3.28Å; E695-R717 IonicContact OE1-NE 3.42Å; E695-R717 IonicContact OE1-NH1 2.7Å; E695-R717 PolarHBondContact OE1-NH1 3.01Å; E695-R717 VanDerWaalsContact OE1-NH1 3.13Å; E695-R717 IonicContact OE2-CZ 3.94Å; E695-R717 IonicContact OE2-NH1 3.82Å; E695-R717 PolarHBondContact OE2-NH1 3.48Å; R717-S719 VanDerWaalsContact C-N 3.3Å; R717-S719 PolarHBondContact O-N 2.9Å; R717-T720 PolarHBondContact O-N 3.37Å; R717-T720 VanDerWaalsContact O-N 3.12Å; R717-V721 PolarHBondContact O-N 2.78Å
718	L	74.9	Confident	84.7	Confident	38 Å²	38	37.5 Å²	37.5	20%	0.199	19%	0.185	C	C	.	.	H	α-helix	trans	-53.2	-41.7	-176.6	-177	61.8	0	0	0	113.7	T720 V721 E722 V755 V759	L718-T720 PolarHBondContact O-N 2.63Å; L718-V721 PolarHBondContact O-N 3.39Å; L718-E722 WeakPolarHBondContact O-CB 3.49Å; L718-E722 PolarHBondContact O-N 2.88Å; L718-V755 HydrophobicContact CD1-CB 4.33Å; L718-V755 HydrophobicContact CD1-CG1 3.77Å; L718-V755 HydrophobicContact CD1-CG2 3.77Å; L718-V755 HydrophobicContact CD2-CG1 4.04Å; L718-V759 HydrophobicContact CD2-CG2 3.74Å
719	S	74.4	Confident	85.4	Confident	44 Å²	44	30.6 Å²	30.6	31%	0.308	15%	0.152	S	C	.	.	H	α-helix	trans	-57.7	-22.4	-179.2	56.2	0	0	0	0	114.9	R717 K723	R717-S719 VanDerWaalsContact C-N 3.3Å; R717-S719 PolarHBondContact O-N 2.9Å; S719-K723 WeakPolarHBondContact O-CD 3.28Å; S719-K723 WeakPolarHBondContact O-CE 3.41Å
720	T	77.2	Confident	85.7	Confident	23 Å²	23	29.2 Å²	29.2	14%	0.141	15%	0.146	C	C	.	.	H	α-helix	trans	-93.8	-33.5	178.1	-42.4	0	0	0	0	111.2	Q699 V713 A715 R717 L718	Q699-T720 PolarHBondContact NE2-OG1 3.1Å; V713-T720 HydrophobicContact CG1-CG2 3.87Å; A715-T720 HydrophobicContact CB-CG2 4.43Å; R717-T720 PolarHBondContact O-N 3.37Å; R717-T720 VanDerWaalsContact O-N 3.12Å; L718-T720 PolarHBondContact O-N 2.63Å
721	V	82.8	Confident	85.7	Confident	5 Å²	5	31.6 Å²	31.6	3%	0.03	16%	0.159	C	C	.	.	H	α-helix	trans	-73	-40.4	177.7	-175.9	0	0	0	0	111.5	A553 V555 A715 R717 L718 K723 A724 I727 Y751	A553-V721 HydrophobicContact CB-CG1 4.27Å; V555-V721 HydrophobicContact CG2-CG1 3.68Å; V555-V721 HydrophobicContact CG2-CG2 3.97Å; A715-V721 HydrophobicContact CB-CG2 3.48Å; A715-V721 VanDerWaalsContact CB-CG2 3.48Å; R717-V721 PolarHBondContact O-N 2.78Å; L718-V721 PolarHBondContact O-N 3.39Å; V721-K723 PolarHBondContact O-N 3.47Å; V721-A724 WeakPolarHBondContact O-CB 3.26Å; V721-A724 PolarHBondContact O-N 3.02Å; V721-I727 HydrophobicContact CG1-CD1 3.82Å; V721-I727 HydrophobicContact CG1-CG1 4.14Å; V721-I727 HydrophobicContact CG1-CG2 4.26Å; V721-Y751 HydrophobicContact CG1-CE2 3.71Å; V721-Y751 VanDerWaalsContact CG1-OH 3.25Å; V721-Y751 WeakPolarHBondContact CG1-OH 3.49Å
722	E	84.3	Confident	85.6	Confident	107 Å²	107	40.4 Å²	40.4	50%	0.5	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-33.3	-179.3	-175.8	-178.8	-178.7	0	0	112.6	L718	L718-E722 WeakPolarHBondContact O-CB 3.49Å; L718-E722 PolarHBondContact O-N 2.88Å
723	K	81.9	Confident	85.4	Confident	113 Å²	113	40.4 Å²	40.4	49%	0.491	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.7	-0.4	-179.1	-60.8	174.9	-169.8	164.9	0	114.1	S719 V721	S719-K723 WeakPolarHBondContact O-CD 3.28Å; S719-K723 WeakPolarHBondContact O-CE 3.41Å; V721-K723 PolarHBondContact O-N 3.47Å
724	A	87.6	Confident	85.5	Confident	7 Å²	7	45.3 Å²	45.3	6%	0.058	21%	0.214	C	C	.	.			trans	-80.2	134.7	-178.5	0	0	0	0	0	111.5	V551 A553 V721 N726 I727	V551-A724 HydrophobicContact CG1-CB 4.13Å; A553-A724 HydrophobicContact CB-CB 3.57Å; V721-A724 WeakPolarHBondContact O-CB 3.26Å; V721-A724 PolarHBondContact O-N 3.02Å; A724-N726 PolarHBondContact O-N 2.99Å; A724-I727 HydrophobicContact CB-CG1 4.25Å
725	D	90.6	Very high	85.7	Confident	89 Å²	89	47.6 Å²	47.6	48%	0.476	23%	0.229	S	C	.	.	S	Bend	trans	-63.6	-33	178.8	-54.4	-70.2	0	0	0	112	E550 V551	E550-D725 HydrophobicContact CB-CB 4.38Å; E550-D725 HydrophobicContact CG-CB 4.44Å; V551-D725 WeakPolarHBondContact CB-OD2 3.26Å; V551-D725 PolarHBondContact N-OD2 3.32Å; V551-D725 PolarHBondContact O-N 3.3Å
726	N	92.9	Very high	86.6	Confident	12 Å²	12	49.9 Å²	49.9	6%	0.064	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	126.4	179.9	170.1	67.3	0	0	0	110.1	V551 T552 A553 A724 R738	V551-N726 PolarHBondContact O-N 3.05Å; T552-N726 CarbonylContact C-O 3.55Å; T552-N726 WeakPolarHBondContact CA-O 3.34Å; T552-N726 WeakPolarHBondContact CG2-ND2 3.45Å; T552-N726 PolarHBondContact OG1-ND2 3Å; A553-N726 PolarHBondContact N-O 2.86Å; A724-N726 PolarHBondContact O-N 2.99Å; N726-R738 WeakPolarHBondContact OD1-CG 3.43Å; N726-R738 PolarHBondContact OD1-NE 3.3Å
727	I	94.3	Very high	87.6	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	133.7	176.9	-56.7	166.9	0	0	0	108.1	A553 V555 V721 A724 V729 R738 G739 H741 L744 Y751	A553-I727 HydrophobicContact CB-CG1 4.37Å; A553-I727 WeakPolarHBondContact O-CA 3.34Å; V555-I727 HydrophobicContact CB-CG2 4.39Å; V555-I727 HydrophobicContact CG2-CG2 3.84Å; V721-I727 HydrophobicContact CG1-CD1 3.82Å; V721-I727 HydrophobicContact CG1-CG1 4.14Å; V721-I727 HydrophobicContact CG1-CG2 4.26Å; A724-I727 HydrophobicContact CB-CG1 4.25Å; I727-V729 HydrophobicContact CG2-CG2 4.41Å; I727-R738 VanDerWaalsContact O-CA 3.28Å; I727-R738 WeakPolarHBondContact O-CA 3.44Å; I727-G739 WeakPolarHBondContact CB-O 3.4Å; I727-G739 PolarHBondContact N-O 2.92Å; I727-G739 PolarHBondContact O-N 2.94Å; I727-G739 VanDerWaalsContact O-N 3.1Å; I727-H741 HydrophobicContact CD1-CB 3.93Å; I727-L744 HydrophobicContact CB-CD1 3.72Å; I727-L744 HydrophobicContact CD1-CD1 4.34Å; I727-L744 HydrophobicContact CG2-CD1 3.77Å; I727-Y751 HydrophobicContact CD1-CE1 4.48Å; I727-Y751 HydrophobicContact CD1-CE2 3.98Å; I727-Y751 HydrophobicContact CG2-CD2 4.04Å; I727-Y751 HydrophobicContact CG2-CE2 3.81Å
728	I	94.6	Very high	88.6	Confident	0 Å²	0	50 Å²	50	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	119.7	176	-58.4	170.4	0	0	0	107.6	F544 T552 A553 L554 V555 I730 V735 R738	F544-I728 HydrophobicContact CB-CD1 3.64Å; F544-I728 HydrophobicContact CD1-CD1 4.37Å; F544-I728 HydrophobicContact CD1-CG2 4.49Å; F544-I728 HydrophobicContact CD2-CD1 3.55Å; F544-I728 HydrophobicContact CE2-CD1 4.28Å; F544-I728 HydrophobicContact CG-CD1 3.61Å; T552-I728 HydrophobicContact CG2-CD1 3.51Å; T552-I728 HydrophobicContact CG2-CG1 3.98Å; A553-I728 PolarHBondContact O-N 3.47Å; L554-I728 HydrophobicContact CD1-CB 3.86Å; L554-I728 HydrophobicContact CD1-CG2 3.82Å; V555-I728 PolarHBondContact N-O 3.06Å; I728-I730 HydrophobicContact CG2-CG1 4.33Å; I728-V735 HydrophobicContact CG2-CG1 3.97Å; I728-V735 HydrophobicContact CG2-CG2 4.26Å; I728-R738 HydrophobicContact CG1-CG 4.44Å
729	V	93.4	Very high	89.5	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	117.8	177.5	-170	0	0	0	0	109.1	V555 I727 A736 E737 L744 L750 Y751 L754	V555-V729 CarbonylContact O-C 3.13Å; V555-V729 VanDerWaalsContact O-CA 3.31Å; V555-V729 WeakPolarHBondContact O-CA 3.26Å; I727-V729 HydrophobicContact CG2-CG2 4.41Å; V729-A736 PolarHBondContact O-N 3.08Å; V729-E737 HydrophobicContact CB-CB 3.95Å; V729-E737 HydrophobicContact CG2-CB 3.83Å; V729-E737 PolarHBondContact N-O 3.16Å; V729-L744 HydrophobicContact CG2-CD1 4.22Å; V729-L750 HydrophobicContact CG1-CD2 3.87Å; V729-L750 HydrophobicContact CG1-CG 4.19Å; V729-Y751 HydrophobicContact CG2-CD2 4Å; V729-Y751 HydrophobicContact CG2-CG 4.44Å; V729-L754 HydrophobicContact CG1-CD1 4.45Å
730	I	93.1	Very high	90.4	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	125.3	172.9	-58.8	-173.5	0	0	0	109.7	L554 V555 G556 S560 I728 Q734	L554-I730 HydrophobicContact CD1-CD1 3.67Å; L554-I730 HydrophobicContact CD1-CG1 3.89Å; L554-I730 HydrophobicContact CD2-CD1 4.25Å; L554-I730 HydrophobicContact CG-CD1 4.22Å; V555-I730 PolarHBondContact O-N 3.44Å; G556-I730 WeakPolarHBondContact CA-O 3.3Å; S560-I730 WeakPolarHBondContact CB-O 3.46Å; S560-I730 WeakPolarHBondContact O-CG2 3.19Å; S560-I730 PolarHBondContact OG-O 3.11Å; I728-I730 HydrophobicContact CG2-CG1 4.33Å; I730-Q734 CarbonylContact C-O 3.55Å; I730-Q734 VanDerWaalsContact CA-O 3.28Å; I730-Q734 WeakPolarHBondContact CA-O 3.37Å; I730-Q734 WeakPolarHBondContact CG2-O 3.25Å
731	D	92.3	Very high	91	Very high	51 Å²	51	49.4 Å²	49.4	27%	0.273	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	137.4	168.1	-171	34.9	0	0	0	110.8	G733 Q734 A736 L750	D731-G733 PolarHBondContact O-N 2.86Å; D731-Q734 PolarHBondContact N-O 3.19Å; D731-Q734 PolarHBondContact O-N 3.16Å; D731-A736 HydrophobicContact CB-CB 4.29Å; D731-L750 HydrophobicContact CB-CD2 3.62Å
732	R	90.1	Very high	91.4	Very high	185 Å²	185	53.4 Å²	53.4	70%	0.698	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.4	31.2	176.8	-58.9	173.2	-173.7	-156.1	-4	115.6
733	G	90	Very high	91.7	Very high	1 Å²	1	53.7 Å²	53.7	1%	0.01	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	84.6	13.3	-178.2	0	0	0	0	0	115.7	V538 K540 V542 S560 D731	V538-G733 WeakPolarHBondContact O-CA 3.28Å; K540-G733 PolarHBondContact N-O 2.83Å; V542-G733 WeakPolarHBondContact CG2-O 3.21Å; S560-G733 WeakPolarHBondContact O-CA 3.44Å; S560-G733 PolarHBondContact O-N 2.95Å; D731-G733 PolarHBondContact O-N 2.86Å
734	Q	93.4	Very high	92.1	Very high	111 Å²	111	48.6 Å²	48.6	52%	0.519	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	151.4	179.5	-64.3	-171.4	-23.9	0	0	111.4	K540 I730 D731 A736	K540-Q734 HydrophobicContact CB-CG 3.94Å; I730-Q734 CarbonylContact C-O 3.55Å; I730-Q734 VanDerWaalsContact CA-O 3.28Å; I730-Q734 WeakPolarHBondContact CA-O 3.37Å; I730-Q734 WeakPolarHBondContact CG2-O 3.25Å; D731-Q734 PolarHBondContact N-O 3.19Å; D731-Q734 PolarHBondContact O-N 3.16Å; Q734-A736 PolarHBondContact O-N 3.43Å
735	V	94.1	Very high	92.3	Very high	50 Å²	50	51.1 Å²	51.1	30%	0.303	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	110.4	171.9	-178.4	0	0	0	0	108.4	V542 F544 I728	V542-V735 HydrophobicContact CG1-CG2 4.02Å; F544-V735 HydrophobicContact CD1-CG2 4.33Å; I728-V735 HydrophobicContact CG2-CG1 3.97Å; I728-V735 HydrophobicContact CG2-CG2 4.26Å
736	A	92.6	Very high	92.2	Very high	57 Å²	57	51.1 Å²	51.1	47%	0.471	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	-45	-178.6	0	0	0	0	0	112	V729 D731 Q734 L750	V729-A736 PolarHBondContact O-N 3.08Å; D731-A736 HydrophobicContact CB-CB 4.29Å; Q734-A736 PolarHBondContact O-N 3.43Å; A736-L750 HydrophobicContact CB-CD2 4.47Å
737	E	92.9	Very high	92	Very high	42 Å²	42	55.5 Å²	55.5	20%	0.196	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	149.6	-174.7	-76.6	161.3	-150.4	0	0	110.8	V729 L744 G749 L750 Y751	V729-E737 HydrophobicContact CB-CB 3.95Å; V729-E737 HydrophobicContact CG2-CB 3.83Å; V729-E737 PolarHBondContact N-O 3.16Å; E737-L744 HydrophobicContact CB-CD2 3.9Å; E737-G749 WeakPolarHBondContact OE1-CA 3.47Å; E737-L750 PolarHBondContact OE1-N 3.18Å; E737-L750 PolarHBondContact OE2-N 2.89Å; E737-Y751 VanDerWaalsContact OE2-CB 3.27Å; E737-Y751 WeakPolarHBondContact OE2-CB 3.48Å; E737-Y751 PolarHBondContact OE2-N 3.35Å
738	R	93.8	Very high	91.5	Very high	115 Å²	115	57.4 Å²	57.4	43%	0.434	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	136.8	174	-177.4	-176.9	178.5	173.6	5.8	110.8	N726 I727 I728	N726-R738 WeakPolarHBondContact OD1-CG 3.43Å; N726-R738 PolarHBondContact OD1-NE 3.3Å; I727-R738 VanDerWaalsContact O-CA 3.28Å; I727-R738 WeakPolarHBondContact O-CA 3.44Å; I728-R738 HydrophobicContact CG1-CG 4.44Å
739	G	92.4	Very high	91.3	Very high	8 Å²	8	58 Å²	58	8%	0.082	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	163.5	-172	175.1	0	0	0	0	0	112.9	I727	I727-G739 WeakPolarHBondContact CB-O 3.4Å; I727-G739 PolarHBondContact N-O 2.92Å; I727-G739 PolarHBondContact O-N 2.94Å; I727-G739 VanDerWaalsContact O-N 3.1Å
740	T	92.9	Very high	91.1	Very high	48 Å²	48	60.1 Å²	60.1	29%	0.294	34%	0.337	S	S	.	.			trans	-78	163.7	169.7	71.7	0	0	0	0	111.2	S742 Q743 L744	T740-S742 VanDerWaalsContact C-N 3.31Å; T740-S742 PolarHBondContact O-N 3.38Å; T740-Q743 PolarHBondContact O-N 2.95Å; T740-Q743 VanDerWaalsContact O-N 3.13Å; T740-Q743 WeakPolarHBondContact OG1-CG 3.42Å; T740-Q743 PolarHBondContact OG1-N 2.96Å; T740-L744 WeakPolarHBondContact O-CG 3.3Å; T740-L744 PolarHBondContact O-N 2.96Å
741	H	90.4	Very high	90.9	Very high	36 Å²	36	60.1 Å²	60.1	17%	0.167	34%	0.337	C	S	.	.	H	α-helix	trans	-49.4	-50.9	176.4	176.6	76.1	0	0	0	112.2	I727 Q743 L744 M745 Y751	I727-H741 HydrophobicContact CD1-CB 3.93Å; H741-Q743 VanDerWaalsContact C-N 3.34Å; H741-Q743 PolarHBondContact O-N 3.12Å; H741-L744 PolarHBondContact O-N 3.32Å; H741-M745 WeakPolarHBondContact O-CB 3.5Å; H741-M745 VanDerWaalsContact O-CG 3.28Å; H741-M745 WeakPolarHBondContact O-CG 3.36Å; H741-M745 PolarHBondContact O-N 3.42Å; H741-Y751 AromaticContact ND1-CE1 3.55Å; H741-Y751 AromaticContact ND1-CZ 3.64Å; H741-Y751 PolarHBondContact ND1-OH 3.09Å
742	S	90.5	Very high	90.7	Very high	90 Å²	90	58.1 Å²	58.1	63%	0.629	33%	0.327	S	S	*	.	H	α-helix	trans	-62.9	-37.5	-178.6	-43.7	0	0	0	0	113	T740 A746	T740-S742 VanDerWaalsContact C-N 3.31Å; T740-S742 PolarHBondContact O-N 3.38Å; S742-A746 WeakPolarHBondContact O-CB 3.34Å; S742-A746 PolarHBondContact O-N 3.22Å; S742-A746 VanDerWaalsContact O-N 3.15Å
743	Q	91.8	Very high	90.6	Very high	113 Å²	113	55.3 Å²	55.3	53%	0.528	32%	0.32	S	S	.	.	H	α-helix	trans	-67.5	-45.5	177.6	-70.3	168.2	-8.2	0	0	111.6	T740 H741 A746 T747	T740-Q743 PolarHBondContact O-N 2.95Å; T740-Q743 VanDerWaalsContact O-N 3.13Å; T740-Q743 WeakPolarHBondContact OG1-CG 3.42Å; T740-Q743 PolarHBondContact OG1-N 2.96Å; H741-Q743 VanDerWaalsContact C-N 3.34Å; H741-Q743 PolarHBondContact O-N 3.12Å; Q743-A746 PolarHBondContact O-N 2.93Å; Q743-T747 PolarHBondContact O-N 3.39Å; Q743-T747 VanDerWaalsContact O-N 3.14Å; Q743-T747 PolarHBondContact O-OG1 2.91Å
744	L	91.1	Very high	90.3	Very high	6 Å²	6	57 Å²	57	3%	0.031	33%	0.329	C	S	.	.	H	α-helix	trans	-71.5	-32.9	-178.5	-66.6	-175.6	0	0	0	112.9	I727 V729 E737 T740 H741 T747 Y751	I727-L744 HydrophobicContact CB-CD1 3.72Å; I727-L744 HydrophobicContact CD1-CD1 4.34Å; I727-L744 HydrophobicContact CG2-CD1 3.77Å; V729-L744 HydrophobicContact CG2-CD1 4.22Å; E737-L744 HydrophobicContact CB-CD2 3.9Å; T740-L744 WeakPolarHBondContact O-CG 3.3Å; T740-L744 PolarHBondContact O-N 2.96Å; H741-L744 PolarHBondContact O-N 3.32Å; L744-T747 WeakPolarHBondContact CA-OG1 3.23Å; L744-T747 PolarHBondContact O-OG1 2.8Å; L744-T747 VanDerWaalsContact O-OG1 3.1Å; L744-Y751 HydrophobicContact CB-CD1 3.31Å; L744-Y751 HydrophobicContact CB-CE1 4.02Å; L744-Y751 HydrophobicContact CB-CG 3.64Å; L744-Y751 HydrophobicContact CD1-CD1 4.2Å; L744-Y751 HydrophobicContact CD1-CD2 3.99Å; L744-Y751 HydrophobicContact CD1-CG 3.81Å; L744-Y751 HydrophobicContact CG-CD1 4.41Å; L744-Y751 HydrophobicContact CG-CG 4.37Å
745	M	90.1	Very high	89.9	Confident	59 Å²	59	52.3 Å²	52.3	29%	0.291	31%	0.307	S	S	.	.	H	α-helix	trans	-66.4	-42.3	171.2	-71	-59.8	-71.4	0	0	111.6	H741 T747 G748 Y751 C752 V755	H741-M745 WeakPolarHBondContact O-CB 3.5Å; H741-M745 VanDerWaalsContact O-CG 3.28Å; H741-M745 WeakPolarHBondContact O-CG 3.36Å; H741-M745 PolarHBondContact O-N 3.42Å; M745-T747 VanDerWaalsContact C-N 3.33Å; M745-T747 PolarHBondContact O-N 3.36Å; M745-G748 PolarHBondContact O-N 2.73Å; M745-Y751 HydrophobicContact CG-CD1 4.35Å; M745-Y751 HydrophobicContact CG-CE1 4.01Å; M745-Y751 HydrophobicContact SD-CD1 4.03Å; M745-Y751 HydrophobicContact SD-CE1 3.87Å; M745-C752 HydrophobicContact SD-CB 4.14Å; M745-V755 HydrophobicContact CE-CG1 4.08Å; M745-V755 HydrophobicContact SD-CB 3.96Å; M745-V755 HydrophobicContact SD-CG1 3.95Å; M745-V755 HydrophobicContact SD-CG2 4.08Å
746	A	89.4	Confident	89.5	Confident	90 Å²	90	54.8 Å²	54.8	74%	0.744	32%	0.316	S	S	*	.	H	α-helix	trans	-66.9	-29.5	179.5	0	0	0	0	0	113.7	S742 Q743 G748	S742-A746 WeakPolarHBondContact O-CB 3.34Å; S742-A746 PolarHBondContact O-N 3.22Å; S742-A746 VanDerWaalsContact O-N 3.15Å; Q743-A746 PolarHBondContact O-N 2.93Å; A746-G748 VanDerWaalsContact C-N 3.3Å; A746-G748 PolarHBondContact O-N 3.25Å
747	T	88	Confident	88.8	Confident	104 Å²	104	59.2 Å²	59.2	64%	0.638	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.6	-14.8	175.7	24.2	0	0	0	0	113.8	Q743 L744 M745 G749	Q743-T747 PolarHBondContact O-N 3.39Å; Q743-T747 VanDerWaalsContact O-N 3.14Å; Q743-T747 PolarHBondContact O-OG1 2.91Å; L744-T747 WeakPolarHBondContact CA-OG1 3.23Å; L744-T747 PolarHBondContact O-OG1 2.8Å; L744-T747 VanDerWaalsContact O-OG1 3.1Å; M745-T747 VanDerWaalsContact C-N 3.33Å; M745-T747 PolarHBondContact O-N 3.36Å; T747-G749 PolarHBondContact O-N 2.64Å
748	G	85.1	Confident	88	Confident	40 Å²	40	61.6 Å²	61.6	41%	0.412	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	65	20.3	179.1	0	0	0	0	0	114.5	M745 A746	M745-G748 PolarHBondContact O-N 2.73Å; A746-G748 VanDerWaalsContact C-N 3.3Å; A746-G748 PolarHBondContact O-N 3.25Å
749	G	89.9	Confident	87.1	Confident	12 Å²	12	61 Å²	61	12%	0.124	34%	0.34	C	S	.	.	S	Bend	trans	-73.8	-164.1	-172.3	0	0	0	0	0	115.4	E737 T747 Y751 C752 K753	E737-G749 WeakPolarHBondContact OE1-CA 3.47Å; T747-G749 PolarHBondContact O-N 2.64Å; G749-Y751 PolarHBondContact O-N 2.87Å; G749-C752 PolarHBondContact O-N 3.36Å; G749-K753 WeakPolarHBondContact O-CG 3.46Å; G749-K753 PolarHBondContact O-N 2.97Å; G749-K753 VanDerWaalsContact O-N 3.1Å
750	L	88.1	Confident	85.9	Confident	44 Å²	44	66.6 Å²	66.6	23%	0.23	37%	0.367	C	S	.	.	H	α-helix	trans	-56.5	-39.3	170.6	179.5	61.5	0	0	0	111.1	V729 D731 A736 E737 K753 L754	V729-L750 HydrophobicContact CG1-CD2 3.87Å; V729-L750 HydrophobicContact CG1-CG 4.19Å; D731-L750 HydrophobicContact CB-CD2 3.62Å; A736-L750 HydrophobicContact CB-CD2 4.47Å; E737-L750 PolarHBondContact OE1-N 3.18Å; E737-L750 PolarHBondContact OE2-N 2.89Å; L750-K753 PolarHBondContact O-N 2.66Å; L750-L754 HydrophobicContact CD1-CD1 4.42Å; L750-L754 HydrophobicContact CD1-CG 4.31Å; L750-L754 HydrophobicContact CG-CD1 4.11Å; L750-L754 HydrophobicContact CG-CG 4.45Å; L750-L754 WeakPolarHBondContact O-CG 3.33Å; L750-L754 PolarHBondContact O-N 3.04Å
751	Y	90.4	Very high	84	Confident	1 Å²	1	67.2 Å²	67.2	0%	0.004	38%	0.383	C	S	.	.	H	α-helix	trans	-55	-54.6	174.1	-176.9	-103.3	0	0	0	111.9	V555 V721 I727 V729 E737 H741 L744 M745 G749 K753 L754 V755	V555-Y751 HydrophobicContact CG1-CD2 4.44Å; V555-Y751 HydrophobicContact CG1-CE2 4.47Å; V721-Y751 HydrophobicContact CG1-CE2 3.71Å; V721-Y751 VanDerWaalsContact CG1-OH 3.25Å; V721-Y751 WeakPolarHBondContact CG1-OH 3.49Å; I727-Y751 HydrophobicContact CD1-CE1 4.48Å; I727-Y751 HydrophobicContact CD1-CE2 3.98Å; I727-Y751 HydrophobicContact CG2-CD2 4.04Å; I727-Y751 HydrophobicContact CG2-CE2 3.81Å; V729-Y751 HydrophobicContact CG2-CD2 4Å; V729-Y751 HydrophobicContact CG2-CG 4.44Å; E737-Y751 VanDerWaalsContact OE2-CB 3.27Å; E737-Y751 WeakPolarHBondContact OE2-CB 3.48Å; E737-Y751 PolarHBondContact OE2-N 3.35Å; H741-Y751 AromaticContact ND1-CE1 3.55Å; H741-Y751 AromaticContact ND1-CZ 3.64Å; H741-Y751 PolarHBondContact ND1-OH 3.09Å; L744-Y751 HydrophobicContact CB-CD1 3.31Å; L744-Y751 HydrophobicContact CB-CE1 4.02Å; L744-Y751 HydrophobicContact CB-CG 3.64Å; L744-Y751 HydrophobicContact CD1-CD1 4.2Å; L744-Y751 HydrophobicContact CD1-CD2 3.99Å; L744-Y751 HydrophobicContact CD1-CG 3.81Å; L744-Y751 HydrophobicContact CG-CD1 4.41Å; L744-Y751 HydrophobicContact CG-CG 4.37Å; M745-Y751 HydrophobicContact CG-CD1 4.35Å; M745-Y751 HydrophobicContact CG-CE1 4.01Å; M745-Y751 HydrophobicContact SD-CD1 4.03Å; M745-Y751 HydrophobicContact SD-CE1 3.87Å; G749-Y751 PolarHBondContact O-N 2.87Å; Y751-K753 VanDerWaalsContact C-N 3.26Å; Y751-K753 PolarHBondContact O-N 3.49Å; Y751-L754 WeakPolarHBondContact O-CB 3.37Å; Y751-L754 PolarHBondContact O-N 2.96Å; Y751-V755 HydrophobicContact CD1-CG2 4.04Å; Y751-V755 HydrophobicContact CD2-CG2 4.49Å; Y751-V755 HydrophobicContact CE1-CG2 3.56Å; Y751-V755 HydrophobicContact CE2-CG2 4.03Å; Y751-V755 HydrophobicContact CG-CG2 4.49Å; Y751-V755 WeakPolarHBondContact O-CG2 3.43Å; Y751-V755 PolarHBondContact O-N 3.48Å
752	C	88.5	Confident	81.8	Confident	9 Å²	9	71 Å²	71	6%	0.061	40%	0.404	C	S	.	.	H	α-helix	trans	-59.2	-38.9	-178.4	-170.5	0	0	0	0	111.4	M745 G749 V755 Q756	M745-C752 HydrophobicContact SD-CB 4.14Å; G749-C752 PolarHBondContact O-N 3.36Å; C752-V755 PolarHBondContact O-N 3.33Å; C752-Q756 WeakPolarHBondContact O-CB 3.2Å; C752-Q756 VanDerWaalsContact O-CG 3.24Å; C752-Q756 WeakPolarHBondContact O-CG 3.27Å; C752-Q756 PolarHBondContact O-N 2.57Å
753	K	86.6	Confident	79.4	Confident	125 Å²	125	75.5 Å²	75.5	54%	0.543	42%	0.415	S	S	.	.	H	α-helix	trans	-66.4	-38.3	174.8	-68	167.8	-172.5	170.9	0	113.3	G749 L750 Y751 R757	G749-K753 WeakPolarHBondContact O-CG 3.46Å; G749-K753 PolarHBondContact O-N 2.97Å; G749-K753 VanDerWaalsContact O-N 3.1Å; L750-K753 PolarHBondContact O-N 2.66Å; Y751-K753 VanDerWaalsContact C-N 3.26Å; Y751-K753 PolarHBondContact O-N 3.49Å; K753-R757 WeakPolarHBondContact O-CB 3.43Å; K753-R757 WeakPolarHBondContact O-CG 3.36Å; K753-R757 PolarHBondContact O-N 3.18Å
754	L	84.6	Confident	76.8	Confident	38 Å²	38	76.1 Å²	76.1	20%	0.199	43%	0.426	C	S	.	.	H	α-helix	trans	-66.2	-46.4	175	-71.3	169.7	0	0	0	110.7	V555 V729 L750 Y751 R757 Q758	V555-L754 HydrophobicContact CG1-CD1 4.17Å; V729-L754 HydrophobicContact CG1-CD1 4.45Å; L750-L754 HydrophobicContact CD1-CD1 4.42Å; L750-L754 HydrophobicContact CD1-CG 4.31Å; L750-L754 HydrophobicContact CG-CD1 4.11Å; L750-L754 HydrophobicContact CG-CG 4.45Å; L750-L754 WeakPolarHBondContact O-CG 3.33Å; L750-L754 PolarHBondContact O-N 3.04Å; Y751-L754 WeakPolarHBondContact O-CB 3.37Å; Y751-L754 PolarHBondContact O-N 2.96Å; L754-R757 PolarHBondContact O-N 3.45Å; L754-Q758 WeakPolarHBondContact O-CB 3.42Å; L754-Q758 PolarHBondContact O-N 3.07Å
755	V	85.7	Confident	73.8	Confident	11 Å²	11	79.3 Å²	79.3	7%	0.067	46%	0.461	C	S	.	.	H	α-helix	trans	-59.7	-49.4	175.5	174.3	0	0	0	0	111.2	L718 M745 Y751 C752 R757 Q758 V759	L718-V755 HydrophobicContact CD1-CB 4.33Å; L718-V755 HydrophobicContact CD1-CG1 3.77Å; L718-V755 HydrophobicContact CD1-CG2 3.77Å; L718-V755 HydrophobicContact CD2-CG1 4.04Å; M745-V755 HydrophobicContact CE-CG1 4.08Å; M745-V755 HydrophobicContact SD-CB 3.96Å; M745-V755 HydrophobicContact SD-CG1 3.95Å; M745-V755 HydrophobicContact SD-CG2 4.08Å; Y751-V755 HydrophobicContact CD1-CG2 4.04Å; Y751-V755 HydrophobicContact CD2-CG2 4.49Å; Y751-V755 HydrophobicContact CE1-CG2 3.56Å; Y751-V755 HydrophobicContact CE2-CG2 4.03Å; Y751-V755 HydrophobicContact CG-CG2 4.49Å; Y751-V755 WeakPolarHBondContact O-CG2 3.43Å; Y751-V755 PolarHBondContact O-N 3.48Å; C752-V755 PolarHBondContact O-N 3.33Å; V755-R757 PolarHBondContact O-N 3.45Å; V755-Q758 PolarHBondContact O-N 2.86Å; V755-V759 HydrophobicContact CG1-CG2 4.32Å; V755-V759 WeakPolarHBondContact O-CG2 3.47Å; V755-V759 PolarHBondContact O-N 3.15Å
756	Q	84.1	Confident	71.6	Confident	103 Å²	103	81.4 Å²	81.4	48%	0.481	49%	0.488	S	S	.	.	H	α-helix	trans	-58.8	-44.7	177.9	-76.1	174.8	2.3	0	0	112.3	C752 Q758 V759 L760	C752-Q756 WeakPolarHBondContact O-CB 3.2Å; C752-Q756 VanDerWaalsContact O-CG 3.24Å; C752-Q756 WeakPolarHBondContact O-CG 3.27Å; C752-Q756 PolarHBondContact O-N 2.57Å; Q756-Q758 VanDerWaalsContact C-N 3.33Å; Q756-Q758 PolarHBondContact O-N 3.17Å; Q756-V759 PolarHBondContact O-N 3.12Å; Q756-L760 VanDerWaalsContact O-CB 3.28Å; Q756-L760 WeakPolarHBondContact O-CB 3.32Å; Q756-L760 WeakPolarHBondContact O-CD1 3.37Å; Q756-L760 WeakPolarHBondContact O-CG 3.24Å; Q756-L760 PolarHBondContact O-N 2.79Å
757	R	78.9	Confident	68.9	Low	150 Å²	150	86 Å²	86	57%	0.566	49%	0.494	S	S	*	.	H	α-helix	trans	-60.4	-41.7	175.9	-81.7	177	160.7	-169.5	-8.2	112.5	K753 L754 V755 L760 G761 I762	K753-R757 WeakPolarHBondContact O-CB 3.43Å; K753-R757 WeakPolarHBondContact O-CG 3.36Å; K753-R757 PolarHBondContact O-N 3.18Å; L754-R757 PolarHBondContact O-N 3.45Å; V755-R757 PolarHBondContact O-N 3.45Å; R757-L760 PolarHBondContact O-N 3.13Å; R757-G761 PolarHBondContact O-N 3.06Å; R757-I762 PolarHBondContact O-N 2.94Å
758	Q	75.3	Confident	66.3	Low	92 Å²	92	87.2 Å²	87.2	43%	0.43	50%	0.5	S	S	.	.	H	α-helix	trans	-68.4	-39.9	179	-175.7	167.6	7.9	0	0	112.4	H716 L754 V755 Q756 G761	H716-Q758 PolarHBondContact O-NE2 2.81Å; L754-Q758 WeakPolarHBondContact O-CB 3.42Å; L754-Q758 PolarHBondContact O-N 3.07Å; V755-Q758 PolarHBondContact O-N 2.86Å; Q756-Q758 VanDerWaalsContact C-N 3.33Å; Q756-Q758 PolarHBondContact O-N 3.17Å; Q758-G761 PolarHBondContact O-N 3.01Å
759	V	76	Confident	63.9	Low	102 Å²	102	92.6 Å²	92.6	62%	0.618	52%	0.519	S	S	*	.	H	α-helix	trans	-69	-33.8	175.2	172.8	0	0	0	0	111.8	L718 V755 Q756 G761	L718-V759 HydrophobicContact CD2-CG2 3.74Å; V755-V759 HydrophobicContact CG1-CG2 4.32Å; V755-V759 WeakPolarHBondContact O-CG2 3.47Å; V755-V759 PolarHBondContact O-N 3.15Å; Q756-V759 PolarHBondContact O-N 3.12Å; V759-G761 VanDerWaalsContact C-N 3.32Å
760	L	66.3	Low	60.9	Low	125 Å²	125	98.9 Å²	98.9	65%	0.654	55%	0.55	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.2	-3.2	178.3	-69.5	167.6	0	0	0	114.2	Q756 R757 I762	Q756-L760 VanDerWaalsContact O-CB 3.28Å; Q756-L760 WeakPolarHBondContact O-CB 3.32Å; Q756-L760 WeakPolarHBondContact O-CD1 3.37Å; Q756-L760 WeakPolarHBondContact O-CG 3.24Å; Q756-L760 PolarHBondContact O-N 2.79Å; R757-L760 PolarHBondContact O-N 3.13Å; L760-I762 VanDerWaalsContact C-N 3.29Å; L760-I762 HydrophobicContact CB-CD1 4.44Å; L760-I762 HydrophobicContact CB-CG1 4.32Å; L760-I762 PolarHBondContact O-N 3.43Å
761	G	53	Low	58.3	Low	61 Å²	61	102.2 Å²	102.2	63%	0.629	57%	0.574	S	S	*	*	T	Hydrogen-bonded Turn	trans	67.5	20.8	174.8	0	0	0	0	0	115.5	R757 Q758 V759 E763	R757-G761 PolarHBondContact O-N 3.06Å; Q758-G761 PolarHBondContact O-N 3.01Å; V759-G761 VanDerWaalsContact C-N 3.32Å; G761-E763 PolarHBondContact O-N 3.37Å
762	I	44.3	Very low	55.5	Low	117 Å²	117	107.7 Å²	107.7	60%	0.6	61%	0.613	S	S	*	*			trans	-89.4	92.3	-178.8	-54.1	178.8	0	0	0	109.3	R757 L760	R757-I762 PolarHBondContact O-N 2.94Å; L760-I762 VanDerWaalsContact C-N 3.29Å; L760-I762 HydrophobicContact CB-CD1 4.44Å; L760-I762 HydrophobicContact CB-CG1 4.32Å; L760-I762 PolarHBondContact O-N 3.43Å
763	E	40.3	Very low	52.7	Low	184 Å²	184	115.9 Å²	115.9	86%	0.86	65%	0.65	S	S	*	*			trans	-63.3	145.5	169.9	-68.6	-169.8	157.2	0	0	111.6	G761 G765	G761-E763 PolarHBondContact O-N 3.37Å; E763-G765 PolarHBondContact O-N 3.34Å; E763-G765 VanDerWaalsContact O-N 3.07Å
764	T	36.6	Very low	50.1	Low	125 Å²	125	116.9 Å²	116.9	77%	0.767	67%	0.667	S	S	*	*			trans	-78.7	94	-170.7	43.7	0	0	0	0	113.4
765	G	29.8	Very low	47.5	Very low	73 Å²	73	120.2 Å²	120.2	75%	0.753	69%	0.689	S	S	*	*			trans	-78.8	134.1	146.1	0	0	0	0	0	110	E763 E767	E763-G765 PolarHBondContact O-N 3.34Å; E763-G765 VanDerWaalsContact O-N 3.07Å; G765-E767 PolarHBondContact O-N 3.35Å
766	A	42	Very low	44.7	Very low	104 Å²	104	130.5 Å²	130.5	86%	0.86	73%	0.726	S	S	*	*			trans	-78.3	111.9	-176.4	0	0	0	0	0	112
767	E	33.9	Very low	42	Very low	186 Å²	186	136.7 Å²	136.7	87%	0.869	75%	0.745	S	S	*	*			trans	-157.1	163.1	161.1	-128.8	171.5	-156.2	0	0	113.7	G765	G765-E767 PolarHBondContact O-N 3.35Å
768	V	33.5	Very low	39.5	Very low	129 Å²	129	138.6 Å²	138.6	78%	0.782	76%	0.758	S	S	*	*			trans	73.2	70	177.3	-156.8	0	0	0	0	117.1
769	L	33.2	Very low	37.4	Very low	153 Å²	153	139.9 Å²	139.9	80%	0.801	78%	0.777	S	S	*	*			trans	-113	99.8	137.3	-94.2	170.1	0	0	0	108.3
770	N	28.8	Very low	35.2	Very low	144 Å²	144	142.8 Å²	142.8	77%	0.77	79%	0.789	S	S	*	*			trans	160.5	106.9	146.1	-86.1	-10.6	0	0	0	111.6
771	P	33.2	Very low	33.6	Very low	114 Å²	114	148.3 Å²	148.3	74%	0.74	80%	0.801	S	S	*	*			trans	-82.3	149.7	146.8	31.3	-24.4	0	0	0	110.6
772	S	31.6	Very low	32.4	Very low	117 Å²	117	149.2 Å²	149.2	82%	0.818	81%	0.811	S	S	*	*			trans	59	101.4	174.7	62.5	0	0	0	0	118.9
773	E	30.1	Very low	31.8	Very low	181 Å²	181	155.5 Å²	155.5	85%	0.846	83%	0.827	S	S	*	*				-161.2	127.2	96.4	-103.4	-172.4	-179.4	0	0	111.7	V775	E773-V775 PolarHBondContact O-N 3.34Å
774	T	30.2	Very low	31.3	Very low	146 Å²	146	159 Å²	159	90%	0.896	83%	0.832	S	S	*	*			trans	-88.6	81.2	-176.7	31.2	0	0	0	0	112.2	R776	T774-R776 PolarHBondContact O-N 2.81Å
775	V	31.2	Very low	30.9	Very low	108 Å²	108	162.9 Å²	162.9	66%	0.655	83%	0.833	S	S	*	*			trans	-72.5	101.5	171.8	-178.5	0	0	0	0	110.6	E773 W777	E773-V775 PolarHBondContact O-N 3.34Å; V775-W777 PolarHBondContact O-N 3.48Å; V775-W777 VanDerWaalsContact O-N 3.15Å
776	R	25.8	Very low	30.9	Very low	226 Å²	226	169.1 Å²	169.1	85%	0.853	83%	0.833	S	S	*	*			trans	-77.3	91.1	-176.4	-170.5	-176.6	-166.4	174.9	6.1	111.8	T774 K778	T774-R776 PolarHBondContact O-N 2.81Å; R776-K778 PolarHBondContact O-N 3.12Å; R776-K778 VanDerWaalsContact O-N 3.12Å
777	W	27.3	Very low	30.2	Very low	234 Å²	234	170.9 Å²	170.9	89%	0.886	83%	0.828	S	S	*	*			trans	-65.6	109.1	171.7	-77.6	92.9	0	0	0	111.6	V775	V775-W777 PolarHBondContact O-N 3.48Å; V775-W777 VanDerWaalsContact O-N 3.15Å
778	K	27.2	Very low	29.9	Very low	189 Å²	189	166.4 Å²	166.4	82%	0.822	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-74.5	126.4	166.5	-80.4	179.2	173.2	176.7	0	109.2	R776	R776-K778 PolarHBondContact O-N 3.12Å; R776-K778 VanDerWaalsContact O-N 3.12Å
779	S	30.1	Very low	29.6	Very low	120 Å²	120	165.2 Å²	165.2	84%	0.839	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-78.9	117.6	164.6	48.4	0	0	0	0	109.9
780	D	30.7	Very low	29.4	Very low	163 Å²	163	162.7 Å²	162.7	87%	0.872	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-98.9	141.8	175.1	-152.9	-8.6	0	0	0	111.5	G782	D780-G782 PolarHBondContact O-N 3.16Å
781	R	31.7	Very low	29.4	Very low	241 Å²	241	161 Å²	161	91%	0.909	81%	0.81	S	S	*	*			trans	-97.4	94	-170.4	-67.8	-174	-141.8	-176.2	4.9	111.8
782	G	29.2	Very low	29	Very low	80 Å²	80	159.1 Å²	159.1	83%	0.825	81%	0.811	S	S	*	*			trans	-93.1	94.2	172	0	0	0	0	0	114.1	D780	D780-G782 PolarHBondContact O-N 3.16Å
783	R	30.6	Very low	28.8	Very low	249 Å²	249	159.5 Å²	159.5	94%	0.94	81%	0.814	S	S	*	*			trans	-64.4	133	168.6	-89.2	175.2	163.5	170.8	-4.3	111.5
784	R	30.4	Very low	28.7	Very low	258 Å²	258	159.8 Å²	159.8	97%	0.974	82%	0.815	S	S	*	*			trans	-147.9	157.9	139	-111.8	169	-172.8	-170.3	1	111.9
785	R	29.3	Very low	28.7	Very low	206 Å²	206	158.5 Å²	158.5	78%	0.777	81%	0.812	S	S	*	*			trans	-109.4	150.7	-157.2	-90.5	172.8	155.9	173.8	-5.9	112.5
786	R	29.1	Very low	28.6	Very low	204 Å²	204	162 Å²	162	77%	0.77	82%	0.821	S	S	*	*			trans	61.4	148.3	146.6	-70	176.8	176.2	173.8	-5.5	115.4
787	N	27	Very low	28.8	Very low	141 Å²	141	160.4 Å²	160.4	75%	0.754	82%	0.823	S	S	*	*			cis	-152.3	175.4	9.1	-118.4	23.1	0	0	0	106.9
788	S	28.4	Very low	29	Very low	92 Å²	92	156.1 Å²	156.1	64%	0.643	82%	0.817	S	S	*	*			cis	-163.5	-172.6	-0.2	37.2	0	0	0	0	110.9
789	S	27.2	Very low	29.4	Very low	104 Å²	104	156.4 Å²	156.4	73%	0.727	82%	0.819	S	S	*	*			trans	-42	159	159.8	57.3	0	0	0	0	115.9
790	S	28.8	Very low	29.5	Very low	100 Å²	100	155.4 Å²	155.4	70%	0.699	81%	0.811	S	S	*	*			cis	-171.9	152.5	40.1	49.7	0	0	0	0	114.6
791	S	27.6	Very low	29.9	Very low	109 Å²	109	162 Å²	162	76%	0.762	83%	0.825	S	S	*	*			trans	45.1	108	143.1	63.1	0	0	0	0	122.2
792	G	25.5	Very low	29.8	Very low	74 Å²	74	158 Å²	158	76%	0.763	82%	0.821	S	S	*	*				64.8	125.1	106.9	0	0	0	0	0	121.8
793	S	26.8	Very low	29.8	Very low	125 Å²	125	162.1 Å²	162.1	87%	0.874	82%	0.821	S	S	*	*				-175	151.5	122.6	28.4	0	0	0	0	111.1
794	E	29.5	Very low	29.8	Very low	187 Å²	187	157.3 Å²	157.3	87%	0.874	81%	0.814	S	S	*	*			trans	-75.7	155.8	174.1	-62.4	148	126	0	0	111.3
795	S	28.4	Very low	29.7	Very low	119 Å²	119	151.4 Å²	151.4	83%	0.832	81%	0.805	S	S	*	*			trans	-162.2	112.3	139.2	26.1	0	0	0	0	110.5
796	E	30.8	Very low	29.8	Very low	182 Å²	182	147.9 Å²	147.9	85%	0.85	81%	0.806	S	S	*	*			trans	-62.8	138.3	155.6	-56.1	175.4	118.6	0	0	108.4
797	H	30	Very low	29.8	Very low	191 Å²	191	144.2 Å²	144.2	88%	0.884	81%	0.809	S	S	*	*			trans	-147.5	109.8	142.4	-114.9	45.2	0	0	0	111.7
798	N	31.1	Very low	30	Very low	145 Å²	145	144.4 Å²	144.4	78%	0.775	81%	0.813	S	S	*	*			trans	-91.5	132.4	174.9	-176.7	9.9	0	0	0	108.8
799	K	34.5	Very low	30.1	Very low	195 Å²	195	148.5 Å²	148.5	85%	0.848	83%	0.826	S	S	*	*			trans	-171.1	132.9	154.8	-111	161.4	-168.7	176.3	0	114.1
800	C	32.4	Very low	30.4	Very low	99 Å²	99	152.2 Å²	152.2	67%	0.669	83%	0.834	S	S	*	*			trans	-56	159.1	158.6	-43.6	0	0	0	0	110.5
801	Y	39	Very low	30.5	Very low	300 Å²	300	156.9 Å²	156.9	100%	1.176	85%	0.846	S	S	*	*			cis	-145	0	37.2	-95.8	-94.8	0	0	0	112.2

Retrieved 801 of 801 residues in 620.2 ms (Link to these results)

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