A0A087XGF4_POEFO Loading...

Caspase recruitment domain family member 11

AlphaFold DB , UniProt , Accession A0A087XGF4, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 1,146 aa.

						>A0A087XGF4_POEFO|A0A087XGF4
MDENGTLEDNDALWEKVECKRYELCRNITPAKLTPYLRQCKVLDEQDEDEILNSLLLQAKANRTSRLLDILRTKGERGYGAFLESLEFYYPELYKSVTGKDPTRRFSTIVVEEGQEGLTQFLMNEVMKLQKNTKVKTLQNTELSRKTRTLEDEYKKLRLANQELQAFQQRYNKLREERNSFSDELLRVKDENYKLAMRYATLSEEKNMAVMRSRDLQLEIDQLKHTLNKVEEECKMERRQSLKLKNDIESRPKREQIFELERENEMLKIKLQELQSIIQPGPLPASDKAILDILEHDRQEALEDRQDLVNRLYNLHEEVRQAEELRDKYLEEKEELELKCSTLQKDCEMYRNRIDTISAQLDEVEKERDQAFRARDEAQHHFSQSLVDKDKYRKQIRELEEKSDELHIELVRKEAKLVALESRLRRMSKDIPLDQSLPRDMPLPIISHAAEDKQCWSSDESHEEKCPSDEPRLKRRPNLKAGLRCKSPVSGLRDNPITSDASHRTVNGDFLEIQTPNVNGNNNSLPPSPSFPVSPTFPLPSAPSSLPNMYPCVEQCRQNMLRYRNDSIMSIVPEPPEKASLYRREREKENDFPLRSLSDFDSDNMEMECEDGPNSVISSSSSHQSEGMDTYDLEQVNNIFRKFSLERPFRPSLSSFSRISSTIKPVQEVALQGDNLLKDVTLVGGNESGIFISSVQAGSNAERAGLREGHHLLLLEGSVRGENQSLSLDTSTQEEAHWTLQHCSGPIKLHYRASFDSYRRLQSNLSDGSLASGDSFYIRVNLNICGQSDSCSLNVRCDEVVHVLDTRHQGRCEWLCARVDPYSGTDLAERGTIPSNSRAQQLLLVKIQKFVCRGGKEENEGHRTSRASSLQPEEAGSPPDIKASPRLSRASIFLNQILQFVSRVDIKYKRLNSNERVRIINTCSATLARQSFELLRQEDAADPDNELSRSLNLIPYSPVTPQRTQRRRPVLFTPAALAKTIIQKILNMGAAMDFNICKPDTLTKEEFHLKQNVEPFIHYKEKQATFECITRENIEAVAAKGKHCLLEAELSCVKDLLRREIYPIIVYVKICEKNVKKLRKLPLRVESEEDFVRLCRAKEKELEAIPCLYATLEPDSWTGMEDLIRVIKDRILEEQKKTIWVEQDLL
					

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	48.3	Very low	54.7	Low	233 Å²	233	121.4 Å²	121.4	100%	1.148	66%	0.656	S	S	*	*				0	92.7	0	-70.4	170	-177.2	0	0	105.7
2	D	43.8	Very low	56.5	Low	157 Å²	157	114.2 Å²	114.2	84%	0.84	63%	0.625	S	S	*	*			cis	-135.2	125.2	15.5	-61.5	-43.1	0	0	0	113.2
3	E	47.3	Very low	58.1	Low	173 Å²	173	109.2 Å²	109.2	81%	0.808	60%	0.597	S	S	*	*	S	Bend	trans	-142.9	2.1	175.2	-144.8	168.4	-149.8	0	0	112.5
4	N	46.6	Very low	60	Low	127 Å²	127	101.9 Å²	101.9	68%	0.679	56%	0.556	S	S	*	*	S	Bend	trans	-87.3	-17.1	177.3	-74.9	35.2	0	0	0	113.4	T6 L7	N4-T6 PolarHBondContact O-N 3.08Å; N4-L7 PolarHBondContact O-N 3.2Å
5	G	50.3	Low	61.6	Low	67 Å²	67	103.5 Å²	103.5	69%	0.691	56%	0.559	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70	-10.9	-170.1	0	0	0	0	0	116.1
6	T	55	Low	62.8	Low	96 Å²	96	103.4 Å²	103.4	59%	0.589	55%	0.552	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.8	-10.3	178.7	49	0	0	0	0	113.6	N4 N10	N4-T6 PolarHBondContact O-N 3.08Å; T6-N10 PolarHBondContact O-ND2 3Å; T6-N10 VanDerWaalsContact O-ND2 3.08Å
7	L	53.8	Low	64.1	Low	118 Å²	118	97.4 Å²	97.4	62%	0.618	52%	0.52	S	S	*	.	H	α-helix	trans	-82.9	-42.9	179.7	-150.6	79.9	0	0	0	111.4	N4 D9 N10 D11	N4-L7 PolarHBondContact O-N 3.2Å; L7-D9 VanDerWaalsContact C-N 3.34Å; L7-D9 PolarHBondContact O-N 2.86Å; L7-N10 WeakPolarHBondContact O-CB 3.33Å; L7-N10 PolarHBondContact O-N 3.31Å; L7-D11 PolarHBondContact O-N 3.5Å
8	E	56.2	Low	65.4	Low	152 Å²	152	96.1 Å²	96.1	71%	0.71	51%	0.51	S	S	*	.	H	α-helix	trans	-62.3	-38.9	-179	-64.1	-175.1	165.2	0	0	112.2	A12	E8-A12 VanDerWaalsContact O-CB 3.3Å; E8-A12 WeakPolarHBondContact O-CB 3.2Å; E8-A12 PolarHBondContact O-N 2.92Å
9	D	62.3	Low	66.4	Low	114 Å²	114	96.5 Å²	96.5	61%	0.61	52%	0.52	S	S	*	.	H	α-helix	trans	-72.9	-31.4	177.1	-150.6	16.1	0	0	0	111.8	L7 A12 L13	L7-D9 VanDerWaalsContact C-N 3.34Å; L7-D9 PolarHBondContact O-N 2.86Å; D9-A12 PolarHBondContact O-N 2.99Å; D9-L13 WeakPolarHBondContact O-CG 3.46Å; D9-L13 PolarHBondContact O-N 2.68Å
10	N	65.9	Low	67.4	Low	26 Å²	26	95.2 Å²	95.2	14%	0.139	51%	0.509	C	S	.	.	H	α-helix	trans	-66.1	-47.5	173.9	-104.9	-85.5	0	0	0	112.5	T6 L7 A12 L13 W14 E76	T6-N10 PolarHBondContact O-ND2 3Å; T6-N10 VanDerWaalsContact O-ND2 3.08Å; L7-N10 WeakPolarHBondContact O-CB 3.33Å; L7-N10 PolarHBondContact O-N 3.31Å; N10-A12 VanDerWaalsContact C-N 3.33Å; N10-L13 WeakPolarHBondContact O-CB 3.46Å; N10-L13 PolarHBondContact O-N 2.97Å; N10-W14 PolarHBondContact O-N 3.49Å; N10-E76 WeakPolarHBondContact ND2-CG 3.35Å; N10-E76 PolarHBondContact ND2-OE1 3.46Å; N10-E76 WeakPolarHBondContact OD1-CG 3.45Å; N10-E76 PolarHBondContact OD1-N 3.08Å
11	D	72.9	Confident	68.5	Low	72 Å²	72	92.4 Å²	92.4	39%	0.385	49%	0.491	S	S	.	.	H	α-helix	trans	-67.8	-34.9	176.8	-88	-36.4	0	0	0	111.2	L7 L13 W14 E15 R72	L7-D11 PolarHBondContact O-N 3.5Å; D11-L13 VanDerWaalsContact C-N 3.26Å; D11-L13 PolarHBondContact O-N 3.32Å; D11-W14 PolarHBondContact O-N 2.95Å; D11-E15 VanDerWaalsContact O-CB 3.31Å; D11-E15 WeakPolarHBondContact O-CB 3.49Å; D11-E15 PolarHBondContact O-N 3.04Å; D11-R72 IonicContact OD1-CZ 3.26Å; D11-R72 IonicContact OD1-NE 2.66Å; D11-R72 IonicContact OD1-NH2 3.63Å; D11-R72 PolarHBondContact OD1-NH2 3.33Å
12	A	75.3	Confident	70.2	Confident	35 Å²	35	89.4 Å²	89.4	29%	0.289	47%	0.469	S	S	.	.	H	α-helix	trans	-66.4	-22.1	172.4	0	0	0	0	0	114.1	E8 D9 N10 K16	E8-A12 VanDerWaalsContact O-CB 3.3Å; E8-A12 WeakPolarHBondContact O-CB 3.2Å; E8-A12 PolarHBondContact O-N 2.92Å; D9-A12 PolarHBondContact O-N 2.99Å; N10-A12 VanDerWaalsContact C-N 3.33Å; A12-K16 PolarHBondContact O-NZ 2.9Å
13	L	77.8	Confident	72.2	Confident	50 Å²	50	85 Å²	85	26%	0.262	44%	0.443	S	S	.	.	H	α-helix	trans	-75.5	-52.5	167.4	-72.4	171.1	0	0	0	110.8	D9 N10 D11 E15 K16 Y79	D9-L13 WeakPolarHBondContact O-CG 3.46Å; D9-L13 PolarHBondContact O-N 2.68Å; N10-L13 WeakPolarHBondContact O-CB 3.46Å; N10-L13 PolarHBondContact O-N 2.97Å; D11-L13 VanDerWaalsContact C-N 3.26Å; D11-L13 PolarHBondContact O-N 3.32Å; L13-E15 VanDerWaalsContact C-N 3.33Å; L13-E15 PolarHBondContact O-N 2.88Å; L13-K16 WeakPolarHBondContact O-CB 3.39Å; L13-K16 PolarHBondContact O-N 3.39Å; L13-Y79 HydrophobicContact CB-CD1 4.32Å; L13-Y79 HydrophobicContact CB-CD2 4.37Å; L13-Y79 HydrophobicContact CB-CE1 4.03Å; L13-Y79 HydrophobicContact CB-CE2 4.08Å; L13-Y79 HydrophobicContact CB-CG 4.49Å; L13-Y79 HydrophobicContact CD1-CD1 4.47Å; L13-Y79 HydrophobicContact CD1-CE1 4.49Å; L13-Y79 HydrophobicContact CD2-CE1 3.9Å; L13-Y79 HydrophobicContact CG-CE1 4.37Å; L13-Y79 WeakPolarHBondContact O-CE2 3.34Å; L13-Y79 PolarHBondContact O-OH 3Å
14	W	85.2	Confident	74.1	Confident	6 Å²	6	76.8 Å²	76.8	2%	0.023	41%	0.405	C	S	.	.	H	α-helix	trans	-66.2	-28.7	-178.4	-81.9	104.4	0	0	0	114.1	N10 D11 K16 V17 E18 L71 R72 Y79 F82	N10-W14 PolarHBondContact O-N 3.49Å; D11-W14 PolarHBondContact O-N 2.95Å; W14-K16 PolarHBondContact O-N 2.94Å; W14-V17 HydrophobicContact CE3-CB 4.05Å; W14-V17 HydrophobicContact CE3-CG1 4.03Å; W14-V17 HydrophobicContact CE3-CG2 4.38Å; W14-V17 HydrophobicContact CZ3-CB 4.4Å; W14-V17 HydrophobicContact CZ3-CG1 3.99Å; W14-V17 WeakPolarHBondContact O-CA 3.45Å; W14-V17 WeakPolarHBondContact O-CB 3.29Å; W14-V17 PolarHBondContact O-N 3.27Å; W14-E18 PolarHBondContact O-N 3.23Å; W14-L71 HydrophobicContact CH2-CB 3.85Å; W14-L71 HydrophobicContact CZ2-CB 4.49Å; W14-L71 WeakPolarHBondContact CZ2-O 3.29Å; W14-R72 HydrophobicContact CD2-CB 4.2Å; W14-R72 HydrophobicContact CD2-CG 3.99Å; W14-R72 HydrophobicContact CE3-CB 4.33Å; W14-R72 HydrophobicContact CE3-CG 4.46Å; W14-R72 HydrophobicContact CG-CG 4.04Å; W14-R72 HydrophobicContact CZ2-CB 4.36Å; W14-R72 HydrophobicContact CZ3-CB 4.49Å; W14-Y79 AromaticContact CD2-CD2 3.84Å; W14-Y79 HydrophobicContact CD2-CD2 3.84Å; W14-Y79 AromaticContact CE2-CD2 3.9Å; W14-Y79 HydrophobicContact CE3-CD2 4.11Å; W14-Y79 HydrophobicContact CG-CD2 4.22Å; W14-Y79 HydrophobicContact CH2-CD2 4.48Å; W14-Y79 HydrophobicContact CZ2-CD2 4.25Å; W14-Y79 VanDerWaalsContact CZ2-N 3.34Å; W14-Y79 HydrophobicContact CZ3-CD2 4.42Å; W14-F82 HydrophobicContact CZ3-CD1 4.5Å
15	E	83.7	Confident	76.1	Confident	127 Å²	127	71.3 Å²	71.3	59%	0.593	38%	0.376	S	S	*	.	H	α-helix	trans	-56.1	-33.2	175.5	-174.2	175	-139.9	0	0	112.2	D11 L13 V17 E18 C19	D11-E15 VanDerWaalsContact O-CB 3.31Å; D11-E15 WeakPolarHBondContact O-CB 3.49Å; D11-E15 PolarHBondContact O-N 3.04Å; L13-E15 VanDerWaalsContact C-N 3.33Å; L13-E15 PolarHBondContact O-N 2.88Å; E15-V17 VanDerWaalsContact C-N 3.34Å; E15-V17 PolarHBondContact O-N 3.41Å; E15-E18 PolarHBondContact O-N 3.01Å; E15-C19 VanDerWaalsContact O-CB 3.28Å; E15-C19 WeakPolarHBondContact O-CB 3.22Å; E15-C19 PolarHBondContact O-N 3.44Å; E15-C19 PolarHBondContact O-SG 2.66Å
16	K	81.3	Confident	77.9	Confident	102 Å²	102	74.9 Å²	74.9	44%	0.443	37%	0.369	S	S	.	.	H	α-helix	trans	-67.4	-33.4	176.5	-62	170.1	-178.4	102.7	0	112.5	A12 L13 W14	A12-K16 PolarHBondContact O-NZ 2.9Å; L13-K16 WeakPolarHBondContact O-CB 3.39Å; L13-K16 PolarHBondContact O-N 3.39Å; W14-K16 PolarHBondContact O-N 2.94Å
17	V	84.6	Confident	79.4	Confident	1 Å²	1	73.2 Å²	73.2	1%	0.006	36%	0.356	C	S	.	.	H	α-helix	trans	-76	-43	172.5	167.9	0	0	0	0	110.4	W14 E15 K20 R21 L24 L68 Y79 F82 V97	W14-V17 HydrophobicContact CE3-CB 4.05Å; W14-V17 HydrophobicContact CE3-CG1 4.03Å; W14-V17 HydrophobicContact CE3-CG2 4.38Å; W14-V17 HydrophobicContact CZ3-CB 4.4Å; W14-V17 HydrophobicContact CZ3-CG1 3.99Å; W14-V17 WeakPolarHBondContact O-CA 3.45Å; W14-V17 WeakPolarHBondContact O-CB 3.29Å; W14-V17 PolarHBondContact O-N 3.27Å; E15-V17 VanDerWaalsContact C-N 3.34Å; E15-V17 PolarHBondContact O-N 3.41Å; V17-K20 CarbonylContact O-C 3.55Å; V17-K20 WeakPolarHBondContact O-CA 3.36Å; V17-K20 PolarHBondContact O-N 3.46Å; V17-R21 PolarHBondContact O-N 3.47Å; V17-L24 HydrophobicContact CG1-CD1 3.78Å; V17-L68 HydrophobicContact CG1-CD2 4.31Å; V17-Y79 HydrophobicContact CG2-CD2 4.24Å; V17-Y79 HydrophobicContact CG2-CE2 3.69Å; V17-F82 HydrophobicContact CG1-CE1 3.98Å; V17-F82 HydrophobicContact CG2-CD1 4.37Å; V17-F82 HydrophobicContact CG2-CE1 4.15Å; V17-V97 HydrophobicContact CG2-CG1 3.71Å
18	E	87.2	Confident	81.2	Confident	74 Å²	74	67.6 Å²	67.6	35%	0.346	33%	0.327	S	S	.	.	H	α-helix	trans	-65.4	-42.5	-177.7	-163.2	63.3	-151.9	0	0	111.8	W14 E15 K20 R21	W14-E18 PolarHBondContact O-N 3.23Å; E15-E18 PolarHBondContact O-N 3.01Å; E18-K20 PolarHBondContact O-N 2.69Å; E18-R21 VanDerWaalsContact CD-CD 3.43Å; E18-R21 WeakPolarHBondContact O-CB 3.43Å; E18-R21 PolarHBondContact O-N 2.97Å; E18-R21 WeakPolarHBondContact OE1-CD 3.38Å; E18-R21 IonicContact OE1-CZ 3.96Å; E18-R21 IonicContact OE1-NE 3.88Å; E18-R21 IonicContact OE1-NH1 2.76Å; E18-R21 PolarHBondContact OE1-NH1 3.05Å; E18-R21 WeakPolarHBondContact OE2-CD 3.47Å; E18-R21 IonicContact OE2-CZ 2.95Å; E18-R21 IonicContact OE2-NH1 3.86Å; E18-R21 PolarHBondContact OE2-NH1 3.08Å
19	C	85.3	Confident	82.7	Confident	103 Å²	103	62.7 Å²	62.7	70%	0.696	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	-16.6	170.9	-77	0	0	0	0	114.2	E15	E15-C19 VanDerWaalsContact O-CB 3.28Å; E15-C19 WeakPolarHBondContact O-CB 3.22Å; E15-C19 PolarHBondContact O-N 3.44Å; E15-C19 PolarHBondContact O-SG 2.66Å
20	K	85.7	Confident	83.9	Confident	71 Å²	71	57.5 Å²	57.5	31%	0.309	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111.9	2	177	-68.6	-64.9	-170	143.5	0	113.5	V17 E18 Y22 E23 L24 S96 V97	V17-K20 CarbonylContact O-C 3.55Å; V17-K20 WeakPolarHBondContact O-CA 3.36Å; V17-K20 PolarHBondContact O-N 3.46Å; E18-K20 PolarHBondContact O-N 2.69Å; K20-Y22 VanDerWaalsContact C-N 3.33Å; K20-Y22 PolarHBondContact O-N 3.49Å; K20-Y22 VanDerWaalsContact O-N 3.15Å; K20-E23 IonicContact NZ-OE2 2.71Å; K20-E23 PolarHBondContact NZ-OE2 3.34Å; K20-E23 WeakPolarHBondContact O-CB 3.39Å; K20-E23 PolarHBondContact O-N 3.26Å; K20-L24 HydrophobicContact CB-CD1 4.17Å; K20-L24 HydrophobicContact CB-CG 4.27Å; K20-L24 WeakPolarHBondContact O-CG 3.42Å; K20-L24 PolarHBondContact O-N 2.83Å; K20-L24 VanDerWaalsContact O-N 3.1Å; K20-S96 VanDerWaalsContact CE-O 3.22Å; K20-S96 WeakPolarHBondContact CE-O 3.41Å; K20-S96 PolarHBondContact NZ-O 2.98Å; K20-S96 PolarHBondContact NZ-OG 2.85Å; K20-V97 HydrophobicContact CB-CG2 3.97Å; K20-V97 HydrophobicContact CG-CG2 4.15Å
21	R	89.3	Confident	84.8	Confident	36 Å²	36	58.9 Å²	58.9	14%	0.136	30%	0.295	C	S	.	.	H	α-helix	trans	-54.1	-41.1	-168.6	-176.7	167.8	-175.9	136.4	0.5	114.7	V17 E18 E23 L24 C25 S65 L68 D69	V17-R21 PolarHBondContact O-N 3.47Å; E18-R21 VanDerWaalsContact CD-CD 3.43Å; E18-R21 WeakPolarHBondContact O-CB 3.43Å; E18-R21 PolarHBondContact O-N 2.97Å; E18-R21 WeakPolarHBondContact OE1-CD 3.38Å; E18-R21 IonicContact OE1-CZ 3.96Å; E18-R21 IonicContact OE1-NE 3.88Å; E18-R21 IonicContact OE1-NH1 2.76Å; E18-R21 PolarHBondContact OE1-NH1 3.05Å; E18-R21 WeakPolarHBondContact OE2-CD 3.47Å; E18-R21 IonicContact OE2-CZ 2.95Å; E18-R21 IonicContact OE2-NH1 3.86Å; E18-R21 PolarHBondContact OE2-NH1 3.08Å; R21-E23 VanDerWaalsContact C-N 3.32Å; R21-E23 PolarHBondContact O-N 2.92Å; R21-L24 PolarHBondContact O-N 3.22Å; R21-C25 VanDerWaalsContact O-CB 3.27Å; R21-C25 WeakPolarHBondContact O-CB 3.35Å; R21-C25 PolarHBondContact O-N 2.81Å; R21-C25 PolarHBondContact O-SG 3.5Å; R21-S65 PolarHBondContact NH2-O 3.38Å; R21-S65 PolarHBondContact NH2-OG 2.76Å; R21-L68 HydrophobicContact CG-CD1 4.07Å; R21-D69 IonicContact CZ-OD1 3.22Å; R21-D69 VanDerWaalsContact CZ-OD1 3.31Å; R21-D69 IonicContact NH1-OD1 3.66Å; R21-D69 PolarHBondContact NH1-OD1 3.34Å; R21-D69 IonicContact NH2-OD1 3.79Å; R21-D69 PolarHBondContact NH2-OD1 2.88Å; R21-D69 IonicContact NH2-OD2 2.78Å; R21-D69 PolarHBondContact NH2-OD2 2.75Å
22	Y	86.1	Confident	85.5	Confident	171 Å²	171	61.1 Å²	61.1	67%	0.671	30%	0.301	S	S	*	.	H	α-helix	trans	-60.5	-40.6	177.6	176.6	-94.1	0	0	0	112.7	K20 R26	K20-Y22 VanDerWaalsContact C-N 3.33Å; K20-Y22 PolarHBondContact O-N 3.49Å; K20-Y22 VanDerWaalsContact O-N 3.15Å; Y22-R26 WeakPolarHBondContact O-CB 3.46Å; Y22-R26 PolarHBondContact O-N 2.67Å; Y22-R26 PolarHBondContact OH-NH1 2.83Å
23	E	84.4	Confident	86	Confident	64 Å²	64	59.4 Å²	59.4	30%	0.299	29%	0.287	S	S	.	.	H	α-helix	trans	-67.9	-45.9	177.5	-168.6	-177.5	168.6	0	0	110.7	K20 R21 N27 L93 S96	K20-E23 IonicContact NZ-OE2 2.71Å; K20-E23 PolarHBondContact NZ-OE2 3.34Å; K20-E23 WeakPolarHBondContact O-CB 3.39Å; K20-E23 PolarHBondContact O-N 3.26Å; R21-E23 VanDerWaalsContact C-N 3.32Å; R21-E23 PolarHBondContact O-N 2.92Å; E23-N27 WeakPolarHBondContact O-CB 3.33Å; E23-N27 PolarHBondContact O-N 2.84Å; E23-N27 PolarHBondContact O-ND2 3.08Å; E23-L93 HydrophobicContact CG-CD2 4.26Å; E23-S96 PolarHBondContact OE1-OG 3.45Å; E23-S96 PolarHBondContact OE2-OG 2.81Å
24	L	87.6	Confident	86.4	Confident	1 Å²	1	57 Å²	57	1%	0.005	28%	0.275	C	S	.	.	H	α-helix	trans	-62.4	-51.2	178.3	-61.9	176.1	0	0	0	111.8	V17 K20 R21 R26 N27 I28 L68 F82 L86 L93 V97	V17-L24 HydrophobicContact CG1-CD1 3.78Å; K20-L24 HydrophobicContact CB-CD1 4.17Å; K20-L24 HydrophobicContact CB-CG 4.27Å; K20-L24 WeakPolarHBondContact O-CG 3.42Å; K20-L24 PolarHBondContact O-N 2.83Å; K20-L24 VanDerWaalsContact O-N 3.1Å; R21-L24 PolarHBondContact O-N 3.22Å; L24-R26 VanDerWaalsContact C-N 3.32Å; L24-R26 PolarHBondContact O-N 3.3Å; L24-N27 PolarHBondContact O-N 2.83Å; L24-I28 HydrophobicContact CB-CD1 3.77Å; L24-I28 HydrophobicContact CD2-CD1 4.04Å; L24-I28 HydrophobicContact CG-CD1 4.45Å; L24-I28 WeakPolarHBondContact O-CB 3.47Å; L24-I28 WeakPolarHBondContact O-CG1 3.26Å; L24-I28 PolarHBondContact O-N 2.89Å; L24-L68 HydrophobicContact CB-CD1 4.39Å; L24-F82 HydrophobicContact CD1-CE1 4.45Å; L24-F82 HydrophobicContact CD1-CZ 4.46Å; L24-L86 HydrophobicContact CD2-CD1 4.23Å; L24-L93 HydrophobicContact CD2-CB 4.01Å; L24-L93 HydrophobicContact CD2-CD1 4.29Å; L24-V97 HydrophobicContact CD1-CG2 3.96Å; L24-V97 HydrophobicContact CD2-CG2 3.84Å; L24-V97 HydrophobicContact CG-CG2 4.32Å
25	C	88.8	Confident	86.4	Confident	12 Å²	12	59.8 Å²	59.8	8%	0.081	29%	0.294	C	S	.	.	H	α-helix	trans	-57.6	-40.7	-179.8	-74.6	0	0	0	0	113	R21 A61	R21-C25 VanDerWaalsContact O-CB 3.27Å; R21-C25 WeakPolarHBondContact O-CB 3.35Å; R21-C25 PolarHBondContact O-N 2.81Å; R21-C25 PolarHBondContact O-SG 3.5Å; C25-A61 HydrophobicContact CB-CB 4.3Å; C25-A61 WeakPolarHBondContact O-CA 3.34Å
26	R	87.8	Confident	86.5	Confident	141 Å²	141	55.3 Å²	55.3	53%	0.532	27%	0.271	S	S	.	.	H	α-helix	trans	-70.5	-39.7	-179.8	-162.5	171.5	74.7	-176	8	112.1	Y22 L24 K60	Y22-R26 WeakPolarHBondContact O-CB 3.46Å; Y22-R26 PolarHBondContact O-N 2.67Å; Y22-R26 PolarHBondContact OH-NH1 2.83Å; L24-R26 VanDerWaalsContact C-N 3.32Å; L24-R26 PolarHBondContact O-N 3.3Å; R26-K60 PolarHBondContact O-NZ 2.86Å
27	N	86.2	Confident	86.8	Confident	61 Å²	61	50.5 Å²	50.5	33%	0.326	25%	0.25	S	S	.	.	H	α-helix	trans	-92.4	-44.7	-166.7	-63	-17.5	0	0	0	113.1	E23 L24 K60 L93	E23-N27 WeakPolarHBondContact O-CB 3.33Å; E23-N27 PolarHBondContact O-N 2.84Å; E23-N27 PolarHBondContact O-ND2 3.08Å; L24-N27 PolarHBondContact O-N 2.83Å; N27-K60 PolarHBondContact O-NZ 3.48Å; N27-L93 HydrophobicContact CB-CD1 3.78Å; N27-L93 HydrophobicContact CB-CD2 4.44Å
28	I	90.9	Very high	86.9	Confident	0 Å²	0	54.9 Å²	54.9	0%	0	27%	0.267	C	S	.	.			trans	-67.6	138.2	-178.3	-61.8	163.5	0	0	0	111.4	L24 L33 K60 T64 F82 L86 Y90 L93	L24-I28 HydrophobicContact CB-CD1 3.77Å; L24-I28 HydrophobicContact CD2-CD1 4.04Å; L24-I28 HydrophobicContact CG-CD1 4.45Å; L24-I28 WeakPolarHBondContact O-CB 3.47Å; L24-I28 WeakPolarHBondContact O-CG1 3.26Å; L24-I28 PolarHBondContact O-N 2.89Å; I28-L33 HydrophobicContact CG2-CD1 3.45Å; I28-L33 VanDerWaalsContact CG2-CD1 3.45Å; I28-L33 HydrophobicContact CG2-CG 4.02Å; I28-K60 WeakPolarHBondContact O-CE 3.45Å; I28-T64 HydrophobicContact CB-CG2 3.79Å; I28-T64 HydrophobicContact CD1-CG2 4.3Å; I28-T64 HydrophobicContact CG2-CG2 3.99Å; I28-T64 PolarHBondContact O-OG1 3.41Å; I28-F82 HydrophobicContact CD1-CE2 4.07Å; I28-F82 HydrophobicContact CD1-CZ 3.89Å; I28-L86 HydrophobicContact CD1-CD2 3.65Å; I28-L86 HydrophobicContact CG1-CD2 3.99Å; I28-Y90 HydrophobicContact CB-CE2 4.41Å; I28-Y90 HydrophobicContact CG1-CD2 4.34Å; I28-Y90 HydrophobicContact CG1-CE2 4.46Å; I28-Y90 HydrophobicContact CG2-CE2 4.12Å; I28-L93 HydrophobicContact CG1-CD1 3.88Å
29	T	88.8	Confident	86.8	Confident	49 Å²	49	58.7 Å²	58.7	30%	0.301	29%	0.285	S	S	.	.			trans	-104.7	113.8	171.1	-58.3	0	0	0	0	109.5	A31 K32 K60 Y90	T29-A31 VanDerWaalsContact C-N 3.35Å; T29-A31 PolarHBondContact O-N 2.69Å; T29-K32 PolarHBondContact O-N 2.8Å; T29-K60 WeakPolarHBondContact OG1-CE 3.23Å; T29-Y90 PolarHBondContact N-OH 3.13Å
30	P	86.8	Confident	86.6	Confident	5 Å²	5	56 Å²	56	3%	0.032	27%	0.266	C	S	.	.	H	α-helix	trans	-54.7	-43.9	-171.9	-32.4	39.5	0	0	0	114.4	K32 L33 T34 I51 L52 R63 T64 L67	P30-K32 PolarHBondContact O-N 3.48Å; P30-L33 PolarHBondContact O-N 3.27Å; P30-T34 PolarHBondContact O-N 2.98Å; P30-T34 PolarHBondContact O-OG1 2.84Å; P30-I51 HydrophobicContact CB-CG2 3.66Å; P30-I51 HydrophobicContact CG-CG2 4.34Å; P30-L52 HydrophobicContact CB-CD2 4.05Å; P30-R63 HydrophobicContact CG-CB 3.89Å; P30-T64 WeakPolarHBondContact CD-OG1 3.25Å; P30-T64 WeakPolarHBondContact CG-OG1 3.37Å; P30-L67 HydrophobicContact CB-CD2 4.01Å; P30-L67 HydrophobicContact CG-CD2 4.36Å
31	A	85.6	Confident	86.5	Confident	55 Å²	55	61 Å²	61	46%	0.455	29%	0.288	S	S	.	.	H	α-helix	trans	-60.4	-8.6	178.8	0	0	0	0	0	115.5	T29 L52	T29-A31 VanDerWaalsContact C-N 3.35Å; T29-A31 PolarHBondContact O-N 2.69Å; A31-L52 HydrophobicContact CB-CD1 4.38Å; A31-L52 HydrophobicContact CB-CD2 3.82Å
32	K	86.3	Confident	86.4	Confident	119 Å²	119	59.6 Å²	59.6	52%	0.517	28%	0.284	S	S	.	.	H	α-helix	trans	-89.6	-27.3	169.3	-68.4	-165.4	174.8	-169.8	0	113.2	T29 P30 Y89	T29-K32 PolarHBondContact O-N 2.8Å; P30-K32 PolarHBondContact O-N 3.48Å; K32-Y89 WeakPolarHBondContact O-CE2 3.35Å
33	L	87.3	Confident	86.6	Confident	0 Å²	0	51.8 Å²	51.8	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-96.5	-36.9	-177.7	-53.6	-169.6	0	0	0	112	I28 P30 P35 Y36 L37 L67 F82 L86 Y89 Y90	I28-L33 HydrophobicContact CG2-CD1 3.45Å; I28-L33 VanDerWaalsContact CG2-CD1 3.45Å; I28-L33 HydrophobicContact CG2-CG 4.02Å; P30-L33 PolarHBondContact O-N 3.27Å; L33-P35 VanDerWaalsContact C-CD 3.43Å; L33-Y36 PolarHBondContact O-N 2.91Å; L33-Y36 VanDerWaalsContact O-N 3.1Å; L33-L37 HydrophobicContact CB-CD1 3.79Å; L33-L37 HydrophobicContact CB-CG 4.47Å; L33-L37 WeakPolarHBondContact O-CG 3.39Å; L33-L37 PolarHBondContact O-N 3.12Å; L33-L67 HydrophobicContact CB-CD2 4.49Å; L33-L67 HydrophobicContact CD1-CD2 4.37Å; L33-F82 HydrophobicContact CD1-CD2 4.39Å; L33-F82 HydrophobicContact CD1-CE2 4.05Å; L33-L86 HydrophobicContact CD1-CD2 4.48Å; L33-Y89 HydrophobicContact CD2-CD2 3.47Å; L33-Y89 VanDerWaalsContact CD2-CD2 3.47Å; L33-Y89 HydrophobicContact CD2-CE2 4.32Å; L33-Y89 HydrophobicContact CD2-CG 3.97Å; L33-Y90 HydrophobicContact CD2-CD2 4.11Å; L33-Y90 HydrophobicContact CD2-CE2 3.97Å; L33-Y90 HydrophobicContact CG-CE2 4.47Å
34	T	86.7	Confident	86.7	Confident	0 Å²	0	52.8 Å²	52.8	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-54.9	-38.9	-174.4	53.4	0	0	0	0	114.3	P30 Y36 L37 R38 L43 E48 I51 L67	P30-T34 PolarHBondContact O-N 2.98Å; P30-T34 PolarHBondContact O-OG1 2.84Å; T34-Y36 PolarHBondContact O-N 2.77Å; T34-L37 PolarHBondContact O-N 3.33Å; T34-R38 WeakPolarHBondContact O-CB 3.4Å; T34-R38 PolarHBondContact O-N 3.23Å; T34-L43 HydrophobicContact CG2-CD1 3.93Å; T34-E48 VanDerWaalsContact CB-OE1 3.23Å; T34-E48 WeakPolarHBondContact CB-OE1 3.4Å; T34-E48 HydrophobicContact CG2-CG 4.14Å; T34-E48 VanDerWaalsContact OG1-CD 3.25Å; T34-E48 PolarHBondContact OG1-OE1 3.1Å; T34-I51 HydrophobicContact CG2-CG2 4.27Å; T34-L67 HydrophobicContact CG2-CD1 4.34Å
35	P	84.8	Confident	86.7	Confident	64 Å²	64	59.3 Å²	59.3	42%	0.416	29%	0.291	S	S	.	.	H	α-helix	trans	-65	-37.5	178.2	-21.2	34.9	0	0	0	113.2	L33 Q39	L33-P35 VanDerWaalsContact C-CD 3.43Å; P35-Q39 WeakPolarHBondContact O-CB 3.3Å; P35-Q39 PolarHBondContact O-N 3.42Å
36	Y	84.8	Confident	86.7	Confident	33 Å²	33	65.3 Å²	65.3	13%	0.129	32%	0.318	C	S	.	.	H	α-helix	trans	-72.1	-42.2	176.8	179.2	-100.6	0	0	0	111.4	L33 T34 R38 Q39 C40 E84 F106	L33-Y36 PolarHBondContact O-N 2.91Å; L33-Y36 VanDerWaalsContact O-N 3.1Å; T34-Y36 PolarHBondContact O-N 2.77Å; Y36-R38 VanDerWaalsContact C-N 3.28Å; Y36-R38 PolarHBondContact O-N 3.49Å; Y36-Q39 WeakPolarHBondContact O-CB 3.27Å; Y36-Q39 PolarHBondContact O-N 3.26Å; Y36-Q39 VanDerWaalsContact O-N 3.12Å; Y36-C40 PolarHBondContact O-N 3.19Å; Y36-C40 PolarHBondContact O-SG 3.35Å; Y36-E84 HydrophobicContact CE1-CB 4.15Å; Y36-E84 PolarHBondContact OH-OE2 2.87Å; Y36-F106 HydrophobicContact CE2-CZ 4.16Å
37	L	87.5	Confident	86.7	Confident	0 Å²	0	59.8 Å²	59.8	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-67.2	-29.6	177.5	-63.4	167.1	0	0	0	112.3	L33 T34 K41 V42 L43 L67 L71 A81	L33-L37 HydrophobicContact CB-CD1 3.79Å; L33-L37 HydrophobicContact CB-CG 4.47Å; L33-L37 WeakPolarHBondContact O-CG 3.39Å; L33-L37 PolarHBondContact O-N 3.12Å; T34-L37 PolarHBondContact O-N 3.33Å; L37-K41 PolarHBondContact O-N 3.48Å; L37-V42 PolarHBondContact O-N 2.81Å; L37-L43 HydrophobicContact CB-CD1 3.73Å; L37-L43 HydrophobicContact CB-CG 3.89Å; L37-L43 HydrophobicContact CD1-CD1 4.07Å; L37-L43 PolarHBondContact O-N 2.76Å; L37-L67 HydrophobicContact CD1-CD1 3.91Å; L37-L71 HydrophobicContact CD1-CD1 4.03Å; L37-L71 HydrophobicContact CD1-CD2 4.16Å; L37-L71 HydrophobicContact CD2-CD2 4.11Å; L37-A81 HydrophobicContact CD2-CB 3.93Å
38	R	87.4	Confident	86.9	Confident	93 Å²	93	57.7 Å²	57.7	35%	0.351	29%	0.287	S	S	.	.	H	α-helix	trans	-69.7	-43.4	168.2	-155.4	-155.4	-52.3	176.5	14.1	111.5	T34 Y36 C40 K41 L43 E45 E48	T34-R38 WeakPolarHBondContact O-CB 3.4Å; T34-R38 PolarHBondContact O-N 3.23Å; Y36-R38 VanDerWaalsContact C-N 3.28Å; Y36-R38 PolarHBondContact O-N 3.49Å; R38-C40 VanDerWaalsContact C-N 3.33Å; R38-C40 PolarHBondContact O-N 3.45Å; R38-K41 WeakPolarHBondContact O-CA 3.44Å; R38-K41 PolarHBondContact O-N 3.31Å; R38-L43 WeakPolarHBondContact CA-O 3.36Å; R38-E45 IonicContact CZ-OE1 3.77Å; R38-E45 IonicContact NH1-OE1 2.76Å; R38-E45 PolarHBondContact NH1-OE1 3.33Å; R38-E48 IonicContact CZ-OE2 3.87Å; R38-E48 IonicContact NE-OE2 2.83Å; R38-E48 PolarHBondContact NE-OE2 2.86Å; R38-E48 IonicContact NH2-OE1 3.3Å; R38-E48 PolarHBondContact NH2-OE1 2.87Å; R38-E48 IonicContact NH2-OE2 3.78Å; R38-E48 PolarHBondContact NH2-OE2 3.28Å
39	Q	84.5	Confident	86.6	Confident	155 Å²	155	61.9 Å²	61.9	72%	0.724	31%	0.31	S	S	*	.	H	α-helix	trans	-60.1	-40.8	175.3	-177	178.6	-4.9	0	0	112.2	P35 Y36 K41	P35-Q39 WeakPolarHBondContact O-CB 3.3Å; P35-Q39 PolarHBondContact O-N 3.42Å; Y36-Q39 WeakPolarHBondContact O-CB 3.27Å; Y36-Q39 PolarHBondContact O-N 3.26Å; Y36-Q39 VanDerWaalsContact O-N 3.12Å; Q39-K41 PolarHBondContact O-N 3.49Å
40	C	80.8	Confident	86.6	Confident	45 Å²	45	62.9 Å²	62.9	30%	0.304	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.2	2.1	174.1	-65.5	0	0	0	0	113.9	Y36 R38 V42 A81	Y36-C40 PolarHBondContact O-N 3.19Å; Y36-C40 PolarHBondContact O-SG 3.35Å; R38-C40 VanDerWaalsContact C-N 3.33Å; R38-C40 PolarHBondContact O-N 3.45Å; C40-V42 VanDerWaalsContact C-N 3.3Å; C40-V42 HydrophobicContact CB-CG2 4.17Å; C40-V42 PolarHBondContact O-N 2.8Å; C40-A81 HydrophobicContact CB-CB 4.27Å
41	K	83.9	Confident	86.8	Confident	176 Å²	176	62.6 Å²	62.6	77%	0.765	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.8	41.7	179.8	-54.2	-178.5	-177.7	179.7	0	113.2	L37 R38 Q39	L37-K41 PolarHBondContact O-N 3.48Å; R38-K41 WeakPolarHBondContact O-CA 3.44Å; R38-K41 PolarHBondContact O-N 3.31Å; Q39-K41 PolarHBondContact O-N 3.49Å
42	V	87.6	Confident	86.9	Confident	8 Å²	8	61.8 Å²	61.8	5%	0.048	30%	0.297	C	S	.	.	S	Bend	trans	-103.5	-34.4	175.4	-179.9	0	0	0	0	110.9	L37 C40 L71 K74 R77 A81	L37-V42 PolarHBondContact O-N 2.81Å; C40-V42 VanDerWaalsContact C-N 3.3Å; C40-V42 HydrophobicContact CB-CG2 4.17Å; C40-V42 PolarHBondContact O-N 2.8Å; V42-L71 HydrophobicContact CG1-CD2 3.52Å; V42-K74 HydrophobicContact CG1-CB 4.04Å; V42-K74 HydrophobicContact CG1-CG 3.9Å; V42-K74 WeakPolarHBondContact O-CD 3.39Å; V42-K74 WeakPolarHBondContact O-CE 3.12Å; V42-K74 PolarHBondContact O-NZ 2.98Å; V42-R77 HydrophobicContact CG2-CG 3.97Å; V42-A81 HydrophobicContact CG2-CB 3.75Å
43	L	89.3	Confident	86.8	Confident	7 Å²	7	61.3 Å²	61.3	4%	0.037	30%	0.3	C	S	.	.	S	Bend	trans	-110.6	153.6	166.2	-55.5	178.2	0	0	0	109.9	T34 L37 R38 D47 I51 L67 I70 L71	T34-L43 HydrophobicContact CG2-CD1 3.93Å; L37-L43 HydrophobicContact CB-CD1 3.73Å; L37-L43 HydrophobicContact CB-CG 3.89Å; L37-L43 HydrophobicContact CD1-CD1 4.07Å; L37-L43 PolarHBondContact O-N 2.76Å; R38-L43 WeakPolarHBondContact CA-O 3.36Å; L43-D47 WeakPolarHBondContact CA-OD2 3.21Å; L43-D47 HydrophobicContact CB-CB 4.08Å; L43-D47 HydrophobicContact CD2-CB 4.11Å; L43-I51 HydrophobicContact CD1-CD1 4.22Å; L43-L67 HydrophobicContact CD1-CD1 3.74Å; L43-I70 HydrophobicContact CD2-CG2 3.57Å; L43-L71 HydrophobicContact CD2-CD2 4.17Å
44	D	88.1	Confident	86.6	Confident	85 Å²	85	62.6 Å²	62.6	46%	0.455	31%	0.309	S	S	.	.			trans	-106.1	-174.8	164.5	64.5	42.3	0	0	0	111.7	Q46 D47 E48	D44-Q46 VanDerWaalsContact C-N 3.29Å; D44-Q46 PolarHBondContact O-N 3.05Å; D44-Q46 WeakPolarHBondContact OD1-CA 3.37Å; D44-Q46 WeakPolarHBondContact OD1-CB 3.37Å; D44-Q46 PolarHBondContact OD1-N 3.1Å; D44-D47 PolarHBondContact N-OD2 2.96Å; D44-D47 PolarHBondContact OD1-N 2.93Å; D44-E48 PolarHBondContact O-N 3.33Å
45	E	86.9	Confident	86.2	Confident	137 Å²	137	69.9 Å²	69.9	64%	0.64	35%	0.347	S	S	*	.	H	α-helix	trans	-71.6	-23.9	-178.6	-57.6	-162.3	134.4	0	0	112.7	R38 D49	R38-E45 IonicContact CZ-OE1 3.77Å; R38-E45 IonicContact NH1-OE1 2.76Å; R38-E45 PolarHBondContact NH1-OE1 3.33Å; E45-D49 PolarHBondContact O-N 2.95Å
46	Q	87.7	Confident	85.9	Confident	139 Å²	139	74 Å²	74	65%	0.65	37%	0.365	S	S	*	.	H	α-helix	trans	-81.4	-40.1	179	-173.9	60	83.1	0	0	111.4	D44 E48 E50	D44-Q46 VanDerWaalsContact C-N 3.29Å; D44-Q46 PolarHBondContact O-N 3.05Å; D44-Q46 WeakPolarHBondContact OD1-CA 3.37Å; D44-Q46 WeakPolarHBondContact OD1-CB 3.37Å; D44-Q46 PolarHBondContact OD1-N 3.1Å; Q46-E48 VanDerWaalsContact C-N 3.28Å; Q46-E48 PolarHBondContact O-N 3.47Å; Q46-E50 WeakPolarHBondContact O-CB 3.45Å; Q46-E50 PolarHBondContact O-N 3.43Å
47	D	89.6	Confident	85.8	Confident	25 Å²	25	73.7 Å²	73.7	13%	0.134	37%	0.366	C	S	.	.	H	α-helix	trans	-54.1	-46.4	167	-81.4	-31.3	0	0	0	110.3	L43 D44 E50 I51 I70 K74	L43-D47 WeakPolarHBondContact CA-OD2 3.21Å; L43-D47 HydrophobicContact CB-CB 4.08Å; L43-D47 HydrophobicContact CD2-CB 4.11Å; D44-D47 PolarHBondContact N-OD2 2.96Å; D44-D47 PolarHBondContact OD1-N 2.93Å; D47-E50 PolarHBondContact O-N 3.33Å; D47-I51 VanDerWaalsContact O-CD1 3.3Å; D47-I51 WeakPolarHBondContact O-CD1 3.36Å; D47-I51 WeakPolarHBondContact O-CG1 3.41Å; D47-I51 PolarHBondContact O-N 3.36Å; D47-I70 HydrophobicContact CB-CG2 4.44Å; D47-K74 IonicContact OD1-NZ 3.33Å; D47-K74 IonicContact OD2-NZ 3.98Å; D47-K74 PolarHBondContact OD2-NZ 2.82Å
48	E	89	Confident	85.2	Confident	17 Å²	17	81.7 Å²	81.7	8%	0.079	40%	0.403	C	S	.	.	H	α-helix	trans	-69.9	-41.7	-177.3	-176.5	162.6	-175.2	0	0	113.1	T34 R38 D44 Q46 E50 I51 L52	T34-E48 VanDerWaalsContact CB-OE1 3.23Å; T34-E48 WeakPolarHBondContact CB-OE1 3.4Å; T34-E48 HydrophobicContact CG2-CG 4.14Å; T34-E48 VanDerWaalsContact OG1-CD 3.25Å; T34-E48 PolarHBondContact OG1-OE1 3.1Å; R38-E48 IonicContact CZ-OE2 3.87Å; R38-E48 IonicContact NE-OE2 2.83Å; R38-E48 PolarHBondContact NE-OE2 2.86Å; R38-E48 IonicContact NH2-OE1 3.3Å; R38-E48 PolarHBondContact NH2-OE1 2.87Å; R38-E48 IonicContact NH2-OE2 3.78Å; R38-E48 PolarHBondContact NH2-OE2 3.28Å; D44-E48 PolarHBondContact O-N 3.33Å; Q46-E48 VanDerWaalsContact C-N 3.28Å; Q46-E48 PolarHBondContact O-N 3.47Å; E48-E50 VanDerWaalsContact C-N 3.31Å; E48-E50 PolarHBondContact O-N 2.98Å; E48-I51 PolarHBondContact O-N 3.06Å; E48-L52 HydrophobicContact CG-CD1 3.71Å; E48-L52 HydrophobicContact CG-CG 4.14Å; E48-L52 WeakPolarHBondContact O-CB 3.5Å; E48-L52 WeakPolarHBondContact O-CG 3.36Å; E48-L52 PolarHBondContact O-N 2.87Å
49	D	86.2	Confident	85.1	Confident	88 Å²	88	79.4 Å²	79.4	47%	0.471	40%	0.404	S	S	.	.	H	α-helix	trans	-65.1	-35.6	175.1	-118.1	7.6	0	0	0	111.8	E45 N53 S54	E45-D49 PolarHBondContact O-N 2.95Å; D49-N53 WeakPolarHBondContact O-CA 3.23Å; D49-N53 WeakPolarHBondContact O-CB 3.47Å; D49-N53 PolarHBondContact O-N 3.19Å; D49-N53 PolarHBondContact OD1-ND2 3.43Å; D49-S54 PolarHBondContact O-N 3.45Å
50	E	88.9	Confident	85	Confident	69 Å²	69	76 Å²	76	32%	0.322	39%	0.387	S	S	.	.	H	α-helix	trans	-63.7	-44.8	173.1	-156.1	-155.7	107.2	0	0	111.3	Q46 D47 E48 S54 L57 R66	Q46-E50 WeakPolarHBondContact O-CB 3.45Å; Q46-E50 PolarHBondContact O-N 3.43Å; D47-E50 PolarHBondContact O-N 3.33Å; E48-E50 VanDerWaalsContact C-N 3.31Å; E48-E50 PolarHBondContact O-N 2.98Å; E50-S54 WeakPolarHBondContact O-CB 3.44Å; E50-L57 WeakPolarHBondContact O-CD1 3.43Å; E50-R66 IonicContact OE1-CZ 3.74Å; E50-R66 IonicContact OE1-NE 3.73Å; E50-R66 PolarHBondContact OE1-NE 2.97Å; E50-R66 IonicContact OE1-NH2 3.77Å; E50-R66 PolarHBondContact OE1-NH2 3.48Å; E50-R66 IonicContact OE2-NH2 2.83Å; E50-R66 PolarHBondContact OE2-NH2 3.17Å; E50-R66 VanDerWaalsContact OE2-NH2 3.11Å
51	I	89	Confident	85.2	Confident	0 Å²	0	75.6 Å²	75.6	0%	0	39%	0.387	C	S	.	.	H	α-helix	trans	-68.9	-38.4	-179	-69.2	161.8	0	0	0	112.1	P30 T34 L43 D47 E48 R63 L67 I70	P30-I51 HydrophobicContact CB-CG2 3.66Å; P30-I51 HydrophobicContact CG-CG2 4.34Å; T34-I51 HydrophobicContact CG2-CG2 4.27Å; L43-I51 HydrophobicContact CD1-CD1 4.22Å; D47-I51 VanDerWaalsContact O-CD1 3.3Å; D47-I51 WeakPolarHBondContact O-CD1 3.36Å; D47-I51 WeakPolarHBondContact O-CG1 3.41Å; D47-I51 PolarHBondContact O-N 3.36Å; E48-I51 PolarHBondContact O-N 3.06Å; I51-R63 WeakPolarHBondContact O-CB 3.49Å; I51-R63 WeakPolarHBondContact O-CD 3.44Å; I51-R63 WeakPolarHBondContact O-CG 3.37Å; I51-L67 HydrophobicContact CD1-CB 4.07Å; I51-L67 HydrophobicContact CD1-CD1 3.77Å; I51-L67 HydrophobicContact CG1-CB 4.42Å; I51-L67 HydrophobicContact CG2-CB 4.11Å; I51-I70 HydrophobicContact CD1-CD1 3.81Å; I51-I70 HydrophobicContact CG1-CD1 3.77Å
52	L	88.2	Confident	85.4	Confident	37 Å²	37	71.2 Å²	71.2	19%	0.194	37%	0.372	C	S	.	.	H	α-helix	trans	-92.7	-50.4	-173.6	-61.8	-175	0	0	0	112.9	P30 A31 E48 R63	P30-L52 HydrophobicContact CB-CD2 4.05Å; A31-L52 HydrophobicContact CB-CD1 4.38Å; A31-L52 HydrophobicContact CB-CD2 3.82Å; E48-L52 HydrophobicContact CG-CD1 3.71Å; E48-L52 HydrophobicContact CG-CG 4.14Å; E48-L52 WeakPolarHBondContact O-CB 3.5Å; E48-L52 WeakPolarHBondContact O-CG 3.36Å; E48-L52 PolarHBondContact O-N 2.87Å; L52-R63 PolarHBondContact O-NE 2.88Å; L52-R63 PolarHBondContact O-NH2 3.48Å; L52-R63 VanDerWaalsContact O-NH2 3.09Å
53	N	84.1	Confident	85.5	Confident	110 Å²	110	74 Å²	74	59%	0.588	38%	0.381	S	S	*	.	H	α-helix	trans	-102.7	-6.3	-164.2	-67.8	-38.6	0	0	0	114.1	D49 L55	D49-N53 WeakPolarHBondContact O-CA 3.23Å; D49-N53 WeakPolarHBondContact O-CB 3.47Å; D49-N53 PolarHBondContact O-N 3.19Å; D49-N53 PolarHBondContact OD1-ND2 3.43Å; N53-L55 PolarHBondContact O-N 3.43Å
54	S	83.6	Confident	85.5	Confident	26 Å²	26	73.6 Å²	73.6	18%	0.182	38%	0.379	C	S	.	.			trans	-62.3	120.7	174.1	-178.1	0	0	0	0	113	D49 E50 L56 L57	D49-S54 PolarHBondContact O-N 3.45Å; E50-S54 WeakPolarHBondContact O-CB 3.44Å; S54-L56 PolarHBondContact O-N 3Å; S54-L56 PolarHBondContact OG-N 3.22Å; S54-L57 PolarHBondContact O-N 2.94Å; S54-L57 VanDerWaalsContact O-N 3.17Å
55	L	79.1	Confident	85.6	Confident	153 Å²	153	71.2 Å²	71.2	80%	0.801	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.2	-17.1	174.5	-63.2	175.3	0	0	0	113.3	N53 Q58	N53-L55 PolarHBondContact O-N 3.43Å; L55-Q58 WeakPolarHBondContact O-CG 3.5Å
56	L	77.6	Confident	85.8	Confident	152 Å²	152	69.1 Å²	69.1	80%	0.796	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.3	-25.2	176.9	-57.1	176	0	0	0	112.1	S54 Q58	S54-L56 PolarHBondContact O-N 3Å; S54-L56 PolarHBondContact OG-N 3.22Å; L56-Q58 VanDerWaalsContact C-N 3.34Å; L56-Q58 PolarHBondContact O-N 3.4Å
57	L	82.6	Confident	86	Confident	26 Å²	26	62.5 Å²	62.5	14%	0.136	33%	0.325	C	S	.	.			trans	-97.3	49.2	-176.1	-57.9	177.8	0	0	0	111.6	E50 S54 A59 N62 R63 R66	E50-L57 WeakPolarHBondContact O-CD1 3.43Å; S54-L57 PolarHBondContact O-N 2.94Å; S54-L57 VanDerWaalsContact O-N 3.17Å; L57-A59 VanDerWaalsContact C-N 3.34Å; L57-A59 PolarHBondContact O-N 3.22Å; L57-A59 VanDerWaalsContact O-N 3.15Å; L57-N62 HydrophobicContact CD2-CB 4.38Å; L57-R63 HydrophobicContact CB-CG 3.63Å; L57-R63 HydrophobicContact CD1-CG 4.42Å; L57-R63 VanDerWaalsContact O-CG 3.3Å; L57-R63 WeakPolarHBondContact O-CG 3.31Å; L57-R63 VanDerWaalsContact O-CZ 3.3Å; L57-R63 PolarHBondContact O-NH1 2.78Å; L57-R66 HydrophobicContact CD1-CB 3.83Å; L57-R66 HydrophobicContact CD1-CG 3.87Å; L57-R66 HydrophobicContact CD2-CB 4.2Å
58	Q	75.9	Confident	86	Confident	167 Å²	167	61.4 Å²	61.4	78%	0.78	32%	0.319	S	S	*	.			trans	-48.1	-48	-169.3	-64.1	-178.4	-10	0	0	114.2	L55 L56 R63	L55-Q58 WeakPolarHBondContact O-CG 3.5Å; L56-Q58 VanDerWaalsContact C-N 3.34Å; L56-Q58 PolarHBondContact O-N 3.4Å; Q58-R63 PolarHBondContact O-NH1 2.82Å
59	A	83.5	Confident	86.1	Confident	46 Å²	46	63.4 Å²	63.4	38%	0.38	33%	0.33	S	S	.	.	S	Bend	trans	-83.8	143.9	179.5	0	0	0	0	0	113	L57 A61 N62 R63	L57-A59 VanDerWaalsContact C-N 3.34Å; L57-A59 PolarHBondContact O-N 3.22Å; L57-A59 VanDerWaalsContact O-N 3.15Å; A59-A61 PolarHBondContact O-N 2.94Å; A59-N62 WeakPolarHBondContact O-CB 3.17Å; A59-N62 PolarHBondContact O-N 2.65Å; A59-R63 PolarHBondContact O-N 3.38Å
60	K	83.8	Confident	86.2	Confident	83 Å²	83	59.7 Å²	59.7	36%	0.361	31%	0.31	S	S	.	.	H	α-helix	trans	-48.1	-45.3	172.1	176.9	-166.9	165.3	-160.2	0	112.3	R26 N27 I28 T29 N62 R63 T64	R26-K60 PolarHBondContact O-NZ 2.86Å; N27-K60 PolarHBondContact O-NZ 3.48Å; I28-K60 WeakPolarHBondContact O-CE 3.45Å; T29-K60 WeakPolarHBondContact OG1-CE 3.23Å; K60-N62 VanDerWaalsContact C-N 3.28Å; K60-N62 PolarHBondContact O-N 3.31Å; K60-R63 WeakPolarHBondContact O-CB 3.42Å; K60-R63 PolarHBondContact O-N 2.62Å; K60-T64 PolarHBondContact O-N 3.06Å; K60-T64 PolarHBondContact O-OG1 3.34Å; K60-T64 VanDerWaalsContact O-OG1 3.12Å
61	A	84.5	Confident	86.2	Confident	37 Å²	37	56.4 Å²	56.4	31%	0.306	30%	0.295	S	S	.	.	H	α-helix	trans	-65.3	-29.4	-179.3	0	0	0	0	0	113.3	C25 A59 S65	C25-A61 HydrophobicContact CB-CB 4.3Å; C25-A61 WeakPolarHBondContact O-CA 3.34Å; A59-A61 PolarHBondContact O-N 2.94Å; A61-S65 WeakPolarHBondContact O-CB 3.32Å; A61-S65 PolarHBondContact O-N 3.14Å
62	N	87.6	Confident	86.1	Confident	84 Å²	84	61.3 Å²	61.3	45%	0.449	31%	0.313	S	S	.	.	H	α-helix	trans	-73.7	-40.6	176.5	-59.9	16.9	0	0	0	110.3	L57 A59 K60 S65 R66	L57-N62 HydrophobicContact CD2-CB 4.38Å; A59-N62 WeakPolarHBondContact O-CB 3.17Å; A59-N62 PolarHBondContact O-N 2.65Å; K60-N62 VanDerWaalsContact C-N 3.28Å; K60-N62 PolarHBondContact O-N 3.31Å; N62-S65 WeakPolarHBondContact O-CB 3.44Å; N62-S65 PolarHBondContact O-N 2.76Å; N62-R66 WeakPolarHBondContact O-CB 3.36Å; N62-R66 PolarHBondContact O-N 3.46Å
63	R	90.1	Very high	86	Confident	65 Å²	65	65 Å²	65	25%	0.245	34%	0.337	C	S	.	.	H	α-helix	trans	-59.5	-44.9	171	-63.4	-176.1	165.5	88.9	-13	111.7	P30 I51 L52 L57 Q58 A59 K60 R66 L67	P30-R63 HydrophobicContact CG-CB 3.89Å; I51-R63 WeakPolarHBondContact O-CB 3.49Å; I51-R63 WeakPolarHBondContact O-CD 3.44Å; I51-R63 WeakPolarHBondContact O-CG 3.37Å; L52-R63 PolarHBondContact O-NE 2.88Å; L52-R63 PolarHBondContact O-NH2 3.48Å; L52-R63 VanDerWaalsContact O-NH2 3.09Å; L57-R63 HydrophobicContact CB-CG 3.63Å; L57-R63 HydrophobicContact CD1-CG 4.42Å; L57-R63 VanDerWaalsContact O-CG 3.3Å; L57-R63 WeakPolarHBondContact O-CG 3.31Å; L57-R63 VanDerWaalsContact O-CZ 3.3Å; L57-R63 PolarHBondContact O-NH1 2.78Å; Q58-R63 PolarHBondContact O-NH1 2.82Å; A59-R63 PolarHBondContact O-N 3.38Å; K60-R63 WeakPolarHBondContact O-CB 3.42Å; K60-R63 PolarHBondContact O-N 2.62Å; R63-R66 PolarHBondContact O-N 3.26Å; R63-L67 WeakPolarHBondContact O-CB 3.05Å; R63-L67 PolarHBondContact O-N 3Å
64	T	89.4	Confident	86	Confident	0 Å²	0	63.1 Å²	63.1	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-66	-40.5	176.1	-51.1	0	0	0	0	112.2	I28 P30 K60 R66 L67 L68	I28-T64 HydrophobicContact CB-CG2 3.79Å; I28-T64 HydrophobicContact CD1-CG2 4.3Å; I28-T64 HydrophobicContact CG2-CG2 3.99Å; I28-T64 PolarHBondContact O-OG1 3.41Å; P30-T64 WeakPolarHBondContact CD-OG1 3.25Å; P30-T64 WeakPolarHBondContact CG-OG1 3.37Å; K60-T64 PolarHBondContact O-N 3.06Å; K60-T64 PolarHBondContact O-OG1 3.34Å; K60-T64 VanDerWaalsContact O-OG1 3.12Å; T64-R66 VanDerWaalsContact C-N 3.34Å; T64-R66 PolarHBondContact O-N 3.13Å; T64-L67 WeakPolarHBondContact O-CB 3.4Å; T64-L67 PolarHBondContact O-N 2.98Å; T64-L68 WeakPolarHBondContact O-CG 3.24Å; T64-L68 PolarHBondContact O-N 3.04Å
65	S	90.3	Very high	85.9	Confident	35 Å²	35	62.9 Å²	62.9	25%	0.245	33%	0.326	C	S	.	.	H	α-helix	trans	-56.3	-50.2	173.1	-177.7	0	0	0	0	110.7	R21 A61 N62 L67 L68 D69	R21-S65 PolarHBondContact NH2-O 3.38Å; R21-S65 PolarHBondContact NH2-OG 2.76Å; A61-S65 WeakPolarHBondContact O-CB 3.32Å; A61-S65 PolarHBondContact O-N 3.14Å; N62-S65 WeakPolarHBondContact O-CB 3.44Å; N62-S65 PolarHBondContact O-N 2.76Å; S65-L67 VanDerWaalsContact C-N 3.34Å; S65-L67 PolarHBondContact O-N 3.12Å; S65-L68 WeakPolarHBondContact O-CB 3.23Å; S65-L68 PolarHBondContact O-N 3.16Å; S65-L68 VanDerWaalsContact O-N 3.08Å; S65-D69 PolarHBondContact O-N 2.91Å
66	R	91.4	Very high	86	Confident	93 Å²	93	61.2 Å²	61.2	35%	0.351	31%	0.314	S	S	.	.	H	α-helix	trans	-64	-37.1	180	-173.1	56	168.8	164.3	6	112.9	E50 L57 N62 R63 T64 D69 I70	E50-R66 IonicContact OE1-CZ 3.74Å; E50-R66 IonicContact OE1-NE 3.73Å; E50-R66 PolarHBondContact OE1-NE 2.97Å; E50-R66 IonicContact OE1-NH2 3.77Å; E50-R66 PolarHBondContact OE1-NH2 3.48Å; E50-R66 IonicContact OE2-NH2 2.83Å; E50-R66 PolarHBondContact OE2-NH2 3.17Å; E50-R66 VanDerWaalsContact OE2-NH2 3.11Å; L57-R66 HydrophobicContact CD1-CB 3.83Å; L57-R66 HydrophobicContact CD1-CG 3.87Å; L57-R66 HydrophobicContact CD2-CB 4.2Å; N62-R66 WeakPolarHBondContact O-CB 3.36Å; N62-R66 PolarHBondContact O-N 3.46Å; R63-R66 PolarHBondContact O-N 3.26Å; T64-R66 VanDerWaalsContact C-N 3.34Å; T64-R66 PolarHBondContact O-N 3.13Å; R66-D69 PolarHBondContact O-N 3.15Å; R66-I70 HydrophobicContact CG-CD1 3.96Å; R66-I70 WeakPolarHBondContact O-CB 3.39Å; R66-I70 WeakPolarHBondContact O-CG1 3.36Å; R66-I70 PolarHBondContact O-N 3.47Å
67	L	90.7	Very high	86.3	Confident	0 Å²	0	62.6 Å²	62.6	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-57.8	-45.9	170.1	169.9	65	0	0	0	111.5	P30 L33 T34 L37 L43 I51 R63 T64 S65 I70 L71	P30-L67 HydrophobicContact CB-CD2 4.01Å; P30-L67 HydrophobicContact CG-CD2 4.36Å; L33-L67 HydrophobicContact CB-CD2 4.49Å; L33-L67 HydrophobicContact CD1-CD2 4.37Å; T34-L67 HydrophobicContact CG2-CD1 4.34Å; L37-L67 HydrophobicContact CD1-CD1 3.91Å; L43-L67 HydrophobicContact CD1-CD1 3.74Å; I51-L67 HydrophobicContact CD1-CB 4.07Å; I51-L67 HydrophobicContact CD1-CD1 3.77Å; I51-L67 HydrophobicContact CG1-CB 4.42Å; I51-L67 HydrophobicContact CG2-CB 4.11Å; R63-L67 WeakPolarHBondContact O-CB 3.05Å; R63-L67 PolarHBondContact O-N 3Å; T64-L67 WeakPolarHBondContact O-CB 3.4Å; T64-L67 PolarHBondContact O-N 2.98Å; S65-L67 VanDerWaalsContact C-N 3.34Å; S65-L67 PolarHBondContact O-N 3.12Å; L67-I70 PolarHBondContact O-N 3.45Å; L67-L71 HydrophobicContact CD1-CD1 3.71Å; L67-L71 HydrophobicContact CD1-CG 4.05Å; L67-L71 HydrophobicContact CG-CD1 3.86Å; L67-L71 WeakPolarHBondContact O-CB 3.26Å; L67-L71 WeakPolarHBondContact O-CD1 3.12Å; L67-L71 WeakPolarHBondContact O-CG 3.27Å; L67-L71 PolarHBondContact O-N 3.29Å
68	L	90.6	Very high	86.4	Confident	2 Å²	2	61.3 Å²	61.3	1%	0.01	30%	0.302	C	S	.	.	H	α-helix	trans	-64.5	-40.6	176.7	-65.7	174.9	0	0	0	112.2	V17 R21 L24 T64 S65 L71 R72 F82	V17-L68 HydrophobicContact CG1-CD2 4.31Å; R21-L68 HydrophobicContact CG-CD1 4.07Å; L24-L68 HydrophobicContact CB-CD1 4.39Å; T64-L68 WeakPolarHBondContact O-CG 3.24Å; T64-L68 PolarHBondContact O-N 3.04Å; S65-L68 WeakPolarHBondContact O-CB 3.23Å; S65-L68 PolarHBondContact O-N 3.16Å; S65-L68 VanDerWaalsContact O-N 3.08Å; L68-L71 PolarHBondContact O-N 3.03Å; L68-R72 PolarHBondContact O-N 3.01Å; L68-F82 HydrophobicContact CD2-CD1 4.41Å; L68-F82 HydrophobicContact CD2-CD2 4.35Å; L68-F82 HydrophobicContact CD2-CE1 3.73Å; L68-F82 HydrophobicContact CD2-CE2 3.67Å; L68-F82 HydrophobicContact CD2-CZ 3.32Å
69	D	91.2	Very high	86.9	Confident	58 Å²	58	54.5 Å²	54.5	31%	0.31	27%	0.269	S	S	.	.	H	α-helix	trans	-62.1	-47.8	177	-64.4	-41.9	0	0	0	111.7	R21 S65 R66 R72 T73	R21-D69 IonicContact CZ-OD1 3.22Å; R21-D69 VanDerWaalsContact CZ-OD1 3.31Å; R21-D69 IonicContact NH1-OD1 3.66Å; R21-D69 PolarHBondContact NH1-OD1 3.34Å; R21-D69 IonicContact NH2-OD1 3.79Å; R21-D69 PolarHBondContact NH2-OD1 2.88Å; R21-D69 IonicContact NH2-OD2 2.78Å; R21-D69 PolarHBondContact NH2-OD2 2.75Å; S65-D69 PolarHBondContact O-N 2.91Å; R66-D69 PolarHBondContact O-N 3.15Å; D69-R72 PolarHBondContact O-N 3.08Å; D69-T73 PolarHBondContact O-N 3.14Å
70	I	88.8	Confident	86.9	Confident	10 Å²	10	53.6 Å²	53.6	5%	0.051	27%	0.265	C	S	.	.	H	α-helix	trans	-61.4	-45.9	176.7	-69.3	166.3	0	0	0	109.8	L43 D47 I51 R66 L67 R72 T73 K74	L43-I70 HydrophobicContact CD2-CG2 3.57Å; D47-I70 HydrophobicContact CB-CG2 4.44Å; I51-I70 HydrophobicContact CD1-CD1 3.81Å; I51-I70 HydrophobicContact CG1-CD1 3.77Å; R66-I70 HydrophobicContact CG-CD1 3.96Å; R66-I70 WeakPolarHBondContact O-CB 3.39Å; R66-I70 WeakPolarHBondContact O-CG1 3.36Å; R66-I70 PolarHBondContact O-N 3.47Å; L67-I70 PolarHBondContact O-N 3.45Å; I70-R72 PolarHBondContact O-N 3.19Å; I70-T73 PolarHBondContact O-N 2.95Å; I70-T73 PolarHBondContact O-OG1 3.09Å; I70-K74 WeakPolarHBondContact O-CG 3.29Å
71	L	89.1	Confident	86.9	Confident	0 Å²	0	50 Å²	50	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-61.6	-37.9	177.4	-71.4	167.5	0	0	0	113.3	W14 L37 V42 L43 L67 L68 T73 K74 F82	W14-L71 HydrophobicContact CH2-CB 3.85Å; W14-L71 HydrophobicContact CZ2-CB 4.49Å; W14-L71 WeakPolarHBondContact CZ2-O 3.29Å; L37-L71 HydrophobicContact CD1-CD1 4.03Å; L37-L71 HydrophobicContact CD1-CD2 4.16Å; L37-L71 HydrophobicContact CD2-CD2 4.11Å; V42-L71 HydrophobicContact CG1-CD2 3.52Å; L43-L71 HydrophobicContact CD2-CD2 4.17Å; L67-L71 HydrophobicContact CD1-CD1 3.71Å; L67-L71 HydrophobicContact CD1-CG 4.05Å; L67-L71 HydrophobicContact CG-CD1 3.86Å; L67-L71 WeakPolarHBondContact O-CB 3.26Å; L67-L71 WeakPolarHBondContact O-CD1 3.12Å; L67-L71 WeakPolarHBondContact O-CG 3.27Å; L67-L71 PolarHBondContact O-N 3.29Å; L68-L71 PolarHBondContact O-N 3.03Å; L71-T73 VanDerWaalsContact C-N 3.29Å; L71-T73 PolarHBondContact O-N 2.92Å; L71-K74 PolarHBondContact O-N 3.42Å; L71-F82 HydrophobicContact CD1-CB 4.11Å; L71-F82 HydrophobicContact CD1-CD2 3.69Å; L71-F82 HydrophobicContact CD1-CE2 4.46Å; L71-F82 HydrophobicContact CD1-CG 4.08Å
72	R	86.6	Confident	87.1	Confident	103 Å²	103	48.2 Å²	48.2	39%	0.389	24%	0.236	S	C	.	.	H	α-helix	trans	-61.5	-36.3	175.5	-172.3	173.9	177.7	-174.6	-1.8	111.9	D11 W14 L68 D69 I70 K74 G75	D11-R72 IonicContact OD1-CZ 3.26Å; D11-R72 IonicContact OD1-NE 2.66Å; D11-R72 IonicContact OD1-NH2 3.63Å; D11-R72 PolarHBondContact OD1-NH2 3.33Å; W14-R72 HydrophobicContact CD2-CB 4.2Å; W14-R72 HydrophobicContact CD2-CG 3.99Å; W14-R72 HydrophobicContact CE3-CB 4.33Å; W14-R72 HydrophobicContact CE3-CG 4.46Å; W14-R72 HydrophobicContact CG-CG 4.04Å; W14-R72 HydrophobicContact CZ2-CB 4.36Å; W14-R72 HydrophobicContact CZ3-CB 4.49Å; L68-R72 PolarHBondContact O-N 3.01Å; D69-R72 PolarHBondContact O-N 3.08Å; I70-R72 PolarHBondContact O-N 3.19Å; R72-K74 PolarHBondContact O-N 3.4Å; R72-G75 PolarHBondContact O-N 3.37Å; R72-G75 VanDerWaalsContact O-N 3.14Å
73	T	84.6	Confident	87.1	Confident	114 Å²	114	45.3 Å²	45.3	70%	0.699	22%	0.22	S	C	*	.	H	α-helix	trans	-65.6	-14.5	173.5	69.9	0	0	0	0	114.4	D69 I70 L71	D69-T73 PolarHBondContact O-N 3.14Å; I70-T73 PolarHBondContact O-N 2.95Å; I70-T73 PolarHBondContact O-OG1 3.09Å; L71-T73 VanDerWaalsContact C-N 3.29Å; L71-T73 PolarHBondContact O-N 2.92Å
74	K	84.6	Confident	86.8	Confident	71 Å²	71	46.7 Å²	46.7	31%	0.309	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.2	8.7	175.8	-35	-69.4	-179.4	161.5	0	113.1	V42 D47 I70 L71 R72 G78	V42-K74 HydrophobicContact CG1-CB 4.04Å; V42-K74 HydrophobicContact CG1-CG 3.9Å; V42-K74 WeakPolarHBondContact O-CD 3.39Å; V42-K74 WeakPolarHBondContact O-CE 3.12Å; V42-K74 PolarHBondContact O-NZ 2.98Å; D47-K74 IonicContact OD1-NZ 3.33Å; D47-K74 IonicContact OD2-NZ 3.98Å; D47-K74 PolarHBondContact OD2-NZ 2.82Å; I70-K74 WeakPolarHBondContact O-CG 3.29Å; L71-K74 PolarHBondContact O-N 3.42Å; R72-K74 PolarHBondContact O-N 3.4Å; K74-G78 PolarHBondContact O-N 3.37Å
75	G	83	Confident	86.6	Confident	22 Å²	22	46.8 Å²	46.8	23%	0.227	23%	0.23	C	C	.	.	H	α-helix	trans	60.7	-146.6	172.8	0	0	0	0	0	114.9	R72 R77 G78 Y79	R72-G75 PolarHBondContact O-N 3.37Å; R72-G75 VanDerWaalsContact O-N 3.14Å; G75-R77 VanDerWaalsContact C-N 3.26Å; G75-R77 PolarHBondContact O-N 2.83Å; G75-G78 WeakPolarHBondContact O-CA 3.4Å; G75-G78 PolarHBondContact O-N 2.97Å; G75-Y79 PolarHBondContact O-N 2.78Å
76	E	81.1	Confident	86.3	Confident	117 Å²	117	45.1 Å²	45.1	55%	0.547	22%	0.218	S	C	.	.	H	α-helix	trans	-54.5	-37.8	179.1	-59.7	179.6	-169.6	0	0	113.6	N10 G78 Y79 G80	N10-E76 WeakPolarHBondContact ND2-CG 3.35Å; N10-E76 PolarHBondContact ND2-OE1 3.46Å; N10-E76 WeakPolarHBondContact OD1-CG 3.45Å; N10-E76 PolarHBondContact OD1-N 3.08Å; E76-G78 VanDerWaalsContact C-N 3.31Å; E76-G78 PolarHBondContact O-N 2.83Å; E76-Y79 PolarHBondContact O-N 2.87Å; E76-G80 PolarHBondContact O-N 2.92Å
77	R	83.1	Confident	86	Confident	181 Å²	181	42.6 Å²	42.6	68%	0.683	21%	0.21	S	C	*	.	H	α-helix	trans	-66.3	-37.4	177.1	-172	-173.8	-74.3	-179.8	-1.6	111	V42 G75 A81	V42-R77 HydrophobicContact CG2-CG 3.97Å; G75-R77 VanDerWaalsContact C-N 3.26Å; G75-R77 PolarHBondContact O-N 2.83Å; R77-A81 WeakPolarHBondContact O-CB 3.47Å; R77-A81 PolarHBondContact O-N 2.87Å
78	G	85	Confident	85.5	Confident	0 Å²	0	48 Å²	48	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-60.9	-46.2	169.7	0	0	0	0	0	112.2	K74 G75 E76 F82	K74-G78 PolarHBondContact O-N 3.37Å; G75-G78 WeakPolarHBondContact O-CA 3.4Å; G75-G78 PolarHBondContact O-N 2.97Å; E76-G78 VanDerWaalsContact C-N 3.31Å; E76-G78 PolarHBondContact O-N 2.83Å; G78-F82 WeakPolarHBondContact O-CB 3.49Å; G78-F82 PolarHBondContact O-N 3.39Å
79	Y	86.4	Confident	85	Confident	23 Å²	23	52.3 Å²	52.3	9%	0.09	25%	0.251	C	S	.	.	H	α-helix	trans	-64.9	-47.7	-179	-174.4	-99.9	0	0	0	112.4	L13 W14 V17 G75 E76 F82 L83	L13-Y79 HydrophobicContact CB-CD1 4.32Å; L13-Y79 HydrophobicContact CB-CD2 4.37Å; L13-Y79 HydrophobicContact CB-CE1 4.03Å; L13-Y79 HydrophobicContact CB-CE2 4.08Å; L13-Y79 HydrophobicContact CB-CG 4.49Å; L13-Y79 HydrophobicContact CD1-CD1 4.47Å; L13-Y79 HydrophobicContact CD1-CE1 4.49Å; L13-Y79 HydrophobicContact CD2-CE1 3.9Å; L13-Y79 HydrophobicContact CG-CE1 4.37Å; L13-Y79 WeakPolarHBondContact O-CE2 3.34Å; L13-Y79 PolarHBondContact O-OH 3Å; W14-Y79 AromaticContact CD2-CD2 3.84Å; W14-Y79 HydrophobicContact CD2-CD2 3.84Å; W14-Y79 AromaticContact CE2-CD2 3.9Å; W14-Y79 HydrophobicContact CE3-CD2 4.11Å; W14-Y79 HydrophobicContact CG-CD2 4.22Å; W14-Y79 HydrophobicContact CH2-CD2 4.48Å; W14-Y79 HydrophobicContact CZ2-CD2 4.25Å; W14-Y79 VanDerWaalsContact CZ2-N 3.34Å; W14-Y79 HydrophobicContact CZ3-CD2 4.42Å; V17-Y79 HydrophobicContact CG2-CD2 4.24Å; V17-Y79 HydrophobicContact CG2-CE2 3.69Å; G75-Y79 PolarHBondContact O-N 2.78Å; E76-Y79 PolarHBondContact O-N 2.87Å; Y79-F82 PolarHBondContact O-N 3.49Å; Y79-L83 HydrophobicContact CD1-CD1 3.99Å; Y79-L83 HydrophobicContact CD1-CG 4.49Å; Y79-L83 HydrophobicContact CE1-CD1 3.38Å; Y79-L83 HydrophobicContact CE1-CG 4.23Å; Y79-L83 HydrophobicContact CE2-CD1 4.46Å; Y79-L83 WeakPolarHBondContact O-CG 3.23Å; Y79-L83 PolarHBondContact O-N 2.98Å
80	G	82.2	Confident	84.8	Confident	28 Å²	28	51.3 Å²	51.3	29%	0.289	24%	0.243	S	C	.	.	H	α-helix	trans	-61.1	-55.5	178.8	0	0	0	0	0	112.4	E76 F82 L83 E84	E76-G80 PolarHBondContact O-N 2.92Å; G80-F82 VanDerWaalsContact C-N 3.25Å; G80-F82 PolarHBondContact O-N 3.21Å; G80-L83 PolarHBondContact O-N 3.12Å; G80-L83 VanDerWaalsContact O-N 3.12Å; G80-E84 WeakPolarHBondContact O-CG 3.48Å; G80-E84 PolarHBondContact O-N 3.38Å
81	A	84.4	Confident	84.4	Confident	7 Å²	7	52.3 Å²	52.3	6%	0.058	25%	0.25	C	S	.	.	H	α-helix	trans	-63.5	-31.8	179.2	0	0	0	0	0	112.5	L37 C40 V42 R77 S85	L37-A81 HydrophobicContact CD2-CB 3.93Å; C40-A81 HydrophobicContact CB-CB 4.27Å; V42-A81 HydrophobicContact CG2-CB 3.75Å; R77-A81 WeakPolarHBondContact O-CB 3.47Å; R77-A81 PolarHBondContact O-N 2.87Å; A81-S85 VanDerWaalsContact O-CB 3.31Å; A81-S85 WeakPolarHBondContact O-CB 3.29Å; A81-S85 PolarHBondContact O-N 3.42Å; A81-S85 PolarHBondContact O-OG 3.04Å
82	F	89.2	Confident	84	Confident	0 Å²	0	59.2 Å²	59.2	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-64.6	-49.2	171.8	179	-119.1	0	0	0	111.6	W14 V17 L24 I28 L33 L68 L71 G78 Y79 G80 S85 L86	W14-F82 HydrophobicContact CZ3-CD1 4.5Å; V17-F82 HydrophobicContact CG1-CE1 3.98Å; V17-F82 HydrophobicContact CG2-CD1 4.37Å; V17-F82 HydrophobicContact CG2-CE1 4.15Å; L24-F82 HydrophobicContact CD1-CE1 4.45Å; L24-F82 HydrophobicContact CD1-CZ 4.46Å; I28-F82 HydrophobicContact CD1-CE2 4.07Å; I28-F82 HydrophobicContact CD1-CZ 3.89Å; L33-F82 HydrophobicContact CD1-CD2 4.39Å; L33-F82 HydrophobicContact CD1-CE2 4.05Å; L68-F82 HydrophobicContact CD2-CD1 4.41Å; L68-F82 HydrophobicContact CD2-CD2 4.35Å; L68-F82 HydrophobicContact CD2-CE1 3.73Å; L68-F82 HydrophobicContact CD2-CE2 3.67Å; L68-F82 HydrophobicContact CD2-CZ 3.32Å; L71-F82 HydrophobicContact CD1-CB 4.11Å; L71-F82 HydrophobicContact CD1-CD2 3.69Å; L71-F82 HydrophobicContact CD1-CE2 4.46Å; L71-F82 HydrophobicContact CD1-CG 4.08Å; G78-F82 WeakPolarHBondContact O-CB 3.49Å; G78-F82 PolarHBondContact O-N 3.39Å; Y79-F82 PolarHBondContact O-N 3.49Å; G80-F82 VanDerWaalsContact C-N 3.25Å; G80-F82 PolarHBondContact O-N 3.21Å; F82-S85 PolarHBondContact O-N 3.04Å; F82-S85 PolarHBondContact O-OG 2.86Å; F82-L86 HydrophobicContact CD1-CD1 4.27Å; F82-L86 HydrophobicContact CD2-CG 4.44Å; F82-L86 HydrophobicContact CE1-CD1 3.59Å; F82-L86 HydrophobicContact CE1-CG 4.15Å; F82-L86 HydrophobicContact CE2-CD1 4.25Å; F82-L86 HydrophobicContact CE2-CD2 3.99Å; F82-L86 HydrophobicContact CE2-CG 3.98Å; F82-L86 HydrophobicContact CZ-CD1 3.56Å; F82-L86 HydrophobicContact CZ-CD2 3.95Å; F82-L86 HydrophobicContact CZ-CG 3.81Å; F82-L86 PolarHBondContact O-N 3.12Å
83	L	87.1	Confident	83.9	Confident	23 Å²	23	55 Å²	55	12%	0.12	27%	0.267	C	S	.	.	H	α-helix	trans	-62.4	-43.9	177.4	-74.2	-172.5	0	0	0	112.3	Y79 G80 S85 L86 E87 Y94 V97 T98	Y79-L83 HydrophobicContact CD1-CD1 3.99Å; Y79-L83 HydrophobicContact CD1-CG 4.49Å; Y79-L83 HydrophobicContact CE1-CD1 3.38Å; Y79-L83 HydrophobicContact CE1-CG 4.23Å; Y79-L83 HydrophobicContact CE2-CD1 4.46Å; Y79-L83 WeakPolarHBondContact O-CG 3.23Å; Y79-L83 PolarHBondContact O-N 2.98Å; G80-L83 PolarHBondContact O-N 3.12Å; G80-L83 VanDerWaalsContact O-N 3.12Å; L83-S85 VanDerWaalsContact C-N 3.28Å; L83-S85 PolarHBondContact O-N 2.92Å; L83-L86 HydrophobicContact CD2-CD1 4.36Å; L83-L86 CarbonylContact O-C 3.55Å; L83-L86 PolarHBondContact O-N 3.43Å; L83-L86 VanDerWaalsContact O-N 3.1Å; L83-E87 WeakPolarHBondContact O-CB 3.41Å; L83-E87 PolarHBondContact O-N 3.39Å; L83-Y94 HydrophobicContact CB-CD2 4.39Å; L83-Y94 HydrophobicContact CB-CE2 4.13Å; L83-Y94 HydrophobicContact CD2-CD2 4.42Å; L83-Y94 VanDerWaalsContact O-CD2 3.3Å; L83-Y94 WeakPolarHBondContact O-CD2 3.49Å; L83-V97 HydrophobicContact CD2-CG1 4.09Å; L83-T98 HydrophobicContact CD1-CG2 3.84Å; L83-T98 HydrophobicContact CD2-CG2 3.71Å; L83-T98 HydrophobicContact CG-CG2 4.4Å
84	E	84.5	Confident	83.9	Confident	94 Å²	94	50.7 Å²	50.7	44%	0.439	24%	0.239	S	C	.	.	H	α-helix	trans	-55.9	-43.8	173.1	-70.8	170.3	169.7	0	0	111.3	Y36 G80 L86 E87 F88	Y36-E84 HydrophobicContact CE1-CB 4.15Å; Y36-E84 PolarHBondContact OH-OE2 2.87Å; G80-E84 WeakPolarHBondContact O-CG 3.48Å; G80-E84 PolarHBondContact O-N 3.38Å; E84-L86 PolarHBondContact O-N 3.25Å; E84-E87 PolarHBondContact O-N 3.34Å; E84-F88 PolarHBondContact O-N 3.06Å; E84-F88 VanDerWaalsContact O-N 3.11Å
85	S	84.1	Confident	83.8	Confident	1 Å²	1	51.3 Å²	51.3	1%	0.007	24%	0.241	C	C	.	.	H	α-helix	trans	-67.2	-33	177.3	84	0	0	0	0	113	A81 F82 L83 Y89	A81-S85 VanDerWaalsContact O-CB 3.31Å; A81-S85 WeakPolarHBondContact O-CB 3.29Å; A81-S85 PolarHBondContact O-N 3.42Å; A81-S85 PolarHBondContact O-OG 3.04Å; F82-S85 PolarHBondContact O-N 3.04Å; F82-S85 PolarHBondContact O-OG 2.86Å; L83-S85 VanDerWaalsContact C-N 3.28Å; L83-S85 PolarHBondContact O-N 2.92Å; S85-Y89 WeakPolarHBondContact O-CB 3.42Å; S85-Y89 WeakPolarHBondContact O-CD2 3.49Å; S85-Y89 PolarHBondContact O-N 3.25Å
86	L	85.6	Confident	83.8	Confident	0 Å²	0	52 Å²	52	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-71	-42.3	171.1	-70.5	-172.2	0	0	0	111.8	L24 I28 L33 F82 L83 E84 F88 Y90 Y94	L24-L86 HydrophobicContact CD2-CD1 4.23Å; I28-L86 HydrophobicContact CD1-CD2 3.65Å; I28-L86 HydrophobicContact CG1-CD2 3.99Å; L33-L86 HydrophobicContact CD1-CD2 4.48Å; F82-L86 HydrophobicContact CD1-CD1 4.27Å; F82-L86 HydrophobicContact CD2-CG 4.44Å; F82-L86 HydrophobicContact CE1-CD1 3.59Å; F82-L86 HydrophobicContact CE1-CG 4.15Å; F82-L86 HydrophobicContact CE2-CD1 4.25Å; F82-L86 HydrophobicContact CE2-CD2 3.99Å; F82-L86 HydrophobicContact CE2-CG 3.98Å; F82-L86 HydrophobicContact CZ-CD1 3.56Å; F82-L86 HydrophobicContact CZ-CD2 3.95Å; F82-L86 HydrophobicContact CZ-CG 3.81Å; F82-L86 PolarHBondContact O-N 3.12Å; L83-L86 HydrophobicContact CD2-CD1 4.36Å; L83-L86 CarbonylContact O-C 3.55Å; L83-L86 PolarHBondContact O-N 3.43Å; L83-L86 VanDerWaalsContact O-N 3.1Å; E84-L86 PolarHBondContact O-N 3.25Å; L86-F88 PolarHBondContact O-N 3.16Å; L86-Y90 HydrophobicContact CD2-CD2 4.25Å; L86-Y90 CarbonylContact O-C 3.52Å; L86-Y90 VanDerWaalsContact O-CA 3.23Å; L86-Y90 WeakPolarHBondContact O-CA 3.44Å; L86-Y90 PolarHBondContact O-N 3.41Å; L86-Y94 HydrophobicContact CB-CD2 4.37Å
87	E	84.6	Confident	83.8	Confident	40 Å²	40	47 Å²	47	19%	0.187	22%	0.22	C	C	.	.	H	α-helix	trans	-58.6	-37.7	-179.9	-156.2	167.8	169	0	0	111	L83 E84 Y94 P102 T103	L83-E87 WeakPolarHBondContact O-CB 3.41Å; L83-E87 PolarHBondContact O-N 3.39Å; E84-E87 PolarHBondContact O-N 3.34Å; E87-Y94 HydrophobicContact CB-CD2 3.52Å; E87-Y94 HydrophobicContact CB-CE2 3.6Å; E87-Y94 HydrophobicContact CB-CG 3.98Å; E87-Y94 HydrophobicContact CG-CD1 4.09Å; E87-Y94 HydrophobicContact CG-CD2 3.89Å; E87-Y94 HydrophobicContact CG-CE1 3.97Å; E87-Y94 HydrophobicContact CG-CE2 3.71Å; E87-Y94 HydrophobicContact CG-CG 4.03Å; E87-Y94 PolarHBondContact OE1-OH 2.82Å; E87-Y94 WeakPolarHBondContact OE2-CE2 3.48Å; E87-Y94 PolarHBondContact OE2-OH 3.33Å; E87-P102 HydrophobicContact CG-CB 3.9Å; E87-T103 WeakPolarHBondContact OE1-CA 3.42Å; E87-T103 WeakPolarHBondContact OE1-CB 3.47Å; E87-T103 PolarHBondContact OE1-N 3.46Å
88	F	79.8	Confident	83.7	Confident	115 Å²	115	40.1 Å²	40.1	50%	0.504	20%	0.198	S	C	.	.	H	α-helix	trans	-81.2	-54.1	178.1	-171.9	-103	0	0	0	114	E84 L86 F106	E84-F88 PolarHBondContact O-N 3.06Å; E84-F88 VanDerWaalsContact O-N 3.11Å; L86-F88 PolarHBondContact O-N 3.16Å; F88-F106 AromaticContact CD2-CD2 3.78Å; F88-F106 HydrophobicContact CD2-CD2 3.78Å; F88-F106 HydrophobicContact CD2-CE2 4.32Å; F88-F106 HydrophobicContact CE2-CD2 4.09Å
89	Y	80.8	Confident	83.3	Confident	91 Å²	91	43.3 Å²	43.3	36%	0.357	23%	0.231	S	C	.	.	H	α-helix	trans	-90.4	-22.1	-172.2	-67.7	-70.2	0	0	0	114.7	K32 L33 S85	K32-Y89 WeakPolarHBondContact O-CE2 3.35Å; L33-Y89 HydrophobicContact CD2-CD2 3.47Å; L33-Y89 VanDerWaalsContact CD2-CD2 3.47Å; L33-Y89 HydrophobicContact CD2-CE2 4.32Å; L33-Y89 HydrophobicContact CD2-CG 3.97Å; S85-Y89 WeakPolarHBondContact O-CB 3.42Å; S85-Y89 WeakPolarHBondContact O-CD2 3.49Å; S85-Y89 PolarHBondContact O-N 3.25Å
90	Y	86.9	Confident	82.9	Confident	37 Å²	37	48.9 Å²	48.9	15%	0.145	26%	0.256	C	S	.	.			trans	-144.8	55.9	-171.6	-65.6	-78.9	0	0	0	112.8	I28 T29 L33 L86 E92 L93 Y94	I28-Y90 HydrophobicContact CB-CE2 4.41Å; I28-Y90 HydrophobicContact CG1-CD2 4.34Å; I28-Y90 HydrophobicContact CG1-CE2 4.46Å; I28-Y90 HydrophobicContact CG2-CE2 4.12Å; T29-Y90 PolarHBondContact N-OH 3.13Å; L33-Y90 HydrophobicContact CD2-CD2 4.11Å; L33-Y90 HydrophobicContact CD2-CE2 3.97Å; L33-Y90 HydrophobicContact CG-CE2 4.47Å; L86-Y90 HydrophobicContact CD2-CD2 4.25Å; L86-Y90 CarbonylContact O-C 3.52Å; L86-Y90 VanDerWaalsContact O-CA 3.23Å; L86-Y90 WeakPolarHBondContact O-CA 3.44Å; L86-Y90 PolarHBondContact O-N 3.41Å; Y90-E92 VanDerWaalsContact C-N 3.28Å; Y90-E92 PolarHBondContact O-N 3.06Å; Y90-E92 VanDerWaalsContact O-N 3.1Å; Y90-L93 HydrophobicContact CD1-CD1 4.03Å; Y90-L93 HydrophobicContact CG-CD1 4.13Å; Y90-L93 WeakPolarHBondContact O-CA 3.38Å; Y90-L93 WeakPolarHBondContact O-CB 3.4Å; Y90-L93 PolarHBondContact O-N 3.44Å; Y90-Y94 PolarHBondContact O-N 2.83Å; Y90-Y94 VanDerWaalsContact O-N 3.11Å
91	P	80.6	Confident	82.4	Confident	31 Å²	31	52.8 Å²	52.8	20%	0.201	27%	0.27	C	S	.	.	H	α-helix	trans	-54.1	-35.2	-170.2	16.6	-31.4	0	0	0	115.2	L93 Y94 K95 P102	P91-L93 VanDerWaalsContact C-N 3.34Å; P91-L93 PolarHBondContact O-N 2.91Å; P91-Y94 WeakPolarHBondContact O-CB 3.43Å; P91-Y94 PolarHBondContact O-N 2.88Å; P91-K95 PolarHBondContact O-N 2.76Å; P91-P102 HydrophobicContact CB-CB 3.94Å; P91-P102 HydrophobicContact CB-CG 3.64Å; P91-P102 WeakPolarHBondContact O-CG 3.42Å
92	E	80.2	Confident	81.8	Confident	145 Å²	145	54.2 Å²	54.2	68%	0.678	28%	0.279	S	S	*	.	H	α-helix	trans	-65.5	-35.7	176	-52.7	-51.9	137.4	0	0	112.5	Y90 K95 S96	Y90-E92 VanDerWaalsContact C-N 3.28Å; Y90-E92 PolarHBondContact O-N 3.06Å; Y90-E92 VanDerWaalsContact O-N 3.1Å; E92-K95 PolarHBondContact O-N 3.01Å; E92-S96 WeakPolarHBondContact O-CB 3.47Å; E92-S96 PolarHBondContact O-N 2.73Å
93	L	83.6	Confident	80.6	Confident	14 Å²	14	58.9 Å²	58.9	7%	0.073	31%	0.307	C	S	.	.	H	α-helix	trans	-74.4	-37.3	176.5	-57.3	-177.4	0	0	0	111.1	E23 L24 N27 I28 Y90 P91 K95 S96 V97	E23-L93 HydrophobicContact CG-CD2 4.26Å; L24-L93 HydrophobicContact CD2-CB 4.01Å; L24-L93 HydrophobicContact CD2-CD1 4.29Å; N27-L93 HydrophobicContact CB-CD1 3.78Å; N27-L93 HydrophobicContact CB-CD2 4.44Å; I28-L93 HydrophobicContact CG1-CD1 3.88Å; Y90-L93 HydrophobicContact CD1-CD1 4.03Å; Y90-L93 HydrophobicContact CG-CD1 4.13Å; Y90-L93 WeakPolarHBondContact O-CA 3.38Å; Y90-L93 WeakPolarHBondContact O-CB 3.4Å; Y90-L93 PolarHBondContact O-N 3.44Å; P91-L93 VanDerWaalsContact C-N 3.34Å; P91-L93 PolarHBondContact O-N 2.91Å; L93-K95 VanDerWaalsContact C-N 3.31Å; L93-K95 PolarHBondContact O-N 3.23Å; L93-S96 WeakPolarHBondContact O-CB 3.33Å; L93-S96 PolarHBondContact O-N 3.37Å; L93-V97 WeakPolarHBondContact O-CG2 3.46Å; L93-V97 PolarHBondContact O-N 2.91Å
94	Y	84.4	Confident	79.2	Confident	25 Å²	25	68.7 Å²	68.7	10%	0.098	34%	0.343	C	S	.	.	H	α-helix	trans	-56.2	-46.6	170.7	176.8	-86.4	0	0	0	111.3	L83 L86 E87 Y90 P91 V97 T98 K100 P102	L83-Y94 HydrophobicContact CB-CD2 4.39Å; L83-Y94 HydrophobicContact CB-CE2 4.13Å; L83-Y94 HydrophobicContact CD2-CD2 4.42Å; L83-Y94 VanDerWaalsContact O-CD2 3.3Å; L83-Y94 WeakPolarHBondContact O-CD2 3.49Å; L86-Y94 HydrophobicContact CB-CD2 4.37Å; E87-Y94 HydrophobicContact CB-CD2 3.52Å; E87-Y94 HydrophobicContact CB-CE2 3.6Å; E87-Y94 HydrophobicContact CB-CG 3.98Å; E87-Y94 HydrophobicContact CG-CD1 4.09Å; E87-Y94 HydrophobicContact CG-CD2 3.89Å; E87-Y94 HydrophobicContact CG-CE1 3.97Å; E87-Y94 HydrophobicContact CG-CE2 3.71Å; E87-Y94 HydrophobicContact CG-CG 4.03Å; E87-Y94 PolarHBondContact OE1-OH 2.82Å; E87-Y94 WeakPolarHBondContact OE2-CE2 3.48Å; E87-Y94 PolarHBondContact OE2-OH 3.33Å; Y90-Y94 PolarHBondContact O-N 2.83Å; Y90-Y94 VanDerWaalsContact O-N 3.11Å; P91-Y94 WeakPolarHBondContact O-CB 3.43Å; P91-Y94 PolarHBondContact O-N 2.88Å; Y94-V97 PolarHBondContact O-N 3.45Å; Y94-T98 HydrophobicContact CD1-CG2 4.45Å; Y94-T98 HydrophobicContact CD2-CG2 4.15Å; Y94-T98 HydrophobicContact CE1-CG2 4.32Å; Y94-T98 WeakPolarHBondContact CE1-OG1 3.47Å; Y94-T98 HydrophobicContact CE2-CG2 4.05Å; Y94-T98 HydrophobicContact CG-CG2 4.38Å; Y94-T98 WeakPolarHBondContact O-CB 3.4Å; Y94-T98 WeakPolarHBondContact O-CG2 3.34Å; Y94-T98 PolarHBondContact O-N 2.95Å; Y94-T98 PolarHBondContact O-OG1 2.83Å; Y94-K100 HydrophobicContact CE1-CB 4.28Å; Y94-P102 HydrophobicContact CD1-CB 4.49Å; Y94-P102 HydrophobicContact CD1-CG 4.02Å
95	K	83.4	Confident	77.7	Confident	83 Å²	83	74.3 Å²	74.3	36%	0.361	36%	0.36	S	S	.	.	H	α-helix	trans	-65.6	-38.5	176.7	-172.4	165.2	-175.2	170.3	0	112.2	P91 E92 L93 V97 G99 K100 D101	P91-K95 PolarHBondContact O-N 2.76Å; E92-K95 PolarHBondContact O-N 3.01Å; L93-K95 VanDerWaalsContact C-N 3.31Å; L93-K95 PolarHBondContact O-N 3.23Å; K95-V97 VanDerWaalsContact C-N 3.3Å; K95-V97 PolarHBondContact O-N 3.26Å; K95-G99 WeakPolarHBondContact O-CA 3.41Å; K95-G99 PolarHBondContact O-N 2.77Å; K95-K100 WeakPolarHBondContact CG-O 3.38Å; K95-D101 WeakPolarHBondContact CE-OD1 3.35Å; K95-D101 VanDerWaalsContact NZ-CG 3.3Å; K95-D101 IonicContact NZ-OD1 3.67Å; K95-D101 PolarHBondContact NZ-OD1 2.76Å; K95-D101 IonicContact NZ-OD2 3.86Å; K95-D101 PolarHBondContact NZ-OD2 2.96Å
96	S	82.2	Confident	75.9	Confident	37 Å²	37	80 Å²	80	26%	0.259	39%	0.385	S	S	.	.	H	α-helix	trans	-63	-30.6	175.2	-168.5	0	0	0	0	113.6	K20 E23 E92 L93	K20-S96 VanDerWaalsContact CE-O 3.22Å; K20-S96 WeakPolarHBondContact CE-O 3.41Å; K20-S96 PolarHBondContact NZ-O 2.98Å; K20-S96 PolarHBondContact NZ-OG 2.85Å; E23-S96 PolarHBondContact OE1-OG 3.45Å; E23-S96 PolarHBondContact OE2-OG 2.81Å; E92-S96 WeakPolarHBondContact O-CB 3.47Å; E92-S96 PolarHBondContact O-N 2.73Å; L93-S96 WeakPolarHBondContact O-CB 3.33Å; L93-S96 PolarHBondContact O-N 3.37Å
97	V	82.5	Confident	74.3	Confident	12 Å²	12	84.9 Å²	84.9	7%	0.073	42%	0.419	C	S	.	.	H	α-helix	trans	-91.6	-42.6	-179.8	171.4	0	0	0	0	113	V17 K20 L24 L83 L93 Y94 K95	V17-V97 HydrophobicContact CG2-CG1 3.71Å; K20-V97 HydrophobicContact CB-CG2 3.97Å; K20-V97 HydrophobicContact CG-CG2 4.15Å; L24-V97 HydrophobicContact CD1-CG2 3.96Å; L24-V97 HydrophobicContact CD2-CG2 3.84Å; L24-V97 HydrophobicContact CG-CG2 4.32Å; L83-V97 HydrophobicContact CD2-CG1 4.09Å; L93-V97 WeakPolarHBondContact O-CG2 3.46Å; L93-V97 PolarHBondContact O-N 2.91Å; Y94-V97 PolarHBondContact O-N 3.45Å; K95-V97 VanDerWaalsContact C-N 3.3Å; K95-V97 PolarHBondContact O-N 3.26Å
98	T	80.9	Confident	72.6	Confident	36 Å²	36	88.3 Å²	88.3	22%	0.221	44%	0.443	C	S	.	.	H	α-helix	trans	-98.2	-18.9	-170.5	66.4	0	0	0	0	114.3	L83 Y94 K100	L83-T98 HydrophobicContact CD1-CG2 3.84Å; L83-T98 HydrophobicContact CD2-CG2 3.71Å; L83-T98 HydrophobicContact CG-CG2 4.4Å; Y94-T98 HydrophobicContact CD1-CG2 4.45Å; Y94-T98 HydrophobicContact CD2-CG2 4.15Å; Y94-T98 HydrophobicContact CE1-CG2 4.32Å; Y94-T98 WeakPolarHBondContact CE1-OG1 3.47Å; Y94-T98 HydrophobicContact CE2-CG2 4.05Å; Y94-T98 HydrophobicContact CG-CG2 4.38Å; Y94-T98 WeakPolarHBondContact O-CB 3.4Å; Y94-T98 WeakPolarHBondContact O-CG2 3.34Å; Y94-T98 PolarHBondContact O-N 2.95Å; Y94-T98 PolarHBondContact O-OG1 2.83Å; T98-K100 PolarHBondContact O-N 2.95Å; T98-K100 PolarHBondContact OG1-N 3.16Å
99	G	76.9	Confident	71.2	Confident	67 Å²	67	89.7 Å²	89.7	69%	0.691	45%	0.454	S	S	*	.	S	Bend	trans	70.4	3.5	-170.3	0	0	0	0	0	114.9	K95	K95-G99 WeakPolarHBondContact O-CA 3.41Å; K95-G99 PolarHBondContact O-N 2.77Å
100	K	76.3	Confident	69.7	Low	140 Å²	140	91.5 Å²	91.5	61%	0.609	47%	0.474	S	S	*	.	S	Bend	trans	-103.4	153.8	-177.9	-63.2	179.4	-177.2	176.9	0	111.8	Y94 K95 T98	Y94-K100 HydrophobicContact CE1-CB 4.28Å; K95-K100 WeakPolarHBondContact CG-O 3.38Å; T98-K100 PolarHBondContact O-N 2.95Å; T98-K100 PolarHBondContact OG1-N 3.16Å
101	D	72.2	Confident	67.8	Low	111 Å²	111	95.1 Å²	95.1	59%	0.594	50%	0.5	S	S	*	.	P	Polyproline II helix	trans	-77.9	133.1	173.4	-87.8	-66.3	0	0	0	111.9	K95	K95-D101 WeakPolarHBondContact CE-OD1 3.35Å; K95-D101 VanDerWaalsContact NZ-CG 3.3Å; K95-D101 IonicContact NZ-OD1 3.67Å; K95-D101 PolarHBondContact NZ-OD1 2.76Å; K95-D101 IonicContact NZ-OD2 3.86Å; K95-D101 PolarHBondContact NZ-OD2 2.96Å
102	P	71.6	Confident	66.4	Low	36 Å²	36	102.9 Å²	102.9	23%	0.234	53%	0.534	C	S	.	.	P	Polyproline II helix	trans	-64.7	128.7	-178.4	-25.2	35	0	0	0	115.1	E87 P91 Y94 R104	E87-P102 HydrophobicContact CG-CB 3.9Å; P91-P102 HydrophobicContact CB-CB 3.94Å; P91-P102 HydrophobicContact CB-CG 3.64Å; P91-P102 WeakPolarHBondContact O-CG 3.42Å; Y94-P102 HydrophobicContact CD1-CB 4.49Å; Y94-P102 HydrophobicContact CD1-CG 4.02Å; P102-R104 PolarHBondContact O-N 3.34Å
103	T	64.7	Low	64.9	Low	99 Å²	99	103.3 Å²	103.3	61%	0.607	54%	0.536	S	S	*	.			trans	-91.5	88.8	-179.7	-51.1	0	0	0	0	110.9	E87 R105	E87-T103 WeakPolarHBondContact OE1-CA 3.42Å; E87-T103 WeakPolarHBondContact OE1-CB 3.47Å; E87-T103 PolarHBondContact OE1-N 3.46Å; T103-R105 PolarHBondContact O-N 3.48Å
104	R	57.8	Low	63.6	Low	228 Å²	228	105.2 Å²	105.2	86%	0.86	56%	0.559	S	S	*	*			trans	-65.7	89.2	178.7	-70.4	-173.6	178.7	179.7	1.9	113.3	P102	P102-R104 PolarHBondContact O-N 3.34Å
105	R	52.8	Low	62	Low	212 Å²	212	112.3 Å²	112.3	80%	0.8	59%	0.593	S	S	*	*			trans	-143.1	118.1	164.1	-72.2	-167.5	176.1	-153.1	-0.8	112.5	T103	T103-R105 PolarHBondContact O-N 3.48Å
106	F	47.1	Very low	60.7	Low	121 Å²	121	116.7 Å²	116.7	53%	0.531	61%	0.614	S	S	.	*			trans	-134.2	114.6	150.3	-98	-76.2	0	0	0	108.3	Y36 F88	Y36-F106 HydrophobicContact CE2-CZ 4.16Å; F88-F106 AromaticContact CD2-CD2 3.78Å; F88-F106 HydrophobicContact CD2-CD2 3.78Å; F88-F106 HydrophobicContact CD2-CE2 4.32Å; F88-F106 HydrophobicContact CE2-CD2 4.09Å
107	S	50.3	Low	59.5	Low	103 Å²	103	115.8 Å²	115.8	72%	0.72	61%	0.611	S	S	*	*			trans	-135.8	93	179.8	-61.8	0	0	0	0	108.3
108	T	50.3	Low	58.5	Low	111 Å²	111	119.2 Å²	119.2	68%	0.681	63%	0.628	S	S	*	*	S	Bend	trans	-151	9.1	-173	-25.2	0	0	0	0	115.1
109	I	50.8	Low	57.7	Low	144 Å²	144	121.8 Å²	121.8	74%	0.738	64%	0.644	S	S	*	*	S	Bend	trans	-132.3	-9.2	176.2	-73.5	-176.1	0	0	0	113.3
110	V	48.1	Very low	57.3	Low	130 Å²	130	125.2 Å²	125.2	79%	0.788	64%	0.642	S	S	*	*	S	Bend	trans	-117.8	37.8	179.1	-159	0	0	0	0	111.8
111	V	47.3	Very low	57.2	Low	113 Å²	113	124.9 Å²	124.9	69%	0.685	64%	0.641	S	S	*	*	S	Bend	trans	-153.1	116.1	163.1	-162.1	0	0	0	0	101.5
112	E	51.2	Low	57.3	Low	194 Å²	194	124 Å²	124	91%	0.907	64%	0.636	S	S	*	*	S	Bend	cis	-128.4	-8.1	39	-67.9	168.2	129.6	0	0	115.6
113	E	49.3	Very low	57.5	Low	154 Å²	154	128.3 Å²	128.3	72%	0.72	65%	0.654	S	S	*	*	S	Bend	trans	-106.9	144.8	176.9	-67	-171.7	162.6	0	0	112.4
114	G	55.3	Low	58.2	Low	54 Å²	54	128.2 Å²	128.2	56%	0.557	65%	0.65	S	S	*	*			trans	-75.7	-172.4	-173.9	0	0	0	0	0	115.2	E116 G117 L118	G114-E116 PolarHBondContact O-N 3.41Å; G114-G117 PolarHBondContact O-N 3.12Å; G114-G117 VanDerWaalsContact O-N 3.08Å; G114-L118 PolarHBondContact O-N 3.48Å
115	Q	50.8	Low	59.3	Low	174 Å²	174	120.7 Å²	120.7	81%	0.813	63%	0.625	S	S	*	*	H	α-helix	trans	-53.1	-28	-179.6	-75.3	179.1	-81.8	0	0	113.5	T119	Q115-T119 WeakPolarHBondContact O-CB 3.08Å; Q115-T119 PolarHBondContact O-N 2.88Å; Q115-T119 PolarHBondContact O-OG1 3.1Å
116	E	55.7	Low	60.6	Low	174 Å²	174	113.7 Å²	113.7	81%	0.813	61%	0.606	S	S	*	*	H	α-helix	trans	-68.1	-45	178.9	-60.1	-176.7	160.4	0	0	112.5	G114 T119 Q120	G114-E116 PolarHBondContact O-N 3.41Å; E116-T119 PolarHBondContact O-N 3.32Å; E116-Q120 WeakPolarHBondContact O-CB 3.44Å; E116-Q120 PolarHBondContact O-N 3.49Å
117	G	58	Low	62.2	Low	18 Å²	18	113.5 Å²	113.5	19%	0.186	61%	0.608	C	S	.	*	H	α-helix	trans	-63.9	-44.5	177.7	0	0	0	0	0	112	G114 T119 Q120 F121	G114-G117 PolarHBondContact O-N 3.12Å; G114-G117 VanDerWaalsContact O-N 3.08Å; G117-T119 VanDerWaalsContact C-N 3.33Å; G117-T119 PolarHBondContact O-N 3.18Å; G117-Q120 PolarHBondContact O-N 3.3Å; G117-F121 WeakPolarHBondContact O-CB 3.08Å; G117-F121 PolarHBondContact O-N 3.43Å
118	L	61.9	Low	63.7	Low	85 Å²	85	113.7 Å²	113.7	45%	0.445	60%	0.595	S	S	.	*	H	α-helix	trans	-59.3	-42.9	172.6	179.2	61.8	0	0	0	111.7	G114 L122	G114-L118 PolarHBondContact O-N 3.48Å; L118-L122 HydrophobicContact CD1-CD1 4.08Å; L118-L122 HydrophobicContact CD1-CG 4.25Å; L118-L122 HydrophobicContact CG-CD1 3.98Å; L118-L122 WeakPolarHBondContact O-CB 3.27Å; L118-L122 VanDerWaalsContact O-CG 3.22Å; L118-L122 WeakPolarHBondContact O-CG 3.25Å; L118-L122 PolarHBondContact O-N 3.13Å
119	T	63.8	Low	65.3	Low	90 Å²	90	113.3 Å²	113.3	55%	0.552	59%	0.589	S	S	*	*	H	α-helix	trans	-65.9	-39.9	178.6	-58.3	0	0	0	0	111.5	Q115 E116 G117 M123	Q115-T119 WeakPolarHBondContact O-CB 3.08Å; Q115-T119 PolarHBondContact O-N 2.88Å; Q115-T119 PolarHBondContact O-OG1 3.1Å; E116-T119 PolarHBondContact O-N 3.32Å; G117-T119 VanDerWaalsContact C-N 3.33Å; G117-T119 PolarHBondContact O-N 3.18Å; T119-M123 VanDerWaalsContact O-CB 3.29Å; T119-M123 WeakPolarHBondContact O-CB 3.47Å; T119-M123 PolarHBondContact O-N 2.82Å
120	Q	67.4	Low	66.6	Low	139 Å²	139	111.5 Å²	111.5	65%	0.65	58%	0.577	S	S	*	*	H	α-helix	trans	-72.2	-36.5	179.2	-161.2	171.7	34.2	0	0	112.5	E116 G117 N124	E116-Q120 WeakPolarHBondContact O-CB 3.44Å; E116-Q120 PolarHBondContact O-N 3.49Å; G117-Q120 PolarHBondContact O-N 3.3Å; Q120-N124 PolarHBondContact O-N 3.03Å
121	F	74.4	Confident	68.2	Low	133 Å²	133	112.4 Å²	112.4	58%	0.583	57%	0.571	S	S	*	*	H	α-helix	trans	-62	-50.7	170.3	-177.9	-93.2	0	0	0	111.3	G117 M123 N124 E125	G117-F121 WeakPolarHBondContact O-CB 3.08Å; G117-F121 PolarHBondContact O-N 3.43Å; F121-M123 VanDerWaalsContact C-N 3.33Å; F121-M123 PolarHBondContact O-N 2.83Å; F121-N124 PolarHBondContact O-N 2.86Å; F121-E125 PolarHBondContact O-N 2.84Å
122	L	74.3	Confident	69.7	Low	93 Å²	93	111.5 Å²	111.5	49%	0.487	56%	0.562	S	S	.	*	H	α-helix	trans	-59.7	-41	176.8	-73	170.3	0	0	0	112	L118 E125 V126	L118-L122 HydrophobicContact CD1-CD1 4.08Å; L118-L122 HydrophobicContact CD1-CG 4.25Å; L118-L122 HydrophobicContact CG-CD1 3.98Å; L118-L122 WeakPolarHBondContact O-CB 3.27Å; L118-L122 VanDerWaalsContact O-CG 3.22Å; L118-L122 WeakPolarHBondContact O-CG 3.25Å; L118-L122 PolarHBondContact O-N 3.13Å; L122-E125 PolarHBondContact O-N 3.41Å; L122-V126 WeakPolarHBondContact O-CB 3.35Å; L122-V126 VanDerWaalsContact O-CG2 3.25Å; L122-V126 WeakPolarHBondContact O-CG2 3.02Å; L122-V126 PolarHBondContact O-N 2.85Å
123	M	76.4	Confident	71	Confident	126 Å²	126	106.2 Å²	106.2	62%	0.621	54%	0.543	S	S	*	.	H	α-helix	trans	-62.8	-43.6	176.7	-174.7	62.7	127.1	0	0	112	T119 F121 M127	T119-M123 VanDerWaalsContact O-CB 3.29Å; T119-M123 WeakPolarHBondContact O-CB 3.47Å; T119-M123 PolarHBondContact O-N 2.82Å; F121-M123 VanDerWaalsContact C-N 3.33Å; F121-M123 PolarHBondContact O-N 2.83Å; M123-M127 WeakPolarHBondContact O-CB 3.47Å; M123-M127 WeakPolarHBondContact O-CG 3.32Å; M123-M127 PolarHBondContact O-N 2.93Å
124	N	79.2	Confident	72.5	Confident	97 Å²	97	105.5 Å²	105.5	52%	0.519	54%	0.537	S	S	.	.	H	α-helix	trans	-63.9	-40.8	174.9	-91.9	-34	0	0	0	112.3	Q120 F121 M127 K128	Q120-N124 PolarHBondContact O-N 3.03Å; F121-N124 PolarHBondContact O-N 2.86Å; N124-M127 WeakPolarHBondContact O-CB 3.49Å; N124-M127 PolarHBondContact O-N 2.86Å; N124-K128 WeakPolarHBondContact O-CG 3.26Å; N124-K128 PolarHBondContact O-N 2.71Å
125	E	81	Confident	74	Confident	69 Å²	69	106.8 Å²	106.8	32%	0.322	53%	0.534	S	S	.	.	H	α-helix	trans	-73.2	-36	179.8	-144.9	59.6	-148.7	0	0	112	F121 L122 M127 K128 L129	F121-E125 PolarHBondContact O-N 2.84Å; L122-E125 PolarHBondContact O-N 3.41Å; E125-M127 VanDerWaalsContact C-N 3.34Å; E125-M127 PolarHBondContact O-N 2.98Å; E125-K128 PolarHBondContact O-N 3.33Å; E125-K128 WeakPolarHBondContact OE1-CD 3.45Å; E125-K128 IonicContact OE1-NZ 3.46Å; E125-K128 PolarHBondContact OE1-NZ 3.23Å; E125-K128 WeakPolarHBondContact OE2-CD 3.37Å; E125-K128 WeakPolarHBondContact OE2-CE 3.34Å; E125-K128 IonicContact OE2-NZ 2.66Å; E125-K128 PolarHBondContact OE2-NZ 2.67Å; E125-L129 WeakPolarHBondContact O-CB 3.32Å; E125-L129 VanDerWaalsContact O-CG 3.26Å; E125-L129 WeakPolarHBondContact O-CG 3.46Å; E125-L129 PolarHBondContact O-N 2.7Å
126	V	79.4	Confident	75.4	Confident	66 Å²	66	105.6 Å²	105.6	40%	0.4	53%	0.526	S	S	.	.	H	α-helix	trans	-61.4	-41.3	168.8	168	0	0	0	0	111.1	L122 L129 Q130	L122-V126 WeakPolarHBondContact O-CB 3.35Å; L122-V126 VanDerWaalsContact O-CG2 3.25Å; L122-V126 WeakPolarHBondContact O-CG2 3.02Å; L122-V126 PolarHBondContact O-N 2.85Å; V126-L129 PolarHBondContact O-N 3.37Å; V126-Q130 HydrophobicContact CG1-CG 4.42Å; V126-Q130 WeakPolarHBondContact O-CB 3.44Å; V126-Q130 WeakPolarHBondContact O-CG 3.23Å; V126-Q130 PolarHBondContact O-N 2.86Å
127	M	81	Confident	76.5	Confident	117 Å²	117	101 Å²	101	58%	0.576	51%	0.51	S	S	*	.	H	α-helix	trans	-62.1	-43.4	174.5	-77	-91.6	-81.4	0	0	112.2	M123 N124 E125 Q130 K131	M123-M127 WeakPolarHBondContact O-CB 3.47Å; M123-M127 WeakPolarHBondContact O-CG 3.32Å; M123-M127 PolarHBondContact O-N 2.93Å; N124-M127 WeakPolarHBondContact O-CB 3.49Å; N124-M127 PolarHBondContact O-N 2.86Å; E125-M127 VanDerWaalsContact C-N 3.34Å; E125-M127 PolarHBondContact O-N 2.98Å; M127-Q130 PolarHBondContact O-N 3.28Å; M127-K131 WeakPolarHBondContact O-CB 3.34Å; M127-K131 PolarHBondContact O-N 3.11Å
128	K	83.2	Confident	77.7	Confident	106 Å²	106	105.8 Å²	105.8	46%	0.461	53%	0.531	S	S	.	.	H	α-helix	trans	-62.7	-45.1	172.5	-68.8	176.7	-160.8	161.4	0	111.7	N124 E125 Q130 K131 N132	N124-K128 WeakPolarHBondContact O-CG 3.26Å; N124-K128 PolarHBondContact O-N 2.71Å; E125-K128 PolarHBondContact O-N 3.33Å; E125-K128 WeakPolarHBondContact OE1-CD 3.45Å; E125-K128 IonicContact OE1-NZ 3.46Å; E125-K128 PolarHBondContact OE1-NZ 3.23Å; E125-K128 WeakPolarHBondContact OE2-CD 3.37Å; E125-K128 WeakPolarHBondContact OE2-CE 3.34Å; E125-K128 IonicContact OE2-NZ 2.66Å; E125-K128 PolarHBondContact OE2-NZ 2.67Å; K128-Q130 PolarHBondContact O-N 3.33Å; K128-K131 PolarHBondContact O-N 3.38Å; K128-N132 WeakPolarHBondContact O-CB 3.47Å; K128-N132 PolarHBondContact O-N 2.97Å
129	L	82.4	Confident	78.8	Confident	103 Å²	103	107.1 Å²	107.1	54%	0.539	54%	0.535	S	S	.	.	H	α-helix	trans	-62.8	-40.8	178.2	-75.1	168.2	0	0	0	112	E125 V126 T133	E125-L129 WeakPolarHBondContact O-CB 3.32Å; E125-L129 VanDerWaalsContact O-CG 3.26Å; E125-L129 WeakPolarHBondContact O-CG 3.46Å; E125-L129 PolarHBondContact O-N 2.7Å; V126-L129 PolarHBondContact O-N 3.37Å; L129-T133 VanDerWaalsContact O-CB 3.23Å; L129-T133 WeakPolarHBondContact O-CB 3.35Å; L129-T133 PolarHBondContact O-N 3.1Å; L129-T133 PolarHBondContact O-OG1 2.65Å
130	Q	78.7	Confident	79.5	Confident	106 Å²	106	107.8 Å²	107.8	50%	0.495	54%	0.535	S	S	.	.	H	α-helix	trans	-63.6	-43.1	172.5	-74.3	-174.6	16.5	0	0	112.1	V126 M127 K128 T133 K134	V126-Q130 HydrophobicContact CG1-CG 4.42Å; V126-Q130 WeakPolarHBondContact O-CB 3.44Å; V126-Q130 WeakPolarHBondContact O-CG 3.23Å; V126-Q130 PolarHBondContact O-N 2.86Å; M127-Q130 PolarHBondContact O-N 3.28Å; K128-Q130 PolarHBondContact O-N 3.33Å; Q130-T133 PolarHBondContact O-N 2.93Å; Q130-K134 WeakPolarHBondContact O-CG 3.1Å; Q130-K134 PolarHBondContact O-N 3.04Å
131	K	80.6	Confident	80.2	Confident	150 Å²	150	105.1 Å²	105.1	65%	0.652	53%	0.528	S	S	*	.	H	α-helix	trans	-62.9	-46.9	176.3	-169.9	178.5	-178.4	-178.9	0	111.4	M127 K128 T133 K134 V135	M127-K131 WeakPolarHBondContact O-CB 3.34Å; M127-K131 PolarHBondContact O-N 3.11Å; K128-K131 PolarHBondContact O-N 3.38Å; K131-T133 VanDerWaalsContact C-N 3.31Å; K131-T133 PolarHBondContact O-N 3.2Å; K131-K134 PolarHBondContact O-N 3.36Å; K131-V135 WeakPolarHBondContact O-CG2 3.31Å; K131-V135 PolarHBondContact O-N 2.8Å
132	N	79.3	Confident	80.5	Confident	94 Å²	94	102.7 Å²	102.7	50%	0.503	52%	0.519	S	S	.	.	H	α-helix	trans	-65.1	-34.7	176.6	-73.9	-8.8	0	0	0	112.1	K128 V135 K136	K128-N132 WeakPolarHBondContact O-CB 3.47Å; K128-N132 PolarHBondContact O-N 2.97Å; N132-V135 PolarHBondContact O-N 3.1Å; N132-K136 WeakPolarHBondContact O-CB 3.39Å; N132-K136 WeakPolarHBondContact O-CG 3.4Å; N132-K136 PolarHBondContact O-N 3.46Å
133	T	79.6	Confident	80.8	Confident	82 Å²	82	102.6 Å²	102.6	50%	0.503	52%	0.518	S	S	.	.	H	α-helix	trans	-66.6	-43.7	174.1	-59.6	0	0	0	0	110.9	L129 Q130 K131 V135 K136 T137	L129-T133 VanDerWaalsContact O-CB 3.23Å; L129-T133 WeakPolarHBondContact O-CB 3.35Å; L129-T133 PolarHBondContact O-N 3.1Å; L129-T133 PolarHBondContact O-OG1 2.65Å; Q130-T133 PolarHBondContact O-N 2.93Å; K131-T133 VanDerWaalsContact C-N 3.31Å; K131-T133 PolarHBondContact O-N 3.2Å; T133-V135 PolarHBondContact O-N 2.73Å; T133-K136 PolarHBondContact O-N 3.44Å; T133-T137 HydrophobicContact CG2-CG2 4.46Å; T133-T137 WeakPolarHBondContact O-CG2 3.4Å; T133-T137 PolarHBondContact O-N 3.48Å; T133-T137 PolarHBondContact O-OG1 3.19Å; T133-T137 VanDerWaalsContact O-OG1 3.12Å
134	K	81.3	Confident	80.9	Confident	140 Å²	140	98.8 Å²	98.8	61%	0.609	50%	0.504	S	S	*	.	H	α-helix	trans	-61.6	-40.9	174.1	-74	176.3	179.2	178.3	0	112.6	Q130 K131 T137 L138	Q130-K134 WeakPolarHBondContact O-CG 3.1Å; Q130-K134 PolarHBondContact O-N 3.04Å; K131-K134 PolarHBondContact O-N 3.36Å; K134-T137 WeakPolarHBondContact CA-OG1 3.3Å; K134-T137 PolarHBondContact O-OG1 3.29Å; K134-T137 VanDerWaalsContact O-OG1 3.05Å; K134-L138 WeakPolarHBondContact O-CG 3.37Å; K134-L138 PolarHBondContact O-N 3.47Å; K134-L138 VanDerWaalsContact O-N 3.08Å
135	V	85.4	Confident	80.9	Confident	80 Å²	80	99.4 Å²	99.4	49%	0.485	50%	0.499	S	S	.	.	H	α-helix	trans	-65.4	-47	173.9	173.9	0	0	0	0	110.9	K131 N132 T133 T137 L138 Q139	K131-V135 WeakPolarHBondContact O-CG2 3.31Å; K131-V135 PolarHBondContact O-N 2.8Å; N132-V135 PolarHBondContact O-N 3.1Å; T133-V135 PolarHBondContact O-N 2.73Å; V135-T137 PolarHBondContact O-N 2.85Å; V135-L138 PolarHBondContact O-N 3.39Å; V135-Q139 WeakPolarHBondContact O-CB 3.15Å; V135-Q139 PolarHBondContact O-N 2.95Å
136	K	80.8	Confident	81	Confident	150 Å²	150	102 Å²	102	65%	0.652	51%	0.509	S	S	*	.	H	α-helix	trans	-61.4	-40	176.7	-79.6	-173.3	174.7	-174	0	112.5	N132 T133 Q139 N140	N132-K136 WeakPolarHBondContact O-CB 3.39Å; N132-K136 WeakPolarHBondContact O-CG 3.4Å; N132-K136 PolarHBondContact O-N 3.46Å; T133-K136 PolarHBondContact O-N 3.44Å; K136-Q139 PolarHBondContact O-N 2.99Å; K136-N140 WeakPolarHBondContact O-CB 3.5Å; K136-N140 PolarHBondContact O-N 3.29Å
137	T	79.7	Confident	81	Confident	76 Å²	76	102.5 Å²	102.5	47%	0.466	51%	0.513	S	S	.	.	H	α-helix	trans	-67.9	-42.8	177.1	51.5	0	0	0	0	111.7	T133 K134 V135 N140 T141	T133-T137 HydrophobicContact CG2-CG2 4.46Å; T133-T137 WeakPolarHBondContact O-CG2 3.4Å; T133-T137 PolarHBondContact O-N 3.48Å; T133-T137 PolarHBondContact O-OG1 3.19Å; T133-T137 VanDerWaalsContact O-OG1 3.12Å; K134-T137 WeakPolarHBondContact CA-OG1 3.3Å; K134-T137 PolarHBondContact O-OG1 3.29Å; K134-T137 VanDerWaalsContact O-OG1 3.05Å; V135-T137 PolarHBondContact O-N 2.85Å; T137-N140 PolarHBondContact O-N 3.19Å; T137-T141 WeakPolarHBondContact O-CG2 3.43Å; T137-T141 PolarHBondContact O-N 3.05Å
138	L	83.2	Confident	80.9	Confident	119 Å²	119	105 Å²	105	62%	0.623	52%	0.515	S	S	*	.	H	α-helix	trans	-57.9	-50.6	172.8	-73.3	170.2	0	0	0	111.4	K134 V135 N140 T141 E142	K134-L138 WeakPolarHBondContact O-CG 3.37Å; K134-L138 PolarHBondContact O-N 3.47Å; K134-L138 VanDerWaalsContact O-N 3.08Å; V135-L138 PolarHBondContact O-N 3.39Å; L138-N140 VanDerWaalsContact C-N 3.29Å; L138-N140 PolarHBondContact O-N 2.88Å; L138-T141 PolarHBondContact O-N 3.2Å; L138-T141 PolarHBondContact O-OG1 3.12Å; L138-E142 PolarHBondContact O-N 2.67Å
139	Q	84.6	Confident	80.8	Confident	114 Å²	114	103.5 Å²	103.5	53%	0.533	52%	0.516	S	S	.	.	H	α-helix	trans	-58.8	-39	176.7	-168.4	177.3	14.6	0	0	112.1	V135 K136 E142 L143	V135-Q139 WeakPolarHBondContact O-CB 3.15Å; V135-Q139 PolarHBondContact O-N 2.95Å; K136-Q139 PolarHBondContact O-N 2.99Å; Q139-E142 PolarHBondContact O-N 3.48Å; Q139-L143 HydrophobicContact CG-CD1 4.37Å; Q139-L143 WeakPolarHBondContact O-CG 3.38Å; Q139-L143 PolarHBondContact O-N 3.41Å
140	N	77.1	Confident	80.8	Confident	104 Å²	104	103.9 Å²	103.9	56%	0.556	52%	0.518	S	S	*	.	H	α-helix	trans	-71.7	-35.3	178.2	-158.6	20.2	0	0	0	112.5	K136 T137 L138 E142 S144	K136-N140 WeakPolarHBondContact O-CB 3.5Å; K136-N140 PolarHBondContact O-N 3.29Å; T137-N140 PolarHBondContact O-N 3.19Å; L138-N140 VanDerWaalsContact C-N 3.29Å; L138-N140 PolarHBondContact O-N 2.88Å; N140-E142 VanDerWaalsContact C-N 3.29Å; N140-E142 PolarHBondContact O-N 3.49Å; N140-S144 VanDerWaalsContact O-CB 3.24Å; N140-S144 WeakPolarHBondContact O-CB 3.37Å; N140-S144 PolarHBondContact O-N 3.26Å; N140-S144 PolarHBondContact O-OG 2.82Å
141	T	81.9	Confident	80.8	Confident	82 Å²	82	103.1 Å²	103.1	50%	0.503	51%	0.514	S	S	.	.	H	α-helix	trans	-67.7	-29.8	170.4	65.2	0	0	0	0	112.4	T137 L138 R145	T137-T141 WeakPolarHBondContact O-CG2 3.43Å; T137-T141 PolarHBondContact O-N 3.05Å; L138-T141 PolarHBondContact O-N 3.2Å; L138-T141 PolarHBondContact O-OG1 3.12Å; T141-R145 WeakPolarHBondContact O-CB 3.36Å; T141-R145 PolarHBondContact O-N 3.28Å
142	E	81.5	Confident	80.8	Confident	82 Å²	82	97.6 Å²	97.6	38%	0.383	49%	0.492	S	S	.	.	H	α-helix	trans	-75.3	-42.9	175.1	-177.6	144.1	-83.5	0	0	112.8	L138 Q139 N140 R145 K146	L138-E142 PolarHBondContact O-N 2.67Å; Q139-E142 PolarHBondContact O-N 3.48Å; N140-E142 VanDerWaalsContact C-N 3.29Å; N140-E142 PolarHBondContact O-N 3.49Å; E142-R145 VanDerWaalsContact O-CB 3.26Å; E142-R145 WeakPolarHBondContact O-CB 3.31Å; E142-R145 PolarHBondContact O-N 2.9Å; E142-R145 VanDerWaalsContact O-N 3.14Å; E142-R145 IonicContact OE1-CZ 3.19Å; E142-R145 IonicContact OE1-NH1 2.69Å; E142-R145 PolarHBondContact OE1-NH1 2.99Å; E142-R145 IonicContact OE1-NH2 2.8Å; E142-R145 PolarHBondContact OE1-NH2 3.36Å; E142-K146 PolarHBondContact O-N 2.71Å
143	L	81.6	Confident	80.8	Confident	92 Å²	92	98 Å²	98	48%	0.482	49%	0.49	S	S	.	.	H	α-helix	trans	-59.9	-48.3	170.5	-72	168.5	0	0	0	110.4	Q139 R145 K146 T147	Q139-L143 HydrophobicContact CG-CD1 4.37Å; Q139-L143 WeakPolarHBondContact O-CG 3.38Å; Q139-L143 PolarHBondContact O-N 3.41Å; L143-R145 PolarHBondContact O-N 3.12Å; L143-R145 VanDerWaalsContact O-N 3.16Å; L143-K146 PolarHBondContact O-N 3.26Å; L143-T147 PolarHBondContact O-N 2.99Å; L143-T147 PolarHBondContact O-OG1 3.2Å; L143-T147 VanDerWaalsContact O-OG1 3.08Å
144	S	77.3	Confident	80.8	Confident	45 Å²	45	101.3 Å²	101.3	32%	0.315	50%	0.495	S	S	.	.	H	α-helix	trans	-56.8	-30.9	173.9	-61.8	0	0	0	0	113.3	N140 R148	N140-S144 VanDerWaalsContact O-CB 3.24Å; N140-S144 WeakPolarHBondContact O-CB 3.37Å; N140-S144 PolarHBondContact O-N 3.26Å; N140-S144 PolarHBondContact O-OG 2.82Å; S144-R148 WeakPolarHBondContact O-CD 3.47Å; S144-R148 VanDerWaalsContact O-CG 3.23Å; S144-R148 WeakPolarHBondContact O-CG 3.17Å; S144-R148 PolarHBondContact O-N 3.2Å
145	R	80.2	Confident	80.8	Confident	111 Å²	111	98.4 Å²	98.4	42%	0.419	48%	0.482	S	S	.	.	H	α-helix	trans	-70.2	-45.9	174.1	-157.1	-166.5	-44.7	132.7	8.5	111.1	T141 E142 L143 R148 T149	T141-R145 WeakPolarHBondContact O-CB 3.36Å; T141-R145 PolarHBondContact O-N 3.28Å; E142-R145 VanDerWaalsContact O-CB 3.26Å; E142-R145 WeakPolarHBondContact O-CB 3.31Å; E142-R145 PolarHBondContact O-N 2.9Å; E142-R145 VanDerWaalsContact O-N 3.14Å; E142-R145 IonicContact OE1-CZ 3.19Å; E142-R145 IonicContact OE1-NH1 2.69Å; E142-R145 PolarHBondContact OE1-NH1 2.99Å; E142-R145 IonicContact OE1-NH2 2.8Å; E142-R145 PolarHBondContact OE1-NH2 3.36Å; L143-R145 PolarHBondContact O-N 3.12Å; L143-R145 VanDerWaalsContact O-N 3.16Å; R145-R148 PolarHBondContact O-N 2.93Å; R145-T149 PolarHBondContact O-N 3.11Å; R145-T149 VanDerWaalsContact O-N 3.12Å; R145-T149 PolarHBondContact O-OG1 3.41Å
146	K	82.7	Confident	80.5	Confident	122 Å²	122	100.3 Å²	100.3	53%	0.53	48%	0.484	S	S	.	.	H	α-helix	trans	-65.7	-42	178.8	-72.1	178.8	176.9	178.3	0	112.2	E142 L143 R148 T149 L150	E142-K146 PolarHBondContact O-N 2.71Å; L143-K146 PolarHBondContact O-N 3.26Å; K146-R148 PolarHBondContact O-N 2.93Å; K146-T149 WeakPolarHBondContact CA-OG1 3.41Å; K146-T149 PolarHBondContact O-N 2.86Å; K146-T149 PolarHBondContact O-OG1 2.83Å; K146-L150 WeakPolarHBondContact O-CG 3.28Å; K146-L150 PolarHBondContact O-N 2.81Å
147	T	79.2	Confident	80.6	Confident	78 Å²	78	99.1 Å²	99.1	48%	0.479	48%	0.484	S	S	.	.	H	α-helix	trans	-59.3	-47	175	-49.9	0	0	0	0	111	L143 T149 L150 E151	L143-T147 PolarHBondContact O-N 2.99Å; L143-T147 PolarHBondContact O-OG1 3.2Å; L143-T147 VanDerWaalsContact O-OG1 3.08Å; T147-T149 PolarHBondContact O-N 2.92Å; T147-L150 PolarHBondContact O-N 2.78Å; T147-E151 WeakPolarHBondContact O-CG 3.22Å; T147-E151 PolarHBondContact O-N 3.44Å
148	R	78.8	Confident	80.8	Confident	168 Å²	168	102.6 Å²	102.6	63%	0.634	49%	0.488	S	S	*	.	H	α-helix	trans	-64.8	-34.7	178.8	-70	171.8	-169.2	-173.5	4.4	113.5	S144 R145 K146 E151 D152	S144-R148 WeakPolarHBondContact O-CD 3.47Å; S144-R148 VanDerWaalsContact O-CG 3.23Å; S144-R148 WeakPolarHBondContact O-CG 3.17Å; S144-R148 PolarHBondContact O-N 3.2Å; R145-R148 PolarHBondContact O-N 2.93Å; K146-R148 PolarHBondContact O-N 2.93Å; R148-E151 PolarHBondContact O-N 3.07Å; R148-D152 PolarHBondContact O-N 3.1Å; R148-D152 VanDerWaalsContact O-N 3.12Å
149	T	80.8	Confident	80.6	Confident	76 Å²	76	99.5 Å²	99.5	47%	0.466	47%	0.472	S	S	.	.	H	α-helix	trans	-68	-40.5	172.9	44.6	0	0	0	0	111.8	R145 K146 T147 E151 D152 E153	R145-T149 PolarHBondContact O-N 3.11Å; R145-T149 VanDerWaalsContact O-N 3.12Å; R145-T149 PolarHBondContact O-OG1 3.41Å; K146-T149 WeakPolarHBondContact CA-OG1 3.41Å; K146-T149 PolarHBondContact O-N 2.86Å; K146-T149 PolarHBondContact O-OG1 2.83Å; T147-T149 PolarHBondContact O-N 2.92Å; T149-E151 VanDerWaalsContact C-N 3.34Å; T149-E151 PolarHBondContact O-N 3.27Å; T149-D152 PolarHBondContact O-N 3.06Å; T149-E153 WeakPolarHBondContact O-CG 3.34Å; T149-E153 PolarHBondContact O-N 3.04Å
150	L	82	Confident	80.2	Confident	111 Å²	111	96.4 Å²	96.4	58%	0.581	47%	0.466	S	S	*	.	H	α-helix	trans	-65.9	-34.6	175.2	-68.8	168.2	0	0	0	112.1	K146 T147 E153 Y154	K146-L150 WeakPolarHBondContact O-CG 3.28Å; K146-L150 PolarHBondContact O-N 2.81Å; T147-L150 PolarHBondContact O-N 2.78Å; L150-E153 PolarHBondContact O-N 3.32Å; L150-Y154 VanDerWaalsContact O-CB 3.23Å; L150-Y154 WeakPolarHBondContact O-CB 3.34Å; L150-Y154 PolarHBondContact O-N 3.49Å
151	E	80.1	Confident	80.4	Confident	89 Å²	89	95.9 Å²	95.9	42%	0.416	46%	0.463	S	S	.	.	H	α-helix	trans	-64.3	-45.5	172.1	-75	173.2	-141.2	0	0	112.9	T147 R148 T149 E153 Y154 K155	T147-E151 WeakPolarHBondContact O-CG 3.22Å; T147-E151 PolarHBondContact O-N 3.44Å; R148-E151 PolarHBondContact O-N 3.07Å; T149-E151 VanDerWaalsContact C-N 3.34Å; T149-E151 PolarHBondContact O-N 3.27Å; E151-E153 VanDerWaalsContact C-N 3.31Å; E151-Y154 PolarHBondContact O-N 3.17Å; E151-K155 WeakPolarHBondContact O-CB 3.42Å; E151-K155 WeakPolarHBondContact O-CD 2.94Å; E151-K155 VanDerWaalsContact O-CG 3.22Å; E151-K155 WeakPolarHBondContact O-CG 3.42Å; E151-K155 PolarHBondContact O-N 3.17Å; E151-K155 IonicContact OE2-NZ 2.7Å
152	D	79.5	Confident	80.2	Confident	35 Å²	35	96.6 Å²	96.6	19%	0.187	46%	0.461	C	S	.	.	H	α-helix	trans	-70.2	-27.1	177.7	-86.9	-12.2	0	0	0	111.8	R148 T149 K155 K156 R425	R148-D152 PolarHBondContact O-N 3.1Å; R148-D152 VanDerWaalsContact O-N 3.12Å; T149-D152 PolarHBondContact O-N 3.06Å; D152-K155 IonicContact OD1-NZ 2.79Å; D152-K156 WeakPolarHBondContact O-CG 3.38Å; D152-K156 PolarHBondContact O-N 2.84Å; D152-R425 IonicContact OD1-CZ 3.23Å; D152-R425 IonicContact OD1-NE 2.78Å; D152-R425 IonicContact OD1-NH2 2.67Å; D152-R425 PolarHBondContact OD1-NH2 2.96Å; D152-R425 IonicContact OD2-NE 3.13Å; D152-R425 IonicContact OD2-NH2 2.67Å
153	E	79	Confident	79.9	Confident	101 Å²	101	96.8 Å²	96.8	47%	0.472	46%	0.462	S	S	.	.	H	α-helix	trans	-73.9	-44.2	170	-74.9	176.7	168.9	0	0	112.6	T149 L150 E151 K155 K156 L157	T149-E153 WeakPolarHBondContact O-CG 3.34Å; T149-E153 PolarHBondContact O-N 3.04Å; L150-E153 PolarHBondContact O-N 3.32Å; E151-E153 VanDerWaalsContact C-N 3.31Å; E153-K155 VanDerWaalsContact C-N 3.29Å; E153-K155 PolarHBondContact O-N 3.12Å; E153-K156 WeakPolarHBondContact O-CB 3.35Å; E153-K156 PolarHBondContact O-N 2.98Å; E153-K156 VanDerWaalsContact O-N 3.12Å; E153-L157 PolarHBondContact O-N 2.97Å
154	Y	80.3	Confident	79.9	Confident	152 Å²	152	97.4 Å²	97.4	60%	0.596	47%	0.465	S	S	*	.	H	α-helix	trans	-58.3	-40.1	173.6	176.5	-97.3	0	0	0	111.8	L150 E151 L157 R158	L150-Y154 VanDerWaalsContact O-CB 3.23Å; L150-Y154 WeakPolarHBondContact O-CB 3.34Å; L150-Y154 PolarHBondContact O-N 3.49Å; E151-Y154 PolarHBondContact O-N 3.17Å; Y154-L157 PolarHBondContact O-N 3.37Å; Y154-R158 WeakPolarHBondContact O-CB 3.17Å; Y154-R158 PolarHBondContact O-N 3.45Å
155	K	82.1	Confident	79.9	Confident	80 Å²	80	100 Å²	100	35%	0.348	47%	0.473	S	S	.	.	H	α-helix	trans	-62.2	-41.4	174	-72.7	162	-165.8	159.6	0	112.4	E151 D152 E153 R158 L159	E151-K155 WeakPolarHBondContact O-CB 3.42Å; E151-K155 WeakPolarHBondContact O-CD 2.94Å; E151-K155 VanDerWaalsContact O-CG 3.22Å; E151-K155 WeakPolarHBondContact O-CG 3.42Å; E151-K155 PolarHBondContact O-N 3.17Å; E151-K155 IonicContact OE2-NZ 2.7Å; D152-K155 IonicContact OD1-NZ 2.79Å; E153-K155 VanDerWaalsContact C-N 3.29Å; E153-K155 PolarHBondContact O-N 3.12Å; K155-R158 PolarHBondContact O-N 3.25Å; K155-L159 WeakPolarHBondContact O-CG 3.42Å; K155-L159 PolarHBondContact O-N 3.17Å; K155-L159 VanDerWaalsContact O-N 3.11Å
156	K	79.1	Confident	79.7	Confident	120 Å²	120	96.7 Å²	96.7	52%	0.522	47%	0.469	S	S	.	.	H	α-helix	trans	-65.1	-46.1	174.2	-68.2	167.4	-171.9	169.3	0	112.1	D152 E153 R158 L159 A160	D152-K156 WeakPolarHBondContact O-CG 3.38Å; D152-K156 PolarHBondContact O-N 2.84Å; E153-K156 WeakPolarHBondContact O-CB 3.35Å; E153-K156 PolarHBondContact O-N 2.98Å; E153-K156 VanDerWaalsContact O-N 3.12Å; K156-R158 VanDerWaalsContact C-N 3.29Å; K156-R158 PolarHBondContact O-N 3.12Å; K156-L159 PolarHBondContact O-N 2.92Å; K156-A160 PolarHBondContact O-N 3.34Å
157	L	81.9	Confident	79.3	Confident	124 Å²	124	97.9 Å²	97.9	65%	0.649	47%	0.474	S	S	*	.	H	α-helix	trans	-60.6	-39.4	177.4	-85.2	157.2	0	0	0	111.7	E153 Y154 N161	E153-L157 PolarHBondContact O-N 2.97Å; Y154-L157 PolarHBondContact O-N 3.37Å; L157-N161 WeakPolarHBondContact O-CB 3.47Å; L157-N161 PolarHBondContact O-N 3.25Å
158	R	83.3	Confident	79.5	Confident	149 Å²	149	100 Å²	100	56%	0.562	48%	0.478	S	S	*	.	H	α-helix	trans	-61.5	-46.7	173.8	-179.9	173.1	174.1	157.2	-1.1	112	Y154 K155 K156 N161 Q162	Y154-R158 WeakPolarHBondContact O-CB 3.17Å; Y154-R158 PolarHBondContact O-N 3.45Å; K155-R158 PolarHBondContact O-N 3.25Å; K156-R158 VanDerWaalsContact C-N 3.29Å; K156-R158 PolarHBondContact O-N 3.12Å; R158-N161 PolarHBondContact O-N 2.84Å; R158-Q162 WeakPolarHBondContact O-CG 3.22Å; R158-Q162 PolarHBondContact O-N 3.29Å
159	L	79.4	Confident	79.7	Confident	55 Å²	55	98.4 Å²	98.4	29%	0.288	48%	0.478	S	S	.	.	H	α-helix	trans	-63.5	-46.7	177.3	-70.5	165.4	0	0	0	112	K155 K156 N161 Q162 E163 V418	K155-L159 WeakPolarHBondContact O-CG 3.42Å; K155-L159 PolarHBondContact O-N 3.17Å; K155-L159 VanDerWaalsContact O-N 3.11Å; K156-L159 PolarHBondContact O-N 2.92Å; L159-N161 PolarHBondContact O-N 3.38Å; L159-Q162 WeakPolarHBondContact O-CA 3.26Å; L159-Q162 WeakPolarHBondContact O-CB 3.11Å; L159-Q162 PolarHBondContact O-N 3.43Å; L159-E163 PolarHBondContact O-N 2.92Å; L159-V418 HydrophobicContact CD1-CB 4.32Å; L159-V418 HydrophobicContact CD1-CG1 4.06Å; L159-V418 HydrophobicContact CD1-CG2 4.09Å
160	A	76.6	Confident	79.5	Confident	49 Å²	49	101 Å²	101	41%	0.405	48%	0.48	S	S	.	.	H	α-helix	trans	-60.8	-33.1	176.7	0	0	0	0	0	112.7	K156 L164	K156-A160 PolarHBondContact O-N 3.34Å; A160-L164 WeakPolarHBondContact O-CB 3.37Å; A160-L164 PolarHBondContact O-N 2.82Å
161	N	80.9	Confident	79.2	Confident	92 Å²	92	103 Å²	103	49%	0.492	48%	0.48	S	S	.	.	H	α-helix	trans	-72.9	-34.2	174.2	-160.8	0.3	0	0	0	112	L157 R158 L159 L164 Q165	L157-N161 WeakPolarHBondContact O-CB 3.47Å; L157-N161 PolarHBondContact O-N 3.25Å; R158-N161 PolarHBondContact O-N 2.84Å; L159-N161 PolarHBondContact O-N 3.38Å; N161-L164 PolarHBondContact O-N 2.94Å; N161-Q165 WeakPolarHBondContact O-CG 3.4Å; N161-Q165 PolarHBondContact O-N 3.42Å
162	Q	78.3	Confident	79.4	Confident	98 Å²	98	101.8 Å²	101.8	46%	0.458	48%	0.477	S	S	.	.	H	α-helix	trans	-67.9	-41.2	171.6	-69.8	175.8	-88.2	0	0	111.9	R158 L159 Q165 A166	R158-Q162 WeakPolarHBondContact O-CG 3.22Å; R158-Q162 PolarHBondContact O-N 3.29Å; L159-Q162 WeakPolarHBondContact O-CA 3.26Å; L159-Q162 WeakPolarHBondContact O-CB 3.11Å; L159-Q162 PolarHBondContact O-N 3.43Å; Q162-Q165 PolarHBondContact O-N 3.24Å; Q162-A166 PolarHBondContact O-N 2.88Å
163	E	75.3	Confident	79.7	Confident	86 Å²	86	104.8 Å²	104.8	40%	0.402	49%	0.488	S	S	.	.	H	α-helix	trans	-59.5	-46.2	171.2	-70.3	-179.5	149.5	0	0	111	L159 Q165 A166 F167 V411	L159-E163 PolarHBondContact O-N 2.92Å; E163-Q165 PolarHBondContact O-N 2.88Å; E163-A166 WeakPolarHBondContact O-CB 3.23Å; E163-A166 PolarHBondContact O-N 2.79Å; E163-F167 WeakPolarHBondContact O-CD2 3.42Å; E163-F167 PolarHBondContact O-N 2.93Å; E163-V411 HydrophobicContact CG-CG1 4.16Å
164	L	81.1	Confident	79.8	Confident	105 Å²	105	105.3 Å²	105.3	55%	0.55	49%	0.494	S	S	.	.	H	α-helix	trans	-60.9	-42	176.7	-176.6	62.5	0	0	0	112.5	A160 N161 F167 Q168	A160-L164 WeakPolarHBondContact O-CB 3.37Å; A160-L164 PolarHBondContact O-N 2.82Å; N161-L164 PolarHBondContact O-N 2.94Å; L164-F167 PolarHBondContact O-N 2.88Å; L164-Q168 WeakPolarHBondContact O-CB 3.49Å; L164-Q168 PolarHBondContact O-N 2.87Å
165	Q	78.3	Confident	80.1	Confident	100 Å²	100	104.3 Å²	104.3	47%	0.467	49%	0.489	S	S	.	.	H	α-helix	trans	-63.2	-40.3	174.1	-77.5	-175.7	-12.7	0	0	112.2	N161 Q162 E163 Q168 Q169	N161-Q165 WeakPolarHBondContact O-CG 3.4Å; N161-Q165 PolarHBondContact O-N 3.42Å; Q162-Q165 PolarHBondContact O-N 3.24Å; E163-Q165 PolarHBondContact O-N 2.88Å; Q165-Q168 PolarHBondContact O-N 2.83Å; Q165-Q169 WeakPolarHBondContact O-CG 3.5Å; Q165-Q169 PolarHBondContact O-N 2.81Å
166	A	75.9	Confident	80.4	Confident	41 Å²	41	106.8 Å²	106.8	34%	0.339	50%	0.502	S	S	.	.	H	α-helix	trans	-63.3	-43.9	175.4	0	0	0	0	0	111.7	Q162 E163 Q168 Q169 R170	Q162-A166 PolarHBondContact O-N 2.88Å; E163-A166 WeakPolarHBondContact O-CB 3.23Å; E163-A166 PolarHBondContact O-N 2.79Å; A166-Q168 VanDerWaalsContact C-N 3.35Å; A166-Q168 PolarHBondContact O-N 3.02Å; A166-Q169 PolarHBondContact O-N 3.03Å; A166-R170 WeakPolarHBondContact O-CB 3.32Å; A166-R170 PolarHBondContact O-N 2.66Å
167	F	73.6	Confident	80.6	Confident	146 Å²	146	104 Å²	104	64%	0.64	49%	0.49	S	S	*	.	H	α-helix	trans	-60.7	-41.9	172.6	-75.7	-63.5	0	0	0	112.4	E163 L164 R170 Y171	E163-F167 WeakPolarHBondContact O-CD2 3.42Å; E163-F167 PolarHBondContact O-N 2.93Å; L164-F167 PolarHBondContact O-N 2.88Å; F167-R170 PolarHBondContact O-N 2.71Å; F167-Y171 WeakPolarHBondContact O-CB 3.5Å; F167-Y171 PolarHBondContact O-N 2.91Å
168	Q	82.5	Confident	80.8	Confident	122 Å²	122	105 Å²	105	57%	0.57	49%	0.486	S	S	*	.	H	α-helix	trans	-67.1	-38.5	179.1	-167.5	175.8	14	0	0	112.3	L164 Q165 A166 N172	L164-Q168 WeakPolarHBondContact O-CB 3.49Å; L164-Q168 PolarHBondContact O-N 2.87Å; Q165-Q168 PolarHBondContact O-N 2.83Å; A166-Q168 VanDerWaalsContact C-N 3.35Å; A166-Q168 PolarHBondContact O-N 3.02Å; Q168-N172 VanDerWaalsContact O-CG 3.31Å; Q168-N172 PolarHBondContact O-N 3.11Å; Q168-N172 PolarHBondContact O-ND2 3.1Å
169	Q	82.9	Confident	80.9	Confident	135 Å²	135	100.8 Å²	100.8	63%	0.631	47%	0.474	S	S	*	.	H	α-helix	trans	-64.8	-44.9	172.5	-72.9	175.8	9.6	0	0	111.6	Q165 A166 Y171 N172 K173	Q165-Q169 WeakPolarHBondContact O-CG 3.5Å; Q165-Q169 PolarHBondContact O-N 2.81Å; A166-Q169 PolarHBondContact O-N 3.03Å; Q169-Y171 VanDerWaalsContact C-N 3.34Å; Q169-Y171 PolarHBondContact O-N 3.47Å; Q169-N172 PolarHBondContact O-N 3.37Å; Q169-N172 VanDerWaalsContact O-N 3.14Å; Q169-K173 PolarHBondContact O-N 3.26Å
170	R	76.7	Confident	81.5	Confident	132 Å²	132	101.5 Å²	101.5	50%	0.498	48%	0.484	S	S	.	.	H	α-helix	trans	-64.5	-37.7	178.3	-157.6	167.9	-176.1	-119.8	4.1	111.8	A166 F167 K173 L174 D404	A166-R170 WeakPolarHBondContact O-CB 3.32Å; A166-R170 PolarHBondContact O-N 2.66Å; F167-R170 PolarHBondContact O-N 2.71Å; R170-K173 PolarHBondContact O-N 3.41Å; R170-L174 PolarHBondContact O-N 2.88Å; R170-D404 IonicContact CZ-OD2 2.74Å; R170-D404 IonicContact NE-OD2 3.65Å; R170-D404 PolarHBondContact NE-OD2 3.01Å; R170-D404 IonicContact NH2-OD2 3.9Å; R170-D404 PolarHBondContact NH2-OD2 3.46Å
171	Y	77.1	Confident	81.7	Confident	151 Å²	151	105.8 Å²	105.8	59%	0.592	49%	0.493	S	S	*	.	H	α-helix	trans	-62.7	-41.5	170.7	175.6	-102.5	0	0	0	112.7	F167 Q169 L174 R175	F167-Y171 WeakPolarHBondContact O-CB 3.5Å; F167-Y171 PolarHBondContact O-N 2.91Å; Q169-Y171 VanDerWaalsContact C-N 3.34Å; Q169-Y171 PolarHBondContact O-N 3.47Å; Y171-L174 PolarHBondContact O-N 3.47Å; Y171-R175 WeakPolarHBondContact O-CB 3.4Å; Y171-R175 PolarHBondContact O-N 3.31Å
172	N	83.1	Confident	81.9	Confident	65 Å²	65	104.4 Å²	104.4	35%	0.348	49%	0.491	S	S	.	.	H	α-helix	trans	-65.7	-43.2	176.2	-72.9	-20.7	0	0	0	112	Q168 Q169 L174 R175 E176	Q168-N172 VanDerWaalsContact O-CG 3.31Å; Q168-N172 PolarHBondContact O-N 3.11Å; Q168-N172 PolarHBondContact O-ND2 3.1Å; Q169-N172 PolarHBondContact O-N 3.37Å; Q169-N172 VanDerWaalsContact O-N 3.14Å; N172-L174 VanDerWaalsContact C-N 3.35Å; N172-L174 PolarHBondContact O-N 2.78Å; N172-R175 WeakPolarHBondContact O-CB 3.46Å; N172-R175 PolarHBondContact O-N 2.88Å; N172-R175 VanDerWaalsContact O-N 3.15Å; N172-E176 WeakPolarHBondContact O-CG 3.49Å; N172-E176 PolarHBondContact O-N 3.27Å
173	K	87.6	Confident	82.4	Confident	97 Å²	97	104.4 Å²	104.4	42%	0.422	49%	0.494	S	S	.	.	H	α-helix	trans	-55.6	-49.1	172.2	-174.2	-179.5	-171.8	-90.9	0	110.8	Q169 R170 R175 E176 E177 E400	Q169-K173 PolarHBondContact O-N 3.26Å; R170-K173 PolarHBondContact O-N 3.41Å; K173-R175 VanDerWaalsContact C-N 3.28Å; K173-R175 PolarHBondContact O-N 3.29Å; K173-E176 PolarHBondContact O-N 3.47Å; K173-E176 VanDerWaalsContact O-N 3.15Å; K173-E177 WeakPolarHBondContact CE-OE1 3.23Å; K173-E177 HydrophobicContact CG-CG 4.5Å; K173-E177 WeakPolarHBondContact CG-OE1 3.45Å; K173-E177 IonicContact NZ-OE1 3.67Å; K173-E177 PolarHBondContact NZ-OE1 2.9Å; K173-E177 WeakPolarHBondContact O-CB 3.45Å; K173-E177 WeakPolarHBondContact O-CG 3.47Å; K173-E177 PolarHBondContact O-N 3.43Å; K173-E400 IonicContact NZ-OE1 3.85Å; K173-E400 PolarHBondContact NZ-OE1 2.72Å
174	L	79.6	Confident	83.1	Confident	112 Å²	112	103.7 Å²	103.7	59%	0.586	49%	0.491	S	S	*	.	H	α-helix	trans	-61.3	-35	178.4	-138.2	75.8	0	0	0	112.8	R170 Y171 N172 R178	R170-L174 PolarHBondContact O-N 2.88Å; Y171-L174 PolarHBondContact O-N 3.47Å; N172-L174 VanDerWaalsContact C-N 3.35Å; N172-L174 PolarHBondContact O-N 2.78Å; L174-R178 VanDerWaalsContact O-CB 3.29Å; L174-R178 WeakPolarHBondContact O-CB 3.37Å; L174-R178 PolarHBondContact O-N 3.18Å
175	R	88.1	Confident	83.2	Confident	131 Å²	131	103.2 Å²	103.2	49%	0.494	49%	0.489	S	S	.	.	H	α-helix	trans	-70.1	-39.8	175.3	-177.5	-178.5	178.7	-175.7	1	112.1	Y171 N172 K173 N179	Y171-R175 WeakPolarHBondContact O-CB 3.4Å; Y171-R175 PolarHBondContact O-N 3.31Å; N172-R175 WeakPolarHBondContact O-CB 3.46Å; N172-R175 PolarHBondContact O-N 2.88Å; N172-R175 VanDerWaalsContact O-N 3.15Å; K173-R175 VanDerWaalsContact C-N 3.28Å; K173-R175 PolarHBondContact O-N 3.29Å; R175-N179 PolarHBondContact O-N 3.45Å; R175-N179 PolarHBondContact O-ND2 3.05Å; R175-N179 PolarHBondContact O-OD1 3.48Å
176	E	88.4	Confident	83.7	Confident	132 Å²	132	103.3 Å²	103.3	62%	0.617	49%	0.492	S	S	*	.	H	α-helix	trans	-68.7	-42.8	176.1	-72.7	173.8	-169.3	0	0	111.6	N172 K173 N179 S180	N172-E176 WeakPolarHBondContact O-CG 3.49Å; N172-E176 PolarHBondContact O-N 3.27Å; K173-E176 PolarHBondContact O-N 3.47Å; K173-E176 VanDerWaalsContact O-N 3.15Å; E176-N179 WeakPolarHBondContact O-CB 3.4Å; E176-N179 PolarHBondContact O-N 3.04Å; E176-S180 PolarHBondContact O-N 3.41Å
177	E	82.7	Confident	84.5	Confident	61 Å²	61	107 Å²	107	29%	0.285	50%	0.497	S	S	.	.	H	α-helix	trans	-58.2	-48.2	171.2	-72.9	169.4	179.9	0	0	111.3	K173 N179 S180 F181	K173-E177 WeakPolarHBondContact CE-OE1 3.23Å; K173-E177 HydrophobicContact CG-CG 4.5Å; K173-E177 WeakPolarHBondContact CG-OE1 3.45Å; K173-E177 IonicContact NZ-OE1 3.67Å; K173-E177 PolarHBondContact NZ-OE1 2.9Å; K173-E177 WeakPolarHBondContact O-CB 3.45Å; K173-E177 WeakPolarHBondContact O-CG 3.47Å; K173-E177 PolarHBondContact O-N 3.43Å; E177-N179 VanDerWaalsContact C-N 3.29Å; E177-N179 PolarHBondContact O-N 2.88Å; E177-S180 WeakPolarHBondContact O-CB 3.45Å; E177-S180 PolarHBondContact O-N 2.91Å; E177-S180 VanDerWaalsContact O-N 3.09Å; E177-F181 HydrophobicContact CB-CE2 4.14Å; E177-F181 WeakPolarHBondContact O-CD2 3.43Å; E177-F181 WeakPolarHBondContact O-CG 3.42Å; E177-F181 PolarHBondContact O-N 3.3Å
178	R	86.2	Confident	85	Confident	146 Å²	146	103.8 Å²	103.8	55%	0.551	49%	0.489	S	S	*	.	H	α-helix	trans	-58.9	-38.8	175.5	-173	-85.5	-65.3	171	-4.8	112.4	L174 S182	L174-R178 VanDerWaalsContact O-CB 3.29Å; L174-R178 WeakPolarHBondContact O-CB 3.37Å; L174-R178 PolarHBondContact O-N 3.18Å; R178-S182 PolarHBondContact O-N 2.99Å; R178-S182 VanDerWaalsContact O-N 3.09Å
179	N	85.7	Confident	85.2	Confident	61 Å²	61	104.1 Å²	104.1	33%	0.326	49%	0.489	S	S	.	.	H	α-helix	trans	-65.1	-46.1	173.7	-66.6	-18.6	0	0	0	110.9	R175 E176 E177 F181 S182 D183	R175-N179 PolarHBondContact O-N 3.45Å; R175-N179 PolarHBondContact O-ND2 3.05Å; R175-N179 PolarHBondContact O-OD1 3.48Å; E176-N179 WeakPolarHBondContact O-CB 3.4Å; E176-N179 PolarHBondContact O-N 3.04Å; E177-N179 VanDerWaalsContact C-N 3.29Å; E177-N179 PolarHBondContact O-N 2.88Å; N179-F181 VanDerWaalsContact C-N 3.33Å; N179-F181 PolarHBondContact O-N 2.9Å; N179-S182 WeakPolarHBondContact O-CA 3.42Å; N179-S182 VanDerWaalsContact O-CB 3.25Å; N179-S182 WeakPolarHBondContact O-CB 3.44Å; N179-S182 PolarHBondContact O-N 3.39Å; N179-D183 PolarHBondContact O-N 3.37Å
180	S	90.4	Very high	85.6	Confident	70 Å²	70	101.6 Å²	101.6	49%	0.49	48%	0.479	S	S	.	.	H	α-helix	trans	-59.9	-39.7	177.8	-172	0	0	0	0	112.9	E176 E177 S182 D183 E184	E176-S180 PolarHBondContact O-N 3.41Å; E177-S180 WeakPolarHBondContact O-CB 3.45Å; E177-S180 PolarHBondContact O-N 2.91Å; E177-S180 VanDerWaalsContact O-N 3.09Å; S180-S182 VanDerWaalsContact C-N 3.34Å; S180-D183 PolarHBondContact O-N 3.4Å; S180-E184 WeakPolarHBondContact O-CB 3.48Å; S180-E184 PolarHBondContact O-N 3.17Å
181	F	81.8	Confident	86.2	Confident	138 Å²	138	101 Å²	101	61%	0.605	48%	0.483	S	S	*	.	H	α-helix	trans	-67.6	-31.9	172.9	-65.9	-52.2	0	0	0	112.8	E177 N179 L185	E177-F181 HydrophobicContact CB-CE2 4.14Å; E177-F181 WeakPolarHBondContact O-CD2 3.43Å; E177-F181 WeakPolarHBondContact O-CG 3.42Å; E177-F181 PolarHBondContact O-N 3.3Å; N179-F181 VanDerWaalsContact C-N 3.33Å; N179-F181 PolarHBondContact O-N 2.9Å; F181-L185 VanDerWaalsContact O-CB 3.23Å; F181-L185 WeakPolarHBondContact O-CB 3.42Å; F181-L185 PolarHBondContact O-N 3.06Å
182	S	85.8	Confident	86.4	Confident	63 Å²	63	99 Å²	99	44%	0.441	48%	0.482	S	S	.	.	H	α-helix	trans	-66.2	-40.7	172.2	-168.2	0	0	0	0	111.9	R178 N179 S180 L185 L186	R178-S182 PolarHBondContact O-N 2.99Å; R178-S182 VanDerWaalsContact O-N 3.09Å; N179-S182 WeakPolarHBondContact O-CA 3.42Å; N179-S182 VanDerWaalsContact O-CB 3.25Å; N179-S182 WeakPolarHBondContact O-CB 3.44Å; N179-S182 PolarHBondContact O-N 3.39Å; S180-S182 VanDerWaalsContact C-N 3.34Å; S182-L185 PolarHBondContact O-N 3.21Å; S182-L186 PolarHBondContact O-N 3.08Å
183	D	88.6	Confident	86.7	Confident	99 Å²	99	103.3 Å²	103.3	53%	0.529	49%	0.494	S	S	.	.	H	α-helix	trans	-72.3	-35.9	178.3	-64.7	-21.4	0	0	0	112.1	N179 S180 L186 R187	N179-D183 PolarHBondContact O-N 3.37Å; S180-D183 PolarHBondContact O-N 3.4Å; D183-L186 PolarHBondContact O-N 3.18Å; D183-R187 PolarHBondContact O-N 3.41Å
184	E	88.8	Confident	86.9	Confident	70 Å²	70	104 Å²	104	33%	0.327	50%	0.497	S	S	.	.	H	α-helix	trans	-68	-41.2	171.6	-174.7	129.4	-103.2	0	0	111.5	S180 L186 R187 V188	S180-E184 WeakPolarHBondContact O-CB 3.48Å; S180-E184 PolarHBondContact O-N 3.17Å; E184-L186 VanDerWaalsContact C-N 3.29Å; E184-L186 PolarHBondContact O-N 2.64Å; E184-R187 VanDerWaalsContact CD-NH2 3.27Å; E184-R187 PolarHBondContact O-N 2.95Å; E184-R187 IonicContact OE1-CZ 2.67Å; E184-R187 IonicContact OE1-NH1 2.7Å; E184-R187 PolarHBondContact OE1-NH1 3.18Å; E184-R187 IonicContact OE1-NH2 2.79Å; E184-R187 PolarHBondContact OE1-NH2 3.14Å; E184-V188 WeakPolarHBondContact O-CG2 3.3Å; E184-V188 PolarHBondContact O-N 3.39Å
185	L	83.3	Confident	87.2	Confident	96 Å²	96	104 Å²	104	50%	0.503	50%	0.497	S	S	.	.	H	α-helix	trans	-60	-38.6	172.6	177.8	62	0	0	0	112	F181 S182 V188 K189	F181-L185 VanDerWaalsContact O-CB 3.23Å; F181-L185 WeakPolarHBondContact O-CB 3.42Å; F181-L185 PolarHBondContact O-N 3.06Å; S182-L185 PolarHBondContact O-N 3.21Å; L185-V188 PolarHBondContact O-N 3.03Å; L185-K189 WeakPolarHBondContact O-CG 3.12Å; L185-K189 PolarHBondContact O-N 3.47Å
186	L	89.3	Confident	86.9	Confident	102 Å²	102	100 Å²	100	53%	0.534	49%	0.492	S	S	.	.	H	α-helix	trans	-65.9	-44.3	175.4	-172.9	61.9	0	0	0	111.5	S182 D183 E184 V188 K189 D190	S182-L186 PolarHBondContact O-N 3.08Å; D183-L186 PolarHBondContact O-N 3.18Å; E184-L186 VanDerWaalsContact C-N 3.29Å; E184-L186 PolarHBondContact O-N 2.64Å; L186-V188 VanDerWaalsContact C-N 3.34Å; L186-V188 PolarHBondContact O-N 3.17Å; L186-K189 WeakPolarHBondContact O-CB 3.46Å; L186-K189 PolarHBondContact O-N 3.19Å; L186-D190 PolarHBondContact O-N 3.49Å
187	R	92.6	Very high	86.8	Confident	118 Å²	118	98 Å²	98	45%	0.445	48%	0.484	S	S	.	.	H	α-helix	trans	-59	-42.3	173	-78.9	-171.2	-73.7	108.7	-5.2	112.8	D183 E184 K189 D190 E191	D183-R187 PolarHBondContact O-N 3.41Å; E184-R187 VanDerWaalsContact CD-NH2 3.27Å; E184-R187 PolarHBondContact O-N 2.95Å; E184-R187 IonicContact OE1-CZ 2.67Å; E184-R187 IonicContact OE1-NH1 2.7Å; E184-R187 PolarHBondContact OE1-NH1 3.18Å; E184-R187 IonicContact OE1-NH2 2.79Å; E184-R187 PolarHBondContact OE1-NH2 3.14Å; R187-K189 VanDerWaalsContact C-N 3.34Å; R187-K189 PolarHBondContact O-N 3.21Å; R187-D190 WeakPolarHBondContact O-CB 3.2Å; R187-D190 PolarHBondContact O-N 2.87Å; R187-E191 WeakPolarHBondContact O-CB 3.5Å; R187-E191 WeakPolarHBondContact O-CG 3.21Å; R187-E191 PolarHBondContact O-N 3.31Å
188	V	84.5	Confident	87.2	Confident	79 Å²	79	103.5 Å²	103.5	48%	0.479	50%	0.502	S	S	.	.	H	α-helix	trans	-65.6	-37	177.7	171.4	0	0	0	0	111.4	E184 L185 L186 E191 N192	E184-V188 WeakPolarHBondContact O-CG2 3.3Å; E184-V188 PolarHBondContact O-N 3.39Å; L185-V188 PolarHBondContact O-N 3.03Å; L186-V188 VanDerWaalsContact C-N 3.34Å; L186-V188 PolarHBondContact O-N 3.17Å; V188-E191 PolarHBondContact O-N 3.17Å; V188-N192 VanDerWaalsContact O-CB 3.3Å; V188-N192 WeakPolarHBondContact O-CB 3.47Å; V188-N192 PolarHBondContact O-N 2.65Å
189	K	87.3	Confident	87	Confident	129 Å²	129	102.9 Å²	102.9	56%	0.561	50%	0.501	S	S	*	.	H	α-helix	trans	-63.2	-45.1	172	-74.6	176.2	177.8	-174.3	0	112	L185 L186 R187 E191 N192 Y193	L185-K189 WeakPolarHBondContact O-CG 3.12Å; L185-K189 PolarHBondContact O-N 3.47Å; L186-K189 WeakPolarHBondContact O-CB 3.46Å; L186-K189 PolarHBondContact O-N 3.19Å; R187-K189 VanDerWaalsContact C-N 3.34Å; R187-K189 PolarHBondContact O-N 3.21Å; K189-E191 PolarHBondContact O-N 2.78Å; K189-N192 PolarHBondContact O-N 2.9Å; K189-Y193 WeakPolarHBondContact O-CB 3.17Å; K189-Y193 PolarHBondContact O-N 2.95Å
190	D	90.1	Very high	87	Confident	81 Å²	81	101.9 Å²	101.9	43%	0.433	50%	0.501	S	S	.	.	H	α-helix	trans	-61.6	-40.2	175.8	-89.9	14.8	0	0	0	112.9	L186 R187 K194	L186-D190 PolarHBondContact O-N 3.49Å; R187-D190 WeakPolarHBondContact O-CB 3.2Å; R187-D190 PolarHBondContact O-N 2.87Å; D190-K194 VanDerWaalsContact O-CD 3.23Å; D190-K194 WeakPolarHBondContact O-CD 3.29Å; D190-K194 WeakPolarHBondContact O-CE 3.45Å; D190-K194 WeakPolarHBondContact O-CG 3.45Å; D190-K194 PolarHBondContact O-N 3.24Å; D190-K194 VanDerWaalsContact O-N 3.09Å; D190-K194 IonicContact OD2-NZ 3.85Å
191	E	88.8	Confident	86.8	Confident	121 Å²	121	101.8 Å²	101.8	57%	0.565	50%	0.498	S	S	*	.	H	α-helix	trans	-70.4	-39.9	176.5	-74.9	178.3	-177.2	0	0	111.8	R187 V188 K189 K194 L195	R187-E191 WeakPolarHBondContact O-CB 3.5Å; R187-E191 WeakPolarHBondContact O-CG 3.21Å; R187-E191 PolarHBondContact O-N 3.31Å; V188-E191 PolarHBondContact O-N 3.17Å; K189-E191 PolarHBondContact O-N 2.78Å; E191-K194 PolarHBondContact O-N 2.86Å; E191-L195 WeakPolarHBondContact O-CB 3.49Å; E191-L195 PolarHBondContact O-N 2.82Å
192	N	82.3	Confident	87.1	Confident	109 Å²	109	100.2 Å²	100.2	58%	0.583	50%	0.495	S	S	*	.	H	α-helix	trans	-63.8	-42.2	173.7	-166.3	17	0	0	0	111.7	V188 K189 K194 L195 A196	V188-N192 VanDerWaalsContact O-CB 3.3Å; V188-N192 WeakPolarHBondContact O-CB 3.47Å; V188-N192 PolarHBondContact O-N 2.65Å; K189-N192 PolarHBondContact O-N 2.9Å; N192-K194 PolarHBondContact O-N 2.84Å; N192-L195 WeakPolarHBondContact O-CB 3.24Å; N192-L195 PolarHBondContact O-N 2.93Å; N192-L195 VanDerWaalsContact O-N 3.11Å; N192-A196 PolarHBondContact O-N 3.27Å
193	Y	90.1	Very high	86.9	Confident	155 Å²	155	99.1 Å²	99.1	61%	0.608	49%	0.487	S	S	*	.	H	α-helix	trans	-60.2	-43.8	173.7	-174.2	-94.3	0	0	0	112	K189 L195 A196 M197	K189-Y193 WeakPolarHBondContact O-CB 3.17Å; K189-Y193 PolarHBondContact O-N 2.95Å; Y193-L195 VanDerWaalsContact C-N 3.28Å; Y193-L195 PolarHBondContact O-N 2.96Å; Y193-A196 PolarHBondContact O-N 3.37Å; Y193-M197 HydrophobicContact CD1-CG 4.12Å; Y193-M197 HydrophobicContact CE1-CG 3.74Å; Y193-M197 HydrophobicContact CE1-SD 4.25Å; Y193-M197 VanDerWaalsContact O-CG 3.29Å; Y193-M197 WeakPolarHBondContact O-CG 3.36Å; Y193-M197 PolarHBondContact O-N 2.73Å
194	K	90.4	Very high	86.9	Confident	111 Å²	111	100.4 Å²	100.4	48%	0.483	49%	0.49	S	S	.	.	H	α-helix	trans	-63.8	-31.5	174.5	-69.7	158.1	-164.1	155.2	0	112.5	D190 E191 N192 R198	D190-K194 VanDerWaalsContact O-CD 3.23Å; D190-K194 WeakPolarHBondContact O-CD 3.29Å; D190-K194 WeakPolarHBondContact O-CE 3.45Å; D190-K194 WeakPolarHBondContact O-CG 3.45Å; D190-K194 PolarHBondContact O-N 3.24Å; D190-K194 VanDerWaalsContact O-N 3.09Å; D190-K194 IonicContact OD2-NZ 3.85Å; E191-K194 PolarHBondContact O-N 2.86Å; N192-K194 PolarHBondContact O-N 2.84Å; K194-R198 WeakPolarHBondContact O-CG 3.35Å; K194-R198 PolarHBondContact O-N 2.68Å
195	L	86.5	Confident	86.9	Confident	111 Å²	111	102.4 Å²	102.4	58%	0.581	50%	0.5	S	S	*	.	H	α-helix	trans	-73.5	-44.6	175.4	-174.6	61.2	0	0	0	111.5	E191 N192 Y193 M197 R198 Y199	E191-L195 WeakPolarHBondContact O-CB 3.49Å; E191-L195 PolarHBondContact O-N 2.82Å; N192-L195 WeakPolarHBondContact O-CB 3.24Å; N192-L195 PolarHBondContact O-N 2.93Å; N192-L195 VanDerWaalsContact O-N 3.11Å; Y193-L195 VanDerWaalsContact C-N 3.28Å; Y193-L195 PolarHBondContact O-N 2.96Å; L195-M197 VanDerWaalsContact C-N 3.32Å; L195-M197 PolarHBondContact O-N 3.28Å; L195-R198 PolarHBondContact O-N 3.33Å; L195-R198 VanDerWaalsContact O-N 3.16Å; L195-Y199 PolarHBondContact O-N 2.96Å
196	A	81.7	Confident	87.2	Confident	48 Å²	48	104.2 Å²	104.2	40%	0.397	50%	0.504	S	S	.	.	H	α-helix	trans	-59.3	-41.1	174.8	0	0	0	0	0	112.1	N192 Y193 Y199 A200	N192-A196 PolarHBondContact O-N 3.27Å; Y193-A196 PolarHBondContact O-N 3.37Å; A196-Y199 PolarHBondContact O-N 3.38Å; A196-A200 PolarHBondContact O-N 3.24Å
197	M	86.9	Confident	87	Confident	90 Å²	90	103.6 Å²	103.6	44%	0.443	50%	0.501	S	S	.	.	H	α-helix	trans	-62.7	-42.6	173.6	-68.5	-71.4	96.8	0	0	112.5	Y193 L195 Y199 A200 T201	Y193-M197 HydrophobicContact CD1-CG 4.12Å; Y193-M197 HydrophobicContact CE1-CG 3.74Å; Y193-M197 HydrophobicContact CE1-SD 4.25Å; Y193-M197 VanDerWaalsContact O-CG 3.29Å; Y193-M197 WeakPolarHBondContact O-CG 3.36Å; Y193-M197 PolarHBondContact O-N 2.73Å; L195-M197 VanDerWaalsContact C-N 3.32Å; L195-M197 PolarHBondContact O-N 3.28Å; M197-Y199 VanDerWaalsContact C-N 3.33Å; M197-Y199 PolarHBondContact O-N 3.47Å; M197-A200 PolarHBondContact O-N 2.86Å; M197-T201 PolarHBondContact O-N 2.57Å; M197-T201 VanDerWaalsContact O-N 3.13Å; M197-T201 PolarHBondContact O-OG1 3Å
198	R	89.9	Confident	86.9	Confident	176 Å²	176	103.8 Å²	103.8	66%	0.664	51%	0.508	S	S	*	.	H	α-helix	trans	-63.7	-38.9	173.5	-70.3	169.9	-170.5	-119.5	3.9	112.1	K194 L195 T201 L202	K194-R198 WeakPolarHBondContact O-CG 3.35Å; K194-R198 PolarHBondContact O-N 2.68Å; L195-R198 PolarHBondContact O-N 3.33Å; L195-R198 VanDerWaalsContact O-N 3.16Å; R198-T201 PolarHBondContact O-N 2.76Å; R198-L202 WeakPolarHBondContact O-CB 3.09Å; R198-L202 VanDerWaalsContact O-CG 3.31Å; R198-L202 WeakPolarHBondContact O-CG 3.45Å; R198-L202 PolarHBondContact O-N 3.41Å
199	Y	82.5	Confident	86.9	Confident	133 Å²	133	102.1 Å²	102.1	52%	0.522	50%	0.503	S	S	.	.	H	α-helix	trans	-64.2	-40.7	176.9	-176.5	-92.7	0	0	0	111.6	L195 A196 M197 L202 S203 P943	L195-Y199 PolarHBondContact O-N 2.96Å; A196-Y199 PolarHBondContact O-N 3.38Å; M197-Y199 VanDerWaalsContact C-N 3.33Å; M197-Y199 PolarHBondContact O-N 3.47Å; Y199-L202 PolarHBondContact O-N 3.22Å; Y199-S203 WeakPolarHBondContact O-CB 3.14Å; Y199-S203 PolarHBondContact O-N 3.26Å; Y199-P943 WeakPolarHBondContact OH-CG 3.35Å
200	A	85.4	Confident	87	Confident	40 Å²	40	100 Å²	100	33%	0.331	50%	0.501	S	S	.	.	H	α-helix	trans	-59.1	-51.5	173.6	0	0	0	0	0	111.7	A196 M197 L202 S203 E204	A196-A200 PolarHBondContact O-N 3.24Å; M197-A200 PolarHBondContact O-N 2.86Å; A200-L202 PolarHBondContact O-N 3.37Å; A200-S203 WeakPolarHBondContact O-CA 3.03Å; A200-S203 VanDerWaalsContact O-CB 3.31Å; A200-S203 WeakPolarHBondContact O-CB 3.45Å; A200-S203 PolarHBondContact O-N 2.75Å; A200-S203 VanDerWaalsContact O-N 3.07Å; A200-E204 PolarHBondContact O-N 2.88Å
201	T	87.3	Confident	86.9	Confident	69 Å²	69	100.6 Å²	100.6	42%	0.423	50%	0.502	S	S	.	.	H	α-helix	trans	-59.9	-42.6	177.4	-50.8	0	0	0	0	112.5	M197 R198 S203 E204 E205	M197-T201 PolarHBondContact O-N 2.57Å; M197-T201 VanDerWaalsContact O-N 3.13Å; M197-T201 PolarHBondContact O-OG1 3Å; R198-T201 PolarHBondContact O-N 2.76Å; T201-S203 VanDerWaalsContact C-N 3.28Å; T201-S203 PolarHBondContact O-N 3.14Å; T201-E204 WeakPolarHBondContact O-CB 3.47Å; T201-E204 PolarHBondContact O-N 2.91Å; T201-E205 WeakPolarHBondContact O-CG 3.5Å; T201-E205 PolarHBondContact O-N 2.86Å
202	L	86.4	Confident	87.1	Confident	104 Å²	104	101.9 Å²	101.9	55%	0.545	50%	0.501	S	S	.	.	H	α-helix	trans	-66.2	-29.9	176	-72	169	0	0	0	112.7	R198 Y199 A200 K206	R198-L202 WeakPolarHBondContact O-CB 3.09Å; R198-L202 VanDerWaalsContact O-CG 3.31Å; R198-L202 WeakPolarHBondContact O-CG 3.45Å; R198-L202 PolarHBondContact O-N 3.41Å; Y199-L202 PolarHBondContact O-N 3.22Å; A200-L202 PolarHBondContact O-N 3.37Å; L202-K206 VanDerWaalsContact O-CB 3.23Å; L202-K206 WeakPolarHBondContact O-CB 3.33Å; L202-K206 PolarHBondContact O-N 3.14Å
203	S	82.4	Confident	87.1	Confident	40 Å²	40	100.4 Å²	100.4	28%	0.28	50%	0.5	S	S	.	.	H	α-helix	trans	-69.8	-41.1	172.7	-166	0	0	0	0	111.4	Y199 A200 T201 K206 N207	Y199-S203 WeakPolarHBondContact O-CB 3.14Å; Y199-S203 PolarHBondContact O-N 3.26Å; A200-S203 WeakPolarHBondContact O-CA 3.03Å; A200-S203 VanDerWaalsContact O-CB 3.31Å; A200-S203 WeakPolarHBondContact O-CB 3.45Å; A200-S203 PolarHBondContact O-N 2.75Å; A200-S203 VanDerWaalsContact O-N 3.07Å; T201-S203 VanDerWaalsContact C-N 3.28Å; T201-S203 PolarHBondContact O-N 3.14Å; S203-K206 WeakPolarHBondContact O-CB 3.33Å; S203-K206 PolarHBondContact O-N 2.96Å; S203-N207 WeakPolarHBondContact O-CB 3.47Å; S203-N207 PolarHBondContact O-N 2.96Å; S203-N207 PolarHBondContact O-ND2 3.5Å
204	E	88.9	Confident	87.2	Confident	127 Å²	127	100.7 Å²	100.7	59%	0.593	50%	0.499	S	S	*	.	H	α-helix	trans	-62.9	-47.5	172.7	-68.7	172.4	169	0	0	111.6	A200 T201 K206 N207 M208	A200-E204 PolarHBondContact O-N 2.88Å; T201-E204 WeakPolarHBondContact O-CB 3.47Å; T201-E204 PolarHBondContact O-N 2.91Å; E204-K206 VanDerWaalsContact C-N 3.34Å; E204-K206 PolarHBondContact O-N 3.31Å; E204-N207 PolarHBondContact O-N 3.03Å; E204-N207 VanDerWaalsContact O-N 3.16Å; E204-M208 WeakPolarHBondContact O-CG 3.5Å; E204-M208 PolarHBondContact O-N 3.07Å
205	E	87.8	Confident	87.3	Confident	112 Å²	112	99 Å²	99	52%	0.523	50%	0.496	S	S	.	.	H	α-helix	trans	-58.9	-42.7	174.8	-74.3	179.1	-172.4	0	0	112.2	T201 M208 A209	T201-E205 WeakPolarHBondContact O-CG 3.5Å; T201-E205 PolarHBondContact O-N 2.86Å; E205-M208 PolarHBondContact O-N 3.14Å; E205-A209 WeakPolarHBondContact O-CB 3.47Å; E205-A209 PolarHBondContact O-N 2.87Å
206	K	89.7	Confident	87.5	Confident	134 Å²	134	98.3 Å²	98.3	58%	0.583	49%	0.492	S	S	*	.	H	α-helix	trans	-59.9	-46.8	173.2	174.6	-172.6	172.5	-171.5	0	111.3	L202 S203 E204 M208 A209 V210	L202-K206 VanDerWaalsContact O-CB 3.23Å; L202-K206 WeakPolarHBondContact O-CB 3.33Å; L202-K206 PolarHBondContact O-N 3.14Å; S203-K206 WeakPolarHBondContact O-CB 3.33Å; S203-K206 PolarHBondContact O-N 2.96Å; E204-K206 VanDerWaalsContact C-N 3.34Å; E204-K206 PolarHBondContact O-N 3.31Å; K206-M208 VanDerWaalsContact C-N 3.34Å; K206-M208 PolarHBondContact O-N 3.1Å; K206-A209 WeakPolarHBondContact O-CB 3.43Å; K206-A209 PolarHBondContact O-N 3.21Å; K206-A209 VanDerWaalsContact O-N 3.12Å; K206-V210 WeakPolarHBondContact O-CG2 3.23Å; K206-V210 PolarHBondContact O-N 3.3Å
207	N	84.9	Confident	87.7	Confident	88 Å²	88	100 Å²	100	47%	0.471	49%	0.492	S	S	.	.	H	α-helix	trans	-63.6	-41.1	178.5	-69	-24.8	0	0	0	111.2	S203 E204 A209 V210 M211	S203-N207 WeakPolarHBondContact O-CB 3.47Å; S203-N207 PolarHBondContact O-N 2.96Å; S203-N207 PolarHBondContact O-ND2 3.5Å; E204-N207 PolarHBondContact O-N 3.03Å; E204-N207 VanDerWaalsContact O-N 3.16Å; N207-A209 VanDerWaalsContact C-N 3.29Å; N207-A209 PolarHBondContact O-N 3.42Å; N207-V210 PolarHBondContact O-N 3.36Å; N207-M211 WeakPolarHBondContact O-CG 3.24Å; N207-M211 PolarHBondContact O-N 2.87Å
208	M	90.6	Very high	87.9	Confident	123 Å²	123	100 Å²	100	61%	0.606	49%	0.493	S	S	*	.	H	α-helix	trans	-65.7	-28.2	173.2	-69.1	-61.9	-70.5	0	0	113.1	E204 E205 K206 R212	E204-M208 WeakPolarHBondContact O-CG 3.5Å; E204-M208 PolarHBondContact O-N 3.07Å; E205-M208 PolarHBondContact O-N 3.14Å; K206-M208 VanDerWaalsContact C-N 3.34Å; K206-M208 PolarHBondContact O-N 3.1Å; M208-R212 WeakPolarHBondContact O-CG 3.31Å; M208-R212 PolarHBondContact O-N 3.4Å; M208-R212 PolarHBondContact O-NE 3.28Å
209	A	85.6	Confident	88	Confident	44 Å²	44	96.8 Å²	96.8	36%	0.364	49%	0.486	S	S	.	.	H	α-helix	trans	-75.6	-39.8	171.3	0	0	0	0	0	112.4	E205 K206 N207 R212 S213	E205-A209 WeakPolarHBondContact O-CB 3.47Å; E205-A209 PolarHBondContact O-N 2.87Å; K206-A209 WeakPolarHBondContact O-CB 3.43Å; K206-A209 PolarHBondContact O-N 3.21Å; K206-A209 VanDerWaalsContact O-N 3.12Å; N207-A209 VanDerWaalsContact C-N 3.29Å; N207-A209 PolarHBondContact O-N 3.42Å; A209-R212 PolarHBondContact O-N 3.23Å; A209-S213 WeakPolarHBondContact O-CB 3.35Å; A209-S213 PolarHBondContact O-N 3.11Å
210	V	88.9	Confident	88.2	Confident	85 Å²	85	94.2 Å²	94.2	52%	0.515	48%	0.48	S	S	.	.	H	α-helix	trans	-63.7	-41.4	175.1	169.6	0	0	0	0	111.3	K206 N207 S213 R214	K206-V210 WeakPolarHBondContact O-CG2 3.23Å; K206-V210 PolarHBondContact O-N 3.3Å; N207-V210 PolarHBondContact O-N 3.36Å; V210-S213 PolarHBondContact O-N 3.23Å; V210-R214 PolarHBondContact O-N 3Å
211	M	88.6	Confident	88.4	Confident	92 Å²	92	95.6 Å²	95.6	45%	0.453	48%	0.482	S	S	.	.	H	α-helix	trans	-60.4	-53.2	173.7	-72.3	-60.9	-62.8	0	0	111.3	N207 S213 R214 D215	N207-M211 WeakPolarHBondContact O-CG 3.24Å; N207-M211 PolarHBondContact O-N 2.87Å; M211-S213 VanDerWaalsContact C-N 3.25Å; M211-S213 PolarHBondContact O-N 3.49Å; M211-R214 WeakPolarHBondContact O-CA 3.17Å; M211-R214 VanDerWaalsContact O-CB 3.31Å; M211-R214 WeakPolarHBondContact O-CB 3.38Å; M211-R214 PolarHBondContact O-N 2.97Å; M211-D215 VanDerWaalsContact O-CG 3.24Å; M211-D215 PolarHBondContact O-N 2.84Å
212	R	92.4	Very high	88.7	Confident	149 Å²	149	98.4 Å²	98.4	56%	0.562	49%	0.49	S	S	*	.	H	α-helix	trans	-56.8	-37.4	175.3	-74.7	175.7	-71.9	157.2	-3.7	113.1	M208 A209 R214 D215 L216	M208-R212 WeakPolarHBondContact O-CG 3.31Å; M208-R212 PolarHBondContact O-N 3.4Å; M208-R212 PolarHBondContact O-NE 3.28Å; A209-R212 PolarHBondContact O-N 3.23Å; R212-R214 VanDerWaalsContact C-N 3.33Å; R212-D215 PolarHBondContact O-N 2.87Å; R212-L216 WeakPolarHBondContact O-CB 3.35Å; R212-L216 WeakPolarHBondContact O-CG 3.44Å; R212-L216 PolarHBondContact O-N 3.03Å
213	S	82.3	Confident	88.9	Confident	78 Å²	78	99 Å²	99	55%	0.545	49%	0.493	S	S	.	.	H	α-helix	trans	-68.6	-30.4	175.3	-172.4	0	0	0	0	113	A209 V210 M211 Q217	A209-S213 WeakPolarHBondContact O-CB 3.35Å; A209-S213 PolarHBondContact O-N 3.11Å; V210-S213 PolarHBondContact O-N 3.23Å; M211-S213 VanDerWaalsContact C-N 3.25Å; M211-S213 PolarHBondContact O-N 3.49Å; S213-Q217 WeakPolarHBondContact O-CB 3.5Å; S213-Q217 PolarHBondContact O-N 3.2Å; S213-Q217 VanDerWaalsContact O-N 3.07Å
214	R	92.3	Very high	89.1	Confident	160 Å²	160	101.8 Å²	101.8	60%	0.604	50%	0.501	S	S	*	.	H	α-helix	trans	-71.8	-41.8	172.7	-179.5	-175	179.2	-177	-0.3	111	V210 M211 R212 Q217 L218	V210-R214 PolarHBondContact O-N 3Å; M211-R214 WeakPolarHBondContact O-CA 3.17Å; M211-R214 VanDerWaalsContact O-CB 3.31Å; M211-R214 WeakPolarHBondContact O-CB 3.38Å; M211-R214 PolarHBondContact O-N 2.97Å; R212-R214 VanDerWaalsContact C-N 3.33Å; R214-Q217 WeakPolarHBondContact O-CB 3.32Å; R214-Q217 PolarHBondContact O-N 2.74Å; R214-Q217 VanDerWaalsContact O-N 3.17Å; R214-L218 WeakPolarHBondContact O-CG 3.47Å; R214-L218 PolarHBondContact O-N 3.01Å
215	D	92	Very high	89.3	Confident	77 Å²	77	102.2 Å²	102.2	41%	0.412	50%	0.502	S	S	.	.	H	α-helix	trans	-64.3	-46.2	178.9	-56.3	-33.2	0	0	0	110.4	M211 R212 Q217 L218 E219	M211-D215 VanDerWaalsContact O-CG 3.24Å; M211-D215 PolarHBondContact O-N 2.84Å; R212-D215 PolarHBondContact O-N 2.87Å; D215-Q217 VanDerWaalsContact C-N 3.3Å; D215-Q217 PolarHBondContact O-N 3.47Å; D215-L218 WeakPolarHBondContact O-CB 3.16Å; D215-L218 PolarHBondContact O-N 2.96Å; D215-L218 VanDerWaalsContact O-N 3.11Å; D215-E219 PolarHBondContact O-N 3Å
216	L	90.4	Very high	89.5	Confident	96 Å²	96	100.5 Å²	100.5	50%	0.503	50%	0.5	S	S	.	.	H	α-helix	trans	-61.1	-34.6	171.3	-71	169.9	0	0	0	113	R212 L218 E219 I220	R212-L216 WeakPolarHBondContact O-CB 3.35Å; R212-L216 WeakPolarHBondContact O-CG 3.44Å; R212-L216 PolarHBondContact O-N 3.03Å; L216-L218 VanDerWaalsContact C-N 3.35Å; L216-E219 PolarHBondContact O-N 2.84Å; L216-I220 WeakPolarHBondContact O-CB 3.3Å; L216-I220 VanDerWaalsContact O-CG1 3.26Å; L216-I220 WeakPolarHBondContact O-CG1 3.39Å; L216-I220 PolarHBondContact O-N 2.82Å
217	Q	86.6	Confident	89.4	Confident	83 Å²	83	98.8 Å²	98.8	39%	0.388	50%	0.496	S	S	.	.	H	α-helix	trans	-66.8	-37.3	174.4	-174.6	55.6	60.7	0	0	111.5	S213 R214 D215 I220 D221	S213-Q217 WeakPolarHBondContact O-CB 3.5Å; S213-Q217 PolarHBondContact O-N 3.2Å; S213-Q217 VanDerWaalsContact O-N 3.07Å; R214-Q217 WeakPolarHBondContact O-CB 3.32Å; R214-Q217 PolarHBondContact O-N 2.74Å; R214-Q217 VanDerWaalsContact O-N 3.17Å; D215-Q217 VanDerWaalsContact C-N 3.3Å; D215-Q217 PolarHBondContact O-N 3.47Å; Q217-I220 PolarHBondContact O-N 3Å; Q217-D221 PolarHBondContact NE2-OD1 3.01Å; Q217-D221 VanDerWaalsContact NE2-OD1 3.09Å; Q217-D221 PolarHBondContact NE2-OD2 2.95Å; Q217-D221 WeakPolarHBondContact O-CB 3.3Å; Q217-D221 VanDerWaalsContact O-CG 3.29Å; Q217-D221 PolarHBondContact O-N 3.32Å
218	L	91.3	Very high	89.6	Confident	89 Å²	89	99 Å²	99	47%	0.466	50%	0.497	S	S	.	.	H	α-helix	trans	-66.9	-38.5	173.7	-67.2	170	0	0	0	112	R214 D215 L216 D221 Q222	R214-L218 WeakPolarHBondContact O-CG 3.47Å; R214-L218 PolarHBondContact O-N 3.01Å; D215-L218 WeakPolarHBondContact O-CB 3.16Å; D215-L218 PolarHBondContact O-N 2.96Å; D215-L218 VanDerWaalsContact O-N 3.11Å; L216-L218 VanDerWaalsContact C-N 3.35Å; L218-D221 PolarHBondContact O-N 3.09Å; L218-Q222 VanDerWaalsContact O-CG 3.29Å; L218-Q222 WeakPolarHBondContact O-CG 3.49Å; L218-Q222 PolarHBondContact O-N 2.83Å
219	E	92.6	Very high	89.6	Confident	109 Å²	109	98.9 Å²	98.9	51%	0.509	49%	0.493	S	S	.	.	H	α-helix	trans	-62.5	-45.9	171.1	-70.1	-177.7	177.6	0	0	111.6	D215 L216 D221 Q222 L223	D215-E219 PolarHBondContact O-N 3Å; L216-E219 PolarHBondContact O-N 2.84Å; E219-D221 VanDerWaalsContact C-N 3.31Å; E219-D221 PolarHBondContact O-N 2.93Å; E219-Q222 PolarHBondContact O-N 2.87Å; E219-L223 WeakPolarHBondContact O-CB 3.29Å; E219-L223 WeakPolarHBondContact O-CG 3.49Å; E219-L223 PolarHBondContact O-N 2.9Å
220	I	86.9	Confident	89.8	Confident	79 Å²	79	100.9 Å²	100.9	41%	0.405	50%	0.501	S	S	.	.	H	α-helix	trans	-58.7	-41.7	175.9	-75.2	166	0	0	0	111.3	L216 Q217 L223 K224	L216-I220 WeakPolarHBondContact O-CB 3.3Å; L216-I220 VanDerWaalsContact O-CG1 3.26Å; L216-I220 WeakPolarHBondContact O-CG1 3.39Å; L216-I220 PolarHBondContact O-N 2.82Å; Q217-I220 PolarHBondContact O-N 3Å; I220-L223 PolarHBondContact O-N 3.03Å; I220-K224 HydrophobicContact CG2-CD 4.4Å; I220-K224 VanDerWaalsContact CG2-CE 3.48Å; I220-K224 WeakPolarHBondContact O-CG 3.38Å; I220-K224 PolarHBondContact O-N 2.97Å
221	D	88.9	Confident	89.7	Confident	69 Å²	69	100.7 Å²	100.7	37%	0.369	49%	0.494	S	S	.	.	H	α-helix	trans	-76.5	-28.7	-179.2	-66.9	-32.5	0	0	0	112.8	Q217 L218 E219 K224 H225	Q217-D221 PolarHBondContact NE2-OD1 3.01Å; Q217-D221 VanDerWaalsContact NE2-OD1 3.09Å; Q217-D221 PolarHBondContact NE2-OD2 2.95Å; Q217-D221 WeakPolarHBondContact O-CB 3.3Å; Q217-D221 VanDerWaalsContact O-CG 3.29Å; Q217-D221 PolarHBondContact O-N 3.32Å; L218-D221 PolarHBondContact O-N 3.09Å; E219-D221 VanDerWaalsContact C-N 3.31Å; E219-D221 PolarHBondContact O-N 2.93Å; D221-K224 WeakPolarHBondContact OD1-CD 3.45Å; D221-K224 WeakPolarHBondContact OD1-CE 3.49Å; D221-K224 IonicContact OD1-NZ 2.66Å; D221-K224 PolarHBondContact OD1-NZ 3.26Å; D221-H225 PolarHBondContact O-N 2.84Å
222	Q	92.6	Very high	89.7	Confident	129 Å²	129	100.6 Å²	100.6	60%	0.603	49%	0.493	S	S	*	.	H	α-helix	trans	-64.1	-45	165.1	-73.2	172.4	46.8	0	0	111.6	L218 E219 K224 H225 T226	L218-Q222 VanDerWaalsContact O-CG 3.29Å; L218-Q222 WeakPolarHBondContact O-CG 3.49Å; L218-Q222 PolarHBondContact O-N 2.83Å; E219-Q222 PolarHBondContact O-N 2.87Å; Q222-K224 PolarHBondContact O-N 3.48Å; Q222-H225 WeakPolarHBondContact O-CB 3.35Å; Q222-H225 PolarHBondContact O-N 2.97Å; Q222-H225 VanDerWaalsContact O-N 3.09Å; Q222-T226 PolarHBondContact O-N 3.12Å; Q222-T226 PolarHBondContact O-OG1 3.22Å
223	L	90.8	Very high	89.4	Confident	115 Å²	115	98.2 Å²	98.2	60%	0.602	49%	0.488	S	S	*	.	H	α-helix	trans	-65.5	-35	177.4	-71.4	170.3	0	0	0	112.6	E219 I220 T226 L227	E219-L223 WeakPolarHBondContact O-CB 3.29Å; E219-L223 WeakPolarHBondContact O-CG 3.49Å; E219-L223 PolarHBondContact O-N 2.9Å; I220-L223 PolarHBondContact O-N 3.03Å; L223-T226 PolarHBondContact O-OG1 3.45Å; L223-T226 VanDerWaalsContact O-OG1 3.09Å; L223-L227 WeakPolarHBondContact O-CB 3.37Å; L223-L227 PolarHBondContact O-N 3.41Å
224	K	87.8	Confident	89.3	Confident	100 Å²	100	97 Å²	97	44%	0.435	48%	0.479	S	S	.	.	H	α-helix	trans	-64.9	-38.4	169.2	-72.2	170.9	-165	158.6	0	111.9	I220 D221 Q222 N228	I220-K224 HydrophobicContact CG2-CD 4.4Å; I220-K224 VanDerWaalsContact CG2-CE 3.48Å; I220-K224 WeakPolarHBondContact O-CG 3.38Å; I220-K224 PolarHBondContact O-N 2.97Å; D221-K224 WeakPolarHBondContact OD1-CD 3.45Å; D221-K224 WeakPolarHBondContact OD1-CE 3.49Å; D221-K224 IonicContact OD1-NZ 2.66Å; D221-K224 PolarHBondContact OD1-NZ 3.26Å; Q222-K224 PolarHBondContact O-N 3.48Å; K224-N228 VanDerWaalsContact O-CB 3.29Å; K224-N228 WeakPolarHBondContact O-CB 3.33Å; K224-N228 VanDerWaalsContact O-CG 3.27Å; K224-N228 PolarHBondContact O-N 2.69Å; K224-N228 PolarHBondContact O-ND2 3.41Å
225	H	91.7	Very high	89	Confident	136 Å²	136	92.7 Å²	92.7	63%	0.63	47%	0.465	S	S	*	.	H	α-helix	trans	-67.8	-43	178.6	-176.4	67.4	0	0	0	111.8	D221 Q222 K229	D221-H225 PolarHBondContact O-N 2.84Å; Q222-H225 WeakPolarHBondContact O-CB 3.35Å; Q222-H225 PolarHBondContact O-N 2.97Å; Q222-H225 VanDerWaalsContact O-N 3.09Å; H225-K229 WeakPolarHBondContact O-CB 3.33Å; H225-K229 PolarHBondContact O-N 3.31Å
226	T	92	Very high	88.4	Confident	76 Å²	76	93.7 Å²	93.7	47%	0.466	47%	0.468	S	S	.	.	H	α-helix	trans	-67.3	-40	174.6	56.4	0	0	0	0	112	Q222 L223 K229 V230	Q222-T226 PolarHBondContact O-N 3.12Å; Q222-T226 PolarHBondContact O-OG1 3.22Å; L223-T226 PolarHBondContact O-OG1 3.45Å; L223-T226 VanDerWaalsContact O-OG1 3.09Å; T226-K229 PolarHBondContact O-N 2.94Å; T226-V230 WeakPolarHBondContact O-CG2 3.16Å; T226-V230 PolarHBondContact O-N 2.98Å
227	L	88.4	Confident	87.8	Confident	98 Å²	98	94.6 Å²	94.6	51%	0.513	47%	0.47	S	S	.	.	H	α-helix	trans	-60.4	-50.2	173.4	179.4	62.1	0	0	0	111.8	L223 K229 V230 E231	L223-L227 WeakPolarHBondContact O-CB 3.37Å; L223-L227 PolarHBondContact O-N 3.41Å; L227-K229 VanDerWaalsContact C-N 3.27Å; L227-K229 PolarHBondContact O-N 3.33Å; L227-V230 PolarHBondContact O-N 3.01Å; L227-E231 WeakPolarHBondContact O-CB 3.42Å; L227-E231 PolarHBondContact O-N 3.36Å
228	N	88.1	Confident	87.4	Confident	92 Å²	92	99 Å²	99	49%	0.492	48%	0.483	S	S	.	.	H	α-helix	trans	-58.7	-39	176.9	-79.5	-20.8	0	0	0	112	K224 E231 E232	K224-N228 VanDerWaalsContact O-CB 3.29Å; K224-N228 WeakPolarHBondContact O-CB 3.33Å; K224-N228 VanDerWaalsContact O-CG 3.27Å; K224-N228 PolarHBondContact O-N 2.69Å; K224-N228 PolarHBondContact O-ND2 3.41Å; N228-E231 PolarHBondContact O-N 2.94Å; N228-E232 PolarHBondContact O-N 2.94Å
229	K	92.5	Very high	87	Confident	120 Å²	120	102.1 Å²	102.1	52%	0.522	49%	0.488	S	S	.	.	H	α-helix	trans	-61.7	-50.6	175.2	179.2	-177.5	165.4	-176	0	111.2	H225 T226 L227 E231 E232 E233	H225-K229 WeakPolarHBondContact O-CB 3.33Å; H225-K229 PolarHBondContact O-N 3.31Å; T226-K229 PolarHBondContact O-N 2.94Å; L227-K229 VanDerWaalsContact C-N 3.27Å; L227-K229 PolarHBondContact O-N 3.33Å; K229-E231 VanDerWaalsContact C-N 3.29Å; K229-E231 PolarHBondContact O-N 3.37Å; K229-E232 PolarHBondContact O-N 3.5Å; K229-E233 WeakPolarHBondContact CE-OE1 3.35Å; K229-E233 IonicContact NZ-OE1 3.58Å; K229-E233 WeakPolarHBondContact O-CG 3.4Å; K229-E233 PolarHBondContact O-N 3.24Å
230	V	89.4	Confident	86.3	Confident	86 Å²	86	102.4 Å²	102.4	52%	0.521	49%	0.49	S	S	.	.	H	α-helix	trans	-65.1	-33.5	178.7	172.9	0	0	0	0	111.6	T226 L227 C234	T226-V230 WeakPolarHBondContact O-CG2 3.16Å; T226-V230 PolarHBondContact O-N 2.98Å; L227-V230 PolarHBondContact O-N 3.01Å; V230-C234 VanDerWaalsContact O-CB 3.29Å; V230-C234 WeakPolarHBondContact O-CB 3.33Å; V230-C234 PolarHBondContact O-N 2.94Å
231	E	86.3	Confident	85.8	Confident	82 Å²	82	101.9 Å²	101.9	38%	0.383	49%	0.493	S	S	.	.	H	α-helix	trans	-64.6	-45.7	172	-87.3	-160.3	-161	0	0	112.8	L227 N228 K229 C234 K235	L227-E231 WeakPolarHBondContact O-CB 3.42Å; L227-E231 PolarHBondContact O-N 3.36Å; N228-E231 PolarHBondContact O-N 2.94Å; K229-E231 VanDerWaalsContact C-N 3.29Å; K229-E231 PolarHBondContact O-N 3.37Å; E231-C234 PolarHBondContact O-N 3.08Å; E231-K235 WeakPolarHBondContact O-CB 2.88Å; E231-K235 WeakPolarHBondContact O-CD 3.5Å; E231-K235 WeakPolarHBondContact O-CG 3.4Å; E231-K235 PolarHBondContact O-N 2.99Å; E231-K235 WeakPolarHBondContact OE2-CE 3.42Å; E231-K235 IonicContact OE2-NZ 2.89Å; E231-K235 PolarHBondContact OE2-NZ 3.26Å
232	E	87.8	Confident	85.3	Confident	90 Å²	90	103.6 Å²	103.6	42%	0.421	50%	0.502	S	S	.	.	H	α-helix	trans	-68.6	-37.3	176.9	-69.6	-51.3	127.6	0	0	111.9	N228 K229 C234 K235 M236	N228-E232 PolarHBondContact O-N 2.94Å; K229-E232 PolarHBondContact O-N 3.5Å; E232-C234 PolarHBondContact O-N 3.47Å; E232-K235 PolarHBondContact O-N 2.84Å; E232-K235 WeakPolarHBondContact OE1-CD 3.43Å; E232-K235 WeakPolarHBondContact OE1-CE 3.2Å; E232-K235 IonicContact OE1-NZ 3.75Å; E232-K235 PolarHBondContact OE1-NZ 2.98Å; E232-M236 WeakPolarHBondContact O-CB 3.13Å; E232-M236 VanDerWaalsContact O-CG 3.23Å; E232-M236 WeakPolarHBondContact O-CG 3.3Å; E232-M236 PolarHBondContact O-N 3.46Å
233	E	86.4	Confident	84.8	Confident	98 Å²	98	103.8 Å²	103.8	46%	0.458	50%	0.501	S	S	.	.	H	α-helix	trans	-57.5	-48.1	169.3	-73.1	168.7	169	0	0	110.4	K229 K235 M236 E237	K229-E233 WeakPolarHBondContact CE-OE1 3.35Å; K229-E233 IonicContact NZ-OE1 3.58Å; K229-E233 WeakPolarHBondContact O-CG 3.4Å; K229-E233 PolarHBondContact O-N 3.24Å; E233-K235 PolarHBondContact O-N 2.67Å; E233-M236 PolarHBondContact O-N 3.19Å; E233-E237 PolarHBondContact O-N 3.27Å
234	C	80.9	Confident	83.9	Confident	53 Å²	53	103.5 Å²	103.5	36%	0.358	50%	0.499	S	S	.	.	H	α-helix	trans	-64.3	-36.9	175.8	-170.5	0	0	0	0	113.5	V230 E231 E232 E237 R238	V230-C234 VanDerWaalsContact O-CB 3.29Å; V230-C234 WeakPolarHBondContact O-CB 3.33Å; V230-C234 PolarHBondContact O-N 2.94Å; E231-C234 PolarHBondContact O-N 3.08Å; E232-C234 PolarHBondContact O-N 3.47Å; C234-E237 PolarHBondContact O-N 3.11Å; C234-R238 WeakPolarHBondContact O-CB 3.35Å; C234-R238 VanDerWaalsContact O-CG 3.23Å; C234-R238 WeakPolarHBondContact O-CG 3.36Å; C234-R238 PolarHBondContact O-N 3.37Å; C234-R238 PolarHBondContact SG-NE 2.88Å
235	K	86.2	Confident	83.3	Confident	70 Å²	70	103.9 Å²	103.9	30%	0.304	50%	0.501	S	S	.	.	H	α-helix	trans	-67.9	-37.1	174.9	-71.2	158.3	-160.2	167.1	0	111.3	E231 E232 E233 R239	E231-K235 WeakPolarHBondContact O-CB 2.88Å; E231-K235 WeakPolarHBondContact O-CD 3.5Å; E231-K235 WeakPolarHBondContact O-CG 3.4Å; E231-K235 PolarHBondContact O-N 2.99Å; E231-K235 WeakPolarHBondContact OE2-CE 3.42Å; E231-K235 IonicContact OE2-NZ 2.89Å; E231-K235 PolarHBondContact OE2-NZ 3.26Å; E232-K235 PolarHBondContact O-N 2.84Å; E232-K235 WeakPolarHBondContact OE1-CD 3.43Å; E232-K235 WeakPolarHBondContact OE1-CE 3.2Å; E232-K235 IonicContact OE1-NZ 3.75Å; E232-K235 PolarHBondContact OE1-NZ 2.98Å; E233-K235 PolarHBondContact O-N 2.67Å; K235-R239 WeakPolarHBondContact O-CB 3.38Å; K235-R239 VanDerWaalsContact O-CG 3.22Å; K235-R239 WeakPolarHBondContact O-CG 3.48Å; K235-R239 PolarHBondContact O-N 2.77Å
236	M	78.8	Confident	82.6	Confident	98 Å²	98	101.2 Å²	101.2	48%	0.483	49%	0.491	S	S	.	.	H	α-helix	trans	-68.7	-42	174.6	-71.3	-65	-74.8	0	0	111.4	E232 E233 R239 Q240	E232-M236 WeakPolarHBondContact O-CB 3.13Å; E232-M236 VanDerWaalsContact O-CG 3.23Å; E232-M236 WeakPolarHBondContact O-CG 3.3Å; E232-M236 PolarHBondContact O-N 3.46Å; E233-M236 PolarHBondContact O-N 3.19Å; M236-R239 WeakPolarHBondContact O-CB 3.48Å; M236-R239 PolarHBondContact O-N 2.68Å; M236-Q240 PolarHBondContact O-N 3.03Å
237	E	77.2	Confident	81.9	Confident	115 Å²	115	101.3 Å²	101.3	54%	0.537	49%	0.489	S	S	.	.	H	α-helix	trans	-59.6	-50.2	173.9	-151.4	64.6	-166.9	0	0	110.9	E233 C234 R239 Q240 S241	E233-E237 PolarHBondContact O-N 3.27Å; C234-E237 PolarHBondContact O-N 3.11Å; E237-R239 VanDerWaalsContact C-N 3.28Å; E237-R239 PolarHBondContact O-N 3.24Å; E237-Q240 WeakPolarHBondContact O-CA 3.36Å; E237-Q240 WeakPolarHBondContact O-CB 3.49Å; E237-Q240 PolarHBondContact O-N 3.04Å; E237-S241 PolarHBondContact O-N 2.82Å; E237-S241 PolarHBondContact O-OG 3.11Å; E237-S241 VanDerWaalsContact O-OG 3.05Å
238	R	79.5	Confident	80.9	Confident	175 Å²	175	101.5 Å²	101.5	66%	0.66	49%	0.489	S	S	*	.	H	α-helix	trans	-58.5	-35.8	174.6	-72.2	171.8	-173.2	-174.1	4.4	112.9	C234 L242	C234-R238 WeakPolarHBondContact O-CB 3.35Å; C234-R238 VanDerWaalsContact O-CG 3.23Å; C234-R238 WeakPolarHBondContact O-CG 3.36Å; C234-R238 PolarHBondContact O-N 3.37Å; C234-R238 PolarHBondContact SG-NE 2.88Å; R238-L242 VanDerWaalsContact O-CB 3.28Å; R238-L242 WeakPolarHBondContact O-CB 3.4Å; R238-L242 PolarHBondContact O-N 2.8Å
239	R	82.3	Confident	79.8	Confident	154 Å²	154	103.3 Å²	103.3	58%	0.581	50%	0.495	S	S	*	.	H	α-helix	trans	-68.2	-38.3	174.1	-77.1	167.7	179.7	167.8	2.9	111.8	K235 M236 E237 K243	K235-R239 WeakPolarHBondContact O-CB 3.38Å; K235-R239 VanDerWaalsContact O-CG 3.22Å; K235-R239 WeakPolarHBondContact O-CG 3.48Å; K235-R239 PolarHBondContact O-N 2.77Å; M236-R239 WeakPolarHBondContact O-CB 3.48Å; M236-R239 PolarHBondContact O-N 2.68Å; E237-R239 VanDerWaalsContact C-N 3.28Å; E237-R239 PolarHBondContact O-N 3.24Å; R239-K243 WeakPolarHBondContact O-CB 3.36Å; R239-K243 PolarHBondContact O-N 3.33Å
240	Q	78.2	Confident	78.4	Confident	115 Å²	115	101.8 Å²	101.8	54%	0.537	50%	0.499	S	S	.	.	H	α-helix	trans	-65.1	-46	172.4	-68.1	-169	52.2	0	0	111.3	M236 E237 L242 K243 L244	M236-Q240 PolarHBondContact O-N 3.03Å; E237-Q240 WeakPolarHBondContact O-CA 3.36Å; E237-Q240 WeakPolarHBondContact O-CB 3.49Å; E237-Q240 PolarHBondContact O-N 3.04Å; Q240-L242 PolarHBondContact O-N 2.97Å; Q240-K243 PolarHBondContact O-N 2.86Å; Q240-L244 PolarHBondContact O-N 3.36Å
241	S	76.6	Confident	77.1	Confident	69 Å²	69	106.1 Å²	106.1	48%	0.483	51%	0.506	S	S	.	.	H	α-helix	trans	-60.6	-42	175.6	-44.9	0	0	0	0	112.3	E237 L244 K245	E237-S241 PolarHBondContact O-N 2.82Å; E237-S241 PolarHBondContact O-OG 3.11Å; E237-S241 VanDerWaalsContact O-OG 3.05Å; S241-L244 PolarHBondContact O-N 2.98Å; S241-K245 WeakPolarHBondContact O-CB 2.98Å; S241-K245 PolarHBondContact O-N 3.19Å
242	L	78.4	Confident	75.7	Confident	104 Å²	104	106.4 Å²	106.4	55%	0.545	52%	0.515	S	S	.	.	H	α-helix	trans	-67.1	-37.9	176.6	-164.1	80.5	0	0	0	111.6	R238 Q240 K245 N246	R238-L242 VanDerWaalsContact O-CB 3.28Å; R238-L242 WeakPolarHBondContact O-CB 3.4Å; R238-L242 PolarHBondContact O-N 2.8Å; Q240-L242 PolarHBondContact O-N 2.97Å; L242-K245 PolarHBondContact O-N 2.78Å; L242-N246 VanDerWaalsContact O-CG 3.22Å; L242-N246 PolarHBondContact O-N 2.94Å; L242-N246 PolarHBondContact O-OD1 2.93Å
243	K	80.8	Confident	74.4	Confident	134 Å²	134	108.7 Å²	108.7	58%	0.583	52%	0.524	S	S	*	.	H	α-helix	trans	-64.3	-49.8	174.2	-168	-165.4	170.8	-163.5	0	110.8	R239 Q240 K245 N246 D247	R239-K243 WeakPolarHBondContact O-CB 3.36Å; R239-K243 PolarHBondContact O-N 3.33Å; Q240-K243 PolarHBondContact O-N 2.86Å; K243-K245 VanDerWaalsContact C-N 3.25Å; K243-K245 PolarHBondContact O-N 2.86Å; K243-N246 CarbonylContact O-C 3.58Å; K243-N246 PolarHBondContact O-N 2.91Å; K243-D247 VanDerWaalsContact CE-OD2 3.31Å; K243-D247 WeakPolarHBondContact CE-OD2 3.5Å; K243-D247 IonicContact NZ-OD2 2.77Å; K243-D247 WeakPolarHBondContact O-CB 3.33Å; K243-D247 PolarHBondContact O-N 2.95Å
244	L	73	Confident	73.1	Confident	109 Å²	109	113.8 Å²	113.8	57%	0.571	54%	0.539	S	S	*	.	H	α-helix	trans	-54.7	-42.2	174.4	-81.6	162.2	0	0	0	111.8	Q240 S241 D247 I248	Q240-L244 PolarHBondContact O-N 3.36Å; S241-L244 PolarHBondContact O-N 2.98Å; L244-D247 PolarHBondContact O-N 3.19Å; L244-I248 WeakPolarHBondContact O-CD1 3.41Å; L244-I248 VanDerWaalsContact O-CG1 3.24Å; L244-I248 WeakPolarHBondContact O-CG1 3.47Å; L244-I248 PolarHBondContact O-N 2.88Å
245	K	75.6	Confident	72	Confident	108 Å²	108	117.7 Å²	117.7	47%	0.47	55%	0.552	S	S	.	*	H	α-helix	trans	-61	-47.4	174	-178	179.4	170.3	-177.6	0	111.9	S241 L242 K243 D247 I248 E249	S241-K245 WeakPolarHBondContact O-CB 2.98Å; S241-K245 PolarHBondContact O-N 3.19Å; L242-K245 PolarHBondContact O-N 2.78Å; K243-K245 VanDerWaalsContact C-N 3.25Å; K243-K245 PolarHBondContact O-N 2.86Å; K245-D247 VanDerWaalsContact C-N 3.34Å; K245-D247 PolarHBondContact O-N 3.4Å; K245-I248 WeakPolarHBondContact O-CB 3.37Å; K245-I248 PolarHBondContact O-N 3.12Å; K245-I248 VanDerWaalsContact O-N 3.14Å; K245-E249 WeakPolarHBondContact CE-OE1 3.44Å; K245-E249 HydrophobicContact CG-CG 4.48Å; K245-E249 IonicContact NZ-OE1 3.65Å; K245-E249 PolarHBondContact NZ-OE1 3.35Å; K245-E249 VanDerWaalsContact NZ-OE1 3.14Å; K245-E249 PolarHBondContact O-N 3.37Å
246	N	75.4	Confident	70.6	Confident	79 Å²	79	119.5 Å²	119.5	42%	0.422	56%	0.561	S	S	.	*	H	α-helix	trans	-66	-36	178	-66.7	-5.8	0	0	0	112.1	L242 K243 I248 E249 S250	L242-N246 VanDerWaalsContact O-CG 3.22Å; L242-N246 PolarHBondContact O-N 2.94Å; L242-N246 PolarHBondContact O-OD1 2.93Å; K243-N246 CarbonylContact O-C 3.58Å; K243-N246 PolarHBondContact O-N 2.91Å; N246-I248 PolarHBondContact O-N 2.95Å; N246-E249 PolarHBondContact O-N 2.85Å; N246-S250 WeakPolarHBondContact O-CB 3.37Å; N246-S250 PolarHBondContact O-N 3.31Å; N246-S250 PolarHBondContact O-OG 2.85Å
247	D	77.1	Confident	69.8	Low	78 Å²	78	118.3 Å²	118.3	42%	0.417	56%	0.556	S	S	.	*	H	α-helix	trans	-70.7	-15.9	175.3	-64.7	-14	0	0	0	111.9	K243 L244 K245	K243-D247 VanDerWaalsContact CE-OD2 3.31Å; K243-D247 WeakPolarHBondContact CE-OD2 3.5Å; K243-D247 IonicContact NZ-OD2 2.77Å; K243-D247 WeakPolarHBondContact O-CB 3.33Å; K243-D247 PolarHBondContact O-N 2.95Å; L244-D247 PolarHBondContact O-N 3.19Å; K245-D247 VanDerWaalsContact C-N 3.34Å; K245-D247 PolarHBondContact O-N 3.4Å
248	I	69.5	Low	69.1	Low	103 Å²	103	119.1 Å²	119.1	53%	0.528	56%	0.558	S	S	.	*	H	α-helix	trans	-89.2	-47.1	169.3	-69.8	162.9	0	0	0	110.9	L244 K245 N246 S250 R251	L244-I248 WeakPolarHBondContact O-CD1 3.41Å; L244-I248 VanDerWaalsContact O-CG1 3.24Å; L244-I248 WeakPolarHBondContact O-CG1 3.47Å; L244-I248 PolarHBondContact O-N 2.88Å; K245-I248 WeakPolarHBondContact O-CB 3.37Å; K245-I248 PolarHBondContact O-N 3.12Å; K245-I248 VanDerWaalsContact O-N 3.14Å; N246-I248 PolarHBondContact O-N 2.95Å; I248-S250 VanDerWaalsContact C-N 3.27Å; I248-S250 PolarHBondContact O-N 2.93Å; I248-R251 WeakPolarHBondContact O-CB 3.45Å; I248-R251 WeakPolarHBondContact O-CG 3.49Å; I248-R251 PolarHBondContact O-N 3.3Å
249	E	64.3	Low	68.4	Low	129 Å²	129	116.8 Å²	116.8	60%	0.603	56%	0.555	S	S	*	*	H	α-helix	trans	-69.2	-20.7	179.5	-73.4	-176.2	167.5	0	0	113.5	K245 N246	K245-E249 WeakPolarHBondContact CE-OE1 3.44Å; K245-E249 HydrophobicContact CG-CG 4.48Å; K245-E249 IonicContact NZ-OE1 3.65Å; K245-E249 PolarHBondContact NZ-OE1 3.35Å; K245-E249 VanDerWaalsContact NZ-OE1 3.14Å; K245-E249 PolarHBondContact O-N 3.37Å; N246-E249 PolarHBondContact O-N 2.85Å
250	S	63.7	Low	67.5	Low	88 Å²	88	114.8 Å²	114.8	62%	0.615	56%	0.555	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.3	1.3	175.9	57.6	0	0	0	0	114.7	N246 I248	N246-S250 WeakPolarHBondContact O-CB 3.37Å; N246-S250 PolarHBondContact O-N 3.31Å; N246-S250 PolarHBondContact O-OG 2.85Å; I248-S250 VanDerWaalsContact C-N 3.27Å; I248-S250 PolarHBondContact O-N 2.93Å
251	R	61.7	Low	66.8	Low	177 Å²	177	114 Å²	114	67%	0.668	55%	0.551	S	S	*	*	S	Bend	trans	-62.8	141	169	-67.5	179.3	175.9	-161.9	-2.8	110	I248 K253	I248-R251 WeakPolarHBondContact O-CB 3.45Å; I248-R251 WeakPolarHBondContact O-CG 3.49Å; I248-R251 PolarHBondContact O-N 3.3Å; R251-K253 PolarHBondContact O-N 2.88Å
252	P	56.2	Low	66.6	Low	89 Å²	89	120.2 Å²	120.2	58%	0.578	56%	0.564	S	S	*	*	P	Polyproline II helix	trans	-57.8	137	177.6	24.2	-33.4	0	0	0	110.5	I257	P252-I257 HydrophobicContact CG-CD1 4.42Å
253	K	61.1	Low	66.2	Low	138 Å²	138	120.9 Å²	120.9	60%	0.6	56%	0.564	S	S	*	*	P	Polyproline II helix	trans	-64.7	141.8	-176.1	-69.2	-173.1	177.5	-174.3	0	110.2	R251 E255 Q256 I257	R251-K253 PolarHBondContact O-N 2.88Å; K253-E255 PolarHBondContact O-N 3.49Å; K253-Q256 PolarHBondContact O-N 3.11Å; K253-I257 PolarHBondContact O-N 3.44Å
254	R	58.5	Low	65.3	Low	205 Å²	205	119.1 Å²	119.1	77%	0.774	56%	0.562	S	S	*	*	H	α-helix	trans	-53.4	-31.2	-178.2	-157.1	174.2	-170.3	170.8	2.6	112.8	I257 F258	R254-I257 PolarHBondContact O-N 2.86Å; R254-F258 HydrophobicContact CG-CD2 4.5Å; R254-F258 PolarHBondContact O-N 2.8Å; R254-F258 VanDerWaalsContact O-N 3.13Å
255	E	58	Low	65.3	Low	135 Å²	135	118.8 Å²	118.8	63%	0.631	56%	0.557	S	S	*	*	H	α-helix	trans	-62.2	-45.1	174.8	-63	156.9	142.6	0	0	112.6	K253 I257 F258 E259	K253-E255 PolarHBondContact O-N 3.49Å; E255-I257 VanDerWaalsContact C-N 3.3Å; E255-I257 PolarHBondContact O-N 2.93Å; E255-F258 WeakPolarHBondContact O-CB 3.43Å; E255-F258 PolarHBondContact O-N 2.96Å; E255-E259 WeakPolarHBondContact O-CG 3.3Å; E255-E259 PolarHBondContact O-N 3.43Å
256	Q	56.1	Low	65.1	Low	107 Å²	107	118.2 Å²	118.2	50%	0.5	56%	0.557	S	S	.	*	H	α-helix	trans	-69.8	-27.9	180	-66.1	179.2	-44.9	0	0	112.5	K253 L260	K253-Q256 PolarHBondContact O-N 3.11Å; Q256-L260 WeakPolarHBondContact O-CG 3.48Å; Q256-L260 PolarHBondContact O-N 2.88Å; Q256-L260 VanDerWaalsContact O-N 3.14Å
257	I	62.4	Low	64.4	Low	73 Å²	73	119.4 Å²	119.4	37%	0.374	56%	0.563	S	S	.	*	H	α-helix	trans	-68.7	-48.6	172.1	-58.6	175.3	0	0	0	109.2	P252 K253 R254 E255 E259 L260 E261	P252-I257 HydrophobicContact CG-CD1 4.42Å; K253-I257 PolarHBondContact O-N 3.44Å; R254-I257 PolarHBondContact O-N 2.86Å; E255-I257 VanDerWaalsContact C-N 3.3Å; E255-I257 PolarHBondContact O-N 2.93Å; I257-E259 VanDerWaalsContact C-N 3.29Å; I257-E259 PolarHBondContact O-N 2.89Å; I257-L260 PolarHBondContact O-N 3.48Å; I257-E261 HydrophobicContact CG2-CG 4.46Å; I257-E261 WeakPolarHBondContact O-CG 3.48Å; I257-E261 PolarHBondContact O-N 3.31Å
258	F	62.5	Low	63.8	Low	133 Å²	133	121.2 Å²	121.2	58%	0.583	57%	0.567	S	S	*	*	H	α-helix	trans	-59.3	-35.6	175	-99.6	-77.3	0	0	0	113.5	R254 E255 R262	R254-F258 HydrophobicContact CG-CD2 4.5Å; R254-F258 PolarHBondContact O-N 2.8Å; R254-F258 VanDerWaalsContact O-N 3.13Å; E255-F258 WeakPolarHBondContact O-CB 3.43Å; E255-F258 PolarHBondContact O-N 2.96Å; F258-R262 VanDerWaalsContact O-CB 3.27Å; F258-R262 WeakPolarHBondContact O-CB 3.31Å; F258-R262 PolarHBondContact O-N 2.76Å
259	E	64.4	Low	63.9	Low	126 Å²	126	120.8 Å²	120.8	59%	0.589	57%	0.565	S	S	*	*	H	α-helix	trans	-67	-45.2	174.7	-73.2	177.9	142.4	0	0	111.7	E255 I257 R262 E263	E255-E259 WeakPolarHBondContact O-CG 3.3Å; E255-E259 PolarHBondContact O-N 3.43Å; I257-E259 VanDerWaalsContact C-N 3.29Å; I257-E259 PolarHBondContact O-N 2.89Å; E259-R262 PolarHBondContact O-N 3.15Å; E259-E263 PolarHBondContact O-N 2.92Å
260	L	63.6	Low	63.7	Low	111 Å²	111	119.5 Å²	119.5	58%	0.581	56%	0.557	S	S	*	*	H	α-helix	trans	-66.6	-34.7	176.3	-72.5	168.6	0	0	0	113.2	Q256 I257 N264	Q256-L260 WeakPolarHBondContact O-CG 3.48Å; Q256-L260 PolarHBondContact O-N 2.88Å; Q256-L260 VanDerWaalsContact O-N 3.14Å; I257-L260 PolarHBondContact O-N 3.48Å; L260-N264 WeakPolarHBondContact O-CB 3.42Å; L260-N264 PolarHBondContact O-N 3.04Å
261	E	64.1	Low	63.1	Low	100 Å²	100	120.9 Å²	120.9	47%	0.467	56%	0.557	S	S	.	*	H	α-helix	trans	-65.1	-43.6	171.9	-73.7	173.1	153.5	0	0	110.9	I257 E263 N264 E265	I257-E261 HydrophobicContact CG2-CG 4.46Å; I257-E261 WeakPolarHBondContact O-CG 3.48Å; I257-E261 PolarHBondContact O-N 3.31Å; E261-E263 PolarHBondContact O-N 3.47Å; E261-N264 WeakPolarHBondContact O-CA 3.27Å; E261-N264 VanDerWaalsContact O-CB 3.25Å; E261-N264 WeakPolarHBondContact O-CB 3.25Å; E261-N264 PolarHBondContact O-N 2.92Å; E261-N264 VanDerWaalsContact O-N 3.13Å; E261-E265 PolarHBondContact O-N 2.66Å
262	R	71.9	Confident	62.8	Low	199 Å²	199	119.4 Å²	119.4	75%	0.751	56%	0.558	S	S	*	*	H	α-helix	trans	-65.9	-35.4	177	-168.2	-179.6	-170.1	-173.1	4.1	113.1	F258 E259 M266	F258-R262 VanDerWaalsContact O-CB 3.27Å; F258-R262 WeakPolarHBondContact O-CB 3.31Å; F258-R262 PolarHBondContact O-N 2.76Å; E259-R262 PolarHBondContact O-N 3.15Å; R262-M266 PolarHBondContact O-N 3.36Å; R262-M266 VanDerWaalsContact O-N 3.08Å
263	E	71.3	Confident	62.5	Low	117 Å²	117	121.2 Å²	121.2	55%	0.547	56%	0.559	S	S	.	*	H	α-helix	trans	-67	-39.1	170.2	-72.9	-167.9	149.9	0	0	111.8	E259 E261 M266 L267	E259-E263 PolarHBondContact O-N 2.92Å; E261-E263 PolarHBondContact O-N 3.47Å; E263-M266 PolarHBondContact O-N 2.8Å; E263-L267 WeakPolarHBondContact O-CB 3.36Å; E263-L267 VanDerWaalsContact O-CG 3.28Å; E263-L267 WeakPolarHBondContact O-CG 3.47Å; E263-L267 PolarHBondContact O-N 3.1Å
264	N	60.3	Low	61.8	Low	98 Å²	98	121.8 Å²	121.8	52%	0.524	57%	0.568	S	S	.	*	H	α-helix	trans	-59.3	-46.3	173.1	-121.2	-65.6	0	0	0	112	L260 E261 M266 L267 K268	L260-N264 WeakPolarHBondContact O-CB 3.42Å; L260-N264 PolarHBondContact O-N 3.04Å; E261-N264 WeakPolarHBondContact O-CA 3.27Å; E261-N264 VanDerWaalsContact O-CB 3.25Å; E261-N264 WeakPolarHBondContact O-CB 3.25Å; E261-N264 PolarHBondContact O-N 2.92Å; E261-N264 VanDerWaalsContact O-N 3.13Å; N264-M266 VanDerWaalsContact C-N 3.34Å; N264-M266 PolarHBondContact O-N 2.78Å; N264-L267 PolarHBondContact O-N 3.05Å; N264-K268 WeakPolarHBondContact O-CG 3.43Å; N264-K268 PolarHBondContact O-N 2.75Å
265	E	74.2	Confident	61.1	Low	101 Å²	101	120.1 Å²	120.1	47%	0.472	57%	0.569	S	S	.	*	H	α-helix	trans	-60.2	-43.3	175.9	-131.9	72.5	-92	0	0	111.5	E261 L267 K268 I269	E261-E265 PolarHBondContact O-N 2.66Å; E265-L267 VanDerWaalsContact C-N 3.32Å; E265-L267 PolarHBondContact O-N 3.29Å; E265-K268 PolarHBondContact O-N 2.68Å; E265-K268 WeakPolarHBondContact OE1-CD 3.26Å; E265-K268 WeakPolarHBondContact OE1-CE 3.48Å; E265-K268 IonicContact OE1-NZ 3.24Å; E265-K268 PolarHBondContact OE1-NZ 3.03Å; E265-I269 WeakPolarHBondContact O-CG1 3.28Å; E265-I269 PolarHBondContact O-N 2.86Å; E265-I269 VanDerWaalsContact O-N 3.1Å
266	M	70.4	Confident	60.4	Low	96 Å²	96	118 Å²	118	47%	0.473	57%	0.569	S	S	.	*	H	α-helix	trans	-65.5	-33.5	176.5	-162.5	-160.6	-57.1	0	0	112.7	R262 E263 N264 K270	R262-M266 PolarHBondContact O-N 3.36Å; R262-M266 VanDerWaalsContact O-N 3.08Å; E263-M266 PolarHBondContact O-N 2.8Å; N264-M266 VanDerWaalsContact C-N 3.34Å; N264-M266 PolarHBondContact O-N 2.78Å; M266-K270 WeakPolarHBondContact O-CG 3.39Å; M266-K270 PolarHBondContact O-N 3.4Å; M266-K270 VanDerWaalsContact O-N 3.14Å; M266-K270 PolarHBondContact SD-NZ 2.95Å
267	L	61.9	Low	59.9	Low	104 Å²	104	119.8 Å²	119.8	55%	0.545	58%	0.58	S	S	.	*	H	α-helix	trans	-72.1	-37	175.9	-73.9	166.4	0	0	0	112.1	E263 N264 E265 K270 L271	E263-L267 WeakPolarHBondContact O-CB 3.36Å; E263-L267 VanDerWaalsContact O-CG 3.28Å; E263-L267 WeakPolarHBondContact O-CG 3.47Å; E263-L267 PolarHBondContact O-N 3.1Å; N264-L267 PolarHBondContact O-N 3.05Å; E265-L267 VanDerWaalsContact C-N 3.32Å; E265-L267 PolarHBondContact O-N 3.29Å; L267-K270 PolarHBondContact O-N 2.95Å; L267-L271 PolarHBondContact O-N 3.24Å
268	K	63.9	Low	58.8	Low	116 Å²	116	124.4 Å²	124.4	50%	0.504	60%	0.604	S	S	.	*	H	α-helix	trans	-60.7	-47	170.6	-68.6	175.9	-164.2	162.9	0	111.7	N264 E265 K270 L271 Q272	N264-K268 WeakPolarHBondContact O-CG 3.43Å; N264-K268 PolarHBondContact O-N 2.75Å; E265-K268 PolarHBondContact O-N 2.68Å; E265-K268 WeakPolarHBondContact OE1-CD 3.26Å; E265-K268 WeakPolarHBondContact OE1-CE 3.48Å; E265-K268 IonicContact OE1-NZ 3.24Å; E265-K268 PolarHBondContact OE1-NZ 3.03Å; K268-K270 VanDerWaalsContact C-N 3.33Å; K268-K270 PolarHBondContact O-N 3.14Å; K268-L271 WeakPolarHBondContact O-CB 3.42Å; K268-L271 PolarHBondContact O-N 2.95Å; K268-L271 VanDerWaalsContact O-N 3.15Å; K268-Q272 PolarHBondContact O-N 3.38Å
269	I	70.8	Confident	57.7	Low	95 Å²	95	126.9 Å²	126.9	49%	0.487	62%	0.617	S	S	.	*	H	α-helix	trans	-59.9	-44.2	179.5	-67.5	165.4	0	0	0	110.7	E265 L271 Q272 E273	E265-I269 WeakPolarHBondContact O-CG1 3.28Å; E265-I269 PolarHBondContact O-N 2.86Å; E265-I269 VanDerWaalsContact O-N 3.1Å; I269-L271 VanDerWaalsContact C-N 3.35Å; I269-L271 PolarHBondContact O-N 2.91Å; I269-Q272 WeakPolarHBondContact O-CB 3.45Å; I269-Q272 PolarHBondContact O-N 3.45Å; I269-Q272 VanDerWaalsContact O-N 3.13Å; I269-E273 PolarHBondContact O-N 3.19Å
270	K	61	Low	56.6	Low	102 Å²	102	126.7 Å²	126.7	44%	0.443	63%	0.627	S	S	.	*	H	α-helix	trans	-65.9	-32.7	176.4	-73.9	170	179.3	168.6	0	113.6	M266 L267 K268 L274	M266-K270 WeakPolarHBondContact O-CG 3.39Å; M266-K270 PolarHBondContact O-N 3.4Å; M266-K270 VanDerWaalsContact O-N 3.14Å; M266-K270 PolarHBondContact SD-NZ 2.95Å; L267-K270 PolarHBondContact O-N 2.95Å; K268-K270 VanDerWaalsContact C-N 3.33Å; K268-K270 PolarHBondContact O-N 3.14Å; K270-L274 WeakPolarHBondContact O-CG 3.45Å; K270-L274 PolarHBondContact O-N 3.45Å
271	L	51.3	Low	55.3	Low	117 Å²	117	124.5 Å²	124.5	61%	0.613	63%	0.631	S	S	*	*	H	α-helix	trans	-65	-41.4	170.2	-93.4	165	0	0	0	111.5	L267 K268 I269 L274 Q275	L267-L271 PolarHBondContact O-N 3.24Å; K268-L271 WeakPolarHBondContact O-CB 3.42Å; K268-L271 PolarHBondContact O-N 2.95Å; K268-L271 VanDerWaalsContact O-N 3.15Å; I269-L271 VanDerWaalsContact C-N 3.35Å; I269-L271 PolarHBondContact O-N 2.91Å; L271-L274 PolarHBondContact O-N 3.35Å; L271-Q275 PolarHBondContact O-N 2.95Å
272	Q	54.5	Low	54.5	Low	145 Å²	145	125.9 Å²	125.9	68%	0.678	65%	0.649	S	S	*	*	H	α-helix	trans	-68.4	-39.9	179.8	-163.1	171.7	10.1	0	0	112.3	K268 I269 Q275	K268-Q272 PolarHBondContact O-N 3.38Å; I269-Q272 WeakPolarHBondContact O-CB 3.45Å; I269-Q272 PolarHBondContact O-N 3.45Å; I269-Q272 VanDerWaalsContact O-N 3.13Å; Q272-Q275 PolarHBondContact O-N 2.92Å
273	E	51.5	Low	52.9	Low	127 Å²	127	124 Å²	124	59%	0.593	65%	0.653	S	S	*	*	H	α-helix	trans	-60	-45.4	171.8	-73.1	-175.1	125	0	0	111.7	I269 Q275 S276	I269-E273 PolarHBondContact O-N 3.19Å; E273-Q275 PolarHBondContact O-N 2.96Å; E273-S276 WeakPolarHBondContact O-CB 3.38Å; E273-S276 PolarHBondContact O-N 3.3Å; E273-S276 PolarHBondContact O-OG 3.36Å
274	L	44.8	Very low	51.9	Low	151 Å²	151	124 Å²	124	79%	0.791	66%	0.663	S	S	*	*	H	α-helix	trans	-66.4	-15.1	-179.9	-76.4	170.9	0	0	0	114.4	K270 L271	K270-L274 WeakPolarHBondContact O-CG 3.45Å; K270-L274 PolarHBondContact O-N 3.45Å; L271-L274 PolarHBondContact O-N 3.35Å
275	Q	44.6	Very low	50.7	Low	170 Å²	170	124 Å²	124	79%	0.794	68%	0.677	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.9	5	-177.8	-151.3	162.8	9.7	0	0	113.4	L271 Q272 E273	L271-Q275 PolarHBondContact O-N 2.95Å; Q272-Q275 PolarHBondContact O-N 2.92Å; E273-Q275 PolarHBondContact O-N 2.96Å
276	S	43.8	Very low	50	Low	90 Å²	90	123.9 Å²	123.9	63%	0.629	69%	0.687	S	S	*	*			trans	-96.7	2	-166.8	68.2	0	0	0	0	116.9	E273	E273-S276 WeakPolarHBondContact O-CB 3.38Å; E273-S276 PolarHBondContact O-N 3.3Å; E273-S276 PolarHBondContact O-OG 3.36Å
277	I	45.4	Very low	49	Very low	145 Å²	145	125 Å²	125	74%	0.744	70%	0.695	S	S	*	*			trans	-122	98.8	-172	-53.4	178.8	0	0	0	112.4
278	I	39.1	Very low	48.6	Very low	169 Å²	169	127.3 Å²	127.3	87%	0.867	70%	0.701	S	S	*	*			trans	-166	142.6	150.5	-99.8	146.7	0	0	0	109.5
279	Q	38.9	Very low	48.4	Very low	185 Å²	185	124.4 Å²	124.4	86%	0.864	70%	0.698	S	S	*	*			trans	-117	154.3	174.8	-100.5	-172.4	40	0	0	109
280	P	42.4	Very low	47.8	Very low	122 Å²	122	124.5 Å²	124.5	79%	0.792	70%	0.699	S	S	*	*				-149.7	178.7	65.1	39.3	-18.3	0	0	0	117.2
281	G	34.9	Very low	47.9	Very low	66 Å²	66	125.5 Å²	125.5	68%	0.68	71%	0.708	S	S	*	*			trans	-102.3	-159.4	169.7	0	0	0	0	0	113.6
282	P	48.2	Very low	48.8	Very low	128 Å²	128	124.4 Å²	124.4	83%	0.831	70%	0.703	S	S	*	*			cis	-134.5	-176.2	9.5	42.9	-25.1	0	0	0	117.1
283	L	37.4	Very low	49.8	Very low	160 Å²	160	121.9 Å²	121.9	84%	0.838	69%	0.693	S	S	*	*			trans	-34.9	171.3	168.2	-69.9	166.5	0	0	0	119.4
284	P	50.8	Low	50.9	Low	117 Å²	117	120.7 Å²	120.7	76%	0.76	69%	0.69	S	S	*	*			cis	-135.1	159.6	-4.3	36	-18.6	0	0	0	117
285	A	34.8	Very low	52.4	Low	99 Å²	99	118.8 Å²	118.8	82%	0.818	68%	0.677	S	S	*	*			trans	-169.9	104.1	144.6	0	0	0	0	0	109.7
286	S	58.8	Low	54.1	Low	97 Å²	97	116.8 Å²	116.8	68%	0.678	67%	0.668	S	S	*	*			trans	-91.1	176.9	-172.1	66.9	0	0	0	0	114.1	K288	S286-K288 PolarHBondContact O-N 3.01Å
287	D	51.1	Low	56	Low	121 Å²	121	116.1 Å²	116.1	65%	0.647	66%	0.657	S	S	*	*	S	Bend	trans	86.2	-18.7	162.1	-53.8	9.9	0	0	0	118.5
288	K	52.3	Low	57.8	Low	152 Å²	152	114.8 Å²	114.8	66%	0.661	64%	0.643	S	S	*	*	S	Bend	trans	-91.7	-51.7	165.8	-165.7	179.5	176.4	-172.3	0	113.2	S286 I290 L291 D292	S286-K288 PolarHBondContact O-N 3.01Å; K288-I290 PolarHBondContact O-N 2.84Å; K288-L291 PolarHBondContact O-N 3.36Å; K288-D292 PolarHBondContact O-N 2.93Å
289	A	60	Low	59.8	Low	55 Å²	55	110.3 Å²	110.3	46%	0.455	62%	0.618	S	S	.	*	H	α-helix	trans	-59.3	-24.2	-175.2	0	0	0	0	0	114	L291 D292 I293	A289-L291 VanDerWaalsContact C-N 3.35Å; A289-D292 PolarHBondContact O-N 3.47Å; A289-I293 WeakPolarHBondContact O-CB 3.36Å; A289-I293 WeakPolarHBondContact O-CD1 3.44Å; A289-I293 WeakPolarHBondContact O-CG1 3.19Å; A289-I293 PolarHBondContact O-N 2.92Å
290	I	58.4	Low	61.9	Low	97 Å²	97	107 Å²	107	50%	0.497	60%	0.602	S	S	.	*	H	α-helix	trans	-67.5	-35.6	178.4	-59.9	173.4	0	0	0	111.3	K288 L294	K288-I290 PolarHBondContact O-N 2.84Å; I290-L294 HydrophobicContact CG2-CD1 4.09Å; I290-L294 WeakPolarHBondContact O-CB 3.09Å; I290-L294 VanDerWaalsContact O-CG 3.27Å; I290-L294 WeakPolarHBondContact O-CG 3.46Å; I290-L294 PolarHBondContact O-N 3.28Å; I290-L294 VanDerWaalsContact O-N 3.07Å
291	L	62.4	Low	63.8	Low	123 Å²	123	104 Å²	104	64%	0.644	59%	0.588	S	S	*	*	H	α-helix	trans	-73.1	-42.1	174.1	-74.1	168.8	0	0	0	111.2	K288 A289 I293 L294 E295	K288-L291 PolarHBondContact O-N 3.36Å; A289-L291 VanDerWaalsContact C-N 3.35Å; L291-I293 VanDerWaalsContact C-N 3.3Å; L291-I293 PolarHBondContact O-N 2.89Å; L291-L294 PolarHBondContact O-N 2.92Å; L291-E295 WeakPolarHBondContact O-CB 3.31Å; L291-E295 PolarHBondContact O-N 3.18Å
292	D	71	Confident	66	Low	93 Å²	93	104.3 Å²	104.3	50%	0.497	57%	0.574	S	S	.	*	H	α-helix	trans	-63	-36.6	177.9	-60.6	-36	0	0	0	111.4	K288 A289 H296	K288-D292 PolarHBondContact O-N 2.93Å; A289-D292 PolarHBondContact O-N 3.47Å; D292-H296 WeakPolarHBondContact O-CB 3.32Å; D292-H296 PolarHBondContact O-N 3.24Å; D292-H296 VanDerWaalsContact O-N 3.12Å
293	I	74.3	Confident	67.8	Low	93 Å²	93	103.7 Å²	103.7	48%	0.477	56%	0.56	S	S	.	*	H	α-helix	trans	-66.7	-52	172.2	-70	162.7	0	0	0	110.9	A289 L291 E295 H296 D297	A289-I293 WeakPolarHBondContact O-CB 3.36Å; A289-I293 WeakPolarHBondContact O-CD1 3.44Å; A289-I293 WeakPolarHBondContact O-CG1 3.19Å; A289-I293 PolarHBondContact O-N 2.92Å; L291-I293 VanDerWaalsContact C-N 3.3Å; L291-I293 PolarHBondContact O-N 2.89Å; I293-E295 PolarHBondContact O-N 2.79Å; I293-H296 CarbonylContact O-C 3.56Å; I293-H296 WeakPolarHBondContact O-CA 3.22Å; I293-H296 WeakPolarHBondContact O-CB 3.5Å; I293-H296 PolarHBondContact O-N 3.21Å; I293-D297 VanDerWaalsContact O-CG 3.27Å; I293-D297 PolarHBondContact O-N 3.38Å
294	L	76.1	Confident	70	Confident	101 Å²	101	101.5 Å²	101.5	53%	0.529	55%	0.549	S	S	.	.	H	α-helix	trans	-65	-27.2	-178.4	-70.7	170.8	0	0	0	113.2	I290 L291 R298	I290-L294 HydrophobicContact CG2-CD1 4.09Å; I290-L294 WeakPolarHBondContact O-CB 3.09Å; I290-L294 VanDerWaalsContact O-CG 3.27Å; I290-L294 WeakPolarHBondContact O-CG 3.46Å; I290-L294 PolarHBondContact O-N 3.28Å; I290-L294 VanDerWaalsContact O-N 3.07Å; L291-L294 PolarHBondContact O-N 2.92Å; L294-R298 WeakPolarHBondContact O-CB 3.46Å; L294-R298 PolarHBondContact O-N 3.2Å
295	E	75.7	Confident	71.7	Confident	112 Å²	112	102.2 Å²	102.2	52%	0.523	54%	0.537	S	S	.	.	H	α-helix	trans	-70.4	-38.2	169.6	-172.1	92.8	-89.8	0	0	111.3	L291 I293 R298 Q299	L291-E295 WeakPolarHBondContact O-CB 3.31Å; L291-E295 PolarHBondContact O-N 3.18Å; I293-E295 PolarHBondContact O-N 2.79Å; E295-R298 IonicContact OE1-CZ 3.51Å; E295-R298 VanDerWaalsContact OE1-CZ 3.27Å; E295-R298 IonicContact OE1-NE 2.79Å; E295-R298 PolarHBondContact OE1-NE 3.15Å; E295-R298 IonicContact OE1-NH2 2.68Å; E295-R298 PolarHBondContact OE1-NH2 3.26Å; E295-Q299 WeakPolarHBondContact O-CB 3.43Å; E295-Q299 PolarHBondContact O-N 3.18Å; E295-Q299 VanDerWaalsContact O-N 3.07Å
296	H	81.4	Confident	74.3	Confident	128 Å²	128	101.5 Å²	101.5	59%	0.593	52%	0.517	S	S	*	.	H	α-helix	trans	-68.2	-50.9	176.3	-167.8	45.8	0	0	0	111.8	D292 I293 R298 Q299 E300	D292-H296 WeakPolarHBondContact O-CB 3.32Å; D292-H296 PolarHBondContact O-N 3.24Å; D292-H296 VanDerWaalsContact O-N 3.12Å; I293-H296 CarbonylContact O-C 3.56Å; I293-H296 WeakPolarHBondContact O-CA 3.22Å; I293-H296 WeakPolarHBondContact O-CB 3.5Å; I293-H296 PolarHBondContact O-N 3.21Å; H296-R298 PolarHBondContact O-N 3.17Å; H296-Q299 CarbonylContact O-C 3.6Å; H296-Q299 WeakPolarHBondContact O-CA 3.23Å; H296-Q299 WeakPolarHBondContact O-CB 3.49Å; H296-Q299 PolarHBondContact O-N 3.36Å; H296-E300 PolarHBondContact O-N 2.97Å
297	D	82.6	Confident	75.6	Confident	75 Å²	75	100.3 Å²	100.3	40%	0.401	50%	0.502	S	S	.	.	H	α-helix	trans	-55.3	-40.6	175.1	-59.2	-5.7	0	0	0	111	I293 Q299 A301	I293-D297 VanDerWaalsContact O-CG 3.27Å; I293-D297 PolarHBondContact O-N 3.38Å; D297-Q299 VanDerWaalsContact C-N 3.31Å; D297-Q299 PolarHBondContact O-N 2.68Å; D297-A301 VanDerWaalsContact O-CB 3.28Å; D297-A301 WeakPolarHBondContact O-CB 3.45Å; D297-A301 PolarHBondContact O-N 2.85Å
298	R	82.3	Confident	77.5	Confident	117 Å²	117	99.6 Å²	99.6	44%	0.442	50%	0.498	S	S	.	.	H	α-helix	trans	-66.5	-31.4	175.9	-171.9	-164.1	63	57.3	-4.8	112.4	L294 E295 H296 L302	L294-R298 WeakPolarHBondContact O-CB 3.46Å; L294-R298 PolarHBondContact O-N 3.2Å; E295-R298 IonicContact OE1-CZ 3.51Å; E295-R298 VanDerWaalsContact OE1-CZ 3.27Å; E295-R298 IonicContact OE1-NE 2.79Å; E295-R298 PolarHBondContact OE1-NE 3.15Å; E295-R298 IonicContact OE1-NH2 2.68Å; E295-R298 PolarHBondContact OE1-NH2 3.26Å; H296-R298 PolarHBondContact O-N 3.17Å; R298-L302 VanDerWaalsContact NH1-CD1 3.26Å; R298-L302 WeakPolarHBondContact O-CD1 3.43Å; R298-L302 VanDerWaalsContact O-CG 3.3Å; R298-L302 WeakPolarHBondContact O-CG 3.42Å; R298-L302 PolarHBondContact O-N 3.31Å
299	Q	82.8	Confident	79.3	Confident	76 Å²	76	95.3 Å²	95.3	36%	0.355	48%	0.484	S	S	.	.	H	α-helix	trans	-80.4	-45.2	179.1	-174.1	60.7	25.6	0	0	111.2	E295 H296 D297 A301 L302 E303	E295-Q299 WeakPolarHBondContact O-CB 3.43Å; E295-Q299 PolarHBondContact O-N 3.18Å; E295-Q299 VanDerWaalsContact O-N 3.07Å; H296-Q299 CarbonylContact O-C 3.6Å; H296-Q299 WeakPolarHBondContact O-CA 3.23Å; H296-Q299 WeakPolarHBondContact O-CB 3.49Å; H296-Q299 PolarHBondContact O-N 3.36Å; D297-Q299 VanDerWaalsContact C-N 3.31Å; D297-Q299 PolarHBondContact O-N 2.68Å; Q299-A301 PolarHBondContact O-N 3.3Å; Q299-L302 WeakPolarHBondContact O-CB 3.48Å; Q299-L302 PolarHBondContact O-N 3.32Å; Q299-E303 WeakPolarHBondContact CG-OE1 3.43Å; Q299-E303 PolarHBondContact NE2-OE1 3.1Å; Q299-E303 PolarHBondContact O-N 3.34Å
300	E	82.9	Confident	80.7	Confident	114 Å²	114	96 Å²	96	53%	0.533	48%	0.48	S	S	.	.	H	α-helix	trans	-55.3	-49.8	173.4	-174.5	174.3	-146	0	0	110.7	H296 L302 E303 D304	H296-E300 PolarHBondContact O-N 2.97Å; E300-L302 PolarHBondContact O-N 2.82Å; E300-L302 VanDerWaalsContact O-N 3.16Å; E300-E303 PolarHBondContact O-N 3.21Å; E300-E303 VanDerWaalsContact O-N 3.09Å; E300-D304 PolarHBondContact O-N 3.2Å
301	A	82.4	Confident	82.3	Confident	60 Å²	60	98.6 Å²	98.6	50%	0.496	48%	0.484	S	S	.	.	H	α-helix	trans	-63.9	-20.6	176.9	0	0	0	0	0	114.6	D297 Q299 R305	D297-A301 VanDerWaalsContact O-CB 3.28Å; D297-A301 WeakPolarHBondContact O-CB 3.45Å; D297-A301 PolarHBondContact O-N 2.85Å; Q299-A301 PolarHBondContact O-N 3.3Å; A301-R305 WeakPolarHBondContact O-CB 3.22Å; A301-R305 PolarHBondContact O-N 2.85Å
302	L	80.9	Confident	83.7	Confident	73 Å²	73	96.9 Å²	96.9	38%	0.382	48%	0.475	S	S	.	.	H	α-helix	trans	-84.5	-34.2	172.8	-79.2	173.3	0	0	0	112.4	R298 Q299 E300 Q306	R298-L302 VanDerWaalsContact NH1-CD1 3.26Å; R298-L302 WeakPolarHBondContact O-CD1 3.43Å; R298-L302 VanDerWaalsContact O-CG 3.3Å; R298-L302 WeakPolarHBondContact O-CG 3.42Å; R298-L302 PolarHBondContact O-N 3.31Å; Q299-L302 WeakPolarHBondContact O-CB 3.48Å; Q299-L302 PolarHBondContact O-N 3.32Å; E300-L302 PolarHBondContact O-N 2.82Å; E300-L302 VanDerWaalsContact O-N 3.16Å; L302-Q306 PolarHBondContact O-N 2.93Å
303	E	85	Confident	84.7	Confident	115 Å²	115	100.3 Å²	100.3	54%	0.537	48%	0.482	S	S	.	.	H	α-helix	trans	-70.4	-47.2	175.5	-72.2	173.9	-161.9	0	0	110.2	Q299 E300 R305 Q306 D307	Q299-E303 WeakPolarHBondContact CG-OE1 3.43Å; Q299-E303 PolarHBondContact NE2-OE1 3.1Å; Q299-E303 PolarHBondContact O-N 3.34Å; E300-E303 PolarHBondContact O-N 3.21Å; E300-E303 VanDerWaalsContact O-N 3.09Å; E303-R305 VanDerWaalsContact C-N 3.3Å; E303-R305 PolarHBondContact O-N 3.48Å; E303-Q306 CarbonylContact O-C 3.59Å; E303-Q306 WeakPolarHBondContact O-CA 3.29Å; E303-Q306 WeakPolarHBondContact O-CB 3.47Å; E303-Q306 PolarHBondContact O-N 3.32Å; E303-D307 PolarHBondContact O-N 3.29Å
304	D	85.1	Confident	85.5	Confident	114 Å²	114	100.3 Å²	100.3	61%	0.61	48%	0.483	S	S	*	.	H	α-helix	trans	-52.6	-45.4	169.9	-98.2	-6	0	0	0	112.4	E300 Q306 D307 L308	E300-D304 PolarHBondContact O-N 3.2Å; D304-Q306 VanDerWaalsContact C-N 3.32Å; D304-Q306 PolarHBondContact O-N 2.83Å; D304-D307 PolarHBondContact O-N 3.46Å; D304-L308 WeakPolarHBondContact O-CB 3.13Å; D304-L308 PolarHBondContact O-N 3.02Å
305	R	85.3	Confident	86.2	Confident	131 Å²	131	100 Å²	100	49%	0.494	48%	0.482	S	S	.	.	H	α-helix	trans	-65.8	-35.7	178.1	-168.5	-159	66.6	73.8	12.9	111.6	A301 E303 V309	A301-R305 WeakPolarHBondContact O-CB 3.22Å; A301-R305 PolarHBondContact O-N 2.85Å; E303-R305 VanDerWaalsContact C-N 3.3Å; E303-R305 PolarHBondContact O-N 3.48Å; R305-V309 WeakPolarHBondContact O-CG2 3.39Å; R305-V309 PolarHBondContact O-N 2.82Å
306	Q	88.4	Confident	86.9	Confident	85 Å²	85	101.2 Å²	101.2	40%	0.397	49%	0.487	S	S	.	.	H	α-helix	trans	-70.9	-39.1	175.3	-173.4	55.8	49	0	0	111.1	L302 E303 D304 V309 N310	L302-Q306 PolarHBondContact O-N 2.93Å; E303-Q306 CarbonylContact O-C 3.59Å; E303-Q306 WeakPolarHBondContact O-CA 3.29Å; E303-Q306 WeakPolarHBondContact O-CB 3.47Å; E303-Q306 PolarHBondContact O-N 3.32Å; D304-Q306 VanDerWaalsContact C-N 3.32Å; D304-Q306 PolarHBondContact O-N 2.83Å; Q306-V309 WeakPolarHBondContact O-CB 3.43Å; Q306-V309 PolarHBondContact O-N 3.03Å; Q306-N310 PolarHBondContact NE2-OD1 3.37Å; Q306-N310 PolarHBondContact O-N 2.69Å; Q306-N310 PolarHBondContact O-ND2 3.05Å; Q306-N310 PolarHBondContact O-OD1 2.85Å
307	D	87.6	Confident	87.4	Confident	71 Å²	71	97.5 Å²	97.5	38%	0.38	47%	0.47	S	S	.	.	H	α-helix	trans	-67.6	-36.8	178.2	-133	47.4	0	0	0	112.1	E303 D304 N310 R311	E303-D307 PolarHBondContact O-N 3.29Å; D304-D307 PolarHBondContact O-N 3.46Å; D307-N310 PolarHBondContact O-N 2.98Å; D307-R311 WeakPolarHBondContact O-CB 3.4Å; D307-R311 VanDerWaalsContact O-CG 3.23Å; D307-R311 WeakPolarHBondContact O-CG 3.35Å; D307-R311 PolarHBondContact O-N 3.3Å; D307-R311 IonicContact OD2-CZ 2.78Å; D307-R311 IonicContact OD2-NE 3.15Å; D307-R311 PolarHBondContact OD2-NE 2.9Å; D307-R311 IonicContact OD2-NH2 2.69Å; D307-R311 PolarHBondContact OD2-NH2 3.15Å
308	L	90.1	Very high	87.8	Confident	106 Å²	106	99.7 Å²	99.7	56%	0.555	48%	0.478	S	S	*	.	H	α-helix	trans	-64	-38.8	170.6	-174.2	62.8	0	0	0	112.1	D304 R311 L312	D304-L308 WeakPolarHBondContact O-CB 3.13Å; D304-L308 PolarHBondContact O-N 3.02Å; L308-R311 PolarHBondContact O-N 3.15Å; L308-L312 HydrophobicContact CG-CD1 4.38Å; L308-L312 WeakPolarHBondContact O-CB 3.48Å; L308-L312 WeakPolarHBondContact O-CG 3.49Å; L308-L312 PolarHBondContact O-N 3.06Å
309	V	91.1	Very high	88.2	Confident	62 Å²	62	98.1 Å²	98.1	38%	0.376	48%	0.481	S	S	.	.	H	α-helix	trans	-66.3	-42.2	173.7	167.3	0	0	0	0	111.3	R305 Q306 R311 L312 Y313	R305-V309 WeakPolarHBondContact O-CG2 3.39Å; R305-V309 PolarHBondContact O-N 2.82Å; Q306-V309 WeakPolarHBondContact O-CB 3.43Å; Q306-V309 PolarHBondContact O-N 3.03Å; V309-R311 PolarHBondContact O-N 3.03Å; V309-L312 PolarHBondContact O-N 3.15Å; V309-Y313 PolarHBondContact O-N 2.99Å
310	N	89.6	Confident	88.7	Confident	69 Å²	69	100.1 Å²	100.1	37%	0.369	49%	0.485	S	S	.	.	H	α-helix	trans	-60.5	-44.7	175.6	-62.2	-20.8	0	0	0	110.9	Q306 D307 Y313 N314	Q306-N310 PolarHBondContact NE2-OD1 3.37Å; Q306-N310 PolarHBondContact O-N 2.69Å; Q306-N310 PolarHBondContact O-ND2 3.05Å; Q306-N310 PolarHBondContact O-OD1 2.85Å; D307-N310 PolarHBondContact O-N 2.98Å; N310-Y313 PolarHBondContact O-N 3.14Å; N310-N314 PolarHBondContact O-N 3.25Å; N310-N314 PolarHBondContact O-OD1 3.5Å
311	R	91.3	Very high	89.2	Confident	153 Å²	153	99.2 Å²	99.2	58%	0.577	48%	0.481	S	S	*	.	H	α-helix	trans	-63.7	-42.9	175.4	-69.8	167.1	-162.6	-130.1	6.5	112.2	D307 L308 V309 Y313 N314 L315	D307-R311 WeakPolarHBondContact O-CB 3.4Å; D307-R311 VanDerWaalsContact O-CG 3.23Å; D307-R311 WeakPolarHBondContact O-CG 3.35Å; D307-R311 PolarHBondContact O-N 3.3Å; D307-R311 IonicContact OD2-CZ 2.78Å; D307-R311 IonicContact OD2-NE 3.15Å; D307-R311 PolarHBondContact OD2-NE 2.9Å; D307-R311 IonicContact OD2-NH2 2.69Å; D307-R311 PolarHBondContact OD2-NH2 3.15Å; L308-R311 PolarHBondContact O-N 3.15Å; V309-R311 PolarHBondContact O-N 3.03Å; R311-Y313 VanDerWaalsContact C-N 3.31Å; R311-Y313 PolarHBondContact O-N 2.86Å; R311-N314 PolarHBondContact O-N 3.31Å; R311-L315 WeakPolarHBondContact O-CB 3.42Å; R311-L315 VanDerWaalsContact O-CG 3.3Å; R311-L315 WeakPolarHBondContact O-CG 3.12Å; R311-L315 PolarHBondContact O-N 2.96Å
312	L	91	Very high	89.5	Confident	87 Å²	87	99.2 Å²	99.2	46%	0.455	48%	0.481	S	S	.	.	H	α-helix	trans	-62.5	-36.8	175.8	-79.9	167.8	0	0	0	112.4	L308 V309 H316	L308-L312 HydrophobicContact CG-CD1 4.38Å; L308-L312 WeakPolarHBondContact O-CB 3.48Å; L308-L312 WeakPolarHBondContact O-CG 3.49Å; L308-L312 PolarHBondContact O-N 3.06Å; V309-L312 PolarHBondContact O-N 3.15Å; L312-H316 PolarHBondContact O-N 3.03Å; L312-H316 VanDerWaalsContact O-N 3.11Å; L312-H316 PolarHBondContact O-ND1 3.26Å
313	Y	92.3	Very high	89.9	Confident	165 Å²	165	99.9 Å²	99.9	65%	0.647	48%	0.482	S	S	*	.	H	α-helix	trans	-66.6	-48.4	174.9	-172.6	-93.4	0	0	0	111.6	V309 N310 R311 L315 H316 E317	V309-Y313 PolarHBondContact O-N 2.99Å; N310-Y313 PolarHBondContact O-N 3.14Å; R311-Y313 VanDerWaalsContact C-N 3.31Å; R311-Y313 PolarHBondContact O-N 2.86Å; Y313-L315 VanDerWaalsContact C-N 3.32Å; Y313-L315 PolarHBondContact O-N 2.93Å; Y313-H316 PolarHBondContact O-N 3.12Å; Y313-E317 PolarHBondContact O-N 3.1Å
314	N	92	Very high	90.3	Very high	93 Å²	93	99.4 Å²	99.4	50%	0.497	48%	0.48	S	S	.	.	H	α-helix	trans	-59.9	-41.2	176.8	-67.3	-6.9	0	0	0	112	N310 R311 H316 E317 E318	N310-N314 PolarHBondContact O-N 3.25Å; N310-N314 PolarHBondContact O-OD1 3.5Å; R311-N314 PolarHBondContact O-N 3.31Å; N314-H316 PolarHBondContact O-N 3.29Å; N314-E317 PolarHBondContact O-N 2.92Å; N314-E318 WeakPolarHBondContact O-CG 3.36Å; N314-E318 PolarHBondContact O-N 2.69Å
315	L	91.3	Very high	90.6	Very high	95 Å²	95	98.4 Å²	98.4	50%	0.497	47%	0.474	S	S	.	.	H	α-helix	trans	-66.2	-34.5	176.5	-73.4	168.4	0	0	0	113.1	R311 Y313 E317 V319	R311-L315 WeakPolarHBondContact O-CB 3.42Å; R311-L315 VanDerWaalsContact O-CG 3.3Å; R311-L315 WeakPolarHBondContact O-CG 3.12Å; R311-L315 PolarHBondContact O-N 2.96Å; Y313-L315 VanDerWaalsContact C-N 3.32Å; Y313-L315 PolarHBondContact O-N 2.93Å; L315-E317 VanDerWaalsContact C-N 3.35Å; L315-V319 WeakPolarHBondContact O-CB 3.1Å; L315-V319 VanDerWaalsContact O-CG2 3.26Å; L315-V319 WeakPolarHBondContact O-CG2 3.32Å; L315-V319 PolarHBondContact O-N 2.87Å
316	H	89.8	Confident	91	Very high	136 Å²	136	98 Å²	98	63%	0.63	47%	0.472	S	S	*	.	H	α-helix	trans	-67.3	-37.4	171.9	-81.8	76.5	0	0	0	111.8	L312 Y313 N314 V319 R320	L312-H316 PolarHBondContact O-N 3.03Å; L312-H316 VanDerWaalsContact O-N 3.11Å; L312-H316 PolarHBondContact O-ND1 3.26Å; Y313-H316 PolarHBondContact O-N 3.12Å; N314-H316 PolarHBondContact O-N 3.29Å; H316-V319 PolarHBondContact O-N 3.23Å; H316-R320 WeakPolarHBondContact O-CB 3.49Å; H316-R320 PolarHBondContact O-N 3.06Å
317	E	92.6	Very high	91.2	Very high	51 Å²	51	97.3 Å²	97.3	24%	0.238	47%	0.471	C	S	.	.	H	α-helix	trans	-69.3	-41.3	177	-179.2	57.2	-160.5	0	0	112	Y313 N314 L315 R320 Q321	Y313-E317 PolarHBondContact O-N 3.1Å; N314-E317 PolarHBondContact O-N 2.92Å; L315-E317 VanDerWaalsContact C-N 3.35Å; E317-R320 PolarHBondContact O-N 3.34Å; E317-R320 IonicContact OE1-CZ 2.62Å; E317-R320 IonicContact OE1-NE 3.15Å; E317-R320 IonicContact OE1-NH2 2.69Å; E317-R320 PolarHBondContact OE1-NH2 3.08Å; E317-R320 IonicContact OE2-CZ 2.75Å; E317-R320 VanDerWaalsContact OE2-CZ 3.25Å; E317-R320 IonicContact OE2-NE 3.84Å; E317-R320 PolarHBondContact OE2-NE 3.33Å; E317-R320 IonicContact OE2-NH2 2.89Å; E317-R320 PolarHBondContact OE2-NH2 3.36Å; E317-Q321 WeakPolarHBondContact O-CG 3.38Å; E317-Q321 PolarHBondContact O-N 2.98Å; E317-Q321 PolarHBondContact OE1-NE2 3.4Å
318	E	90.7	Very high	91.5	Very high	120 Å²	120	99 Å²	99	56%	0.561	48%	0.475	S	S	*	.	H	α-helix	trans	-62.1	-41.7	172	-75	175.9	-161.9	0	0	112.2	N314 Q321 A322	N314-E318 WeakPolarHBondContact O-CG 3.36Å; N314-E318 PolarHBondContact O-N 2.69Å; E318-Q321 PolarHBondContact O-N 2.71Å; E318-A322 WeakPolarHBondContact O-CB 3.34Å; E318-A322 PolarHBondContact O-N 2.98Å
319	V	91.1	Very high	91.6	Very high	85 Å²	85	101.1 Å²	101.1	52%	0.515	48%	0.477	S	S	.	.	H	α-helix	trans	-62.1	-47.8	173.8	166.9	0	0	0	0	110.4	L315 H316 Q321 A322 E323	L315-V319 WeakPolarHBondContact O-CB 3.1Å; L315-V319 VanDerWaalsContact O-CG2 3.26Å; L315-V319 WeakPolarHBondContact O-CG2 3.32Å; L315-V319 PolarHBondContact O-N 2.87Å; H316-V319 PolarHBondContact O-N 3.23Å; V319-Q321 VanDerWaalsContact C-N 3.34Å; V319-Q321 PolarHBondContact O-N 2.64Å; V319-A322 WeakPolarHBondContact O-CB 3.21Å; V319-A322 PolarHBondContact O-N 3.18Å; V319-A322 VanDerWaalsContact O-N 3.09Å; V319-E323 HydrophobicContact CG1-CG 4.48Å; V319-E323 WeakPolarHBondContact O-CG 3.34Å; V319-E323 PolarHBondContact O-N 3.49Å
320	R	92.8	Very high	91.7	Very high	117 Å²	117	102.3 Å²	102.3	44%	0.442	48%	0.481	S	S	.	.	H	α-helix	trans	-57.3	-45.7	177.8	-175.3	174.6	71.6	91.5	-7.8	112	H316 E317 A322 E323 E324	H316-R320 WeakPolarHBondContact O-CB 3.49Å; H316-R320 PolarHBondContact O-N 3.06Å; E317-R320 PolarHBondContact O-N 3.34Å; E317-R320 IonicContact OE1-CZ 2.62Å; E317-R320 IonicContact OE1-NE 3.15Å; E317-R320 IonicContact OE1-NH2 2.69Å; E317-R320 PolarHBondContact OE1-NH2 3.08Å; E317-R320 IonicContact OE2-CZ 2.75Å; E317-R320 VanDerWaalsContact OE2-CZ 3.25Å; E317-R320 IonicContact OE2-NE 3.84Å; E317-R320 PolarHBondContact OE2-NE 3.33Å; E317-R320 IonicContact OE2-NH2 2.89Å; E317-R320 PolarHBondContact OE2-NH2 3.36Å; R320-A322 VanDerWaalsContact C-N 3.33Å; R320-A322 PolarHBondContact O-N 2.91Å; R320-E323 PolarHBondContact O-N 2.9Å; R320-E324 WeakPolarHBondContact CG-OE1 3.29Å; R320-E324 IonicContact CZ-OE1 3.95Å; R320-E324 IonicContact NH1-OE1 2.72Å; R320-E324 PolarHBondContact NH1-OE1 2.97Å; R320-E324 IonicContact NH1-OE2 3.04Å; R320-E324 WeakPolarHBondContact O-CG 3.41Å; R320-E324 PolarHBondContact O-N 2.74Å
321	Q	92.3	Very high	91.8	Very high	96 Å²	96	105.7 Å²	105.7	45%	0.449	49%	0.494	S	S	.	.	H	α-helix	trans	-65.2	-34.8	176.5	-69.4	174.6	22.1	0	0	112.4	E317 E318 V319 L325	E317-Q321 WeakPolarHBondContact O-CG 3.38Å; E317-Q321 PolarHBondContact O-N 2.98Å; E317-Q321 PolarHBondContact OE1-NE2 3.4Å; E318-Q321 PolarHBondContact O-N 2.71Å; V319-Q321 VanDerWaalsContact C-N 3.34Å; V319-Q321 PolarHBondContact O-N 2.64Å; Q321-L325 WeakPolarHBondContact O-CB 3.35Å; Q321-L325 VanDerWaalsContact O-CG 3.3Å; Q321-L325 WeakPolarHBondContact O-CG 3.41Å; Q321-L325 PolarHBondContact O-N 2.98Å
322	A	88.5	Confident	91.8	Very high	59 Å²	59	102.1 Å²	102.1	49%	0.488	48%	0.484	S	S	.	.	H	α-helix	trans	-68.6	-33.2	173.6	0	0	0	0	0	112.8	E318 V319 R320 R326	E318-A322 WeakPolarHBondContact O-CB 3.34Å; E318-A322 PolarHBondContact O-N 2.98Å; V319-A322 WeakPolarHBondContact O-CB 3.21Å; V319-A322 PolarHBondContact O-N 3.18Å; V319-A322 VanDerWaalsContact O-N 3.09Å; R320-A322 VanDerWaalsContact C-N 3.33Å; R320-A322 PolarHBondContact O-N 2.91Å; A322-R326 WeakPolarHBondContact O-CB 3.35Å; A322-R326 PolarHBondContact O-N 3.45Å
323	E	89.9	Confident	91.9	Very high	88 Å²	88	103 Å²	103	41%	0.411	48%	0.484	S	S	.	.	H	α-helix	trans	-71.6	-44.4	173	-64.4	-161	106.5	0	0	112.1	V319 R320 L325 R326 D327	V319-E323 HydrophobicContact CG1-CG 4.48Å; V319-E323 WeakPolarHBondContact O-CG 3.34Å; V319-E323 PolarHBondContact O-N 3.49Å; R320-E323 PolarHBondContact O-N 2.9Å; E323-L325 VanDerWaalsContact C-N 3.28Å; E323-L325 PolarHBondContact O-N 2.89Å; E323-R326 WeakPolarHBondContact O-CB 3.27Å; E323-R326 PolarHBondContact O-N 3.21Å; E323-R326 VanDerWaalsContact O-N 3.14Å; E323-R326 IonicContact OE1-CZ 3.87Å; E323-R326 IonicContact OE1-NH1 2.68Å; E323-R326 PolarHBondContact OE1-NH1 3.41Å; E323-R326 IonicContact OE1-NH2 3.27Å; E323-D327 PolarHBondContact O-N 2.87Å
324	E	92.9	Very high	92	Very high	104 Å²	104	100.7 Å²	100.7	49%	0.486	48%	0.48	S	S	.	.	H	α-helix	trans	-58.4	-39.4	173.8	-72.5	173	-162	0	0	111.9	R320 K328	R320-E324 WeakPolarHBondContact CG-OE1 3.29Å; R320-E324 IonicContact CZ-OE1 3.95Å; R320-E324 IonicContact NH1-OE1 2.72Å; R320-E324 PolarHBondContact NH1-OE1 2.97Å; R320-E324 IonicContact NH1-OE2 3.04Å; R320-E324 WeakPolarHBondContact O-CG 3.41Å; R320-E324 PolarHBondContact O-N 2.74Å; E324-K328 WeakPolarHBondContact O-CB 3.44Å; E324-K328 PolarHBondContact O-N 3.36Å; E324-K328 VanDerWaalsContact O-N 3.15Å
325	L	92.7	Very high	92	Very high	94 Å²	94	101.1 Å²	101.1	49%	0.492	48%	0.479	S	S	.	.	H	α-helix	trans	-70	-40.4	173.6	-73.9	171.9	0	0	0	113.1	Q321 E323 D327 Y329	Q321-L325 WeakPolarHBondContact O-CB 3.35Å; Q321-L325 VanDerWaalsContact O-CG 3.3Å; Q321-L325 WeakPolarHBondContact O-CG 3.41Å; Q321-L325 PolarHBondContact O-N 2.98Å; E323-L325 VanDerWaalsContact C-N 3.28Å; E323-L325 PolarHBondContact O-N 2.89Å; L325-D327 VanDerWaalsContact C-N 3.33Å; L325-D327 PolarHBondContact O-N 2.82Å; L325-Y329 WeakPolarHBondContact O-CD2 3.35Å; L325-Y329 PolarHBondContact O-N 3.23Å
326	R	93.1	Very high	92	Very high	121 Å²	121	101.4 Å²	101.4	46%	0.457	48%	0.48	S	S	.	.	H	α-helix	trans	-57.1	-48.5	175.4	175.5	-161.9	69.5	-144.9	-7.7	110.6	A322 E323 Y329 L330	A322-R326 WeakPolarHBondContact O-CB 3.35Å; A322-R326 PolarHBondContact O-N 3.45Å; E323-R326 WeakPolarHBondContact O-CB 3.27Å; E323-R326 PolarHBondContact O-N 3.21Å; E323-R326 VanDerWaalsContact O-N 3.14Å; E323-R326 IonicContact OE1-CZ 3.87Å; E323-R326 IonicContact OE1-NH1 2.68Å; E323-R326 PolarHBondContact OE1-NH1 3.41Å; E323-R326 IonicContact OE1-NH2 3.27Å; R326-Y329 PolarHBondContact O-N 2.99Å; R326-L330 PolarHBondContact O-N 2.91Å
327	D	92.1	Very high	92	Very high	71 Å²	71	100 Å²	100	38%	0.38	47%	0.474	S	S	.	.	H	α-helix	trans	-71.8	-38.2	-173.7	-64.8	-15.9	0	0	0	110.8	E323 L325 Y329 L330 E331	E323-D327 PolarHBondContact O-N 2.87Å; L325-D327 VanDerWaalsContact C-N 3.33Å; L325-D327 PolarHBondContact O-N 2.82Å; D327-Y329 PolarHBondContact O-N 2.89Å; D327-L330 WeakPolarHBondContact O-CA 3.22Å; D327-L330 WeakPolarHBondContact O-CB 3.46Å; D327-L330 PolarHBondContact O-N 3.13Å; D327-L330 VanDerWaalsContact O-N 3.07Å; D327-E331 PolarHBondContact O-N 3.39Å
328	K	94.6	Very high	92.1	Very high	106 Å²	106	103 Å²	103	46%	0.461	49%	0.491	S	S	.	.	H	α-helix	trans	-59.9	-41.3	170.2	-173.1	174.3	-176.1	-68.7	0	113.3	E324 L330 E331 E332	E324-K328 WeakPolarHBondContact O-CB 3.44Å; E324-K328 PolarHBondContact O-N 3.36Å; E324-K328 VanDerWaalsContact O-N 3.15Å; K328-L330 VanDerWaalsContact C-N 3.26Å; K328-L330 PolarHBondContact O-N 3.38Å; K328-E331 PolarHBondContact O-N 2.66Å; K328-E332 IonicContact NZ-OE1 2.9Å; K328-E332 PolarHBondContact NZ-OE1 3.47Å; K328-E332 WeakPolarHBondContact O-CG 3.4Å; K328-E332 PolarHBondContact O-N 2.86Å
329	Y	91.9	Very high	92.2	Very high	152 Å²	152	102.4 Å²	102.4	60%	0.596	49%	0.487	S	S	*	.	H	α-helix	trans	-70	-23.4	174.9	-72.9	-49.5	0	0	0	113.2	L325 R326 D327 K333	L325-Y329 WeakPolarHBondContact O-CD2 3.35Å; L325-Y329 PolarHBondContact O-N 3.23Å; R326-Y329 PolarHBondContact O-N 2.99Å; D327-Y329 PolarHBondContact O-N 2.89Å; Y329-K333 WeakPolarHBondContact O-CB 2.96Å; Y329-K333 PolarHBondContact O-N 2.89Å; Y329-K333 VanDerWaalsContact O-N 3.1Å
330	L	92.7	Very high	91.9	Very high	86 Å²	86	102.4 Å²	102.4	45%	0.45	49%	0.489	S	S	.	.	H	α-helix	trans	-73.8	-44.5	173.1	-164.6	154.4	0	0	0	110.6	R326 D327 K328 K333 E334	R326-L330 PolarHBondContact O-N 2.91Å; D327-L330 WeakPolarHBondContact O-CA 3.22Å; D327-L330 WeakPolarHBondContact O-CB 3.46Å; D327-L330 PolarHBondContact O-N 3.13Å; D327-L330 VanDerWaalsContact O-N 3.07Å; K328-L330 VanDerWaalsContact C-N 3.26Å; K328-L330 PolarHBondContact O-N 3.38Å; L330-K333 WeakPolarHBondContact O-CB 3.14Å; L330-K333 PolarHBondContact O-N 3.19Å; L330-E334 HydrophobicContact CD2-CG 4.23Å; L330-E334 WeakPolarHBondContact CD2-OE1 3.46Å; L330-E334 PolarHBondContact O-N 2.95Å
331	E	92.2	Very high	91.9	Very high	140 Å²	140	99.1 Å²	99.1	65%	0.654	49%	0.485	S	S	*	.	H	α-helix	trans	-58.4	-47.6	171.7	-68.1	-178.4	163.9	0	0	112.1	D327 K328 K333 E334 E335	D327-E331 PolarHBondContact O-N 3.39Å; K328-E331 PolarHBondContact O-N 2.66Å; E331-K333 VanDerWaalsContact C-N 3.28Å; E331-K333 PolarHBondContact O-N 3.04Å; E331-E334 PolarHBondContact O-N 3.39Å; E331-E335 PolarHBondContact O-N 2.94Å
332	E	92.4	Very high	92	Very high	78 Å²	78	97.9 Å²	97.9	36%	0.364	48%	0.484	S	S	.	.	H	α-helix	trans	-60.1	-37	176.2	-75.3	176.7	-170	0	0	112.2	K328 L336	K328-E332 IonicContact NZ-OE1 2.9Å; K328-E332 PolarHBondContact NZ-OE1 3.47Å; K328-E332 WeakPolarHBondContact O-CG 3.4Å; K328-E332 PolarHBondContact O-N 2.86Å; E332-L336 WeakPolarHBondContact O-CB 3.28Å; E332-L336 VanDerWaalsContact O-CG 3.26Å; E332-L336 WeakPolarHBondContact O-CG 3.5Å; E332-L336 PolarHBondContact O-N 3.3Å; E332-L336 VanDerWaalsContact O-N 3.09Å
333	K	92.9	Very high	92.1	Very high	105 Å²	105	100.5 Å²	100.5	46%	0.457	49%	0.489	S	S	.	.	H	α-helix	trans	-65.9	-46.7	174.9	176.1	-173	169.5	-69.7	0	111.7	Y329 L330 E331 E335 L336 E337	Y329-K333 WeakPolarHBondContact O-CB 2.96Å; Y329-K333 PolarHBondContact O-N 2.89Å; Y329-K333 VanDerWaalsContact O-N 3.1Å; L330-K333 WeakPolarHBondContact O-CB 3.14Å; L330-K333 PolarHBondContact O-N 3.19Å; E331-K333 VanDerWaalsContact C-N 3.28Å; E331-K333 PolarHBondContact O-N 3.04Å; K333-E335 VanDerWaalsContact C-N 3.34Å; K333-L336 PolarHBondContact O-N 3.36Å; K333-E337 WeakPolarHBondContact CE-OE1 2.92Å; K333-E337 IonicContact NZ-OE1 2.77Å; K333-E337 PolarHBondContact NZ-OE1 3.2Å; K333-E337 IonicContact NZ-OE2 2.67Å; K333-E337 PolarHBondContact NZ-OE2 3.47Å; K333-E337 WeakPolarHBondContact O-CG 3.49Å; K333-E337 PolarHBondContact O-N 2.71Å
334	E	93.4	Very high	92.2	Very high	118 Å²	118	101.9 Å²	101.9	55%	0.551	50%	0.495	S	S	*	.	H	α-helix	trans	-64.6	-39.2	179.7	-71.2	-172	174.6	0	0	111.7	L330 E331 L336 E337 L338	L330-E334 HydrophobicContact CD2-CG 4.23Å; L330-E334 WeakPolarHBondContact CD2-OE1 3.46Å; L330-E334 PolarHBondContact O-N 2.95Å; E331-E334 PolarHBondContact O-N 3.39Å; E334-L336 PolarHBondContact O-N 2.88Å; E334-E337 PolarHBondContact O-N 2.98Å; E334-L338 WeakPolarHBondContact O-CB 3.4Å; E334-L338 PolarHBondContact O-N 3.35Å
335	E	91.8	Very high	92.2	Very high	101 Å²	101	103 Å²	103	47%	0.472	50%	0.498	S	S	.	.	H	α-helix	trans	-64.2	-39.2	175.2	-155.4	-146.4	178.5	0	0	111.9	E331 K333 K339	E331-E335 PolarHBondContact O-N 2.94Å; K333-E335 VanDerWaalsContact C-N 3.34Å; E335-K339 WeakPolarHBondContact O-CB 3.45Å; E335-K339 WeakPolarHBondContact O-CD 3.42Å; E335-K339 VanDerWaalsContact O-CG 3.24Å; E335-K339 WeakPolarHBondContact O-CG 3.32Å; E335-K339 PolarHBondContact O-N 2.97Å; E335-K339 WeakPolarHBondContact OE1-CE 3.18Å; E335-K339 IonicContact OE1-NZ 3.87Å; E335-K339 PolarHBondContact OE1-NZ 2.76Å; E335-K339 IonicContact OE2-NZ 2.89Å; E335-K339 PolarHBondContact OE2-NZ 3.29Å
336	L	91.3	Very high	92.1	Very high	102 Å²	102	101.5 Å²	101.5	53%	0.534	49%	0.491	S	S	.	.	H	α-helix	trans	-68.2	-41.4	174.5	-74.5	170.3	0	0	0	112.6	E332 K333 E334 L338 K339 C340	E332-L336 WeakPolarHBondContact O-CB 3.28Å; E332-L336 VanDerWaalsContact O-CG 3.26Å; E332-L336 WeakPolarHBondContact O-CG 3.5Å; E332-L336 PolarHBondContact O-N 3.3Å; E332-L336 VanDerWaalsContact O-N 3.09Å; K333-L336 PolarHBondContact O-N 3.36Å; E334-L336 PolarHBondContact O-N 2.88Å; L336-L338 VanDerWaalsContact C-N 3.32Å; L336-L338 PolarHBondContact O-N 3.46Å; L336-K339 PolarHBondContact O-N 3.27Å; L336-C340 PolarHBondContact O-N 2.8Å; L336-C340 PolarHBondContact O-SG 2.9Å; L336-C340 VanDerWaalsContact O-SG 3.39Å
337	E	90.9	Very high	91.9	Very high	105 Å²	105	99 Å²	99	49%	0.491	49%	0.491	S	S	.	.	H	α-helix	trans	-63.6	-38.1	175.5	-76.4	176.6	162.9	0	0	111.5	K333 E334 C340 S341	K333-E337 WeakPolarHBondContact CE-OE1 2.92Å; K333-E337 IonicContact NZ-OE1 2.77Å; K333-E337 PolarHBondContact NZ-OE1 3.2Å; K333-E337 IonicContact NZ-OE2 2.67Å; K333-E337 PolarHBondContact NZ-OE2 3.47Å; K333-E337 WeakPolarHBondContact O-CG 3.49Å; K333-E337 PolarHBondContact O-N 2.71Å; E334-E337 PolarHBondContact O-N 2.98Å; E337-C340 PolarHBondContact O-N 3.05Å; E337-S341 WeakPolarHBondContact O-CB 3.5Å; E337-S341 PolarHBondContact O-N 3.46Å
338	L	93.9	Very high	91.9	Very high	116 Å²	116	99 Å²	99	61%	0.607	49%	0.489	S	S	*	.	H	α-helix	trans	-65.4	-41.9	173.1	-174.9	64.4	0	0	0	112.4	E334 L336 S341 T342	E334-L338 WeakPolarHBondContact O-CB 3.4Å; E334-L338 PolarHBondContact O-N 3.35Å; L336-L338 VanDerWaalsContact C-N 3.32Å; L336-L338 PolarHBondContact O-N 3.46Å; L338-S341 PolarHBondContact O-N 3.42Å; L338-T342 WeakPolarHBondContact O-CB 3.48Å; L338-T342 PolarHBondContact O-N 3.03Å; L338-T342 PolarHBondContact O-OG1 3.07Å
339	K	91.9	Very high	92	Very high	106 Å²	106	98.5 Å²	98.5	46%	0.461	49%	0.489	S	S	.	.	H	α-helix	trans	-62.2	-44.7	174.6	-74.8	164.2	-178.4	172.5	0	111.5	E335 L336 T342 L343	E335-K339 WeakPolarHBondContact O-CB 3.45Å; E335-K339 WeakPolarHBondContact O-CD 3.42Å; E335-K339 VanDerWaalsContact O-CG 3.24Å; E335-K339 WeakPolarHBondContact O-CG 3.32Å; E335-K339 PolarHBondContact O-N 2.97Å; E335-K339 WeakPolarHBondContact OE1-CE 3.18Å; E335-K339 IonicContact OE1-NZ 3.87Å; E335-K339 PolarHBondContact OE1-NZ 2.76Å; E335-K339 IonicContact OE2-NZ 2.89Å; E335-K339 PolarHBondContact OE2-NZ 3.29Å; L336-K339 PolarHBondContact O-N 3.27Å; K339-T342 PolarHBondContact O-N 3.24Å; K339-L343 WeakPolarHBondContact O-CB 3.25Å; K339-L343 PolarHBondContact O-N 3.01Å
340	C	85.3	Confident	91.8	Very high	85 Å²	85	97.9 Å²	97.9	57%	0.574	49%	0.487	S	S	*	.	H	α-helix	trans	-63	-43.6	175.1	-72.1	0	0	0	0	112.6	L336 E337 T342 L343 Q344	L336-C340 PolarHBondContact O-N 2.8Å; L336-C340 PolarHBondContact O-SG 2.9Å; L336-C340 VanDerWaalsContact O-SG 3.39Å; E337-C340 PolarHBondContact O-N 3.05Å; C340-T342 VanDerWaalsContact C-N 3.3Å; C340-T342 PolarHBondContact O-N 3.07Å; C340-L343 PolarHBondContact O-N 3.34Å; C340-Q344 PolarHBondContact O-N 2.84Å
341	S	93.4	Very high	91.8	Very high	49 Å²	49	100.5 Å²	100.5	34%	0.343	49%	0.491	S	S	.	.	H	α-helix	trans	-61.9	-36.1	176.3	-173.6	0	0	0	0	112.7	E337 L338 K345	E337-S341 WeakPolarHBondContact O-CB 3.5Å; E337-S341 PolarHBondContact O-N 3.46Å; L338-S341 PolarHBondContact O-N 3.42Å; S341-K345 WeakPolarHBondContact O-CG 3.24Å; S341-K345 PolarHBondContact O-N 3Å
342	T	93.7	Very high	91.9	Very high	70 Å²	70	98.5 Å²	98.5	43%	0.429	48%	0.484	S	S	.	.	H	α-helix	trans	-69	-51.9	175.3	-54	0	0	0	0	110.9	L338 K339 C340 Q344 K345 D346	L338-T342 WeakPolarHBondContact O-CB 3.48Å; L338-T342 PolarHBondContact O-N 3.03Å; L338-T342 PolarHBondContact O-OG1 3.07Å; K339-T342 PolarHBondContact O-N 3.24Å; C340-T342 VanDerWaalsContact C-N 3.3Å; C340-T342 PolarHBondContact O-N 3.07Å; T342-Q344 VanDerWaalsContact C-N 3.27Å; T342-Q344 PolarHBondContact O-N 2.82Å; T342-K345 WeakPolarHBondContact O-CB 3.32Å; T342-K345 PolarHBondContact O-N 3.17Å; T342-D346 PolarHBondContact O-N 3.09Å
343	L	91.8	Very high	92	Very high	113 Å²	113	102.3 Å²	102.3	59%	0.592	50%	0.496	S	S	*	.	H	α-helix	trans	-59.1	-36.2	179.4	-175.3	65	0	0	0	112.5	K339 C340 D346 C347	K339-L343 WeakPolarHBondContact O-CB 3.25Å; K339-L343 PolarHBondContact O-N 3.01Å; C340-L343 PolarHBondContact O-N 3.34Å; L343-D346 PolarHBondContact O-N 3.39Å; L343-C347 PolarHBondContact O-N 2.93Å; L343-C347 PolarHBondContact O-SG 3.02Å; L343-C347 VanDerWaalsContact O-SG 3.34Å
344	Q	90.8	Very high	91.9	Very high	117 Å²	117	102.2 Å²	102.2	55%	0.547	50%	0.499	S	S	.	.	H	α-helix	trans	-60.5	-46.1	174.3	-177.9	-177.6	-27	0	0	111.8	C340 T342 D346 C347 E348	C340-Q344 PolarHBondContact O-N 2.84Å; T342-Q344 VanDerWaalsContact C-N 3.27Å; T342-Q344 PolarHBondContact O-N 2.82Å; Q344-D346 VanDerWaalsContact C-N 3.32Å; Q344-D346 PolarHBondContact O-N 2.92Å; Q344-C347 WeakPolarHBondContact O-CB 3.27Å; Q344-C347 PolarHBondContact O-N 3.48Å; Q344-E348 WeakPolarHBondContact CG-OE1 3.38Å; Q344-E348 PolarHBondContact NE2-OE1 3.22Å; Q344-E348 WeakPolarHBondContact O-CG 3.34Å; Q344-E348 PolarHBondContact O-N 3.18Å
345	K	94	Very high	91.8	Very high	128 Å²	128	100.8 Å²	100.8	56%	0.557	50%	0.495	S	S	*	.	H	α-helix	trans	-64.7	-37.4	178.9	-69	168.8	-173.6	169.5	0	111.8	S341 T342 E348 M349	S341-K345 WeakPolarHBondContact O-CG 3.24Å; S341-K345 PolarHBondContact O-N 3Å; T342-K345 WeakPolarHBondContact O-CB 3.32Å; T342-K345 PolarHBondContact O-N 3.17Å; K345-E348 PolarHBondContact O-N 2.88Å; K345-M349 WeakPolarHBondContact O-CB 3.43Å; K345-M349 PolarHBondContact O-N 2.83Å
346	D	90.9	Very high	91.9	Very high	63 Å²	63	99.9 Å²	99.9	34%	0.337	50%	0.497	S	S	.	.	H	α-helix	trans	-63.5	-45.6	173	-68.9	-33.7	0	0	0	111	T342 L343 Q344 E348 M349 Y350	T342-D346 PolarHBondContact O-N 3.09Å; L343-D346 PolarHBondContact O-N 3.39Å; Q344-D346 VanDerWaalsContact C-N 3.32Å; Q344-D346 PolarHBondContact O-N 2.92Å; D346-E348 VanDerWaalsContact C-N 3.31Å; D346-E348 PolarHBondContact O-N 3.4Å; D346-M349 PolarHBondContact O-N 3.39Å; D346-Y350 HydrophobicContact CB-CD2 4.5Å; D346-Y350 HydrophobicContact CB-CE2 4.36Å; D346-Y350 WeakPolarHBondContact O-CD2 3.28Å; D346-Y350 PolarHBondContact O-N 3.27Å
347	C	87.1	Confident	92	Very high	67 Å²	67	98.8 Å²	98.8	45%	0.453	49%	0.491	S	S	.	.	H	α-helix	trans	-60.4	-36.4	174.4	-71	0	0	0	0	113.4	L343 Q344 R351	L343-C347 PolarHBondContact O-N 2.93Å; L343-C347 PolarHBondContact O-SG 3.02Å; L343-C347 VanDerWaalsContact O-SG 3.34Å; Q344-C347 WeakPolarHBondContact O-CB 3.27Å; Q344-C347 PolarHBondContact O-N 3.48Å; C347-R351 WeakPolarHBondContact O-CB 3.3Å; C347-R351 PolarHBondContact O-N 3.04Å
348	E	93.6	Very high	91.8	Very high	72 Å²	72	96.4 Å²	96.4	34%	0.336	49%	0.485	S	S	.	.	H	α-helix	trans	-69.2	-40.4	173.8	-72.5	169.6	-167.4	0	0	111.7	Q344 K345 D346 R351 N352	Q344-E348 WeakPolarHBondContact CG-OE1 3.38Å; Q344-E348 PolarHBondContact NE2-OE1 3.22Å; Q344-E348 WeakPolarHBondContact O-CG 3.34Å; Q344-E348 PolarHBondContact O-N 3.18Å; K345-E348 PolarHBondContact O-N 2.88Å; D346-E348 VanDerWaalsContact C-N 3.31Å; D346-E348 PolarHBondContact O-N 3.4Å; E348-R351 WeakPolarHBondContact O-CB 3.46Å; E348-R351 PolarHBondContact O-N 2.96Å; E348-N352 PolarHBondContact O-N 3.35Å; E348-N352 PolarHBondContact O-ND2 3.26Å
349	M	95.1	Very high	91.7	Very high	95 Å²	95	93.6 Å²	93.6	47%	0.468	48%	0.479	S	S	.	.	H	α-helix	trans	-65.4	-41.6	175.4	-176.5	-102.2	-67.6	0	0	112.4	K345 D346 R353	K345-M349 WeakPolarHBondContact O-CB 3.43Å; K345-M349 PolarHBondContact O-N 2.83Å; D346-M349 PolarHBondContact O-N 3.39Å; M349-R353 WeakPolarHBondContact O-CB 3.42Å; M349-R353 PolarHBondContact O-N 3.29Å
350	Y	89.4	Confident	91.6	Very high	139 Å²	139	94 Å²	94	55%	0.545	48%	0.483	S	S	.	.	H	α-helix	trans	-63	-40.4	172.2	-76.8	-62.6	0	0	0	112.2	D346 R353 I354	D346-Y350 HydrophobicContact CB-CD2 4.5Å; D346-Y350 HydrophobicContact CB-CE2 4.36Å; D346-Y350 WeakPolarHBondContact O-CD2 3.28Å; D346-Y350 PolarHBondContact O-N 3.27Å; Y350-R353 PolarHBondContact O-N 2.78Å; Y350-I354 VanDerWaalsContact O-CG1 3.32Å; Y350-I354 WeakPolarHBondContact O-CG1 3.23Å; Y350-I354 PolarHBondContact O-N 3.15Å
351	R	92	Very high	91.6	Very high	141 Å²	141	95.3 Å²	95.3	53%	0.532	48%	0.483	S	S	.	.	H	α-helix	trans	-60.3	-54.5	175.5	-168.5	-173.2	-56.6	137.1	8.2	111.1	C347 E348 R353 I354 D355	C347-R351 WeakPolarHBondContact O-CB 3.3Å; C347-R351 PolarHBondContact O-N 3.04Å; E348-R351 WeakPolarHBondContact O-CB 3.46Å; E348-R351 PolarHBondContact O-N 2.96Å; R351-R353 PolarHBondContact O-N 3.45Å; R351-R353 VanDerWaalsContact O-N 3.15Å; R351-I354 WeakPolarHBondContact O-CA 3.37Å; R351-I354 WeakPolarHBondContact O-CB 3.06Å; R351-I354 PolarHBondContact O-N 3.15Å; R351-D355 VanDerWaalsContact O-CG 3.24Å; R351-D355 PolarHBondContact O-N 3.36Å
352	N	94.9	Very high	91.4	Very high	98 Å²	98	97.2 Å²	97.2	52%	0.524	49%	0.489	S	S	.	.	H	α-helix	trans	-56	-35.9	178.3	-64.2	-20.2	0	0	0	112.3	E348 T356	E348-N352 PolarHBondContact O-N 3.35Å; E348-N352 PolarHBondContact O-ND2 3.26Å; N352-T356 WeakPolarHBondContact O-CB 3.35Å; N352-T356 PolarHBondContact O-N 2.84Å; N352-T356 PolarHBondContact O-OG1 2.69Å
353	R	94.9	Very high	91.3	Very high	158 Å²	158	99.7 Å²	99.7	60%	0.596	50%	0.496	S	S	*	.	H	α-helix	trans	-69.9	-39.7	175.6	-174.5	173.9	179.8	169.2	0	112.8	M349 Y350 R351 T356 I357	M349-R353 WeakPolarHBondContact O-CB 3.42Å; M349-R353 PolarHBondContact O-N 3.29Å; Y350-R353 PolarHBondContact O-N 2.78Å; R351-R353 PolarHBondContact O-N 3.45Å; R351-R353 VanDerWaalsContact O-N 3.15Å; R353-T356 PolarHBondContact O-N 2.84Å; R353-I357 HydrophobicContact CG-CD1 4.15Å; R353-I357 WeakPolarHBondContact O-CD1 3.28Å; R353-I357 VanDerWaalsContact O-CG1 3.29Å; R353-I357 WeakPolarHBondContact O-CG1 3.2Å; R353-I357 PolarHBondContact O-N 3.12Å
354	I	89.5	Confident	91.2	Very high	104 Å²	104	98.6 Å²	98.6	53%	0.533	49%	0.494	S	S	.	.	H	α-helix	trans	-64.4	-47	173.5	-69.9	163.4	0	0	0	109.8	Y350 R351 T356 I357 S358	Y350-I354 VanDerWaalsContact O-CG1 3.32Å; Y350-I354 WeakPolarHBondContact O-CG1 3.23Å; Y350-I354 PolarHBondContact O-N 3.15Å; R351-I354 WeakPolarHBondContact O-CA 3.37Å; R351-I354 WeakPolarHBondContact O-CB 3.06Å; R351-I354 PolarHBondContact O-N 3.15Å; I354-T356 VanDerWaalsContact C-N 3.28Å; I354-T356 PolarHBondContact O-N 3.28Å; I354-I357 PolarHBondContact O-N 2.84Å; I354-I357 VanDerWaalsContact O-N 3.11Å; I354-S358 PolarHBondContact O-N 2.82Å; I354-S358 PolarHBondContact O-OG 2.79Å
355	D	91.9	Very high	90.9	Very high	88 Å²	88	97.5 Å²	97.5	47%	0.471	49%	0.489	S	S	.	.	H	α-helix	trans	-58.8	-40.1	177.7	-59.5	-32.3	0	0	0	111.7	R351 S358 A359	R351-D355 VanDerWaalsContact O-CG 3.24Å; R351-D355 PolarHBondContact O-N 3.36Å; D355-S358 PolarHBondContact O-N 2.85Å; D355-A359 PolarHBondContact O-N 2.62Å
356	T	93.8	Very high	90.8	Very high	81 Å²	81	97.5 Å²	97.5	50%	0.497	49%	0.489	S	S	.	.	H	α-helix	trans	-64.3	-43.8	175.1	-56.8	0	0	0	0	112.1	N352 R353 I354 A359 Q360	N352-T356 WeakPolarHBondContact O-CB 3.35Å; N352-T356 PolarHBondContact O-N 2.84Å; N352-T356 PolarHBondContact O-OG1 2.69Å; R353-T356 PolarHBondContact O-N 2.84Å; I354-T356 VanDerWaalsContact C-N 3.28Å; I354-T356 PolarHBondContact O-N 3.28Å; T356-A359 PolarHBondContact O-N 3.05Å; T356-Q360 WeakPolarHBondContact O-CG 3.39Å; T356-Q360 PolarHBondContact O-N 3.06Å; T356-Q360 VanDerWaalsContact O-N 3.13Å
357	I	92.7	Very high	90.6	Very high	80 Å²	80	100.7 Å²	100.7	41%	0.41	50%	0.502	S	S	.	.	H	α-helix	trans	-66.4	-39.2	177.2	-69.7	164.9	0	0	0	110.6	R353 I354 Q360 L361	R353-I357 HydrophobicContact CG-CD1 4.15Å; R353-I357 WeakPolarHBondContact O-CD1 3.28Å; R353-I357 VanDerWaalsContact O-CG1 3.29Å; R353-I357 WeakPolarHBondContact O-CG1 3.2Å; R353-I357 PolarHBondContact O-N 3.12Å; I354-I357 PolarHBondContact O-N 2.84Å; I354-I357 VanDerWaalsContact O-N 3.11Å; I357-Q360 PolarHBondContact O-N 3.29Å; I357-L361 HydrophobicContact CG2-CD1 4.13Å; I357-L361 WeakPolarHBondContact O-CG 3.26Å; I357-L361 PolarHBondContact O-N 3.2Å
358	S	86.9	Confident	90.7	Very high	54 Å²	54	102.5 Å²	102.5	38%	0.378	50%	0.499	S	S	.	.	H	α-helix	trans	-61.1	-45.3	174.3	-65.1	0	0	0	0	111.8	I354 D355 Q360 L361 D362	I354-S358 PolarHBondContact O-N 2.82Å; I354-S358 PolarHBondContact O-OG 2.79Å; D355-S358 PolarHBondContact O-N 2.85Å; S358-Q360 VanDerWaalsContact C-N 3.29Å; S358-Q360 PolarHBondContact O-N 2.93Å; S358-L361 PolarHBondContact O-N 2.75Å; S358-L361 VanDerWaalsContact O-N 3.16Å; S358-D362 PolarHBondContact O-N 3.49Å
359	A	91.3	Very high	90.3	Very high	57 Å²	57	101.7 Å²	101.7	47%	0.471	50%	0.497	S	S	.	.	H	α-helix	trans	-61.7	-35	176.1	0	0	0	0	0	113.1	D355 T356 E363	D355-A359 PolarHBondContact O-N 2.62Å; T356-A359 PolarHBondContact O-N 3.05Å; A359-E363 PolarHBondContact O-N 3.24Å; A359-E363 VanDerWaalsContact O-N 3.17Å
360	Q	91.2	Very high	90.2	Very high	116 Å²	116	103.2 Å²	103.2	54%	0.542	50%	0.503	S	S	.	.	H	α-helix	trans	-70	-38.4	173.9	-71.8	179.2	-31.2	0	0	112.4	T356 I357 S358 E363 V364	T356-Q360 WeakPolarHBondContact O-CG 3.39Å; T356-Q360 PolarHBondContact O-N 3.06Å; T356-Q360 VanDerWaalsContact O-N 3.13Å; I357-Q360 PolarHBondContact O-N 3.29Å; S358-Q360 VanDerWaalsContact C-N 3.29Å; S358-Q360 PolarHBondContact O-N 2.93Å; Q360-E363 PolarHBondContact O-N 3.48Å; Q360-V364 WeakPolarHBondContact O-CG2 3.34Å; Q360-V364 PolarHBondContact O-N 2.69Å
361	L	85.3	Confident	89.8	Confident	111 Å²	111	99.5 Å²	99.5	58%	0.581	50%	0.501	S	S	*	.	H	α-helix	trans	-65.4	-40.7	174.2	-70.7	168.6	0	0	0	111.6	I357 S358 E363 V364 E365	I357-L361 HydrophobicContact CG2-CD1 4.13Å; I357-L361 WeakPolarHBondContact O-CG 3.26Å; I357-L361 PolarHBondContact O-N 3.2Å; S358-L361 PolarHBondContact O-N 2.75Å; S358-L361 VanDerWaalsContact O-N 3.16Å; L361-E363 PolarHBondContact O-N 3.5Å; L361-V364 PolarHBondContact O-N 2.97Å; L361-E365 WeakPolarHBondContact O-CB 3.43Å; L361-E365 PolarHBondContact O-N 3.43Å
362	D	88.9	Confident	89.2	Confident	89 Å²	89	96.9 Å²	96.9	48%	0.476	49%	0.494	S	S	.	.	H	α-helix	trans	-61.8	-28.7	173	-80.6	8.2	0	0	0	112.8	S358 K366	S358-D362 PolarHBondContact O-N 3.49Å; D362-K366 WeakPolarHBondContact O-CD 3.44Å; D362-K366 WeakPolarHBondContact O-CE 3.18Å; D362-K366 WeakPolarHBondContact O-CG 3.37Å; D362-K366 PolarHBondContact O-N 2.83Å; D362-K366 PolarHBondContact O-NZ 2.85Å
363	E	92.1	Very high	88.8	Confident	123 Å²	123	98 Å²	98	58%	0.575	49%	0.49	S	S	*	.	H	α-helix	trans	-77.4	-46.6	175.7	-171.7	160.2	-133.2	0	0	111.1	A359 Q360 L361 E365 K366 E367	A359-E363 PolarHBondContact O-N 3.24Å; A359-E363 VanDerWaalsContact O-N 3.17Å; Q360-E363 PolarHBondContact O-N 3.48Å; L361-E363 PolarHBondContact O-N 3.5Å; E363-E365 VanDerWaalsContact C-N 3.28Å; E363-E365 PolarHBondContact O-N 2.94Å; E363-K366 WeakPolarHBondContact O-CB 3.43Å; E363-K366 PolarHBondContact O-N 2.82Å; E363-E367 PolarHBondContact O-N 2.89Å
364	V	89.9	Confident	88.3	Confident	90 Å²	90	93.1 Å²	93.1	55%	0.545	48%	0.484	S	S	.	.	H	α-helix	trans	-60.4	-35.2	174	172.9	0	0	0	0	111.9	Q360 L361 E367 R368	Q360-V364 WeakPolarHBondContact O-CG2 3.34Å; Q360-V364 PolarHBondContact O-N 2.69Å; L361-V364 PolarHBondContact O-N 2.97Å; V364-E367 PolarHBondContact O-N 3.26Å; V364-R368 VanDerWaalsContact O-CB 3.27Å; V364-R368 WeakPolarHBondContact O-CB 3.34Å; V364-R368 PolarHBondContact O-N 2.99Å
365	E	83.8	Confident	88.1	Confident	94 Å²	94	92.6 Å²	92.6	44%	0.439	48%	0.475	S	S	.	.	H	α-helix	trans	-65	-40.2	172.8	175.2	146.3	-106.9	0	0	112.3	L361 E363 R368 D369	L361-E365 WeakPolarHBondContact O-CB 3.43Å; L361-E365 PolarHBondContact O-N 3.43Å; E363-E365 VanDerWaalsContact C-N 3.28Å; E363-E365 PolarHBondContact O-N 2.94Å; E365-R368 PolarHBondContact O-N 2.72Å; E365-R368 IonicContact OE1-CZ 3.48Å; E365-R368 IonicContact OE1-NH1 3.25Å; E365-R368 PolarHBondContact OE1-NH1 3Å; E365-R368 IonicContact OE1-NH2 3.02Å; E365-R368 PolarHBondContact OE1-NH2 3.47Å; E365-D369 WeakPolarHBondContact O-CB 3.48Å; E365-D369 PolarHBondContact O-N 2.95Å
366	K	90.8	Very high	87.7	Confident	128 Å²	128	88.8 Å²	88.8	56%	0.557	46%	0.455	S	S	*	.	H	α-helix	trans	-66	-42.4	175.8	-68.1	158.6	-161.5	134.5	0	111.7	D362 E363 D369 Q370	D362-K366 WeakPolarHBondContact O-CD 3.44Å; D362-K366 WeakPolarHBondContact O-CE 3.18Å; D362-K366 WeakPolarHBondContact O-CG 3.37Å; D362-K366 PolarHBondContact O-N 2.83Å; D362-K366 PolarHBondContact O-NZ 2.85Å; E363-K366 WeakPolarHBondContact O-CB 3.43Å; E363-K366 PolarHBondContact O-N 2.82Å; K366-D369 PolarHBondContact O-N 3.41Å; K366-Q370 WeakPolarHBondContact O-CB 3.5Å; K366-Q370 PolarHBondContact O-N 3.46Å
367	E	88.5	Confident	87.3	Confident	129 Å²	129	90.5 Å²	90.5	60%	0.603	46%	0.457	S	S	*	.	H	α-helix	trans	-63	-46.7	175.3	-70.4	-162.2	142.7	0	0	111.8	E363 V364 D369 Q370 A371	E363-E367 PolarHBondContact O-N 2.89Å; V364-E367 PolarHBondContact O-N 3.26Å; E367-D369 VanDerWaalsContact C-N 3.32Å; E367-D369 PolarHBondContact O-N 3.2Å; E367-Q370 PolarHBondContact O-N 3.04Å; E367-A371 WeakPolarHBondContact O-CB 3.42Å; E367-A371 PolarHBondContact O-N 2.8Å
368	R	88	Confident	87	Confident	106 Å²	106	88.7 Å²	88.7	40%	0.4	45%	0.454	S	S	.	.	H	α-helix	trans	-53.5	-49.1	174.5	-179	-158.5	74.8	-155.1	0.5	111.3	V364 E365 A371 F372	V364-R368 VanDerWaalsContact O-CB 3.27Å; V364-R368 WeakPolarHBondContact O-CB 3.34Å; V364-R368 PolarHBondContact O-N 2.99Å; E365-R368 PolarHBondContact O-N 2.72Å; E365-R368 IonicContact OE1-CZ 3.48Å; E365-R368 IonicContact OE1-NH1 3.25Å; E365-R368 PolarHBondContact OE1-NH1 3Å; E365-R368 IonicContact OE1-NH2 3.02Å; E365-R368 PolarHBondContact OE1-NH2 3.47Å; R368-A371 PolarHBondContact O-N 2.94Å; R368-F372 HydrophobicContact CG-CD2 4.03Å; R368-F372 HydrophobicContact CG-CE2 3.58Å; R368-F372 HydrophobicContact CG-CZ 4.17Å; R368-F372 WeakPolarHBondContact O-CD2 3.29Å; R368-F372 PolarHBondContact O-N 3.44Å
369	D	86	Confident	86.7	Confident	55 Å²	55	90.2 Å²	90.2	29%	0.294	46%	0.455	S	S	.	.	H	α-helix	trans	-72.8	-29.7	-177.2	-75	1.1	0	0	0	112.5	E365 K366 E367 R373	E365-D369 WeakPolarHBondContact O-CB 3.48Å; E365-D369 PolarHBondContact O-N 2.95Å; K366-D369 PolarHBondContact O-N 3.41Å; E367-D369 VanDerWaalsContact C-N 3.32Å; E367-D369 PolarHBondContact O-N 3.2Å; D369-R373 WeakPolarHBondContact O-CG 3.07Å; D369-R373 PolarHBondContact O-N 2.89Å; D369-R373 PolarHBondContact O-NH1 2.85Å
370	Q	91.7	Very high	86.4	Confident	126 Å²	126	93 Å²	93	59%	0.589	46%	0.458	S	S	*	.	H	α-helix	trans	-67	-43.5	169.5	-177.9	169.5	-15.7	0	0	111.7	K366 E367 F372 R373 A374	K366-Q370 WeakPolarHBondContact O-CB 3.5Å; K366-Q370 PolarHBondContact O-N 3.46Å; E367-Q370 PolarHBondContact O-N 3.04Å; Q370-F372 VanDerWaalsContact C-N 3.34Å; Q370-F372 PolarHBondContact O-N 3.26Å; Q370-R373 PolarHBondContact O-N 3.37Å; Q370-A374 WeakPolarHBondContact O-CB 3.46Å; Q370-A374 PolarHBondContact O-N 3.08Å
371	A	81.9	Confident	86.3	Confident	61 Å²	61	93.7 Å²	93.7	50%	0.504	46%	0.461	S	S	.	.	H	α-helix	trans	-62.8	-39.9	176	0	0	0	0	0	111.9	E367 R368 R375	E367-A371 WeakPolarHBondContact O-CB 3.42Å; E367-A371 PolarHBondContact O-N 2.8Å; R368-A371 PolarHBondContact O-N 2.94Å; A371-R375 VanDerWaalsContact O-CB 3.31Å; A371-R375 WeakPolarHBondContact O-CB 2.98Å; A371-R375 PolarHBondContact O-N 3.23Å
372	F	78.5	Confident	86.1	Confident	87 Å²	87	95.8 Å²	95.8	38%	0.382	47%	0.466	S	S	.	.	H	α-helix	trans	-63.5	-50	171.5	-71	-37.5	0	0	0	112.1	R368 Q370 A374 R375 D376	R368-F372 HydrophobicContact CG-CD2 4.03Å; R368-F372 HydrophobicContact CG-CE2 3.58Å; R368-F372 HydrophobicContact CG-CZ 4.17Å; R368-F372 WeakPolarHBondContact O-CD2 3.29Å; R368-F372 PolarHBondContact O-N 3.44Å; Q370-F372 VanDerWaalsContact C-N 3.34Å; Q370-F372 PolarHBondContact O-N 3.26Å; F372-A374 VanDerWaalsContact C-N 3.33Å; F372-A374 PolarHBondContact O-N 3.45Å; F372-R375 PolarHBondContact O-N 2.97Å; F372-D376 WeakPolarHBondContact O-CB 3.43Å; F372-D376 PolarHBondContact O-N 2.87Å; F372-D376 VanDerWaalsContact O-N 3.09Å
373	R	87.3	Confident	85.8	Confident	120 Å²	120	94 Å²	94	45%	0.453	46%	0.461	S	S	.	.	H	α-helix	trans	-53.9	-48.9	177.1	-74.2	-174.1	-58.3	-85.8	3.8	111.9	D369 Q370 D376 E377	D369-R373 WeakPolarHBondContact O-CG 3.07Å; D369-R373 PolarHBondContact O-N 2.89Å; D369-R373 PolarHBondContact O-NH1 2.85Å; Q370-R373 PolarHBondContact O-N 3.37Å; R373-D376 PolarHBondContact O-N 3.32Å; R373-E377 WeakPolarHBondContact O-CG 3.48Å; R373-E377 PolarHBondContact O-N 2.79Å
374	A	84.6	Confident	85.6	Confident	56 Å²	56	92.1 Å²	92.1	46%	0.463	45%	0.452	S	S	.	.	H	α-helix	trans	-64.9	-43.2	-179.2	0	0	0	0	0	113.7	Q370 F372 D376 A378	Q370-A374 WeakPolarHBondContact O-CB 3.46Å; Q370-A374 PolarHBondContact O-N 3.08Å; F372-A374 VanDerWaalsContact C-N 3.33Å; F372-A374 PolarHBondContact O-N 3.45Å; A374-D376 PolarHBondContact O-N 2.68Å; A374-A378 PolarHBondContact O-N 2.91Å
375	R	85.9	Confident	85.4	Confident	93 Å²	93	90.7 Å²	90.7	35%	0.351	45%	0.446	S	S	.	.	H	α-helix	trans	-54.8	-41.9	173.9	178.5	-169.1	70	177.2	-1.3	111.2	A371 F372 A378 Q379	A371-R375 VanDerWaalsContact O-CB 3.31Å; A371-R375 WeakPolarHBondContact O-CB 2.98Å; A371-R375 PolarHBondContact O-N 3.23Å; F372-R375 PolarHBondContact O-N 2.97Å; R375-A378 WeakPolarHBondContact O-CB 3.27Å; R375-Q379 PolarHBondContact O-N 2.99Å
376	D	82.8	Confident	85.3	Confident	8 Å²	8	91.1 Å²	91.1	4%	0.043	45%	0.45	C	S	.	.	H	α-helix	trans	-91.3	-27.7	-168	-81.6	-94.3	0	0	0	114.4	F372 R373 A374 A378 Q379 H380 P885 R886	F372-D376 WeakPolarHBondContact O-CB 3.43Å; F372-D376 PolarHBondContact O-N 2.87Å; F372-D376 VanDerWaalsContact O-N 3.09Å; R373-D376 PolarHBondContact O-N 3.32Å; A374-D376 PolarHBondContact O-N 2.68Å; D376-A378 VanDerWaalsContact C-N 3.26Å; D376-Q379 PolarHBondContact O-N 2.85Å; D376-H380 WeakPolarHBondContact O-CB 3.44Å; D376-H380 PolarHBondContact O-N 2.76Å; D376-P885 HydrophobicContact CB-CB 3.24Å; D376-P885 HydrophobicContact CB-CG 3.3Å; D376-P885 WeakPolarHBondContact OD1-CB 3.47Å; D376-P885 VanDerWaalsContact OD1-CG 3.28Å; D376-P885 WeakPolarHBondContact OD1-CG 3.49Å; D376-R886 PolarHBondContact OD1-N 2.91Å
377	E	85.8	Confident	85.1	Confident	118 Å²	118	89.1 Å²	89.1	55%	0.551	45%	0.449	S	S	*	.	H	α-helix	trans	-57.3	-44.3	161.5	-75.9	166.7	-165.5	0	0	109.7	R373 H380 H381	R373-E377 WeakPolarHBondContact O-CG 3.48Å; R373-E377 PolarHBondContact O-N 2.79Å; E377-H380 PolarHBondContact O-N 2.67Å; E377-H381 PolarHBondContact O-CD2 2.81Å; E377-H381 PolarHBondContact O-N 3.04Å
378	A	85	Confident	85.2	Confident	41 Å²	41	85.4 Å²	85.4	34%	0.339	43%	0.433	S	S	.	.	H	α-helix	trans	-62.1	-44.1	173.3	0	0	0	0	0	112.5	A374 R375 D376 H380 H381 F382	A374-A378 PolarHBondContact O-N 2.91Å; R375-A378 WeakPolarHBondContact O-CB 3.27Å; D376-A378 VanDerWaalsContact C-N 3.26Å; A378-H380 VanDerWaalsContact C-N 3.31Å; A378-H380 PolarHBondContact O-N 3.31Å; A378-H381 PolarHBondContact O-N 3.11Å; A378-F382 HydrophobicContact CB-CE2 4.47Å; A378-F382 WeakPolarHBondContact O-CD2 3.34Å; A378-F382 PolarHBondContact O-N 2.86Å
379	Q	80.6	Confident	85.1	Confident	87 Å²	87	86.6 Å²	86.6	41%	0.407	44%	0.441	S	S	.	.	H	α-helix	trans	-60.2	-38.7	173	-72.5	-169.9	1	0	0	112.7	R375 D376 F382 S383	R375-Q379 PolarHBondContact O-N 2.99Å; D376-Q379 PolarHBondContact O-N 2.85Å; Q379-F382 PolarHBondContact O-N 2.88Å; Q379-S383 WeakPolarHBondContact O-CB 3.37Å; Q379-S383 PolarHBondContact O-N 2.8Å
380	H	86.9	Confident	85	Confident	115 Å²	115	87.3 Å²	87.3	53%	0.532	45%	0.445	S	S	.	.	H	α-helix	trans	-65.2	-43.9	176.4	-176.6	31.4	0	0	0	111.5	D376 E377 A378 F382 S383 Q384	D376-H380 WeakPolarHBondContact O-CB 3.44Å; D376-H380 PolarHBondContact O-N 2.76Å; E377-H380 PolarHBondContact O-N 2.67Å; A378-H380 VanDerWaalsContact C-N 3.31Å; A378-H380 PolarHBondContact O-N 3.31Å; H380-F382 PolarHBondContact O-N 3.01Å; H380-S383 PolarHBondContact O-N 2.77Å; H380-Q384 WeakPolarHBondContact O-CB 3.48Å; H380-Q384 PolarHBondContact O-N 2.81Å
381	H	87.4	Confident	85	Confident	130 Å²	130	87 Å²	87	60%	0.602	44%	0.442	S	S	*	.	H	α-helix	trans	-61.7	-39.8	173.9	-73.2	-57.7	0	0	0	112.8	E377 A378 S385	E377-H381 PolarHBondContact O-CD2 2.81Å; E377-H381 PolarHBondContact O-N 3.04Å; A378-H381 PolarHBondContact O-N 3.11Å; H381-S385 VanDerWaalsContact O-CB 3.3Å; H381-S385 WeakPolarHBondContact O-CB 3.12Å; H381-S385 PolarHBondContact O-N 3.06Å; H381-S385 PolarHBondContact O-OG 3.05Å
382	F	80.9	Confident	85.4	Confident	155 Å²	155	90.6 Å²	90.6	68%	0.68	44%	0.443	S	S	*	.	H	α-helix	trans	-65.5	-43.3	173.4	-73.9	-57.4	0	0	0	112.1	A378 Q379 H380 S385 L386	A378-F382 HydrophobicContact CB-CE2 4.47Å; A378-F382 WeakPolarHBondContact O-CD2 3.34Å; A378-F382 PolarHBondContact O-N 2.86Å; Q379-F382 PolarHBondContact O-N 2.88Å; H380-F382 PolarHBondContact O-N 3.01Å; F382-S385 PolarHBondContact O-N 2.63Å; F382-L386 PolarHBondContact O-N 2.92Å
383	S	83.5	Confident	85.8	Confident	52 Å²	52	92.2 Å²	92.2	36%	0.364	45%	0.447	S	S	.	.	H	α-helix	trans	-61.4	-45.3	177	178.7	0	0	0	0	111.9	Q379 H380 L386 V387	Q379-S383 WeakPolarHBondContact O-CB 3.37Å; Q379-S383 PolarHBondContact O-N 2.8Å; H380-S383 PolarHBondContact O-N 2.77Å; S383-L386 WeakPolarHBondContact O-CB 3.46Å; S383-L386 PolarHBondContact O-N 3.14Å; S383-V387 WeakPolarHBondContact O-CG2 3.45Å; S383-V387 PolarHBondContact O-N 2.8Å; S383-V387 VanDerWaalsContact O-N 3.11Å
384	Q	87.4	Confident	85.8	Confident	84 Å²	84	92.3 Å²	92.3	39%	0.393	45%	0.451	S	S	.	.	H	α-helix	trans	-62.2	-46	175	-176.3	56.4	46.7	0	0	111.2	H380 L386 V387 D388	H380-Q384 WeakPolarHBondContact O-CB 3.48Å; H380-Q384 PolarHBondContact O-N 2.81Å; Q384-L386 PolarHBondContact O-N 3.46Å; Q384-V387 PolarHBondContact O-N 3.09Å; Q384-V387 VanDerWaalsContact O-N 3.16Å; Q384-D388 VanDerWaalsContact NE2-CG 3.29Å; Q384-D388 PolarHBondContact NE2-OD1 3.31Å; Q384-D388 PolarHBondContact NE2-OD2 3.15Å; Q384-D388 PolarHBondContact O-N 2.84Å
385	S	86	Confident	86.2	Confident	60 Å²	60	93.8 Å²	93.8	42%	0.42	45%	0.448	S	S	.	.	H	α-helix	trans	-60.2	-27.6	176.3	-59.5	0	0	0	0	113.5	H381 F382 K389	H381-S385 VanDerWaalsContact O-CB 3.3Å; H381-S385 WeakPolarHBondContact O-CB 3.12Å; H381-S385 PolarHBondContact O-N 3.06Å; H381-S385 PolarHBondContact O-OG 3.05Å; F382-S385 PolarHBondContact O-N 2.63Å; S385-K389 WeakPolarHBondContact O-CB 3.31Å; S385-K389 VanDerWaalsContact O-CG 3.24Å; S385-K389 WeakPolarHBondContact O-CG 3.5Å; S385-K389 PolarHBondContact O-N 2.94Å
386	L	82.1	Confident	86.3	Confident	102 Å²	102	94 Å²	94	53%	0.534	46%	0.455	S	S	.	.	H	α-helix	trans	-75.2	-47.5	175	-151.8	81.4	0	0	0	111.1	F382 S383 Q384 D388 K389 D390	F382-L386 PolarHBondContact O-N 2.92Å; S383-L386 WeakPolarHBondContact O-CB 3.46Å; S383-L386 PolarHBondContact O-N 3.14Å; Q384-L386 PolarHBondContact O-N 3.46Å; L386-D388 VanDerWaalsContact C-N 3.31Å; L386-D388 PolarHBondContact O-N 2.79Å; L386-K389 WeakPolarHBondContact O-CB 3.49Å; L386-K389 PolarHBondContact O-N 3.01Å; L386-K389 VanDerWaalsContact O-N 3.17Å; L386-D390 PolarHBondContact O-N 3.44Å
387	V	87.3	Confident	86.3	Confident	86 Å²	86	101.5 Å²	101.5	52%	0.521	48%	0.483	S	S	.	.	H	α-helix	trans	-58.7	-42.9	176.2	172.3	0	0	0	0	111.2	S383 Q384 D390 K391	S383-V387 WeakPolarHBondContact O-CG2 3.45Å; S383-V387 PolarHBondContact O-N 2.8Å; S383-V387 VanDerWaalsContact O-N 3.11Å; Q384-V387 PolarHBondContact O-N 3.09Å; Q384-V387 VanDerWaalsContact O-N 3.16Å; V387-D390 PolarHBondContact O-N 2.7Å; V387-K391 WeakPolarHBondContact O-CB 3.45Å; V387-K391 PolarHBondContact O-N 3.22Å
388	D	88.9	Confident	86.4	Confident	52 Å²	52	99 Å²	99	28%	0.278	47%	0.471	S	S	.	.	H	α-helix	trans	-66.7	-40.6	176.6	-69.7	-40.1	0	0	0	111.8	Q384 L386 D390 K391 Y392	Q384-D388 VanDerWaalsContact NE2-CG 3.29Å; Q384-D388 PolarHBondContact NE2-OD1 3.31Å; Q384-D388 PolarHBondContact NE2-OD2 3.15Å; Q384-D388 PolarHBondContact O-N 2.84Å; L386-D388 VanDerWaalsContact C-N 3.31Å; L386-D388 PolarHBondContact O-N 2.79Å; D388-D390 VanDerWaalsContact C-N 3.35Å; D388-D390 PolarHBondContact O-N 3.39Å; D388-K391 WeakPolarHBondContact O-CB 3.48Å; D388-K391 PolarHBondContact O-N 3.15Å; D388-Y392 HydrophobicContact CB-CE2 4.25Å; D388-Y392 WeakPolarHBondContact O-CD2 3.46Å; D388-Y392 PolarHBondContact O-N 3.48Å
389	K	86.6	Confident	86.6	Confident	130 Å²	130	102.6 Å²	102.6	57%	0.565	48%	0.484	S	S	*	.	H	α-helix	trans	-59.6	-42.4	172.1	-81.7	173.2	179.7	179.6	0	112.5	S385 L386 Y392 R393	S385-K389 WeakPolarHBondContact O-CB 3.31Å; S385-K389 VanDerWaalsContact O-CG 3.24Å; S385-K389 WeakPolarHBondContact O-CG 3.5Å; S385-K389 PolarHBondContact O-N 2.94Å; L386-K389 WeakPolarHBondContact O-CB 3.49Å; L386-K389 PolarHBondContact O-N 3.01Å; L386-K389 VanDerWaalsContact O-N 3.17Å; K389-Y392 PolarHBondContact O-N 2.9Å; K389-R393 WeakPolarHBondContact O-CB 3.27Å; K389-R393 VanDerWaalsContact O-CG 3.29Å; K389-R393 WeakPolarHBondContact O-CG 3.46Å; K389-R393 PolarHBondContact O-N 2.97Å
390	D	83.6	Confident	86.7	Confident	71 Å²	71	102.3 Å²	102.3	38%	0.38	48%	0.482	S	S	.	.	H	α-helix	trans	-72.6	-31.6	179.8	-72.2	-26.1	0	0	0	112.5	L386 V387 D388 R393 K394	L386-D390 PolarHBondContact O-N 3.44Å; V387-D390 PolarHBondContact O-N 2.7Å; D388-D390 VanDerWaalsContact C-N 3.35Å; D388-D390 PolarHBondContact O-N 3.39Å; D390-R393 PolarHBondContact O-N 2.87Å; D390-R393 WeakPolarHBondContact OD1-CD 3.37Å; D390-R393 IonicContact OD1-CZ 2.85Å; D390-R393 IonicContact OD1-NE 3.66Å; D390-R393 IonicContact OD1-NH1 3.37Å; D390-R393 PolarHBondContact OD1-NH1 3.2Å; D390-K394 WeakPolarHBondContact O-CB 3.5Å; D390-K394 PolarHBondContact O-N 2.65Å
391	K	91.3	Very high	86.5	Confident	120 Å²	120	103.5 Å²	103.5	52%	0.522	49%	0.489	S	S	.	.	H	α-helix	trans	-60.7	-46.7	167.1	-176.2	-177.8	178.6	-176	0	111.6	V387 D388 K394 Q395	V387-K391 WeakPolarHBondContact O-CB 3.45Å; V387-K391 PolarHBondContact O-N 3.22Å; D388-K391 WeakPolarHBondContact O-CB 3.48Å; D388-K391 PolarHBondContact O-N 3.15Å; K391-K394 PolarHBondContact O-N 2.92Å; K391-Q395 WeakPolarHBondContact O-CG 3.41Å; K391-Q395 PolarHBondContact O-N 3.18Å
392	Y	91.8	Very high	86.6	Confident	136 Å²	136	102.5 Å²	102.5	53%	0.533	48%	0.482	S	S	.	.	H	α-helix	trans	-66	-40.4	175	-64.7	-55.3	0	0	0	112.3	D388 K389 K394 Q395 I396	D388-Y392 HydrophobicContact CB-CE2 4.25Å; D388-Y392 WeakPolarHBondContact O-CD2 3.46Å; D388-Y392 PolarHBondContact O-N 3.48Å; K389-Y392 PolarHBondContact O-N 2.9Å; Y392-K394 VanDerWaalsContact C-N 3.26Å; Y392-K394 PolarHBondContact O-N 2.78Å; Y392-Q395 PolarHBondContact O-N 3.42Å; Y392-I396 VanDerWaalsContact O-CG1 3.3Å; Y392-I396 WeakPolarHBondContact O-CG1 3.39Å; Y392-I396 PolarHBondContact O-N 2.72Å
393	R	86.1	Confident	86.8	Confident	121 Å²	121	98.6 Å²	98.6	46%	0.457	47%	0.474	S	S	.	.	H	α-helix	trans	-60.6	-31.8	172.4	-74.5	160.7	155.4	179.3	-8.2	113	K389 D390 R397	K389-R393 WeakPolarHBondContact O-CB 3.27Å; K389-R393 VanDerWaalsContact O-CG 3.29Å; K389-R393 WeakPolarHBondContact O-CG 3.46Å; K389-R393 PolarHBondContact O-N 2.97Å; D390-R393 PolarHBondContact O-N 2.87Å; D390-R393 WeakPolarHBondContact OD1-CD 3.37Å; D390-R393 IonicContact OD1-CZ 2.85Å; D390-R393 IonicContact OD1-NE 3.66Å; D390-R393 IonicContact OD1-NH1 3.37Å; D390-R393 PolarHBondContact OD1-NH1 3.2Å; R393-R397 WeakPolarHBondContact O-CG 3.37Å; R393-R397 PolarHBondContact O-N 3.29Å; R393-R397 PolarHBondContact O-NE 2.82Å
394	K	87.7	Confident	86.5	Confident	122 Å²	122	99 Å²	99	53%	0.53	47%	0.472	S	S	.	.	H	α-helix	trans	-71.4	-47	172.8	-168.4	175.4	-172.4	-77.6	0	111	D390 K391 Y392 I396 R397 E398	D390-K394 WeakPolarHBondContact O-CB 3.5Å; D390-K394 PolarHBondContact O-N 2.65Å; K391-K394 PolarHBondContact O-N 2.92Å; Y392-K394 VanDerWaalsContact C-N 3.26Å; Y392-K394 PolarHBondContact O-N 2.78Å; K394-I396 VanDerWaalsContact C-N 3.34Å; K394-I396 PolarHBondContact O-N 2.76Å; K394-R397 PolarHBondContact O-N 2.81Å; K394-E398 WeakPolarHBondContact CG-OE1 3.41Å; K394-E398 IonicContact NZ-OE1 2.61Å; K394-E398 PolarHBondContact NZ-OE1 2.81Å; K394-E398 WeakPolarHBondContact O-CG 3.3Å; K394-E398 PolarHBondContact O-N 3.21Å
395	Q	93.2	Very high	86.4	Confident	87 Å²	87	101.6 Å²	101.6	41%	0.407	48%	0.484	S	S	.	.	H	α-helix	trans	-60.6	-39.2	176.4	-71.8	178.6	-30.7	0	0	113.1	K391 Y392 E398 L399	K391-Q395 WeakPolarHBondContact O-CG 3.41Å; K391-Q395 PolarHBondContact O-N 3.18Å; Y392-Q395 PolarHBondContact O-N 3.42Å; Q395-E398 PolarHBondContact O-N 3.13Å; Q395-L399 WeakPolarHBondContact O-CB 3.37Å; Q395-L399 VanDerWaalsContact O-CG 3.28Å; Q395-L399 WeakPolarHBondContact O-CG 3.29Å; Q395-L399 PolarHBondContact O-N 3.1Å
396	I	86.9	Confident	86.4	Confident	98 Å²	98	104.2 Å²	104.2	50%	0.503	49%	0.493	S	S	.	.	H	α-helix	trans	-61.5	-49.7	175.3	-70.1	163.7	0	0	0	110.3	Y392 K394 E398 L399 E400	Y392-I396 VanDerWaalsContact O-CG1 3.3Å; Y392-I396 WeakPolarHBondContact O-CG1 3.39Å; Y392-I396 PolarHBondContact O-N 2.72Å; K394-I396 VanDerWaalsContact C-N 3.34Å; K394-I396 PolarHBondContact O-N 2.76Å; I396-E398 PolarHBondContact O-N 2.9Å; I396-L399 PolarHBondContact O-N 2.91Å; I396-E400 HydrophobicContact CG2-CG 4.44Å; I396-E400 PolarHBondContact O-N 3.35Å
397	R	83	Confident	86.5	Confident	164 Å²	164	104.5 Å²	104.5	62%	0.619	49%	0.492	S	S	*	.	H	α-helix	trans	-62.3	-41	177.9	-73.8	-178	-70.2	176.8	0.2	112.9	R393 K394 L399 E400 E401	R393-R397 WeakPolarHBondContact O-CG 3.37Å; R393-R397 PolarHBondContact O-N 3.29Å; R393-R397 PolarHBondContact O-NE 2.82Å; K394-R397 PolarHBondContact O-N 2.81Å; R397-L399 PolarHBondContact O-N 2.68Å; R397-E400 PolarHBondContact O-N 2.61Å; R397-E401 VanDerWaalsContact O-CB 3.3Å; R397-E401 WeakPolarHBondContact O-CB 3.38Å; R397-E401 PolarHBondContact O-N 2.93Å
398	E	88.3	Confident	86	Confident	67 Å²	67	103.6 Å²	103.6	31%	0.313	48%	0.483	S	S	.	.	H	α-helix	trans	-64.6	-21.8	174.2	-73.7	175.2	-161.4	0	0	113.7	K394 Q395 I396 K402	K394-E398 WeakPolarHBondContact CG-OE1 3.41Å; K394-E398 IonicContact NZ-OE1 2.61Å; K394-E398 PolarHBondContact NZ-OE1 2.81Å; K394-E398 WeakPolarHBondContact O-CG 3.3Å; K394-E398 PolarHBondContact O-N 3.21Å; Q395-E398 PolarHBondContact O-N 3.13Å; I396-E398 PolarHBondContact O-N 2.9Å; E398-K402 WeakPolarHBondContact O-CD 3.44Å; E398-K402 WeakPolarHBondContact O-CE 3.32Å; E398-K402 VanDerWaalsContact O-CG 3.24Å; E398-K402 WeakPolarHBondContact O-CG 3.43Å
399	L	88.8	Confident	85.8	Confident	116 Å²	116	105.5 Å²	105.5	61%	0.607	49%	0.49	S	S	*	.	H	α-helix	trans	-89.7	-38.5	175.2	-74.1	168.3	0	0	0	111.8	Q395 I396 R397 K402 S403	Q395-L399 WeakPolarHBondContact O-CB 3.37Å; Q395-L399 VanDerWaalsContact O-CG 3.28Å; Q395-L399 WeakPolarHBondContact O-CG 3.29Å; Q395-L399 PolarHBondContact O-N 3.1Å; I396-L399 PolarHBondContact O-N 2.91Å; R397-L399 PolarHBondContact O-N 2.68Å; L399-K402 PolarHBondContact O-N 3.5Å; L399-S403 WeakPolarHBondContact O-CB 3.42Å; L399-S403 PolarHBondContact O-N 2.92Å
400	E	82.9	Confident	85.7	Confident	80 Å²	80	103.6 Å²	103.6	37%	0.374	49%	0.486	S	S	.	.	H	α-helix	trans	-61.8	-44.8	171.1	-73.6	-176	104.2	0	0	111.2	K173 I396 R397 K402 S403 D404	K173-E400 IonicContact NZ-OE1 3.85Å; K173-E400 PolarHBondContact NZ-OE1 2.72Å; I396-E400 HydrophobicContact CG2-CG 4.44Å; I396-E400 PolarHBondContact O-N 3.35Å; R397-E400 PolarHBondContact O-N 2.61Å; E400-K402 PolarHBondContact O-N 3.36Å; E400-S403 WeakPolarHBondContact O-CB 3.38Å; E400-S403 PolarHBondContact O-N 2.71Å; E400-D404 PolarHBondContact O-N 3.26Å
401	E	83.6	Confident	85.5	Confident	141 Å²	141	102.1 Å²	102.1	66%	0.659	48%	0.479	S	S	*	.	H	α-helix	trans	-59.9	-44.8	177.4	-176.3	171.2	-148	0	0	112.1	R397 D404 E405	R397-E401 VanDerWaalsContact O-CB 3.3Å; R397-E401 WeakPolarHBondContact O-CB 3.38Å; R397-E401 PolarHBondContact O-N 2.93Å; E401-D404 PolarHBondContact O-N 3.42Å; E401-E405 WeakPolarHBondContact O-CB 3.41Å; E401-E405 PolarHBondContact O-N 2.81Å
402	K	88.1	Confident	84.8	Confident	108 Å²	108	103.9 Å²	103.9	47%	0.47	48%	0.483	S	S	.	.	H	α-helix	trans	-67.3	-35.9	174.9	-71.7	168.7	-167.4	153.3	0	112.7	E398 L399 E400 L406	E398-K402 WeakPolarHBondContact O-CD 3.44Å; E398-K402 WeakPolarHBondContact O-CE 3.32Å; E398-K402 VanDerWaalsContact O-CG 3.24Å; E398-K402 WeakPolarHBondContact O-CG 3.43Å; L399-K402 PolarHBondContact O-N 3.5Å; E400-K402 PolarHBondContact O-N 3.36Å; K402-L406 WeakPolarHBondContact O-CB 3.39Å; K402-L406 VanDerWaalsContact O-CG 3.25Å; K402-L406 WeakPolarHBondContact O-CG 3.23Å; K402-L406 PolarHBondContact O-N 3.21Å
403	S	85.3	Confident	84.5	Confident	74 Å²	74	102.2 Å²	102.2	52%	0.517	48%	0.478	S	S	.	.	H	α-helix	trans	-64	-44.9	175.4	-174.4	0	0	0	0	111.1	L399 E400 H407	L399-S403 WeakPolarHBondContact O-CB 3.42Å; L399-S403 PolarHBondContact O-N 2.92Å; E400-S403 WeakPolarHBondContact O-CB 3.38Å; E400-S403 PolarHBondContact O-N 2.71Å; S403-H407 WeakPolarHBondContact O-CB 3.42Å; S403-H407 PolarHBondContact O-N 2.93Å
404	D	78.3	Confident	84.2	Confident	60 Å²	60	101.2 Å²	101.2	32%	0.321	48%	0.479	S	S	.	.	H	α-helix	trans	-67.7	-39.7	176.9	-83.3	7	0	0	0	111.7	R170 E400 E401 H407 I408	R170-D404 IonicContact CZ-OD2 2.74Å; R170-D404 IonicContact NE-OD2 3.65Å; R170-D404 PolarHBondContact NE-OD2 3.01Å; R170-D404 IonicContact NH2-OD2 3.9Å; R170-D404 PolarHBondContact NH2-OD2 3.46Å; E400-D404 PolarHBondContact O-N 3.26Å; E401-D404 PolarHBondContact O-N 3.42Å; D404-H407 PolarHBondContact O-N 3.38Å; D404-I408 WeakPolarHBondContact O-CB 3.15Å; D404-I408 WeakPolarHBondContact O-CD1 3.33Å; D404-I408 VanDerWaalsContact O-CG1 3.23Å; D404-I408 WeakPolarHBondContact O-CG1 3.47Å; D404-I408 PolarHBondContact O-N 2.9Å
405	E	85.3	Confident	83.6	Confident	138 Å²	138	97.5 Å²	97.5	65%	0.645	47%	0.471	S	S	*	.	H	α-helix	trans	-62.6	-46.2	175.1	-176.3	172.4	-140.3	0	0	112	E401 H407 I408 E409	E401-E405 WeakPolarHBondContact O-CB 3.41Å; E401-E405 PolarHBondContact O-N 2.81Å; E405-H407 VanDerWaalsContact C-N 3.34Å; E405-H407 PolarHBondContact O-N 2.96Å; E405-I408 PolarHBondContact O-N 3.11Å; E405-E409 PolarHBondContact O-N 3.29Å
406	L	86.4	Confident	83.1	Confident	116 Å²	116	99.5 Å²	99.5	61%	0.607	48%	0.478	S	S	*	.	H	α-helix	trans	-63.2	-38.7	175.7	-72.9	170.3	0	0	0	112.1	K402 E409 L410	K402-L406 WeakPolarHBondContact O-CB 3.39Å; K402-L406 VanDerWaalsContact O-CG 3.25Å; K402-L406 WeakPolarHBondContact O-CG 3.23Å; K402-L406 PolarHBondContact O-N 3.21Å; L406-E409 PolarHBondContact O-N 2.88Å; L406-L410 WeakPolarHBondContact O-CB 3.22Å; L406-L410 PolarHBondContact O-N 3.39Å
407	H	82.8	Confident	82.9	Confident	107 Å²	107	100 Å²	100	50%	0.495	48%	0.482	S	S	.	.	H	α-helix	trans	-65.4	-42.8	175.9	-168.6	72.8	0	0	0	111.6	S403 D404 E405 E409 L410 V411	S403-H407 WeakPolarHBondContact O-CB 3.42Å; S403-H407 PolarHBondContact O-N 2.93Å; D404-H407 PolarHBondContact O-N 3.38Å; E405-H407 VanDerWaalsContact C-N 3.34Å; E405-H407 PolarHBondContact O-N 2.96Å; H407-E409 VanDerWaalsContact C-N 3.34Å; H407-E409 PolarHBondContact O-N 3.41Å; H407-L410 PolarHBondContact O-N 3.49Å; H407-V411 WeakPolarHBondContact O-CG2 3.4Å; H407-V411 PolarHBondContact O-N 3.3Å; H407-V411 VanDerWaalsContact O-N 3.1Å
408	I	78.1	Confident	82.7	Confident	67 Å²	67	94.3 Å²	94.3	34%	0.344	47%	0.465	S	S	.	.	H	α-helix	trans	-62.7	-39.2	173.6	-70.8	164.6	0	0	0	111.1	D404 E405 R412	D404-I408 WeakPolarHBondContact O-CB 3.15Å; D404-I408 WeakPolarHBondContact O-CD1 3.33Å; D404-I408 VanDerWaalsContact O-CG1 3.23Å; D404-I408 WeakPolarHBondContact O-CG1 3.47Å; D404-I408 PolarHBondContact O-N 2.9Å; E405-I408 PolarHBondContact O-N 3.11Å; I408-R412 VanDerWaalsContact CG2-CZ 3.41Å; I408-R412 WeakPolarHBondContact O-CB 3.36Å; I408-R412 WeakPolarHBondContact O-CD 3.18Å; I408-R412 WeakPolarHBondContact O-CG 2.98Å; I408-R412 PolarHBondContact O-N 2.71Å; I408-R412 VanDerWaalsContact O-N 3.14Å
409	E	84.6	Confident	82.2	Confident	92 Å²	92	93.7 Å²	93.7	43%	0.43	47%	0.471	S	S	.	.	H	α-helix	trans	-67.4	-40.5	176	-145.4	-154.2	-175.3	0	0	112	E405 L406 H407 R412 K413	E405-E409 PolarHBondContact O-N 3.29Å; L406-E409 PolarHBondContact O-N 2.88Å; H407-E409 VanDerWaalsContact C-N 3.34Å; H407-E409 PolarHBondContact O-N 3.41Å; E409-R412 CarbonylContact O-C 3.58Å; E409-R412 WeakPolarHBondContact O-CB 3.49Å; E409-R412 PolarHBondContact O-N 2.84Å; E409-K413 WeakPolarHBondContact O-CG 3.19Å; E409-K413 PolarHBondContact O-N 3.31Å; E409-K413 WeakPolarHBondContact OE1-CE 3.33Å; E409-K413 IonicContact OE1-NZ 3.72Å; E409-K413 PolarHBondContact OE1-NZ 3.41Å; E409-K413 IonicContact OE2-NZ 3.66Å; E409-K413 PolarHBondContact OE2-NZ 3.26Å
410	L	83.5	Confident	81.8	Confident	90 Å²	90	93.1 Å²	93.1	47%	0.471	47%	0.468	S	S	.	.	H	α-helix	trans	-59.1	-52.5	177.9	-174.5	147.7	0	0	0	111.5	L406 H407 R412 K413 E414	L406-L410 WeakPolarHBondContact O-CB 3.22Å; L406-L410 PolarHBondContact O-N 3.39Å; H407-L410 PolarHBondContact O-N 3.49Å; L410-R412 VanDerWaalsContact C-N 3.29Å; L410-R412 PolarHBondContact O-N 3.38Å; L410-K413 WeakPolarHBondContact O-CA 3.41Å; L410-K413 WeakPolarHBondContact O-CB 3.5Å; L410-K413 PolarHBondContact O-N 3Å; L410-E414 HydrophobicContact CD2-CG 4.23Å; L410-E414 PolarHBondContact O-N 2.84Å
411	V	79.8	Confident	81.6	Confident	40 Å²	40	93.8 Å²	93.8	24%	0.242	47%	0.471	C	S	.	.	H	α-helix	trans	-58.8	-41.4	177	175.7	0	0	0	0	111.1	E163 H407 K413 E414 A415	E163-V411 HydrophobicContact CG-CG1 4.16Å; H407-V411 WeakPolarHBondContact O-CG2 3.4Å; H407-V411 PolarHBondContact O-N 3.3Å; H407-V411 VanDerWaalsContact O-N 3.1Å; V411-K413 PolarHBondContact O-N 2.9Å; V411-E414 PolarHBondContact O-N 3.34Å; V411-A415 WeakPolarHBondContact O-CB 3.43Å; V411-A415 PolarHBondContact O-N 2.94Å
412	R	76.9	Confident	81.2	Confident	158 Å²	158	87.6 Å²	87.6	60%	0.596	44%	0.444	S	S	*	.	H	α-helix	trans	-63.8	-24.7	174.4	-74.3	168.9	174.3	173.1	-0.2	113.6	I408 E409 L410 K416	I408-R412 VanDerWaalsContact CG2-CZ 3.41Å; I408-R412 WeakPolarHBondContact O-CB 3.36Å; I408-R412 WeakPolarHBondContact O-CD 3.18Å; I408-R412 WeakPolarHBondContact O-CG 2.98Å; I408-R412 PolarHBondContact O-N 2.71Å; I408-R412 VanDerWaalsContact O-N 3.14Å; E409-R412 CarbonylContact O-C 3.58Å; E409-R412 WeakPolarHBondContact O-CB 3.49Å; E409-R412 PolarHBondContact O-N 2.84Å; L410-R412 VanDerWaalsContact C-N 3.29Å; L410-R412 PolarHBondContact O-N 3.38Å; R412-K416 VanDerWaalsContact O-CD 3.31Å; R412-K416 WeakPolarHBondContact O-CD 3.46Å; R412-K416 VanDerWaalsContact O-CG 3.22Å; R412-K416 WeakPolarHBondContact O-CG 3.26Å
413	K	84.9	Confident	80.7	Confident	101 Å²	101	89.8 Å²	89.8	44%	0.439	45%	0.449	S	S	.	.	H	α-helix	trans	-84.6	-40.8	177.4	-60.6	-101.1	170.5	96.4	0	110.5	E409 L410 V411 K416 L417	E409-K413 WeakPolarHBondContact O-CG 3.19Å; E409-K413 PolarHBondContact O-N 3.31Å; E409-K413 WeakPolarHBondContact OE1-CE 3.33Å; E409-K413 IonicContact OE1-NZ 3.72Å; E409-K413 PolarHBondContact OE1-NZ 3.41Å; E409-K413 IonicContact OE2-NZ 3.66Å; E409-K413 PolarHBondContact OE2-NZ 3.26Å; L410-K413 WeakPolarHBondContact O-CA 3.41Å; L410-K413 WeakPolarHBondContact O-CB 3.5Å; L410-K413 PolarHBondContact O-N 3Å; V411-K413 PolarHBondContact O-N 2.9Å; K413-K416 PolarHBondContact O-N 3.33Å; K413-L417 PolarHBondContact O-N 3.23Å
414	E	79.1	Confident	80.3	Confident	99 Å²	99	92.4 Å²	92.4	46%	0.463	46%	0.456	S	S	.	.	H	α-helix	trans	-60.9	-47.6	173.1	-67.8	-176.9	146.2	0	0	111.8	L410 V411 K416 L417 V418	L410-E414 HydrophobicContact CD2-CG 4.23Å; L410-E414 PolarHBondContact O-N 2.84Å; V411-E414 PolarHBondContact O-N 3.34Å; E414-K416 PolarHBondContact O-N 2.86Å; E414-L417 WeakPolarHBondContact O-CB 3.16Å; E414-L417 PolarHBondContact O-N 3.37Å; E414-L417 VanDerWaalsContact O-N 3.11Å; E414-V418 WeakPolarHBondContact O-CG2 3.38Å; E414-V418 PolarHBondContact O-N 3.14Å
415	A	76.4	Confident	79.9	Confident	45 Å²	45	94.4 Å²	94.4	37%	0.372	46%	0.459	S	S	.	.	H	α-helix	trans	-57.8	-37.2	175.3	0	0	0	0	0	112.6	V411 A419	V411-A415 WeakPolarHBondContact O-CB 3.43Å; V411-A415 PolarHBondContact O-N 2.94Å; A415-A419 WeakPolarHBondContact O-CB 3.47Å; A415-A419 PolarHBondContact O-N 3.41Å
416	K	82.7	Confident	79.1	Confident	129 Å²	129	95.4 Å²	95.4	56%	0.561	46%	0.457	S	S	*	.	H	α-helix	trans	-70.3	-39.9	175	-75.1	171.7	-174	177.6	0	112.5	R412 K413 E414 A419 L420	R412-K416 VanDerWaalsContact O-CD 3.31Å; R412-K416 WeakPolarHBondContact O-CD 3.46Å; R412-K416 VanDerWaalsContact O-CG 3.22Å; R412-K416 WeakPolarHBondContact O-CG 3.26Å; K413-K416 PolarHBondContact O-N 3.33Å; E414-K416 PolarHBondContact O-N 2.86Å; K416-A419 PolarHBondContact O-N 3.2Å; K416-L420 WeakPolarHBondContact O-CB 3.29Å; K416-L420 VanDerWaalsContact O-CG 3.29Å; K416-L420 WeakPolarHBondContact O-CG 3.45Å; K416-L420 PolarHBondContact O-N 2.86Å
417	L	81.7	Confident	78	Confident	109 Å²	109	96.1 Å²	96.1	57%	0.571	46%	0.459	S	S	*	.	H	α-helix	trans	-59.8	-50.9	174.5	-86.6	166.1	0	0	0	111.2	K413 E414 A419 L420 E421	K413-L417 PolarHBondContact O-N 3.23Å; E414-L417 WeakPolarHBondContact O-CB 3.16Å; E414-L417 PolarHBondContact O-N 3.37Å; E414-L417 VanDerWaalsContact O-N 3.11Å; L417-A419 VanDerWaalsContact C-N 3.31Å; L417-A419 PolarHBondContact O-N 2.95Å; L417-L420 PolarHBondContact O-N 2.82Å; L417-L420 VanDerWaalsContact O-N 3.13Å; L417-E421 PolarHBondContact O-N 2.84Å
418	V	79.4	Confident	77	Confident	44 Å²	44	95.2 Å²	95.2	27%	0.267	47%	0.465	S	S	.	.	H	α-helix	trans	-61.9	-38.7	178.8	174.6	0	0	0	0	111.6	L159 E414 S422	L159-V418 HydrophobicContact CD1-CB 4.32Å; L159-V418 HydrophobicContact CD1-CG1 4.06Å; L159-V418 HydrophobicContact CD1-CG2 4.09Å; E414-V418 WeakPolarHBondContact O-CG2 3.38Å; E414-V418 PolarHBondContact O-N 3.14Å; V418-S422 WeakPolarHBondContact O-CB 3.45Å; V418-S422 PolarHBondContact O-N 2.71Å
419	A	78.5	Confident	75.8	Confident	53 Å²	53	99.1 Å²	99.1	44%	0.438	48%	0.479	S	S	.	.	H	α-helix	trans	-63.3	-44.4	173.5	0	0	0	0	0	112.5	A415 K416 L417 S422 R423	A415-A419 WeakPolarHBondContact O-CB 3.47Å; A415-A419 PolarHBondContact O-N 3.41Å; K416-A419 PolarHBondContact O-N 3.2Å; L417-A419 VanDerWaalsContact C-N 3.31Å; L417-A419 PolarHBondContact O-N 2.95Å; A419-S422 PolarHBondContact O-N 2.81Å; A419-S422 PolarHBondContact O-OG 3.22Å; A419-R423 PolarHBondContact O-N 3.25Å; A419-R423 VanDerWaalsContact O-N 3.16Å
420	L	80.1	Confident	73.8	Confident	105 Å²	105	101.3 Å²	101.3	55%	0.55	49%	0.494	S	S	.	.	H	α-helix	trans	-67.4	-44.4	178.5	-74.6	170	0	0	0	112.3	K416 L417 S422 R423 L424	K416-L420 WeakPolarHBondContact O-CB 3.29Å; K416-L420 VanDerWaalsContact O-CG 3.29Å; K416-L420 WeakPolarHBondContact O-CG 3.45Å; K416-L420 PolarHBondContact O-N 2.86Å; L417-L420 PolarHBondContact O-N 2.82Å; L417-L420 VanDerWaalsContact O-N 3.13Å; L420-S422 VanDerWaalsContact C-N 3.32Å; L420-S422 PolarHBondContact O-N 2.78Å; L420-R423 WeakPolarHBondContact O-CA 3.42Å; L420-R423 WeakPolarHBondContact O-CB 3.49Å; L420-R423 PolarHBondContact O-N 2.91Å; L420-L424 PolarHBondContact O-N 3.42Å
421	E	77.3	Confident	72.1	Confident	94 Å²	94	103.4 Å²	103.4	44%	0.439	50%	0.504	S	S	.	.	H	α-helix	trans	-54	-48.4	171.8	-84.3	-169.6	-159.4	0	0	111.8	L417 R423 L424 R425	L417-E421 PolarHBondContact O-N 2.84Å; E421-R423 PolarHBondContact O-N 3.46Å; E421-L424 PolarHBondContact O-N 3.15Å; E421-L424 VanDerWaalsContact O-N 3.12Å; E421-R425 WeakPolarHBondContact O-CG 3.49Å; E421-R425 PolarHBondContact O-N 2.9Å; E421-R425 IonicContact OE2-CZ 3.26Å; E421-R425 IonicContact OE2-NH1 3.96Å; E421-R425 PolarHBondContact OE2-NH1 2.91Å; E421-R425 IonicContact OE2-NH2 2.84Å
422	S	75.6	Confident	70.5	Confident	11 Å²	11	107.5 Å²	107.5	8%	0.077	53%	0.532	C	S	.	.	H	α-helix	trans	-62.9	-28.8	179.3	81.7	0	0	0	0	112.1	V418 A419 L420 R426	V418-S422 WeakPolarHBondContact O-CB 3.45Å; V418-S422 PolarHBondContact O-N 2.71Å; A419-S422 PolarHBondContact O-N 2.81Å; A419-S422 PolarHBondContact O-OG 3.22Å; L420-S422 VanDerWaalsContact C-N 3.32Å; L420-S422 PolarHBondContact O-N 2.78Å; S422-R426 WeakPolarHBondContact O-CG 3.41Å; S422-R426 PolarHBondContact O-N 3.48Å; S422-R426 PolarHBondContact O-NE 3.3Å; S422-R426 PolarHBondContact OG-NH2 3.33Å
423	R	77.1	Confident	68.7	Low	153 Å²	153	107.8 Å²	107.8	58%	0.577	54%	0.544	S	S	*	.	H	α-helix	trans	-73.2	-46	172	-101.1	178	62.6	171.9	-2.4	111	A419 L420 E421 R425 R426 M427	A419-R423 PolarHBondContact O-N 3.25Å; A419-R423 VanDerWaalsContact O-N 3.16Å; L420-R423 WeakPolarHBondContact O-CA 3.42Å; L420-R423 WeakPolarHBondContact O-CB 3.49Å; L420-R423 PolarHBondContact O-N 2.91Å; E421-R423 PolarHBondContact O-N 3.46Å; R423-R425 PolarHBondContact O-N 3.38Å; R423-R426 WeakPolarHBondContact O-CB 3.39Å; R423-R426 PolarHBondContact O-N 3.05Å; R423-M427 WeakPolarHBondContact O-CG 3.46Å; R423-M427 PolarHBondContact O-N 3.38Å
424	L	77.3	Confident	66.4	Low	129 Å²	129	109.1 Å²	109.1	68%	0.675	56%	0.556	S	S	*	*	H	α-helix	trans	-58.2	-48.5	178.4	-162	79.2	0	0	0	111.1	L420 E421 R426 M427 S428	L420-L424 PolarHBondContact O-N 3.42Å; E421-L424 PolarHBondContact O-N 3.15Å; E421-L424 VanDerWaalsContact O-N 3.12Å; L424-R426 PolarHBondContact O-N 3.28Å; L424-M427 PolarHBondContact O-N 2.8Å; L424-M427 VanDerWaalsContact O-N 3.1Å; L424-S428 WeakPolarHBondContact O-CB 3.26Å; L424-S428 PolarHBondContact O-N 2.98Å; L424-S428 PolarHBondContact O-OG 3.45Å
425	R	70.8	Confident	64.6	Low	102 Å²	102	111.9 Å²	111.9	39%	0.385	57%	0.569	S	S	.	*	H	α-helix	trans	-61.9	-20.8	175.4	-70.2	-164.4	-72.5	-92.5	6.3	114.4	D152 E421 R423	D152-R425 IonicContact OD1-CZ 3.23Å; D152-R425 IonicContact OD1-NE 2.78Å; D152-R425 IonicContact OD1-NH2 2.67Å; D152-R425 PolarHBondContact OD1-NH2 2.96Å; D152-R425 IonicContact OD2-NE 3.13Å; D152-R425 IonicContact OD2-NH2 2.67Å; E421-R425 WeakPolarHBondContact O-CG 3.49Å; E421-R425 PolarHBondContact O-N 2.9Å; E421-R425 IonicContact OE2-CZ 3.26Å; E421-R425 IonicContact OE2-NH1 3.96Å; E421-R425 PolarHBondContact OE2-NH1 2.91Å; E421-R425 IonicContact OE2-NH2 2.84Å; R423-R425 PolarHBondContact O-N 3.38Å
426	R	69.1	Low	62.7	Low	160 Å²	160	115.1 Å²	115.1	60%	0.604	59%	0.589	S	S	*	*	H	α-helix	trans	-87.2	-32.4	174.1	-80.1	178.5	-78.3	174.1	-4.1	112.6	S422 R423 L424	S422-R426 WeakPolarHBondContact O-CG 3.41Å; S422-R426 PolarHBondContact O-N 3.48Å; S422-R426 PolarHBondContact O-NE 3.3Å; S422-R426 PolarHBondContact OG-NH2 3.33Å; R423-R426 WeakPolarHBondContact O-CB 3.39Å; R423-R426 PolarHBondContact O-N 3.05Å; L424-R426 PolarHBondContact O-N 3.28Å
427	M	62	Low	60.8	Low	130 Å²	130	117 Å²	117	64%	0.64	60%	0.604	S	S	*	*	H	α-helix	trans	-84.8	-24.1	177.9	-66.2	-179.7	68.6	0	0	113.5	R423 L424 K429	R423-M427 WeakPolarHBondContact O-CG 3.46Å; R423-M427 PolarHBondContact O-N 3.38Å; L424-M427 PolarHBondContact O-N 2.8Å; L424-M427 VanDerWaalsContact O-N 3.1Å; M427-K429 PolarHBondContact O-N 2.85Å
428	S	61.7	Low	59	Low	89 Å²	89	118 Å²	118	62%	0.622	62%	0.617	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.3	34.6	178.9	73.2	0	0	0	0	113.7	L424	L424-S428 WeakPolarHBondContact O-CB 3.26Å; L424-S428 PolarHBondContact O-N 2.98Å; L424-S428 PolarHBondContact O-OG 3.45Å
429	K	54	Low	57.3	Low	148 Å²	148	126.4 Å²	126.4	64%	0.643	64%	0.644	S	S	*	*	T	Hydrogen-bonded Turn	trans	-122.4	-10.7	-170.5	-147.1	175.1	-175.2	-178.1	0	113.9	M427	M427-K429 PolarHBondContact O-N 2.85Å
430	D	42.8	Very low	55	Low	138 Å²	138	130.3 Å²	130.3	74%	0.738	66%	0.657	S	S	*	*	S	Bend	trans	-98.6	18.5	-174.7	-55.6	-35.2	0	0	0	112.9
431	I	47.3	Very low	52.8	Low	135 Å²	135	133.7 Å²	133.7	69%	0.692	67%	0.673	S	S	*	*			trans	-113.5	101.8	174.6	-56.4	178.5	0	0	0	109.2	L433	I431-L433 HydrophobicContact CG2-CD1 4.38Å; I431-L433 PolarHBondContact O-N 3.18Å
432	P	46.7	Very low	50.8	Low	125 Å²	125	134 Å²	134	81%	0.812	68%	0.683	S	S	*	*			trans	-80.8	113.9	169.3	31.4	-30.4	0	0	0	109.8
433	L	38.6	Very low	49.3	Very low	164 Å²	164	141.2 Å²	141.2	86%	0.859	72%	0.72	S	S	*	*			trans	-116.5	114.3	166.8	-106.5	157.2	0	0	0	108.1	I431	I431-L433 HydrophobicContact CG2-CD1 4.38Å; I431-L433 PolarHBondContact O-N 3.18Å
434	D	37.1	Very low	47.2	Very low	130 Å²	130	138.8 Å²	138.8	70%	0.695	72%	0.724	S	S	*	*			trans	-102	163.3	179.8	-176.2	31.1	0	0	0	110.4
435	Q	40.1	Very low	45.1	Very low	157 Å²	157	139.2 Å²	139.2	73%	0.734	73%	0.725	S	S	*	*			trans	83.2	133.3	164.1	-45.8	-166.9	3.7	0	0	120.2
436	S	36.1	Very low	43.1	Very low	113 Å²	113	142.1 Å²	142.1	79%	0.79	75%	0.747	S	S	*	*			trans	73.6	114.6	158.8	69	0	0	0	0	120
437	L	43	Very low	41.3	Very low	168 Å²	168	138.5 Å²	138.5	88%	0.88	75%	0.746	S	S	*	*			trans	-103.6	155.1	143.6	-67.9	170.4	0	0	0	107.3
438	P	45.3	Very low	39.9	Very low	129 Å²	129	140.5 Å²	140.5	84%	0.838	75%	0.754	S	S	*	*				-133.3	-173.1	103.2	37.9	-28.6	0	0	0	113.2
439	R	43.7	Very low	38.3	Very low	221 Å²	221	140.8 Å²	140.8	83%	0.834	76%	0.761	S	S	*	*			trans	-93	175.2	-172.1	-66.8	-175.5	171.7	-176.6	-2.1	114.2
440	D	30	Very low	37.2	Very low	135 Å²	135	137.5 Å²	137.5	72%	0.722	76%	0.762	S	S	*	*			trans	86.9	97.8	147.7	-57.7	-39.1	0	0	0	118.5
441	M	33.4	Very low	36.4	Very low	176 Å²	176	139.1 Å²	139.1	87%	0.867	77%	0.765	S	S	*	*			trans	44.2	150.2	136.1	-76.8	-98.5	-81	0	0	121.9
442	P	34.6	Very low	35.7	Very low	101 Å²	101	138.4 Å²	138.4	66%	0.656	76%	0.762	S	S	*	*			cis	-124.8	-178	6.4	41.6	-27.7	0	0	0	114.4	P444	P442-P444 VanDerWaalsContact O-CD 3.29Å; P442-P444 WeakPolarHBondContact O-CD 3.15Å
443	L	44.5	Very low	35	Very low	163 Å²	163	139.8 Å²	139.8	85%	0.853	76%	0.755	S	S	*	*			trans	-95.9	111	164.7	-77.8	168.3	0	0	0	111.6
444	P	33.5	Very low	34.6	Very low	102 Å²	102	139.4 Å²	139.4	66%	0.662	75%	0.749	S	S	*	*			trans	-93.1	127.3	143.5	33.1	-26.2	0	0	0	108	P442	P442-P444 VanDerWaalsContact O-CD 3.29Å; P442-P444 WeakPolarHBondContact O-CD 3.15Å
445	I	33.7	Very low	34	Very low	138 Å²	138	137.6 Å²	137.6	71%	0.708	75%	0.746	S	S	*	*			cis	55.4	102.5	49.6	-48.1	177.2	0	0	0	112
446	I	28.9	Very low	33.2	Very low	162 Å²	162	140.4 Å²	140.4	83%	0.831	75%	0.75	S	S	*	*			trans	175.8	133.2	137.6	-95.9	156.3	0	0	0	108
447	S	30.6	Very low	32.7	Very low	84 Å²	84	139.4 Å²	139.4	59%	0.587	74%	0.743	S	S	*	*			cis	-165.9	162.8	-14.4	58.3	0	0	0	0	111.7
448	H	31.6	Very low	31.9	Very low	173 Å²	173	136 Å²	136	80%	0.801	73%	0.734	S	S	*	*			trans	16.1	155.4	134	-50	-54.8	0	0	0	121.3
449	A	29.4	Very low	31	Very low	95 Å²	95	136 Å²	136	79%	0.785	73%	0.726	S	S	*	*			cis	-145	179.6	20.5	0	0	0	0	0	111.2
450	A	30.5	Very low	30.1	Very low	79 Å²	79	133.2 Å²	133.2	65%	0.653	72%	0.723	S	S	*	*			cis	-157.1	171.3	0.3	0	0	0	0	0	106.4
451	E	26.6	Very low	30	Very low	172 Å²	172	130.8 Å²	130.8	80%	0.804	72%	0.716	S	S	*	*			cis	-154	135.7	3.1	-113.4	147.5	-144.8	0	0	105.5
452	D	31.6	Very low	29.6	Very low	120 Å²	120	129.9 Å²	129.9	64%	0.642	71%	0.71	S	S	*	*				69.9	138.4	90.1	-102.4	18.4	0	0	0	116.2
453	K	33	Very low	29.2	Very low	153 Å²	153	132.9 Å²	132.9	67%	0.665	72%	0.715	S	S	*	*			cis	-162.5	162.1	-3.1	-146.5	176.4	-156.3	76.6	0	114.4
454	Q	29.4	Very low	28.4	Very low	156 Å²	156	132.5 Å²	132.5	73%	0.729	71%	0.709	S	S	*	*			trans	69.8	174.7	165.8	-64.6	-168.3	75.1	0	0	117.4
455	C	25.3	Very low	27.9	Very low	92 Å²	92	136.1 Å²	136.1	62%	0.622	71%	0.714	S	S	*	*				-173	173.2	-56.6	-144	0	0	0	0	106.4
456	W	23.3	Very low	27.7	Very low	216 Å²	216	135.5 Å²	135.5	82%	0.818	72%	0.72	S	S	*	*			cis	-152.1	-178.5	15.6	-61.6	89.1	0	0	0	107.5
457	S	25.2	Very low	28	Very low	93 Å²	93	133.8 Å²	133.8	65%	0.65	72%	0.72	S	S	*	*			cis	-176.5	142.6	-43.7	-173.4	0	0	0	0	108.7
458	S	26.3	Very low	28	Very low	97 Å²	97	134.3 Å²	134.3	68%	0.678	72%	0.723	S	S	*	*			trans	64.1	155.8	170.9	-83.1	0	0	0	0	118.1
459	D	25.2	Very low	27.8	Very low	128 Å²	128	132.9 Å²	132.9	68%	0.684	72%	0.722	S	S	*	*			cis	-156.3	170.9	-4.9	-127.5	-47.7	0	0	0	113
460	E	25.9	Very low	28.1	Very low	163 Å²	163	134.9 Å²	134.9	76%	0.762	72%	0.715	S	S	*	*			trans	59.6	162.3	160.3	-66.6	-82.1	127.8	0	0	119.4
461	S	26.5	Very low	28.3	Very low	83 Å²	83	137 Å²	137	58%	0.58	72%	0.722	S	S	*	*			cis	-165.4	168.7	-42.4	58.2	0	0	0	0	112.3
462	H	25.9	Very low	28.7	Very low	158 Å²	158	138.2 Å²	138.2	73%	0.731	72%	0.719	S	S	*	*			trans	43.1	123	161.2	-84.9	-91.3	0	0	0	125.3
463	E	25.6	Very low	28.6	Very low	163 Å²	163	140.8 Å²	140.8	76%	0.762	73%	0.732	S	S	*	*				45.5	139.6	126.4	-67.6	-177.3	139.4	0	0	126.4
464	E	27.8	Very low	28.5	Very low	156 Å²	156	143 Å²	143	73%	0.729	74%	0.742	S	S	*	*			trans	76.8	150.5	143.8	-95.9	-148	164.9	0	0	124
465	K	24.6	Very low	29	Very low	178 Å²	178	147.2 Å²	147.2	77%	0.774	75%	0.751	S	S	*	*			trans	70.9	123.2	163.7	-68.5	-179.7	-178.4	74.6	0	120.8
466	C	28.4	Very low	29.4	Very low	124 Å²	124	154.5 Å²	154.5	84%	0.838	77%	0.765	S	S	*	*			trans	-56.6	154.8	152	-82.4	0	0	0	0	111.7
467	P	35.8	Very low	30.3	Very low	126 Å²	126	149.1 Å²	149.1	82%	0.818	76%	0.758	S	S	*	*				-141.6	-152.6	60.8	42.7	-23.7	0	0	0	115.8
468	S	30.9	Very low	30.7	Very low	95 Å²	95	152.3 Å²	152.3	66%	0.664	77%	0.768	S	S	*	*			trans	-65.7	153.8	-170.6	55.9	0	0	0	0	115.7
469	D	27.1	Very low	31	Very low	143 Å²	143	156.1 Å²	156.1	77%	0.765	78%	0.78	S	S	*	*				-174.8	164.1	106.9	-91.2	-6.1	0	0	0	113.2
470	E	34.8	Very low	31.4	Very low	137 Å²	137	159.9 Å²	159.9	64%	0.64	79%	0.79	S	S	*	*			trans	-64.9	152.6	163.5	-78.9	-168.8	149.9	0	0	110.3	R472	E470-R472 IonicContact OE1-NE 3.19Å; E470-R472 IonicContact OE1-NH2 3.95Å; E470-R472 WeakPolarHBondContact OE2-CG 3.39Å; E470-R472 IonicContact OE2-CZ 3.9Å; E470-R472 IonicContact OE2-NE 3.21Å; E470-R472 PolarHBondContact OE2-NE 3.29Å; E470-R472 IonicContact OE2-NH2 2.69Å; E470-R472 PolarHBondContact OE2-NH2 2.88Å
471	P	35.3	Very low	31.5	Very low	125 Å²	125	157.3 Å²	157.3	81%	0.812	80%	0.797	S	S	*	*			trans	-125.9	113.3	131.8	34	-28.2	0	0	0	112.9
472	R	33.9	Very low	31.6	Very low	196 Å²	196	156.7 Å²	156.7	74%	0.74	80%	0.803	S	S	*	*			trans	-70.8	126.9	161.1	-58	168.9	-172.4	-179.7	-2.6	109.2	E470	E470-R472 IonicContact OE1-NE 3.19Å; E470-R472 IonicContact OE1-NH2 3.95Å; E470-R472 WeakPolarHBondContact OE2-CG 3.39Å; E470-R472 IonicContact OE2-CZ 3.9Å; E470-R472 IonicContact OE2-NE 3.21Å; E470-R472 PolarHBondContact OE2-NE 3.29Å; E470-R472 IonicContact OE2-NH2 2.69Å; E470-R472 PolarHBondContact OE2-NH2 2.88Å
473	L	30.9	Very low	31.8	Very low	175 Å²	175	157.1 Å²	157.1	92%	0.916	81%	0.81	S	S	*	*			trans	-125.3	138.2	157.3	-78.9	179.3	0	0	0	111.9
474	K	29.4	Very low	31.9	Very low	200 Å²	200	160.4 Å²	160.4	87%	0.87	82%	0.816	S	S	*	*			trans	-92.1	154	-171.2	-67.6	174	178.4	172.7	0	111.3
475	R	40.9	Very low	31.9	Very low	244 Å²	244	159.4 Å²	159.4	92%	0.921	82%	0.824	S	S	*	*			trans	-44.4	141	162.6	-62.4	172.7	175.6	160.5	-3.2	112
476	R	34.3	Very low	32	Very low	244 Å²	244	160 Å²	160	92%	0.921	83%	0.827	S	S	*	*			trans	-143.3	161	151.4	-96.7	-159.8	175.5	-162.8	-1.9	110.5
477	P	42.1	Very low	32.1	Very low	103 Å²	103	159.5 Å²	159.5	67%	0.669	83%	0.825	S	S	*	*				-131.6	176	-123.1	43.7	-30.7	0	0	0	116.4
478	N	33.9	Very low	32.4	Very low	160 Å²	160	159.9 Å²	159.9	86%	0.856	83%	0.827	S	S	*	*			trans	32.2	116.4	148.5	-62.9	-4	0	0	0	119.4
479	L	31.4	Very low	32.2	Very low	177 Å²	177	162.1 Å²	162.1	93%	0.927	84%	0.837	S	S	*	*			trans	-123.3	127.4	154.1	-109.5	160.8	0	0	0	110
480	K	33.4	Very low	32.2	Very low	208 Å²	208	161.1 Å²	161.1	90%	0.904	84%	0.841	S	S	*	*			trans	-91.1	124.5	169.6	-82.3	-175.2	175.2	-178.8	0	109.4
481	A	28	Very low	31.9	Very low	108 Å²	108	158.2 Å²	158.2	89%	0.893	85%	0.847	S	S	*	*			trans	-158.2	166.9	151.9	0	0	0	0	0	108.3
482	G	29.8	Very low	31.5	Very low	70 Å²	70	159.6 Å²	159.6	72%	0.722	85%	0.847	S	S	*	*			trans	-148.2	-158.9	179.8	0	0	0	0	0	112.6
483	L	29.7	Very low	31.2	Very low	168 Å²	168	160.1 Å²	160.1	88%	0.88	85%	0.849	S	S	*	*			trans	79.2	99.7	178.7	-60.9	166.8	0	0	0	117.4
484	R	28	Very low	31	Very low	231 Å²	231	158.8 Å²	158.8	87%	0.872	84%	0.843	S	S	*	*				62.4	109.4	112.9	-164.9	-166.6	-141	-166.1	8.5	118.7
485	C	26.4	Very low	31	Very low	135 Å²	135	156.5 Å²	156.5	91%	0.912	84%	0.84	S	S	*	*			trans	-151.4	171.6	135.8	-116.9	0	0	0	0	111.7
486	K	27.6	Very low	31.3	Very low	192 Å²	192	149.2 Å²	149.2	84%	0.835	83%	0.825	S	S	*	*			trans	-111.4	160.3	-174.7	-61.6	179.8	177	-178.3	0	111.8
487	S	30.1	Very low	31.1	Very low	113 Å²	113	146 Å²	146	79%	0.79	82%	0.824	S	S	*	*			trans	30.5	139.5	136.4	-56.9	0	0	0	0	120.1
488	P	41.8	Very low	30.4	Very low	134 Å²	134	146.9 Å²	146.9	87%	0.87	83%	0.828	S	S	*	*				-144.4	178.8	67.4	40.2	-22.3	0	0	0	117.8
489	V	27.8	Very low	30.2	Very low	142 Å²	142	144.5 Å²	144.5	86%	0.861	82%	0.823	S	S	*	*			trans	-95.8	139.7	178.4	168.8	0	0	0	0	110.6
490	S	27	Very low	29.9	Very low	122 Å²	122	143.8 Å²	143.8	85%	0.853	82%	0.82	S	S	*	*			trans	-176.3	154.3	136.8	54.5	0	0	0	0	111.4
491	G	28.1	Very low	29.7	Very low	75 Å²	75	138 Å²	138	77%	0.773	81%	0.812	S	S	*	*			trans	-153.8	162.4	177	0	0	0	0	0	112.3
492	L	27	Very low	29.8	Very low	155 Å²	155	138 Å²	138	81%	0.812	81%	0.805	S	S	*	*			trans	-163.3	150.9	-179.4	-84.6	166.3	0	0	0	105.6
493	R	28.2	Very low	29.8	Very low	207 Å²	207	142.1 Å²	142.1	78%	0.781	81%	0.805	S	S	*	*			cis	-153.1	165.6	-17.3	-137.4	-179	-147.3	-158.1	4.7	105.2
494	D	26.2	Very low	29.7	Very low	147 Å²	147	144.3 Å²	144.3	79%	0.786	80%	0.802	S	S	*	*				-171.1	-179.2	77	-102.6	-37	0	0	0	112.6
495	N	29.1	Very low	29.6	Very low	151 Å²	151	138.7 Å²	138.7	81%	0.807	79%	0.793	S	S	*	*			trans	-133.2	-173.2	-165.6	-133.6	13.8	0	0	0	109.3
496	P	47.8	Very low	29.7	Very low	92 Å²	92	137.9 Å²	137.9	60%	0.597	78%	0.784	S	S	*	*			cis	-134	-175.2	-13.1	41.6	-25.3	0	0	0	113.8
497	I	29.3	Very low	29.7	Very low	175 Å²	175	136 Å²	136	90%	0.897	78%	0.783	S	S	*	*			trans	-152.2	156	135.4	-104.1	158.4	0	0	0	108
498	T	27.9	Very low	29.5	Very low	123 Å²	123	134.2 Å²	134.2	76%	0.755	78%	0.782	S	S	*	*			trans	-122.6	143.3	-158.3	50.9	0	0	0	0	115.3
499	S	28.8	Very low	28.7	Very low	109 Å²	109	134.3 Å²	134.3	76%	0.762	78%	0.776	S	S	*	*			trans	-171.1	125.4	137	56.4	0	0	0	0	112.3
500	D	25.8	Very low	28.7	Very low	162 Å²	162	136.4 Å²	136.4	87%	0.866	77%	0.773	S	S	*	*			trans	24.4	159.7	143.5	-55.6	-14.9	0	0	0	124.1
501	A	29.8	Very low	28.8	Very low	88 Å²	88	137.3 Å²	137.3	73%	0.727	77%	0.768	S	S	*	*			cis	176	130.6	-38.1	0	0	0	0	0	109.9
502	S	30.2	Very low	28.6	Very low	107 Å²	107	140.8 Å²	140.8	75%	0.748	76%	0.764	S	S	*	*			trans	172	122.1	138.7	57.8	0	0	0	0	115.4
503	H	29.5	Very low	28.7	Very low	157 Å²	157	138.7 Å²	138.7	73%	0.727	75%	0.753	S	S	*	*			trans	48.3	115	140	-64.8	-89.2	0	0	0	121.2
504	R	27.6	Very low	28.5	Very low	214 Å²	214	136.7 Å²	136.7	81%	0.808	75%	0.752	S	S	*	*				74.2	143.8	80.4	-74.8	-170.3	-171.2	-170.9	1.7	113.5
505	T	25.6	Very low	28.5	Very low	113 Å²	113	135.1 Å²	135.1	69%	0.693	75%	0.748	S	S	*	*			cis	-163.9	135.8	14.8	6.8	0	0	0	0	108.6
506	V	27.6	Very low	29.3	Very low	118 Å²	118	134.3 Å²	134.3	72%	0.715	75%	0.751	S	S	*	*				93.8	116.7	78.2	165.6	0	0	0	0	116.9
507	N	27.7	Very low	28.3	Very low	153 Å²	153	137.1 Å²	137.1	82%	0.818	76%	0.761	S	S	*	*			trans	64.4	155.1	148.1	-62.7	17.2	0	0	0	125
508	G	26.2	Very low	28.2	Very low	75 Å²	75	134.4 Å²	134.4	77%	0.773	75%	0.752	S	S	*	*			trans	119.7	92.8	170.8	0	0	0	0	0	113.6
509	D	26.4	Very low	28.2	Very low	136 Å²	136	135.9 Å²	135.9	73%	0.727	76%	0.756	S	S	*	*			cis	96.8	116.9	20.2	-121.8	-4	0	0	0	116.6
510	F	26.3	Very low	28.1	Very low	186 Å²	186	133.8 Å²	133.8	82%	0.816	75%	0.751	S	S	*	*			trans	66.1	151.6	162.8	-83.3	-139	0	0	0	119.5
511	L	29.9	Very low	28.2	Very low	140 Å²	140	133 Å²	133	73%	0.733	75%	0.747	S	S	*	*			cis	-134	-129.1	19.6	-141.9	-176.8	0	0	0	114.4
512	E	24.2	Very low	28.3	Very low	148 Å²	148	135.2 Å²	135.2	69%	0.692	75%	0.746	S	S	*	*			trans	-157.8	-159	-165.7	-163.1	-104.7	-62.4	0	0	110.6
513	I	27.6	Very low	28.2	Very low	112 Å²	112	137 Å²	137	57%	0.574	75%	0.748	S	S	*	*			trans	91.5	125.7	160.5	-61.6	173	0	0	0	115.7
514	Q	24.2	Very low	28.2	Very low	165 Å²	165	135.3 Å²	135.3	77%	0.771	75%	0.753	S	S	*	*			cis	-152.7	177.1	0.2	-130	166.3	31.3	0	0	114.3
515	T	27.9	Very low	28.4	Very low	114 Å²	114	133 Å²	133	70%	0.699	76%	0.756	S	S	*	*			trans	-101.8	-174.7	178.4	57.5	0	0	0	0	113.2
516	P	44.5	Very low	29.3	Very low	133 Å²	133	133.1 Å²	133.1	86%	0.864	76%	0.759	S	S	*	*				-137.7	-172.2	96.7	37.3	-22.8	0	0	0	115
517	N	27	Very low	30.1	Very low	151 Å²	151	133 Å²	133	81%	0.807	76%	0.76	S	S	*	*			trans	-134.9	-153.7	-156.9	-163.9	-5.6	0	0	0	111.7
518	V	28.5	Very low	30.4	Very low	118 Å²	118	131.1 Å²	131.1	72%	0.715	76%	0.759	S	S	*	*			trans	90.5	129.9	168.8	-179.3	0	0	0	0	114.7
519	N	27.4	Very low	31.1	Very low	155 Å²	155	133.7 Å²	133.7	83%	0.829	76%	0.762	S	S	*	*			cis	-159.9	163.6	-11.5	-101.6	-3.1	0	0	0	107.7
520	G	27.1	Very low	31.2	Very low	64 Å²	64	132 Å²	132	66%	0.66	76%	0.761	S	S	*	*			cis	169.6	166.3	-5.4	0	0	0	0	0	113.6
521	N	28	Very low	31.5	Very low	147 Å²	147	133 Å²	133	79%	0.786	77%	0.766	S	S	*	*			trans	59.8	102.8	161.1	-72	6.7	0	0	0	124.3
522	N	30.1	Very low	32.2	Very low	134 Å²	134	131.7 Å²	131.7	72%	0.717	77%	0.765	S	S	*	*				67.8	135.2	112.9	-60.8	-9	0	0	0	125.1
523	N	29.1	Very low	32.4	Very low	145 Å²	145	130.9 Å²	130.9	78%	0.775	77%	0.77	S	S	*	*			trans	105.6	128.7	141.8	-67.7	-17.9	0	0	0	122.3
524	S	29.2	Very low	32.6	Very low	121 Å²	121	130.9 Å²	130.9	85%	0.846	78%	0.78	S	S	*	*			trans	73.6	146.2	145.6	45.3	0	0	0	0	123.5
525	L	32.8	Very low	33.7	Very low	164 Å²	164	128.3 Å²	128.3	86%	0.859	78%	0.778	S	S	*	*			trans	-71.2	-179.4	161.4	-57.2	162.2	0	0	0	110.5
526	P	43.6	Very low	33.6	Very low	117 Å²	117	128.6 Å²	128.6	76%	0.76	78%	0.78	S	S	*	*			cis	-128.6	-131	-0.4	40.6	-18.6	0	0	0	109.7
527	P	45.2	Very low	32.9	Very low	114 Å²	114	130.7 Å²	130.7	74%	0.74	78%	0.775	S	S	*	*			cis	-127.1	-171.4	-34.1	38.5	-20.7	0	0	0	114.1
528	S	33.3	Very low	33.7	Very low	115 Å²	115	129.3 Å²	129.3	80%	0.804	78%	0.775	S	S	*	*			trans	-79.8	156.2	168.4	-36.3	0	0	0	0	113.9
529	P	41	Very low	34	Very low	129 Å²	129	130.6 Å²	130.6	84%	0.838	78%	0.777	S	S	*	*			trans	-119.7	164.5	161.7	39.1	-29.4	0	0	0	113.9
530	S	27.5	Very low	34.9	Very low	101 Å²	101	128.6 Å²	128.6	71%	0.706	77%	0.772	S	S	*	*			trans	-152.4	106.3	176.3	60	0	0	0	0	114
531	F	33.8	Very low	35	Very low	206 Å²	206	131.1 Å²	131.1	90%	0.904	78%	0.78	S	S	*	*			trans	59.8	177.4	163.2	-61.3	-66.5	0	0	0	116
532	P	45.3	Very low	35.3	Very low	112 Å²	112	128.5 Å²	128.5	73%	0.727	78%	0.779	S	S	*	*			cis	-139.1	-168	5.7	30	-3.5	0	0	0	116.9
533	V	27.2	Very low	36.3	Very low	131 Å²	131	128 Å²	128	79%	0.794	78%	0.783	S	S	*	*			trans	86.2	131.9	156.6	-164.4	0	0	0	0	119.9
534	S	32.3	Very low	36.6	Very low	112 Å²	112	126.1 Å²	126.1	78%	0.783	78%	0.781	S	S	*	*			trans	-131.5	159.5	165.8	-40.6	0	0	0	0	109.6
535	P	46	Very low	36.8	Very low	112 Å²	112	125 Å²	125	73%	0.727	77%	0.773	S	S	*	*			trans	-148.7	140.2	144.7	29.8	-9.3	0	0	0	118.3
536	T	26.6	Very low	36.8	Very low	119 Å²	119	125.1 Å²	125.1	73%	0.73	77%	0.774	S	S	*	*			trans	75.1	102.1	133.3	-54.9	0	0	0	0	122.8
537	F	29.3	Very low	37.5	Very low	177 Å²	177	124.2 Å²	124.2	78%	0.776	77%	0.768	S	S	*	*				52.8	161.6	121.1	-74.5	-63.4	0	0	0	122.6
538	P	45.3	Very low	36.8	Very low	123 Å²	123	126.2 Å²	126.2	80%	0.799	77%	0.772	S	S	*	*			cis	-138.3	-173.2	29.4	43.2	-23.2	0	0	0	119
539	L	33.5	Very low	36.7	Very low	145 Å²	145	127 Å²	127	76%	0.759	77%	0.765	S	S	*	*			trans	-125.1	162.9	177.8	-103.9	108.5	0	0	0	112.2
540	P	47	Very low	36.3	Very low	112 Å²	112	130.5 Å²	130.5	73%	0.727	76%	0.763	S	S	*	*			trans	-130.1	164.1	135	36.9	-26.2	0	0	0	111.9
541	S	28.1	Very low	37.7	Very low	118 Å²	118	131.1 Å²	131.1	83%	0.825	76%	0.764	S	S	*	*			cis	-158	154.3	-7.4	38.6	0	0	0	0	110.9
542	A	34.8	Very low	37.4	Very low	91 Å²	91	126.9 Å²	126.9	75%	0.752	76%	0.759	S	S	*	*			trans	-106.4	-175.2	173.4	0	0	0	0	0	111.6
543	P	50.4	Low	36.6	Very low	124 Å²	124	128 Å²	128	81%	0.805	76%	0.763	S	S	*	*				-132.1	179.6	78	11.6	12.8	0	0	0	112.7
544	S	36.7	Very low	36.7	Very low	106 Å²	106	129.1 Å²	129.1	74%	0.741	76%	0.76	S	S	*	*			cis	-150.1	-129.9	-11.7	43.9	0	0	0	0	106.5
545	S	33.4	Very low	36.7	Very low	97 Å²	97	129.3 Å²	129.3	68%	0.678	75%	0.748	S	S	*	*			cis	-169.7	160.6	-20.4	29.4	0	0	0	0	106.5
546	L	33	Very low	35.7	Very low	167 Å²	167	130 Å²	130	87%	0.874	75%	0.754	S	S	*	*			cis	-146.1	160.7	-33.4	-91.7	178.4	0	0	0	107.7
547	P	58	Low	35.9	Very low	97 Å²	97	132.6 Å²	132.6	63%	0.63	75%	0.751	S	S	*	*			trans	-133.7	-175.8	-154	44.1	-29.1	0	0	0	117.2
548	N	30.9	Very low	35.9	Very low	157 Å²	157	130.9 Å²	130.9	84%	0.84	75%	0.745	S	S	*	*			trans	-178.4	172.6	150.6	-95.2	-35.1	0	0	0	112.1
549	M	30.3	Very low	35	Very low	130 Å²	130	131 Å²	131	64%	0.64	74%	0.739	S	S	*	*				-167.1	162.5	-68.5	-112.5	-59.6	112.5	0	0	115
550	Y	32.8	Very low	34.8	Very low	204 Å²	204	131.4 Å²	131.4	80%	0.8	74%	0.739	S	S	*	*			trans	77.7	154.1	154.9	-65.5	-45.9	0	0	0	123.9
551	P	57.8	Low	33.9	Very low	114 Å²	114	133.3 Å²	133.3	74%	0.74	74%	0.742	S	S	*	*			trans	-148.4	-167.8	-143.3	44.6	-22.1	0	0	0	119.9
552	C	27.7	Very low	33.9	Very low	116 Å²	116	139.9 Å²	139.9	78%	0.784	75%	0.749	S	S	*	*			trans	81.3	152.1	161.5	-129.6	0	0	0	0	117.9
553	V	26.9	Very low	33.6	Very low	135 Å²	135	146 Å²	146	82%	0.818	75%	0.754	S	S	*	*			cis	-156.7	167	48.3	167.7	0	0	0	0	113.5
554	E	30.6	Very low	32.5	Very low	156 Å²	156	151.1 Å²	151.1	73%	0.729	76%	0.757	S	S	*	*			trans	-81.5	-167.2	-178.9	-42.2	175.2	52	0	0	116.6
555	Q	31.8	Very low	32.2	Very low	116 Å²	116	151.9 Å²	151.9	54%	0.542	75%	0.753	S	S	.	*			cis	-164.9	156.2	-1.7	-154.6	-171.2	105.6	0	0	110.8	R557	Q555-R557 VanDerWaalsContact OE1-CZ 3.3Å
556	C	24.1	Very low	32	Very low	125 Å²	125	153.8 Å²	153.8	85%	0.845	76%	0.756	S	S	*	*			trans	-169.3	-176.4	143.8	-142.9	0	0	0	0	116.6
557	R	30.6	Very low	31.9	Very low	175 Å²	175	150.9 Å²	150.9	66%	0.66	75%	0.749	S	S	*	*			trans	-154.4	-174.9	-164	-40.4	-178.5	-161.9	174.3	4.4	111.1	Q555	Q555-R557 VanDerWaalsContact OE1-CZ 3.3Å
558	Q	29.6	Very low	30.8	Very low	141 Å²	141	154.2 Å²	154.2	66%	0.659	76%	0.76	S	S	*	*			cis	-167.6	176.8	-0.1	-140.8	172.1	-86.3	0	0	112.3
559	N	28.1	Very low	30.8	Very low	125 Å²	125	154.9 Å²	154.9	67%	0.668	76%	0.76	S	S	*	*			trans	80.2	128.8	149.7	-79.6	6.5	0	0	0	125.2
560	M	27.2	Very low	30.9	Very low	154 Å²	154	153.3 Å²	153.3	76%	0.759	76%	0.762	S	S	*	*			trans	75.9	115.1	135.1	-69.2	-64	-162.5	0	0	125.7
561	L	29.3	Very low	30.8	Very low	152 Å²	152	150.9 Å²	150.9	80%	0.796	76%	0.761	S	S	*	*			trans	34.9	130.1	132.6	-63.4	174.2	0	0	0	123.2
562	R	28.7	Very low	29.6	Very low	255 Å²	255	151.9 Å²	151.9	96%	0.962	77%	0.765	S	S	*	*				-173	166.7	121.8	-106.3	170.5	-170.5	-163.7	3.4	115.9
563	Y	26.8	Very low	30.1	Very low	219 Å²	219	152 Å²	152	86%	0.859	76%	0.764	S	S	*	*			trans	-103.1	142.1	174.2	-107.1	-102.6	0	0	0	110.8
564	R	29.2	Very low	30.3	Very low	232 Å²	232	154.6 Å²	154.6	88%	0.875	77%	0.767	S	S	*	*				163.9	127.3	125.4	-95.7	-175.7	172	-175.3	-2.8	115.2
565	N	28.7	Very low	31	Very low	123 Å²	123	152.7 Å²	152.7	66%	0.658	77%	0.769	S	S	*	*				32.8	137.6	123.9	-79.8	59.5	0	0	0	125
566	D	29	Very low	31.6	Very low	137 Å²	137	151.8 Å²	151.8	73%	0.733	77%	0.773	S	S	*	*			trans	77.3	105	135.1	-55.3	-25.6	0	0	0	123.2
567	S	31.6	Very low	32.3	Very low	106 Å²	106	153.3 Å²	153.3	74%	0.741	77%	0.768	S	S	*	*				46	123.8	119.1	-161.4	0	0	0	0	121.6
568	I	34.3	Very low	32.9	Very low	167 Å²	167	153.5 Å²	153.5	86%	0.856	77%	0.773	S	S	*	*				-168.2	168.3	108.3	-97.9	164.5	0	0	0	110.1
569	M	32.4	Very low	33.7	Very low	170 Å²	170	150.3 Å²	150.3	84%	0.837	77%	0.771	S	S	*	*			trans	-85.6	160.2	-167.4	-56	176.1	67.6	0	0	115.4
570	S	31.7	Very low	34.6	Very low	97 Å²	97	147 Å²	147	68%	0.678	76%	0.757	S	S	*	*				126.5	159.2	116.2	-150.9	0	0	0	0	118.5
571	I	31.3	Very low	35.4	Very low	153 Å²	153	145 Å²	145	79%	0.785	75%	0.749	S	S	*	*			trans	61.1	139.5	159.3	50.6	173.5	0	0	0	123.5
572	V	32.2	Very low	36.1	Very low	136 Å²	136	147 Å²	147	82%	0.824	75%	0.748	S	S	*	*			trans	76.4	132.3	169.9	-165.3	0	0	0	0	116.3
573	P	38	Very low	36.9	Very low	117 Å²	117	145 Å²	145	76%	0.76	74%	0.74	S	S	*	*			trans	-104	150.3	-175.6	38.6	-32.9	0	0	0	114.8
574	E	30.5	Very low	37.7	Very low	190 Å²	190	142.9 Å²	142.9	89%	0.888	73%	0.731	S	S	*	*			trans	-120.4	148.2	156.9	-72.3	-163.6	130.9	0	0	110.4
575	P	45.9	Very low	38.2	Very low	117 Å²	117	139.3 Å²	139.3	76%	0.76	72%	0.724	S	S	*	*	P	Polyproline II helix	trans	-85.9	151.3	-164.7	33.2	-36.3	0	0	0	114.3
576	P	43.3	Very low	38.7	Very low	96 Å²	96	144.7 Å²	144.7	62%	0.623	74%	0.735	S	S	*	*	P	Polyproline II helix	trans	-70.3	154.4	176.6	29.7	-35.3	0	0	0	113.3
577	E	39.7	Very low	39.2	Very low	158 Å²	158	146.2 Å²	146.2	74%	0.738	74%	0.738	S	S	*	*	P	Polyproline II helix	trans	-56.8	147.4	-168.9	-170	175.7	-170.7	0	0	115.6	A579 S580	E577-A579 PolarHBondContact O-N 3.36Å; E577-S580 VanDerWaalsContact O-CB 3.31Å; E577-S580 WeakPolarHBondContact O-CB 3.36Å; E577-S580 PolarHBondContact O-N 3.34Å; E577-S580 PolarHBondContact O-OG 2.89Å
578	K	43.7	Very low	39.2	Very low	178 Å²	178	149.7 Å²	149.7	77%	0.774	74%	0.739	S	S	*	*	G	3₁₀ helix	trans	-52.4	-27.3	-172.1	-72.4	-177.3	176	178.8	0	115.4	S580 L581	K578-S580 PolarHBondContact O-N 3.09Å; K578-L581 PolarHBondContact O-N 3.21Å
579	A	46.9	Very low	38.9	Very low	75 Å²	75	150.1 Å²	150.1	62%	0.62	74%	0.738	S	S	*	*	G	3₁₀ helix	trans	-62.1	-20.5	174.6	0	0	0	0	0	113.7	E577	E577-A579 PolarHBondContact O-N 3.36Å
580	S	46.4	Very low	38.8	Very low	54 Å²	54	148.6 Å²	148.6	38%	0.378	73%	0.733	S	S	.	*	G	3₁₀ helix	trans	-83.4	-12.1	-179	-60.4	0	0	0	0	114.8	E577 K578	E577-S580 VanDerWaalsContact O-CB 3.31Å; E577-S580 WeakPolarHBondContact O-CB 3.36Å; E577-S580 PolarHBondContact O-N 3.34Å; E577-S580 PolarHBondContact O-OG 2.89Å; K578-S580 PolarHBondContact O-N 3.09Å
581	L	43.8	Very low	38.7	Very low	113 Å²	113	150.3 Å²	150.3	59%	0.592	74%	0.735	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.6	-51.3	-177.7	-71.9	168	0	0	0	111.5	K578 R583 R584	K578-L581 PolarHBondContact O-N 3.21Å; L581-R583 PolarHBondContact O-N 3.38Å; L581-R584 PolarHBondContact O-N 3.39Å
582	Y	43.5	Very low	38.8	Very low	193 Å²	193	151.6 Å²	151.6	76%	0.757	74%	0.735	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.3	-20.5	-177.6	-85	-74.7	0	0	0	115.4
583	R	46.7	Very low	38.9	Very low	213 Å²	213	151.6 Å²	151.6	80%	0.804	74%	0.738	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.6	-16.5	174.4	-161.4	176.9	-64	155.1	2.5	113.3	L581	L581-R583 PolarHBondContact O-N 3.38Å
584	R	43.3	Very low	38.5	Very low	176 Å²	176	153 Å²	153	66%	0.664	74%	0.738	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.8	-7.1	-175.6	-141.9	-178	-58.4	-171.7	1.4	113.7	L581	L581-R584 PolarHBondContact O-N 3.39Å
585	E	38.7	Very low	38.3	Very low	156 Å²	156	155.9 Å²	155.9	73%	0.729	74%	0.741	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.4	5.7	-175.7	-159.7	163.6	-132.9	0	0	113.4
586	R	40.2	Very low	37.3	Very low	236 Å²	236	154.9 Å²	154.9	89%	0.891	74%	0.736	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112.6	-2.9	176.3	-87.6	-161.6	179.9	-158.8	2.4	115.5
587	E	38.5	Very low	36.8	Very low	170 Å²	170	157.9 Å²	157.9	79%	0.794	75%	0.746	S	S	*	*	S	Bend	trans	-134.5	55.7	-170.3	-66.3	-175.3	165.5	0	0	112.7
588	K	31.4	Very low	36.1	Very low	178 Å²	178	155.7 Å²	155.7	77%	0.774	75%	0.749	S	S	*	*			trans	-153.9	106.2	161.6	-87.8	-138.1	168.7	-138.8	0	112.6
589	E	29.4	Very low	35.4	Very low	176 Å²	176	154.1 Å²	154.1	82%	0.822	75%	0.748	S	S	*	*			trans	176	130.5	144.7	-101.4	-164.9	-139.9	0	0	106.5
590	N	29.3	Very low	34.6	Very low	138 Å²	138	159.1 Å²	159.1	74%	0.738	76%	0.757	S	S	*	*			cis	-134.6	161.7	3.6	-87.2	-67.2	0	0	0	111.9
591	D	30	Very low	33.8	Very low	134 Å²	134	163.1 Å²	163.1	72%	0.717	77%	0.774	S	S	*	*			trans	-93.6	169.5	179.7	-101.9	-57.9	0	0	0	113.1
592	F	32.6	Very low	33.2	Very low	180 Å²	180	162.2 Å²	162.2	79%	0.789	78%	0.777	S	S	*	*			trans	-63.9	168.8	-176.8	-67.8	-99.6	0	0	0	115.1
593	P	36.1	Very low	32.6	Very low	135 Å²	135	160 Å²	160	88%	0.877	78%	0.778	S	S	*	*				-131.4	164.1	104.8	38.3	-32	0	0	0	114.8
594	L	27.9	Very low	31.9	Very low	146 Å²	146	156.3 Å²	156.3	76%	0.764	77%	0.774	S	S	*	*			trans	-132.3	136.3	-172.7	-169.9	160.8	0	0	0	110.1
595	R	26	Very low	31.3	Very low	252 Å²	252	154.4 Å²	154.4	95%	0.951	77%	0.774	S	S	*	*			trans	-148.1	169.3	164.1	-118.7	-178.4	-174.3	-125.8	0	112.4
596	S	26.5	Very low	30.9	Very low	95 Å²	95	154 Å²	154	66%	0.664	77%	0.773	S	S	*	*			trans	-132.5	147.7	-158	-166.9	0	0	0	0	113.8
597	L	31.8	Very low	30.4	Very low	160 Å²	160	149.6 Å²	149.6	84%	0.838	76%	0.764	S	S	*	*			trans	31.4	114.6	153.6	-70.2	166.8	0	0	0	120.4
598	S	26.3	Very low	29.9	Very low	112 Å²	112	149.2 Å²	149.2	78%	0.783	76%	0.762	S	S	*	*			trans	-167.4	111.2	133.5	59.2	0	0	0	0	113.1
599	D	29.1	Very low	29.6	Very low	144 Å²	144	145.5 Å²	145.5	77%	0.77	76%	0.758	S	S	*	*			trans	36.6	129.8	131.3	-70	1.6	0	0	0	124.4
600	F	29.6	Very low	29.5	Very low	181 Å²	181	145.4 Å²	145.4	79%	0.794	76%	0.757	S	S	*	*			trans	78.7	138.3	141.1	-87.6	-92.3	0	0	0	124.8
601	D	29.2	Very low	29.5	Very low	138 Å²	138	146.5 Å²	146.5	74%	0.738	76%	0.763	S	S	*	*			trans	80.2	129.9	149.7	-73	-31.2	0	0	0	126.4
602	S	31	Very low	29.4	Very low	93 Å²	93	142.8 Å²	142.8	65%	0.65	76%	0.756	S	S	*	*			trans	60	131.6	148.1	-74	0	0	0	0	124.9
603	D	30.8	Very low	29.9	Very low	147 Å²	147	139.6 Å²	139.6	79%	0.786	75%	0.754	S	S	*	*				30.2	140.5	124.2	-40.2	-38	0	0	0	119
604	N	31.4	Very low	29.4	Very low	136 Å²	136	140.3 Å²	140.3	73%	0.727	75%	0.75	S	S	*	*			cis	-171.6	-179.6	44.3	-163.9	15	0	0	0	111.7
605	M	31.1	Very low	29.4	Very low	135 Å²	135	138.2 Å²	138.2	67%	0.665	75%	0.748	S	S	*	*			trans	14.6	152.1	145.9	-81.3	-179.7	150.8	0	0	121.9
606	E	29.9	Very low	29.6	Very low	149 Å²	149	132.4 Å²	132.4	70%	0.696	74%	0.74	S	S	*	*			cis	-178.3	-162.6	-12.2	-154.5	166.9	-130.9	0	0	106.8
607	M	29.6	Very low	29.6	Very low	143 Å²	143	135.7 Å²	135.7	70%	0.704	75%	0.748	S	S	*	*			trans	70.2	121.6	166.4	-80.6	-177.2	162.1	0	0	116.7
608	E	29.8	Very low	29.3	Very low	161 Å²	161	132.4 Å²	132.4	75%	0.752	74%	0.739	S	S	*	*				75.2	135.6	75	-75.8	-175.1	-175.2	0	0	113.1
609	C	24.9	Very low	29.3	Very low	101 Å²	101	132.8 Å²	132.8	68%	0.682	74%	0.741	S	S	*	*			cis	-154.9	-162.8	-9.2	-139.3	0	0	0	0	111.4
610	E	26	Very low	29.2	Very low	174 Å²	174	131.5 Å²	131.5	81%	0.813	74%	0.744	S	S	*	*			trans	-20	142.5	162.4	-62.5	170.1	134.9	0	0	115.5
611	D	30.5	Very low	29.2	Very low	160 Å²	160	128.2 Å²	128.2	86%	0.856	74%	0.743	S	S	*	*				-160	169.1	65.5	-148.5	-16.9	0	0	0	114.3
612	G	28.2	Very low	29.4	Very low	56 Å²	56	125.9 Å²	125.9	58%	0.577	74%	0.738	S	S	*	*			trans	-108.5	-153	169.2	0	0	0	0	0	112.3
613	P	42.6	Very low	29.4	Very low	114 Å²	114	129.8 Å²	129.8	74%	0.74	75%	0.746	S	S	*	*			cis	-131.4	-165.4	-11.1	42.2	-25.4	0	0	0	112.9
614	N	25.1	Very low	29.4	Very low	149 Å²	149	130 Å²	130	80%	0.797	74%	0.742	S	S	*	*			trans	16.1	141.8	148.7	-54	-26.6	0	0	0	120.1
615	S	28.4	Very low	29.4	Very low	103 Å²	103	128.2 Å²	128.2	72%	0.72	74%	0.74	S	S	*	*			cis	-168.5	135.9	45.2	58.3	0	0	0	0	117.1
616	V	29	Very low	29.3	Very low	130 Å²	130	129.1 Å²	129.1	79%	0.788	74%	0.743	S	S	*	*				44.6	120.2	119.8	-170.1	0	0	0	0	121.1
617	I	27.6	Very low	29.4	Very low	163 Å²	163	125.3 Å²	125.3	84%	0.836	74%	0.743	S	S	*	*			trans	-136.6	137	146	-61	-176.2	0	0	0	110.9
618	S	25.6	Very low	29.5	Very low	92 Å²	92	126.5 Å²	126.5	64%	0.643	75%	0.749	S	S	*	*			trans	-33.7	153.6	167.4	-47.9	0	0	0	0	117.5
619	S	26.2	Very low	29.7	Very low	119 Å²	119	125.6 Å²	125.6	83%	0.832	75%	0.749	S	S	*	*			cis	81.5	129.8	34.1	-51.2	0	0	0	0	116.9
620	S	27.2	Very low	30.3	Very low	118 Å²	118	126.2 Å²	126.2	83%	0.825	75%	0.75	S	S	*	*			trans	121.8	118.3	141.3	-162	0	0	0	0	119
621	S	29.7	Very low	31	Very low	111 Å²	111	128.5 Å²	128.5	78%	0.776	75%	0.753	S	S	*	*			trans	165	145.6	134.4	42.6	0	0	0	0	110.9
622	S	33	Very low	31.5	Very low	90 Å²	90	126 Å²	126	63%	0.629	74%	0.74	S	S	*	*			cis	-170.2	130.4	-17	50.6	0	0	0	0	112.1
623	H	31.4	Very low	32.2	Very low	175 Å²	175	128.6 Å²	128.6	81%	0.81	74%	0.739	S	S	*	*			trans	59.1	150.5	150.2	-55.5	-46.1	0	0	0	119.9
624	Q	30.3	Very low	32	Very low	151 Å²	151	130.8 Å²	130.8	71%	0.706	74%	0.74	S	S	*	*			cis	-154.3	-179.9	-4.8	-126.2	-175.1	-48.3	0	0	106.9	E626	Q624-E626 PolarHBondContact NE2-OE1 3.01Å
625	S	30.7	Very low	32.8	Very low	98 Å²	98	130 Å²	130	69%	0.685	73%	0.731	S	S	*	*			cis	-148.1	173	9.6	55	0	0	0	0	114.3
626	E	30.6	Very low	33.2	Very low	155 Å²	155	127.7 Å²	127.7	72%	0.724	71%	0.713	S	S	*	*			trans	-37.9	156	160	-56.9	110.4	-115.1	0	0	117.3	Q624	Q624-E626 PolarHBondContact NE2-OE1 3.01Å
627	G	30.7	Very low	33.6	Very low	68 Å²	68	126 Å²	126	70%	0.701	70%	0.699	S	S	*	*			cis	165.9	172.2	-4.7	0	0	0	0	0	114
628	M	31.2	Very low	34	Very low	169 Å²	169	123.4 Å²	123.4	83%	0.833	69%	0.687	S	S	*	*			trans	53.7	148.7	172.7	-95.3	60.2	125.9	0	0	118
629	D	34.9	Very low	34.7	Very low	141 Å²	141	122.9 Å²	122.9	75%	0.754	68%	0.676	S	S	*	*			cis	-129.8	153.7	23	-97	-47.5	0	0	0	115.4	Y631	D629-Y631 VanDerWaalsContact C-N 3.27Å; D629-Y631 PolarHBondContact O-N 3.34Å; D629-Y631 VanDerWaalsContact O-N 3.1Å
630	T	37.8	Very low	35.1	Very low	115 Å²	115	124.7 Å²	124.7	71%	0.706	67%	0.669	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.6	23.2	-168	-23	0	0	0	0	115.2
631	Y	40	Very low	35.7	Very low	222 Å²	222	129.4 Å²	129.4	87%	0.871	67%	0.669	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.7	-16.2	-176	-116.3	-91.2	0	0	0	115.2	D629	D629-Y631 VanDerWaalsContact C-N 3.27Å; D629-Y631 PolarHBondContact O-N 3.34Å; D629-Y631 VanDerWaalsContact O-N 3.1Å
632	D	40.7	Very low	35.9	Very low	108 Å²	108	132 Å²	132	58%	0.578	67%	0.667	S	S	*	*	S	Bend	trans	-82	-21.5	179.2	-108.9	-33.8	0	0	0	113.8	E634 Q635 V636	D632-E634 VanDerWaalsContact C-N 3.31Å; D632-E634 PolarHBondContact O-N 2.93Å; D632-Q635 WeakPolarHBondContact O-CA 3.2Å; D632-Q635 WeakPolarHBondContact O-CB 3.42Å; D632-Q635 PolarHBondContact O-N 3.12Å; D632-V636 WeakPolarHBondContact O-CG2 3.47Å; D632-V636 PolarHBondContact O-N 3.14Å
633	L	43	Very low	35.8	Very low	109 Å²	109	136 Å²	136	57%	0.571	67%	0.673	S	S	*	*	H	α-helix	trans	-72.5	-20	-167.3	-164.6	58.2	0	0	0	114	V636 N637	L633-V636 HydrophobicContact CD1-CB 4.48Å; L633-N637 WeakPolarHBondContact O-CB 3.28Å; L633-N637 PolarHBondContact O-N 3.31Å; L633-N637 VanDerWaalsContact O-N 3.12Å; L633-N637 PolarHBondContact O-ND2 3.48Å
634	E	39.3	Very low	35.7	Very low	160 Å²	160	132.4 Å²	132.4	75%	0.748	67%	0.667	S	S	*	*	H	α-helix	trans	-78	-31.5	166.8	-75.3	-156.6	127.4	0	0	112.7	D632 N638	D632-E634 VanDerWaalsContact C-N 3.31Å; D632-E634 PolarHBondContact O-N 2.93Å; E634-N638 PolarHBondContact O-N 2.8Å; E634-N638 PolarHBondContact O-ND2 3Å
635	Q	41.1	Very low	36	Very low	132 Å²	132	133.3 Å²	133.3	62%	0.617	68%	0.676	S	S	*	*	H	α-helix	trans	-70.6	-41.7	174.3	-164	167.2	119.2	0	0	110.6	D632 N637 N638 I639	D632-Q635 WeakPolarHBondContact O-CA 3.2Å; D632-Q635 WeakPolarHBondContact O-CB 3.42Å; D632-Q635 PolarHBondContact O-N 3.12Å; Q635-N637 PolarHBondContact O-N 3.39Å; Q635-N638 WeakPolarHBondContact O-CB 3.29Å; Q635-N638 PolarHBondContact O-N 3.28Å; Q635-N638 VanDerWaalsContact O-N 3.14Å; Q635-I639 PolarHBondContact O-N 3.47Å; Q635-I639 VanDerWaalsContact O-N 3.15Å
636	V	38.1	Very low	36.1	Very low	55 Å²	55	137.7 Å²	137.7	33%	0.333	69%	0.686	S	S	.	*	H	α-helix	trans	-62.8	-40.3	173.6	174.3	0	0	0	0	112.1	D632 L633 N638 I639 F640	D632-V636 WeakPolarHBondContact O-CG2 3.47Å; D632-V636 PolarHBondContact O-N 3.14Å; L633-V636 HydrophobicContact CD1-CB 4.48Å; V636-N638 PolarHBondContact O-N 3.09Å; V636-I639 PolarHBondContact O-N 3.39Å; V636-F640 HydrophobicContact CG1-CD2 3.71Å; V636-F640 HydrophobicContact CG1-CE2 3.71Å; V636-F640 PolarHBondContact O-N 2.83Å
637	N	37	Very low	36.1	Very low	94 Å²	94	141.4 Å²	141.4	50%	0.503	69%	0.693	S	S	.	*	H	α-helix	trans	-62.5	-28.3	173.7	-97	-74.1	0	0	0	113.6	L633 Q635	L633-N637 WeakPolarHBondContact O-CB 3.28Å; L633-N637 PolarHBondContact O-N 3.31Å; L633-N637 VanDerWaalsContact O-N 3.12Å; L633-N637 PolarHBondContact O-ND2 3.48Å; Q635-N637 PolarHBondContact O-N 3.39Å
638	N	36.3	Very low	36.1	Very low	110 Å²	110	144.3 Å²	144.3	59%	0.588	70%	0.699	S	S	*	*	H	α-helix	trans	-77.9	-25.6	173.4	-81.1	-77.4	0	0	0	113	E634 Q635 V636	E634-N638 PolarHBondContact O-N 2.8Å; E634-N638 PolarHBondContact O-ND2 3Å; Q635-N638 WeakPolarHBondContact O-CB 3.29Å; Q635-N638 PolarHBondContact O-N 3.28Å; Q635-N638 VanDerWaalsContact O-N 3.14Å; V636-N638 PolarHBondContact O-N 3.09Å
639	I	39.9	Very low	35.9	Very low	81 Å²	81	146 Å²	146	42%	0.415	70%	0.702	S	S	.	*	H	α-helix	trans	-75.6	-44.3	174.9	-68.8	162	0	0	0	111	Q635 V636 R641 K642 F643	Q635-I639 PolarHBondContact O-N 3.47Å; Q635-I639 VanDerWaalsContact O-N 3.15Å; V636-I639 PolarHBondContact O-N 3.39Å; I639-R641 PolarHBondContact O-N 3.45Å; I639-R641 VanDerWaalsContact O-N 3.15Å; I639-K642 PolarHBondContact O-N 3.47Å; I639-F643 HydrophobicContact CG2-CD2 4.07Å; I639-F643 HydrophobicContact CG2-CE2 4.23Å
640	F	34	Very low	35.7	Very low	156 Å²	156	150.3 Å²	150.3	68%	0.684	71%	0.708	S	S	*	*	H	α-helix	trans	-66	-15.3	177.5	-83.8	-75.7	0	0	0	114.3	V636	V636-F640 HydrophobicContact CG1-CD2 3.71Å; V636-F640 HydrophobicContact CG1-CE2 3.71Å; V636-F640 PolarHBondContact O-N 2.83Å
641	R	39.7	Very low	35.3	Very low	217 Å²	217	150.6 Å²	150.6	82%	0.819	71%	0.712	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.6	-6.7	168.4	-71.5	-170.2	-178.3	-138.7	2.9	114.7	I639	I639-R641 PolarHBondContact O-N 3.45Å; I639-R641 VanDerWaalsContact O-N 3.15Å
642	K	34.6	Very low	34.7	Very low	167 Å²	167	145 Å²	145	73%	0.726	71%	0.706	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.7	-16.5	-178	-80.5	-173.2	171.3	-177.3	0	115.4	I639	I639-K642 PolarHBondContact O-N 3.47Å
643	F	30.2	Very low	34.3	Very low	174 Å²	174	147.2 Å²	147.2	76%	0.763	72%	0.716	S	S	*	*	S	Bend	trans	-108.7	49.5	178.3	-70.6	-75	0	0	0	113	I639	I639-F643 HydrophobicContact CG2-CD2 4.07Å; I639-F643 HydrophobicContact CG2-CE2 4.23Å
644	S	29.6	Very low	33.8	Very low	99 Å²	99	147 Å²	147	69%	0.692	72%	0.724	S	S	*	*			trans	-132.8	70	171.2	-72.6	0	0	0	0	110.8
645	L	36.1	Very low	33.2	Very low	170 Å²	170	144.4 Å²	144.4	89%	0.89	72%	0.724	S	S	*	*			trans	-98.3	56.7	174.3	-76.9	178.1	0	0	0	112.3
646	E	34.1	Very low	32.7	Very low	189 Å²	189	146.5 Å²	146.5	88%	0.883	73%	0.731	S	S	*	*			trans	-145.5	88.4	153.2	-82.8	-142.9	143.3	0	0	110.9
647	R	29.4	Very low	32.4	Very low	234 Å²	234	149 Å²	149	88%	0.883	75%	0.751	S	S	*	*	S	Bend	trans	-142.6	147.9	149.8	-77	-163.1	171.5	156.1	-0.1	109.1
648	P	31.8	Very low	32.7	Very low	128 Å²	128	156 Å²	156	83%	0.831	77%	0.771	S	S	*	*	P	Polyproline II helix	trans	-60.9	143.1	-172.3	-25	35	0	0	0	113.7	R650	P648-R650 PolarHBondContact O-N 2.91Å
649	F	26.5	Very low	32.5	Very low	204 Å²	204	157.9 Å²	157.9	90%	0.895	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-58.7	130.9	174.6	-82.7	-94	0	0	0	111.6
650	R	30	Very low	32.2	Very low	233 Å²	233	159 Å²	159	88%	0.879	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-71.6	128.5	154.5	-79.4	-174.9	170.1	-168.1	-2.2	108.4	P648 S652	P648-R650 PolarHBondContact O-N 2.91Å; R650-S652 PolarHBondContact O-N 2.81Å
651	P	30.5	Very low	32.4	Very low	120 Å²	120	156.2 Å²	156.2	78%	0.779	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-62.5	131.3	170.1	-23.3	34.6	0	0	0	111.7
652	S	27	Very low	32.7	Very low	106 Å²	106	152 Å²	152	74%	0.741	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-73.9	127.3	173.7	-59.8	0	0	0	0	110.8	R650 S654	R650-S652 PolarHBondContact O-N 2.81Å; S652-S654 PolarHBondContact O-N 2.84Å
653	L	32.2	Very low	33.7	Very low	153 Å²	153	151.1 Å²	151.1	80%	0.801	79%	0.794	S	S	*	*	S	Bend	trans	-78.4	75.2	-178	-68.6	171.2	0	0	0	112.4	F656	L653-F656 HydrophobicContact CD2-CZ 4.39Å
654	S	31.9	Very low	35.5	Very low	106 Å²	106	147.8 Å²	147.8	74%	0.741	78%	0.779	S	S	*	*			trans	-145.6	35.2	179.2	67.4	0	0	0	0	116.3	S652	S652-S654 PolarHBondContact O-N 2.84Å
655	S	28.6	Very low	37.8	Very low	105 Å²	105	147.9 Å²	147.9	73%	0.734	78%	0.778	S	S	*	*			trans	-155.7	65.9	170.1	46.2	0	0	0	0	113.1	S657	S655-S657 PolarHBondContact O-N 2.87Å
656	F	29.4	Very low	40.3	Very low	176 Å²	176	143.1 Å²	143.1	77%	0.772	76%	0.755	S	S	*	*			trans	-72.7	80.2	177.9	-85	-82.9	0	0	0	113.7	L653	L653-F656 HydrophobicContact CD2-CZ 4.39Å
657	S	32.2	Very low	43.1	Very low	108 Å²	108	137.7 Å²	137.7	76%	0.755	73%	0.73	S	S	*	*			trans	-79.3	120.5	151.2	45.8	0	0	0	0	108.8	S655 I659	S655-S657 PolarHBondContact O-N 2.87Å; S657-I659 PolarHBondContact O-N 3.41Å
658	R	42.1	Very low	46.1	Very low	241 Å²	241	131.1 Å²	131.1	91%	0.909	71%	0.709	S	S	*	*			trans	-76.8	109.7	-168.1	-52.9	178.2	-166.1	168.8	3	111.9
659	I	33.3	Very low	49	Very low	148 Å²	148	125.5 Å²	125.5	76%	0.759	67%	0.673	S	S	*	*			trans	-133.3	148.6	163.3	-58.4	-175.5	0	0	0	110.2	S657	S657-I659 PolarHBondContact O-N 3.41Å
660	S	32.4	Very low	52.2	Low	105 Å²	105	119.3 Å²	119.3	73%	0.734	66%	0.659	S	S	*	*			trans	-48.9	153.7	-163.2	-170.3	0	0	0	0	118.8
661	S	38.2	Very low	55.2	Low	97 Å²	97	109 Å²	109	68%	0.678	62%	0.621	S	S	*	*	S	Bend	trans	-63.7	169.2	160.5	49.4	0	0	0	0	114.2
662	T	46.6	Very low	58	Low	128 Å²	128	107 Å²	107	79%	0.785	60%	0.601	S	S	*	*			trans	74.8	77.6	173.8	65.1	0	0	0	0	117.1	K664	T662-K664 PolarHBondContact O-N 3.46Å
663	I	56.8	Low	60.8	Low	150 Å²	150	101.9 Å²	101.9	77%	0.769	57%	0.566	S	S	*	*	P	Polyproline II helix	trans	-72.2	118.6	159.7	-61	174.4	0	0	0	108.1
664	K	66.9	Low	63.4	Low	104 Å²	104	98.4 Å²	98.4	45%	0.452	55%	0.548	S	S	.	.	P	Polyproline II helix	trans	-70.2	145.8	173.4	-69.8	178.8	-177.3	173.5	0	110.8	T662	T662-K664 PolarHBondContact O-N 3.46Å
665	P	78.7	Confident	65.8	Low	101 Å²	101	97.9 Å²	97.9	66%	0.656	54%	0.537	S	S	*	.	P	Polyproline II helix	trans	-60	150.5	176.7	26.6	-35	0	0	0	111.4	Q667	P665-Q667 PolarHBondContact O-NE2 3.49Å
666	V	88.1	Confident	68.7	Low	69 Å²	69	93 Å²	93	42%	0.418	50%	0.502	S	S	.	.	P	Polyproline II helix	trans	-66.1	135.6	168.1	178.4	0	0	0	0	108.2	L713 H750 R752	V666-L713 HydrophobicContact CB-CD1 4.36Å; V666-L713 HydrophobicContact CG1-CD1 3.9Å; V666-L713 HydrophobicContact CG2-CD1 3.61Å; V666-H750 HydrophobicContact CG1-CB 3.96Å; V666-R752 VanDerWaalsContact CG2-NH2 3.33Å
667	Q	92.1	Very high	71.6	Confident	75 Å²	75	86.5 Å²	86.5	35%	0.35	48%	0.476	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	149.3	175.8	-76.2	150.9	82	0	0	108.8	P665 H750 Y751	P665-Q667 PolarHBondContact O-NE2 3.49Å; Q667-H750 CarbonylContact O-C 3.55Å; Q667-H750 WeakPolarHBondContact O-CA 3.24Å; Q667-Y751 HydrophobicContact CB-CD1 4.29Å; Q667-Y751 HydrophobicContact CB-CD2 4.35Å; Q667-Y751 HydrophobicContact CB-CE1 3.78Å; Q667-Y751 HydrophobicContact CB-CE2 3.83Å; Q667-Y751 PolarHBondContact N-O 3.34Å; Q667-Y751 WeakPolarHBondContact O-CD1 3.49Å; Q667-Y751 PolarHBondContact O-N 3.45Å
668	E	92.6	Very high	74.3	Confident	97 Å²	97	88.2 Å²	88.2	45%	0.453	47%	0.469	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	144.6	175.2	-171.6	-172.2	131	0	0	108.8	K748 L749 H750	E668-K748 VanDerWaalsContact CD-NZ 3.29Å; E668-K748 HydrophobicContact CG-CB 4.38Å; E668-K748 WeakPolarHBondContact OE1-CE 3.44Å; E668-K748 IonicContact OE1-NZ 3.05Å; E668-K748 PolarHBondContact OE1-NZ 3.32Å; E668-K748 IonicContact OE2-NZ 3.44Å; E668-K748 PolarHBondContact OE2-NZ 2.89Å; E668-L749 CarbonylContact C-O 3.42Å; E668-L749 WeakPolarHBondContact CA-O 3.4Å; E668-H750 IonicContact OE2-CE1 3.38Å; E668-H750 PolarHBondContact OE2-CE1 3.47Å; E668-H750 VanDerWaalsContact OE2-CE1 3.23Å; E668-H750 IonicContact OE2-NE2 2.81Å
669	V	93.6	Very high	76.6	Confident	10 Å²	10	78 Å²	78	6%	0.061	43%	0.433	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	129.9	168.5	56.6	0	0	0	0	110.2	L671 A704 L706 K748 L749 Y751	V669-L671 HydrophobicContact CG1-CD2 4.01Å; V669-L671 HydrophobicContact CG2-CD2 4.16Å; V669-A704 HydrophobicContact CG2-CB 3.46Å; V669-A704 VanDerWaalsContact CG2-CB 3.46Å; V669-A704 WeakPolarHBondContact CG2-O 3.48Å; V669-L706 HydrophobicContact CG1-CD2 3.7Å; V669-L706 HydrophobicContact CG1-CG 4.09Å; V669-K748 CarbonylContact O-C 3.56Å; V669-K748 WeakPolarHBondContact O-CA 3.39Å; V669-L749 HydrophobicContact CG1-CB 3.93Å; V669-L749 PolarHBondContact N-O 2.72Å; V669-L749 PolarHBondContact O-N 2.97Å; V669-Y751 HydrophobicContact CB-CE1 3.97Å; V669-Y751 HydrophobicContact CG1-CD1 3.91Å; V669-Y751 HydrophobicContact CG1-CE1 3.69Å
670	A	93	Very high	79.5	Confident	74 Å²	74	71.1 Å²	71.1	61%	0.612	40%	0.398	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.4	131.6	170.8	0	0	0	0	0	110.1	I747	A670-I747 WeakPolarHBondContact CA-O 3.34Å
671	L	92.9	Very high	82.4	Confident	17 Å²	17	69.3 Å²	69.3	9%	0.089	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.9	177.8	179.3	64.5	150.6	0	0	0	111.2	V669 L676 A704 L706 P746 I747 L749	V669-L671 HydrophobicContact CG1-CD2 4.01Å; V669-L671 HydrophobicContact CG2-CD2 4.16Å; L671-L676 HydrophobicContact CD1-CD1 3.64Å; L671-L676 HydrophobicContact CD1-CD2 4.41Å; L671-A704 HydrophobicContact CB-CB 3.96Å; L671-L706 HydrophobicContact CD1-CD1 4.35Å; L671-P746 WeakPolarHBondContact O-CA 3.31Å; L671-I747 HydrophobicContact CD1-CD1 4.5Å; L671-I747 HydrophobicContact CD2-CD1 4.45Å; L671-I747 HydrophobicContact CD2-CG1 4.25Å; L671-I747 HydrophobicContact CG-CD1 4.2Å; L671-I747 HydrophobicContact CG-CG1 3.96Å; L671-I747 PolarHBondContact N-O 2.74Å; L671-I747 PolarHBondContact O-N 2.74Å; L671-L749 HydrophobicContact CD2-CB 4.47Å; L671-L749 HydrophobicContact CD2-CD1 4.14Å; L671-L749 HydrophobicContact CD2-CG 4.39Å
672	Q	90	Very high	85	Confident	76 Å²	76	65.9 Å²	65.9	36%	0.355	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	125.9	170.6	-120.9	-73.6	17.7	0	0	109.2	D674 G745	Q672-D674 VanDerWaalsContact CD-OD2 3.32Å; Q672-D674 PolarHBondContact NE2-OD2 2.69Å; Q672-D674 VanDerWaalsContact OE1-CB 3.31Å; Q672-D674 PolarHBondContact OE1-OD1 2.67Å; Q672-D674 PolarHBondContact OE1-OD2 2.77Å; Q672-G745 PolarHBondContact OE1-O 3.23Å
673	G	84.4	Confident	87.2	Confident	0 Å²	0	61 Å²	61	0%	0	33%	0.326	C	S	.	.			trans	-81.2	-15.1	-179.8	0	0	0	0	0	114.4	N675 L676 C743 G745	G673-N675 PolarHBondContact O-N 3.32Å; G673-L676 PolarHBondContact O-N 2.96Å; G673-C743 PolarHBondContact O-SG 2.63Å; G673-C743 VanDerWaalsContact O-SG 3.4Å; G673-G745 PolarHBondContact N-O 2.8Å
674	D	87.3	Confident	88.9	Confident	80 Å²	80	53.9 Å²	53.9	43%	0.428	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.8	99.2	-176.3	-70.4	-17.3	0	0	0	112.1	Q672 S744 G745	Q672-D674 VanDerWaalsContact CD-OD2 3.32Å; Q672-D674 PolarHBondContact NE2-OD2 2.69Å; Q672-D674 VanDerWaalsContact OE1-CB 3.31Å; Q672-D674 PolarHBondContact OE1-OD1 2.67Å; Q672-D674 PolarHBondContact OE1-OD2 2.77Å; D674-S744 WeakPolarHBondContact OD1-CA 3.4Å; D674-S744 WeakPolarHBondContact OD1-CB 3.48Å; D674-G745 PolarHBondContact OD1-N 3.12Å
675	N	82.1	Confident	90.2	Very high	94 Å²	94	48.9 Å²	48.9	50%	0.503	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	70.8	29.5	-176	-44.3	-110.7	0	0	0	115.9	G673 L677 K678	G673-N675 PolarHBondContact O-N 3.32Å; N675-L677 PolarHBondContact O-N 3.13Å; N675-K678 HydrophobicContact CB-CD 3.75Å; N675-K678 HydrophobicContact CB-CG 4.15Å; N675-K678 WeakPolarHBondContact O-CB 3.5Å; N675-K678 PolarHBondContact O-N 3.07Å; N675-K678 WeakPolarHBondContact OD1-CE 3.29Å; N675-K678 PolarHBondContact OD1-NZ 2.72Å
676	L	89.3	Confident	90.9	Very high	2 Å²	2	46 Å²	46	1%	0.01	25%	0.247	C	C	.	.	H	α-helix	trans	-46.7	-35.5	-178.3	175.6	58.6	0	0	0	115	L671 G673 K678 D679 V680 A701 L740 I747 L749	L671-L676 HydrophobicContact CD1-CD1 3.64Å; L671-L676 HydrophobicContact CD1-CD2 4.41Å; G673-L676 PolarHBondContact O-N 2.96Å; L676-K678 PolarHBondContact O-N 3.46Å; L676-K678 VanDerWaalsContact O-N 3.1Å; L676-D679 HydrophobicContact CD1-CB 4.38Å; L676-D679 WeakPolarHBondContact O-CA 3.24Å; L676-D679 WeakPolarHBondContact O-CB 3.4Å; L676-D679 PolarHBondContact O-N 2.88Å; L676-V680 HydrophobicContact CD1-CG1 4.17Å; L676-V680 HydrophobicContact CD1-CG2 4.09Å; L676-V680 HydrophobicContact CG-CG2 4.08Å; L676-V680 PolarHBondContact O-N 3.21Å; L676-A701 HydrophobicContact CD1-CB 4.16Å; L676-L740 HydrophobicContact CD2-CD2 3.86Å; L676-I747 HydrophobicContact CD2-CD1 3.9Å; L676-L749 HydrophobicContact CD2-CD1 3.89Å
677	L	90.4	Very high	91.2	Very high	41 Å²	41	48.7 Å²	48.7	22%	0.215	26%	0.255	C	S	.	.	H	α-helix	trans	-69.2	-0.1	176.9	-65.3	174.6	0	0	0	115.7	N675 L682 H737 L740 Q741	N675-L677 PolarHBondContact O-N 3.13Å; L677-L682 HydrophobicContact CD2-CD1 3.62Å; L677-L682 HydrophobicContact CD2-CG 4.15Å; L677-H737 WeakPolarHBondContact CD1-O 3.3Å; L677-L740 HydrophobicContact CD1-CB 4.32Å; L677-L740 HydrophobicContact CD2-CB 3.96Å; L677-L740 HydrophobicContact CG-CB 4.07Å; L677-Q741 HydrophobicContact CD1-CB 3.74Å
678	K	88.6	Confident	91.2	Very high	143 Å²	143	46.9 Å²	46.9	62%	0.622	25%	0.251	S	S	*	.	H	α-helix	trans	-84.6	-37.2	163	-64	178.3	-177	162.3	0	110.9	N675 L676 Q696	N675-K678 HydrophobicContact CB-CD 3.75Å; N675-K678 HydrophobicContact CB-CG 4.15Å; N675-K678 WeakPolarHBondContact O-CB 3.5Å; N675-K678 PolarHBondContact O-N 3.07Å; N675-K678 WeakPolarHBondContact OD1-CE 3.29Å; N675-K678 PolarHBondContact OD1-NZ 2.72Å; L676-K678 PolarHBondContact O-N 3.46Å; L676-K678 VanDerWaalsContact O-N 3.1Å; K678-Q696 PolarHBondContact O-OE1 3.35Å
679	D	91.8	Very high	91.2	Very high	26 Å²	26	42.5 Å²	42.5	14%	0.139	23%	0.231	C	C	.	.	H	α-helix	trans	-79	-26.6	-177.7	-72.9	20.7	0	0	0	112.5	L676 V695 Q696 S699 N700 A701	L676-D679 HydrophobicContact CD1-CB 4.38Å; L676-D679 WeakPolarHBondContact O-CA 3.24Å; L676-D679 WeakPolarHBondContact O-CB 3.4Å; L676-D679 PolarHBondContact O-N 2.88Å; D679-V695 CarbonylContact O-C 3.51Å; D679-V695 WeakPolarHBondContact O-CA 3.43Å; D679-Q696 PolarHBondContact O-N 2.84Å; D679-S699 WeakPolarHBondContact OD2-CB 3.44Å; D679-N700 WeakPolarHBondContact OD2-CA 3.21Å; D679-N700 WeakPolarHBondContact OD2-CB 3.41Å; D679-N700 PolarHBondContact OD2-N 2.92Å; D679-A701 HydrophobicContact CB-CB 3.75Å; D679-A701 PolarHBondContact OD2-N 3.31Å
680	V	93.9	Very high	91.3	Very high	5 Å²	5	42 Å²	42	3%	0.03	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	147.9	-179.3	-54.5	0	0	0	0	113.5	L676 L682 I692 S694 V695 A701 L706	L676-V680 HydrophobicContact CD1-CG1 4.17Å; L676-V680 HydrophobicContact CD1-CG2 4.09Å; L676-V680 HydrophobicContact CG-CG2 4.08Å; L676-V680 PolarHBondContact O-N 3.21Å; V680-L682 HydrophobicContact CG2-CD2 4.39Å; V680-I692 HydrophobicContact CB-CG2 4.44Å; V680-I692 HydrophobicContact CG1-CD1 4.39Å; V680-S694 WeakPolarHBondContact CA-O 3.49Å; V680-V695 HydrophobicContact CG1-CG1 4.29Å; V680-V695 HydrophobicContact CG1-CG2 4.18Å; V680-A701 HydrophobicContact CG1-CB 3.52Å; V680-L706 HydrophobicContact CG1-CD1 4.44Å
681	T	92.9	Very high	91.4	Very high	66 Å²	66	38.7 Å²	38.7	41%	0.405	20%	0.2	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	152.9	165.6	68.3	0	0	0	0	111	I692 S693 S694	T681-I692 WeakPolarHBondContact O-CA 3.47Å; T681-S693 VanDerWaalsContact C-OG 3.22Å; T681-S693 WeakPolarHBondContact CB-OG 3.47Å; T681-S693 PolarHBondContact O-N 3.33Å; T681-S693 PolarHBondContact O-OG 3.33Å; T681-S693 PolarHBondContact OG1-OG 3.35Å; T681-S694 WeakPolarHBondContact CG2-OG 3.25Å; T681-S694 PolarHBondContact N-O 3.32Å; T681-S694 PolarHBondContact OG1-N 3.45Å; T681-S694 PolarHBondContact OG1-OG 3.11Å
682	L	93.3	Very high	91.5	Very high	26 Å²	26	37.9 Å²	37.9	14%	0.136	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	138.8	-173.5	-58.1	174.7	0	0	0	112.4	L677 V680 I690 F691 I692 S693 L712 Q733 L740	L677-L682 HydrophobicContact CD2-CD1 3.62Å; L677-L682 HydrophobicContact CD2-CG 4.15Å; V680-L682 HydrophobicContact CG2-CD2 4.39Å; L682-I690 HydrophobicContact CD2-CG2 4.46Å; L682-F691 WeakPolarHBondContact CA-O 3.41Å; L682-I692 HydrophobicContact CD2-CG1 4.32Å; L682-S693 PolarHBondContact N-OG 3.41Å; L682-L712 HydrophobicContact CD2-CD1 3.97Å; L682-Q733 PolarHBondContact O-NE2 3.44Å; L682-L740 HydrophobicContact CD1-CD1 3.59Å; L682-L740 HydrophobicContact CD2-CD1 4.49Å
683	V	92.9	Very high	91.7	Very high	25 Å²	25	35.6 Å²	35.6	15%	0.152	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	154.3	174	72.6	0	0	0	0	110.5	F691 Y758 L761 L765	V683-F691 HydrophobicContact CG1-CB 4.16Å; V683-F691 PolarHBondContact N-O 3.4Å; V683-F691 PolarHBondContact O-N 3.11Å; V683-Y758 HydrophobicContact CG1-CD2 4.29Å; V683-Y758 HydrophobicContact CG1-CE2 3.68Å; V683-L761 HydrophobicContact CG1-CD2 4.14Å; V683-L761 HydrophobicContact CG2-CD2 4.47Å; V683-L765 HydrophobicContact CG2-CD1 3.52Å
684	G	92.6	Very high	92.1	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	109.2	-154.8	-177.1	0	0	0	0	0	111.9	S688 G689 Q733 S772 G773	G684-S688 WeakPolarHBondContact CA-OG 3.37Å; G684-G689 WeakPolarHBondContact CA-O 3.28Å; G684-Q733 WeakPolarHBondContact O-CB 3.5Å; G684-Q733 VanDerWaalsContact O-CG 3.28Å; G684-Q733 WeakPolarHBondContact O-CG 3.18Å; G684-S772 PolarHBondContact O-OG 3.03Å; G684-G773 VanDerWaalsContact C-CA 3.5Å
685	G	93.4	Very high	92.5	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	165.5	-163.9	-172.1	0	0	0	0	0	111.9	E687 S688 G689 S731 G773 D774	G685-E687 VanDerWaalsContact C-N 3.29Å; G685-E687 PolarHBondContact O-N 3.31Å; G685-S688 PolarHBondContact N-OG 3.42Å; G685-S688 PolarHBondContact O-N 3.24Å; G685-G689 PolarHBondContact N-O 3.11Å; G685-G689 VanDerWaalsContact N-O 3.12Å; G685-G689 CarbonylContact O-C 3.4Å; G685-G689 VanDerWaalsContact O-CA 3.26Å; G685-G689 WeakPolarHBondContact O-CA 3.33Å; G685-G689 PolarHBondContact O-N 3.42Å; G685-S731 CarbonylContact C-O 3.53Å; G685-S731 VanDerWaalsContact C-O 3.32Å; G685-G773 CarbonylContact C-O 3.6Å; G685-G773 VanDerWaalsContact CA-C 3.46Å; G685-G773 WeakPolarHBondContact CA-O 3.48Å; G685-D774 WeakPolarHBondContact CA-OD1 3.3Å
686	N	93.4	Very high	93	Very high	40 Å²	40	36.7 Å²	36.7	21%	0.214	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.3	-14.9	-166.3	77	-87.2	0	0	0	116.1	S731 T732 G773 D774 S775 F776	N686-S731 VanDerWaalsContact CA-O 3.29Å; N686-S731 WeakPolarHBondContact CA-O 3.41Å; N686-S731 PolarHBondContact N-O 2.88Å; N686-S731 VanDerWaalsContact N-O 3.14Å; N686-T732 HydrophobicContact CB-CG2 4.03Å; N686-G773 PolarHBondContact N-O 3.2Å; N686-D774 PolarHBondContact N-OD1 3.04Å; N686-D774 VanDerWaalsContact N-OD1 3.14Å; N686-D774 WeakPolarHBondContact OD1-CA 3.04Å; N686-S775 PolarHBondContact ND2-O 2.69Å; N686-S775 PolarHBondContact OD1-N 2.85Å; N686-F776 VanDerWaalsContact OD1-CD1 3.3Å; N686-F776 WeakPolarHBondContact OD1-CD1 3.35Å
687	E	94.3	Very high	93.1	Very high	126 Å²	126	40.5 Å²	40.5	59%	0.589	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	-102.3	-42.1	175.6	171.7	174	-132.7	0	0	111.8	G685 G689 G773 S775	G685-E687 VanDerWaalsContact C-N 3.29Å; G685-E687 PolarHBondContact O-N 3.31Å; E687-G689 VanDerWaalsContact C-N 3.35Å; E687-G773 PolarHBondContact N-O 3.06Å; E687-S775 WeakPolarHBondContact OE2-CB 3.49Å; E687-S775 PolarHBondContact OE2-OG 2.95Å
688	S	92.1	Very high	93	Very high	37 Å²	37	41 Å²	41	26%	0.259	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.5	-26.1	179.2	69.5	0	0	0	0	113.2	G684 G685 F691 G773	G684-S688 WeakPolarHBondContact CA-OG 3.37Å; G685-S688 PolarHBondContact N-OG 3.42Å; G685-S688 PolarHBondContact O-N 3.24Å; S688-F691 WeakPolarHBondContact O-CE2 3.46Å; S688-G773 PolarHBondContact N-O 3.1Å; S688-G773 VanDerWaalsContact N-O 3.17Å; S688-G773 WeakPolarHBondContact OG-CA 3.22Å
689	G	92.6	Very high	93.2	Very high	4 Å²	4	34.6 Å²	34.6	4%	0.041	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	88.9	165.8	-160.5	0	0	0	0	0	112.9	G684 G685 E687 F691 H711	G684-G689 WeakPolarHBondContact CA-O 3.28Å; G685-G689 PolarHBondContact N-O 3.11Å; G685-G689 VanDerWaalsContact N-O 3.12Å; G685-G689 CarbonylContact O-C 3.4Å; G685-G689 VanDerWaalsContact O-CA 3.26Å; G685-G689 WeakPolarHBondContact O-CA 3.33Å; G685-G689 PolarHBondContact O-N 3.42Å; E687-G689 VanDerWaalsContact C-N 3.35Å; G689-F691 WeakPolarHBondContact O-CD2 3.47Å; G689-H711 WeakPolarHBondContact CA-NE2 3.38Å
690	I	95.6	Very high	93.1	Very high	1 Å²	1	36.5 Å²	36.5	1%	0.005	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	119	-175.8	-60.8	-66.7	0	0	0	111	L682 H711 L712 L728 A736	L682-I690 HydrophobicContact CD2-CG2 4.46Å; I690-H711 PolarHBondContact N-CD2 3.49Å; I690-H711 PolarHBondContact N-NE2 3.38Å; I690-H711 CarbonylContact O-C 3.57Å; I690-H711 WeakPolarHBondContact O-CA 3.38Å; I690-H711 PolarHBondContact O-CD2 3Å; I690-L712 HydrophobicContact CG2-CB 4.36Å; I690-L712 HydrophobicContact CG2-CD1 4.3Å; I690-L712 PolarHBondContact O-N 3.45Å; I690-L728 WeakPolarHBondContact CG1-O 3.42Å; I690-A736 HydrophobicContact CD1-CB 3.6Å; I690-A736 HydrophobicContact CG1-CB 3.77Å; I690-A736 HydrophobicContact CG2-CB 4.09Å
691	F	95.4	Very high	92.9	Very high	3 Å²	3	36.2 Å²	36.2	1%	0.013	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	147.4	-177.8	-63.9	-97.6	0	0	0	113	L682 V683 S688 G689 S693 H710 H711 Y758 L761	L682-F691 WeakPolarHBondContact CA-O 3.41Å; V683-F691 HydrophobicContact CG1-CB 4.16Å; V683-F691 PolarHBondContact N-O 3.4Å; V683-F691 PolarHBondContact O-N 3.11Å; S688-F691 WeakPolarHBondContact O-CE2 3.46Å; G689-F691 WeakPolarHBondContact O-CD2 3.47Å; F691-S693 PolarHBondContact O-N 2.9Å; F691-H710 WeakPolarHBondContact CA-O 3.08Å; F691-H711 HydrophobicContact CD1-CB 3.92Å; F691-H711 AromaticContact CD2-CD2 3.96Å; F691-H711 HydrophobicContact CE1-CB 3.71Å; F691-H711 AromaticContact CE1-CD2 3.86Å; F691-H711 AromaticContact CE2-CD2 3.68Å; F691-H711 HydrophobicContact CZ-CB 4.27Å; F691-H711 AromaticContact CZ-CD2 3.62Å; F691-Y758 HydrophobicContact CB-CD2 3.62Å; F691-Y758 HydrophobicContact CB-CE2 4.1Å; F691-Y758 AromaticContact CD1-CD2 3.9Å; F691-Y758 HydrophobicContact CD1-CD2 3.9Å; F691-Y758 HydrophobicContact CD1-CG 4.23Å; F691-Y758 AromaticContact CG-CD2 3.83Å; F691-Y758 HydrophobicContact CG-CD2 3.83Å; F691-L761 HydrophobicContact CD2-CD2 3.73Å; F691-L761 HydrophobicContact CE2-CD2 4.1Å
692	I	95.3	Very high	92.9	Very high	1 Å²	1	36 Å²	36	1%	0.005	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	119.8	163.4	-62.7	-177.4	0	0	0	109.1	V680 T681 L682 S694 V695 L706 E708 G709 H710 L712	V680-I692 HydrophobicContact CB-CG2 4.44Å; V680-I692 HydrophobicContact CG1-CD1 4.39Å; T681-I692 WeakPolarHBondContact O-CA 3.47Å; L682-I692 HydrophobicContact CD2-CG1 4.32Å; I692-S694 WeakPolarHBondContact CG2-O 3.06Å; I692-V695 HydrophobicContact CG2-CG2 3.54Å; I692-L706 HydrophobicContact CD1-CB 3.87Å; I692-L706 HydrophobicContact CD1-CD1 4.01Å; I692-L706 HydrophobicContact CD1-CD2 3.81Å; I692-L706 HydrophobicContact CD1-CG 4.11Å; I692-E708 WeakPolarHBondContact O-CA 3.16Å; I692-G709 PolarHBondContact O-N 3.33Å; I692-H710 HydrophobicContact CD1-CB 4.31Å; I692-H710 PolarHBondContact N-O 3.5Å; I692-L712 HydrophobicContact CD1-CD2 4.19Å; I692-L712 HydrophobicContact CG1-CD1 4.4Å; I692-L712 HydrophobicContact CG1-CD2 4.32Å; I692-L712 HydrophobicContact CG1-CG 4.36Å
693	S	93.8	Very high	92.8	Very high	27 Å²	27	42.9 Å²	42.9	19%	0.189	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	-27.2	176.8	41.9	0	0	0	0	114.1	T681 L682 F691 E708 Y758	T681-S693 VanDerWaalsContact C-OG 3.22Å; T681-S693 WeakPolarHBondContact CB-OG 3.47Å; T681-S693 PolarHBondContact O-N 3.33Å; T681-S693 PolarHBondContact O-OG 3.33Å; T681-S693 PolarHBondContact OG1-OG 3.35Å; L682-S693 PolarHBondContact N-OG 3.41Å; F691-S693 PolarHBondContact O-N 2.9Å; S693-E708 WeakPolarHBondContact O-CG 3.5Å; S693-Y758 WeakPolarHBondContact CA-OH 3.18Å; S693-Y758 PolarHBondContact O-OH 3.45Å
694	S	93.7	Very high	92.7	Very high	53 Å²	53	43.4 Å²	43.4	37%	0.371	25%	0.25	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.1	160.3	169.9	71.4	0	0	0	0	110.6	V680 T681 I692	V680-S694 WeakPolarHBondContact CA-O 3.49Å; T681-S694 WeakPolarHBondContact CG2-OG 3.25Å; T681-S694 PolarHBondContact N-O 3.32Å; T681-S694 PolarHBondContact OG1-N 3.45Å; T681-S694 PolarHBondContact OG1-OG 3.11Å; I692-S694 WeakPolarHBondContact CG2-O 3.06Å
695	V	94.8	Very high	92.6	Very high	31 Å²	31	44.7 Å²	44.7	19%	0.188	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	135.7	175.3	-173.8	0	0	0	0	107.9	D679 V680 I692 A701 E702	D679-V695 CarbonylContact O-C 3.51Å; D679-V695 WeakPolarHBondContact O-CA 3.43Å; V680-V695 HydrophobicContact CG1-CG1 4.29Å; V680-V695 HydrophobicContact CG1-CG2 4.18Å; I692-V695 HydrophobicContact CG2-CG2 3.54Å; V695-A701 HydrophobicContact CG1-CB 3.91Å; V695-E702 HydrophobicContact CG1-CB 3.81Å
696	Q	93.8	Very high	92.6	Very high	113 Å²	113	44.7 Å²	44.7	53%	0.528	26%	0.263	S	S	.	.			trans	-70.2	132	177.6	-178.3	177.7	5.7	0	0	110.4	K678 D679 S699	K678-Q696 PolarHBondContact O-OE1 3.35Å; D679-Q696 PolarHBondContact O-N 2.84Å; Q696-S699 WeakPolarHBondContact O-CB 3.5Å; Q696-S699 PolarHBondContact O-N 2.74Å; Q696-S699 PolarHBondContact O-OG 3.17Å
697	A	91.1	Very high	92.6	Very high	83 Å²	83	48.1 Å²	48.1	69%	0.686	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.6	135.9	177.6	0	0	0	0	0	111.8	S699 E702	A697-S699 PolarHBondContact O-N 3.38Å; A697-E702 WeakPolarHBondContact CA-OE2 3.12Å
698	G	88	Confident	92.6	Very high	51 Å²	51	46.4 Å²	46.4	53%	0.526	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	79.4	-6.8	-176.5	0	0	0	0	0	115.6	E702 R703	G698-E702 PolarHBondContact N-OE2 2.91Å; G698-R703 PolarHBondContact O-NH1 3.46Å
699	S	92.3	Very high	92.6	Very high	9 Å²	9	44.7 Å²	44.7	6%	0.063	25%	0.253	C	S	.	.			trans	-62.3	167	-175.8	67.1	0	0	0	0	114.4	D679 Q696 A697 A701 E702 R703	D679-S699 WeakPolarHBondContact OD2-CB 3.44Å; Q696-S699 WeakPolarHBondContact O-CB 3.5Å; Q696-S699 PolarHBondContact O-N 2.74Å; Q696-S699 PolarHBondContact O-OG 3.17Å; A697-S699 PolarHBondContact O-N 3.38Å; S699-A701 VanDerWaalsContact C-N 3.31Å; S699-E702 PolarHBondContact O-N 2.96Å; S699-E702 WeakPolarHBondContact OG-CB 3.37Å; S699-E702 PolarHBondContact OG-N 3.33Å; S699-R703 WeakPolarHBondContact O-CG 3.34Å; S699-R703 PolarHBondContact O-N 3.45Å; S699-R703 VanDerWaalsContact O-N 3.15Å; S699-R703 PolarHBondContact O-NH1 2.86Å; S699-R703 VanDerWaalsContact O-NH1 3.16Å
700	N	88.9	Confident	92.7	Very high	65 Å²	65	45.1 Å²	45.1	35%	0.348	25%	0.254	S	S	.	.	H	α-helix	trans	-65.5	-39.6	172.9	-65.5	-33.2	0	0	0	110.4	D679 R703 A704	D679-N700 WeakPolarHBondContact OD2-CA 3.21Å; D679-N700 WeakPolarHBondContact OD2-CB 3.41Å; D679-N700 PolarHBondContact OD2-N 2.92Å; N700-R703 PolarHBondContact O-N 2.91Å; N700-R703 VanDerWaalsContact OD1-CZ 3.31Å; N700-R703 PolarHBondContact OD1-NH1 2.84Å; N700-R703 PolarHBondContact OD1-NH2 3.34Å; N700-A704 VanDerWaalsContact O-CB 3.26Å; N700-A704 WeakPolarHBondContact O-CB 3.22Å; N700-A704 PolarHBondContact O-N 2.87Å
701	A	91.1	Very high	92.7	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-58.9	-45.9	174.8	0	0	0	0	0	113.1	L676 D679 V680 V695 S699 A704 G705 L706	L676-A701 HydrophobicContact CD1-CB 4.16Å; D679-A701 HydrophobicContact CB-CB 3.75Å; D679-A701 PolarHBondContact OD2-N 3.31Å; V680-A701 HydrophobicContact CG1-CB 3.52Å; V695-A701 HydrophobicContact CG1-CB 3.91Å; S699-A701 VanDerWaalsContact C-N 3.31Å; A701-A704 PolarHBondContact O-N 2.91Å; A701-G705 PolarHBondContact O-N 2.98Å; A701-L706 HydrophobicContact CB-CB 4.32Å; A701-L706 HydrophobicContact CB-CD1 3.99Å; A701-L706 WeakPolarHBondContact O-CB 3.49Å; A701-L706 PolarHBondContact O-N 2.99Å
702	E	92.6	Very high	92.6	Very high	62 Å²	62	45.7 Å²	45.7	29%	0.29	26%	0.257	S	S	.	.	H	α-helix	trans	-66	-45.6	179.7	-170.7	-175.8	-135.7	0	0	111.5	V695 A697 G698 S699 A704 G705 R707	V695-E702 HydrophobicContact CG1-CB 3.81Å; A697-E702 WeakPolarHBondContact CA-OE2 3.12Å; G698-E702 PolarHBondContact N-OE2 2.91Å; S699-E702 PolarHBondContact O-N 2.96Å; S699-E702 WeakPolarHBondContact OG-CB 3.37Å; S699-E702 PolarHBondContact OG-N 3.33Å; E702-A704 VanDerWaalsContact C-N 3.27Å; E702-A704 PolarHBondContact O-N 2.72Å; E702-G705 PolarHBondContact O-N 3.4Å; E702-G705 VanDerWaalsContact O-N 3.08Å; E702-R707 PolarHBondContact O-NH1 3.42Å; E702-R707 PolarHBondContact O-NH2 2.86Å
703	R	91.4	Very high	92.5	Very high	169 Å²	169	46.5 Å²	46.5	64%	0.638	26%	0.261	S	S	*	.	H	α-helix	trans	-65	-31	178.8	-64.9	-167.5	-32.9	-78.7	-4.3	112.6	G698 S699 N700 G705	G698-R703 PolarHBondContact O-NH1 3.46Å; S699-R703 WeakPolarHBondContact O-CG 3.34Å; S699-R703 PolarHBondContact O-N 3.45Å; S699-R703 VanDerWaalsContact O-N 3.15Å; S699-R703 PolarHBondContact O-NH1 2.86Å; S699-R703 VanDerWaalsContact O-NH1 3.16Å; N700-R703 PolarHBondContact O-N 2.91Å; N700-R703 VanDerWaalsContact OD1-CZ 3.31Å; N700-R703 PolarHBondContact OD1-NH1 2.84Å; N700-R703 PolarHBondContact OD1-NH2 3.34Å; R703-G705 VanDerWaalsContact C-N 3.29Å
704	A	90.4	Very high	92.6	Very high	37 Å²	37	47.5 Å²	47.5	31%	0.306	26%	0.264	S	S	.	.	H	α-helix	trans	-75.6	-16.4	175.1	0	0	0	0	0	113.2	V669 L671 N700 A701 E702	V669-A704 HydrophobicContact CG2-CB 3.46Å; V669-A704 VanDerWaalsContact CG2-CB 3.46Å; V669-A704 WeakPolarHBondContact CG2-O 3.48Å; L671-A704 HydrophobicContact CB-CB 3.96Å; N700-A704 VanDerWaalsContact O-CB 3.26Å; N700-A704 WeakPolarHBondContact O-CB 3.22Å; N700-A704 PolarHBondContact O-N 2.87Å; A701-A704 PolarHBondContact O-N 2.91Å; E702-A704 VanDerWaalsContact C-N 3.27Å; E702-A704 PolarHBondContact O-N 2.72Å
705	G	90.4	Very high	92.5	Very high	26 Å²	26	45 Å²	45	27%	0.268	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	112	5	173.1	0	0	0	0	0	115.8	A701 E702 R703 H710	A701-G705 PolarHBondContact O-N 2.98Å; E702-G705 PolarHBondContact O-N 3.4Å; E702-G705 VanDerWaalsContact O-N 3.08Å; R703-G705 VanDerWaalsContact C-N 3.29Å; G705-H710 PolarHBondContact O-CE1 3.39Å
706	L	93.3	Very high	92.4	Very high	1 Å²	1	46.4 Å²	46.4	1%	0.005	25%	0.251	C	S	.	.			trans	-69.1	139.6	174.5	-67.5	176.5	0	0	0	111.1	V669 L671 V680 I692 A701 L749 Y751	V669-L706 HydrophobicContact CG1-CD2 3.7Å; V669-L706 HydrophobicContact CG1-CG 4.09Å; L671-L706 HydrophobicContact CD1-CD1 4.35Å; V680-L706 HydrophobicContact CG1-CD1 4.44Å; I692-L706 HydrophobicContact CD1-CB 3.87Å; I692-L706 HydrophobicContact CD1-CD1 4.01Å; I692-L706 HydrophobicContact CD1-CD2 3.81Å; I692-L706 HydrophobicContact CD1-CG 4.11Å; A701-L706 HydrophobicContact CB-CB 4.32Å; A701-L706 HydrophobicContact CB-CD1 3.99Å; A701-L706 WeakPolarHBondContact O-CB 3.49Å; A701-L706 PolarHBondContact O-N 2.99Å; L706-L749 HydrophobicContact CD1-CD1 4.03Å; L706-Y751 HydrophobicContact CD2-CD1 4.2Å; L706-Y751 HydrophobicContact CD2-CE1 4.35Å
707	R	93.8	Very high	92.2	Very high	111 Å²	111	41.7 Å²	41.7	42%	0.419	23%	0.233	S	C	.	.			trans	-141.3	164.2	-180	-60.8	-66	-179.7	-86	7.5	110.3	E702 H710	E702-R707 PolarHBondContact O-NH1 3.42Å; E702-R707 PolarHBondContact O-NH2 2.86Å; R707-H710 PolarHBondContact N-ND1 3.47Å; R707-H710 WeakPolarHBondContact O-CB 3.46Å; R707-H710 VanDerWaalsContact O-CG 3.29Å; R707-H710 PolarHBondContact O-N 3.26Å
708	E	94.8	Very high	91.9	Very high	91 Å²	91	38.8 Å²	38.8	43%	0.425	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.1	143.6	170	-179.5	176.4	-174.6	0	0	111.4	I692 S693 H710 F755 Y758 Q762	I692-E708 WeakPolarHBondContact O-CA 3.16Å; S693-E708 WeakPolarHBondContact O-CG 3.5Å; E708-H710 VanDerWaalsContact C-N 3.25Å; E708-H710 PolarHBondContact O-N 2.91Å; E708-F755 VanDerWaalsContact O-CE1 3.27Å; E708-F755 WeakPolarHBondContact O-CE1 3.38Å; E708-Y758 HydrophobicContact CG-CD1 4.42Å; E708-Y758 HydrophobicContact CG-CE1 3.44Å; E708-Y758 VanDerWaalsContact CG-CE1 3.44Å; E708-Y758 VanDerWaalsContact CG-OH 3.32Å; E708-Y758 WeakPolarHBondContact CG-OH 3.41Å; E708-Y758 WeakPolarHBondContact OE1-CE1 3.24Å; E708-Y758 VanDerWaalsContact OE1-CZ 3.31Å; E708-Y758 PolarHBondContact OE1-OH 3.21Å; E708-Q762 PolarHBondContact OE1-NE2 2.92Å; E708-Q762 VanDerWaalsContact OE1-NE2 3.14Å
709	G	91.6	Very high	91.7	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	75.3	7.5	179.6	0	0	0	0	0	115.2	I692 S754	I692-G709 PolarHBondContact O-N 3.33Å; G709-S754 PolarHBondContact O-N 3Å
710	H	94.8	Very high	91.1	Very high	13 Å²	13	41.8 Å²	41.8	6%	0.06	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	123.1	165	-71.9	-161.4	0	0	0	109.6	F691 I692 G705 R707 E708 Y751	F691-H710 WeakPolarHBondContact CA-O 3.08Å; I692-H710 HydrophobicContact CD1-CB 4.31Å; I692-H710 PolarHBondContact N-O 3.5Å; G705-H710 PolarHBondContact O-CE1 3.39Å; R707-H710 PolarHBondContact N-ND1 3.47Å; R707-H710 WeakPolarHBondContact O-CB 3.46Å; R707-H710 VanDerWaalsContact O-CG 3.29Å; R707-H710 PolarHBondContact O-N 3.26Å; E708-H710 VanDerWaalsContact C-N 3.25Å; E708-H710 PolarHBondContact O-N 2.91Å; H710-Y751 HydrophobicContact CB-CD2 3.97Å; H710-Y751 AromaticContact CE1-CD2 3.9Å; H710-Y751 AromaticContact CE1-CE2 3.27Å; H710-Y751 WeakPolarHBondContact CE1-CE2 3.41Å; H710-Y751 AromaticContact CE1-CZ 3.9Å; H710-Y751 AromaticContact CG-CD2 3.69Å; H710-Y751 AromaticContact CG-CE2 3.88Å; H710-Y751 AromaticContact ND1-CD2 3.29Å; H710-Y751 VanDerWaalsContact ND1-CD2 3.29Å; H710-Y751 WeakPolarHBondContact ND1-CD2 3.42Å; H710-Y751 AromaticContact ND1-CE2 3.12Å; H710-Y751 WeakPolarHBondContact ND1-CE2 3.44Å; H710-Y751 AromaticContact ND1-CZ 3.83Å
711	H	94.8	Very high	90.5	Very high	15 Å²	15	41.3 Å²	41.3	7%	0.069	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	123	173.9	-175	-117	0	0	0	109.9	G689 I690 F691 L713 D729 Y751 R752	G689-H711 WeakPolarHBondContact CA-NE2 3.38Å; I690-H711 PolarHBondContact N-CD2 3.49Å; I690-H711 PolarHBondContact N-NE2 3.38Å; I690-H711 CarbonylContact O-C 3.57Å; I690-H711 WeakPolarHBondContact O-CA 3.38Å; I690-H711 PolarHBondContact O-CD2 3Å; F691-H711 HydrophobicContact CD1-CB 3.92Å; F691-H711 AromaticContact CD2-CD2 3.96Å; F691-H711 HydrophobicContact CE1-CB 3.71Å; F691-H711 AromaticContact CE1-CD2 3.86Å; F691-H711 AromaticContact CE2-CD2 3.68Å; F691-H711 HydrophobicContact CZ-CB 4.27Å; F691-H711 AromaticContact CZ-CD2 3.62Å; H711-L713 VanDerWaalsContact ND1-CD2 3.27Å; H711-L713 WeakPolarHBondContact ND1-CD2 3.35Å; H711-D729 IonicContact CE1-OD1 3.87Å; H711-D729 PolarHBondContact CE1-OD1 3.11Å; H711-D729 VanDerWaalsContact CE1-OD1 3.3Å; H711-D729 IonicContact ND1-OD1 3.87Å; H711-Y751 CarbonylContact O-C 3.56Å; H711-Y751 WeakPolarHBondContact O-CA 3.32Å; H711-Y751 VanDerWaalsContact O-CB 3.25Å; H711-Y751 WeakPolarHBondContact O-CB 3.41Å; H711-R752 VanDerWaalsContact CB-O 3.29Å; H711-R752 WeakPolarHBondContact CB-O 3.23Å; H711-R752 PolarHBondContact N-O 3.45Å; H711-R752 PolarHBondContact O-N 2.85Å
712	L	94.5	Very high	90.1	Very high	2 Å²	2	46.4 Å²	46.4	1%	0.01	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	134.9	179.5	-58.9	-177.3	0	0	0	110.4	L682 I690 I692 L728 L740 L749	L682-L712 HydrophobicContact CD2-CD1 3.97Å; I690-L712 HydrophobicContact CG2-CB 4.36Å; I690-L712 HydrophobicContact CG2-CD1 4.3Å; I690-L712 PolarHBondContact O-N 3.45Å; I692-L712 HydrophobicContact CD1-CD2 4.19Å; I692-L712 HydrophobicContact CG1-CD1 4.4Å; I692-L712 HydrophobicContact CG1-CD2 4.32Å; I692-L712 HydrophobicContact CG1-CG 4.36Å; L712-L728 HydrophobicContact CB-CB 4.33Å; L712-L728 HydrophobicContact CB-CD1 3.91Å; L712-L728 HydrophobicContact CD1-CD1 4.28Å; L712-L740 HydrophobicContact CD1-CD1 4.01Å; L712-L749 HydrophobicContact CD2-CD1 4.42Å
713	L	93.7	Very high	89.7	Confident	17 Å²	17	50.3 Å²	50.3	9%	0.089	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	-42.1	-173.3	-59.6	175.5	0	0	0	112.9	V666 H711 L728 D729 H750 R752	V666-L713 HydrophobicContact CB-CD1 4.36Å; V666-L713 HydrophobicContact CG1-CD1 3.9Å; V666-L713 HydrophobicContact CG2-CD1 3.61Å; H711-L713 VanDerWaalsContact ND1-CD2 3.27Å; H711-L713 WeakPolarHBondContact ND1-CD2 3.35Å; L713-L728 PolarHBondContact O-N 3.33Å; L713-D729 HydrophobicContact CD2-CB 4.15Å; L713-D729 WeakPolarHBondContact CD2-OD1 3.44Å; L713-D729 PolarHBondContact O-N 2.9Å; L713-H750 WeakPolarHBondContact CB-O 3.38Å; L713-H750 PolarHBondContact N-O 3.2Å; L713-R752 HydrophobicContact CD1-CB 4.12Å
714	L	94.2	Very high	89.6	Confident	48 Å²	48	44.5 Å²	44.5	25%	0.251	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.8	140	-174.9	-168.8	76.8	0	0	0	109.3	E716 L726 H750	L714-E716 HydrophobicContact CD2-CG 3.92Å; L714-E716 HydrophobicContact CG-CG 4.25Å; L714-L726 WeakPolarHBondContact CA-O 3.41Å; L714-H750 HydrophobicContact CB-CB 3.97Å; L714-H750 PolarHBondContact N-O 3.32Å; L714-H750 PolarHBondContact O-N 3.38Å
715	L	93.1	Very high	89.5	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	127.4	167	170.7	71.3	0	0	0	108.8	V719 S725 L726 L728 T739 L740 C743 I747 K748 L749	L715-V719 HydrophobicContact CD2-CG2 3.8Å; L715-S725 CarbonylContact O-C 3.59Å; L715-S725 WeakPolarHBondContact O-CA 3.42Å; L715-L726 PolarHBondContact N-O 3.14Å; L715-L726 PolarHBondContact O-N 3.24Å; L715-L728 HydrophobicContact CB-CD1 4.14Å; L715-T739 HydrophobicContact CD2-CG2 3.59Å; L715-L740 HydrophobicContact CD1-CD2 4.3Å; L715-L740 HydrophobicContact CD2-CD2 4Å; L715-C743 HydrophobicContact CD2-CB 4.26Å; L715-I747 HydrophobicContact CD1-CB 3.92Å; L715-I747 HydrophobicContact CD1-CD1 3.75Å; L715-I747 HydrophobicContact CD1-CG1 4.34Å; L715-I747 HydrophobicContact CD1-CG2 4.27Å; L715-K748 WeakPolarHBondContact CA-O 3.16Å; L715-L749 HydrophobicContact CB-CD2 3.95Å; L715-L749 HydrophobicContact CD1-CD2 3.66Å; L715-L749 HydrophobicContact CD1-CG 4.13Å; L715-L749 HydrophobicContact CG-CD2 4.41Å
716	E	92.5	Very high	89.4	Confident	61 Å²	61	46.2 Å²	46.2	29%	0.285	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	137.9	169.2	-38	-158.1	114.4	0	0	110.9	L714 Q724 S725 I747 K748 H750	L714-E716 HydrophobicContact CD2-CG 3.92Å; L714-E716 HydrophobicContact CG-CG 4.25Å; E716-Q724 WeakPolarHBondContact CA-O 3.21Å; E716-S725 WeakPolarHBondContact CG-OG 3.19Å; E716-S725 WeakPolarHBondContact OE1-CB 3.49Å; E716-S725 PolarHBondContact OE1-OG 3.35Å; E716-I747 CarbonylContact O-C 3.52Å; E716-I747 VanDerWaalsContact O-CA 3.32Å; E716-I747 WeakPolarHBondContact O-CA 3.38Å; E716-K748 HydrophobicContact CB-CB 4.19Å; E716-K748 HydrophobicContact CB-CD 4.3Å; E716-K748 PolarHBondContact N-O 3.27Å; E716-K748 PolarHBondContact O-N 3.44Å; E716-H750 IonicContact OE2-NE2 3.37Å
717	G	88.6	Confident	89.3	Confident	15 Å²	15	49.1 Å²	49.1	16%	0.155	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	142.8	-163.2	176	0	0	0	0	0	112.3	V719 N723 Q724	G717-V719 PolarHBondContact O-N 3.36Å; G717-N723 WeakPolarHBondContact O-CA 3.35Å; G717-Q724 PolarHBondContact N-O 2.65Å; G717-Q724 PolarHBondContact O-N 3.15Å
718	S	85.4	Confident	89.3	Confident	22 Å²	22	43.9 Å²	43.9	15%	0.154	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	114.5	-176.8	-163.2	0	0	0	0	111.6	G721 E722 C743 S744	S718-G721 VanDerWaalsContact OG-C 3.22Å; S718-G721 VanDerWaalsContact OG-CA 3.29Å; S718-G721 WeakPolarHBondContact OG-CA 3.3Å; S718-G721 PolarHBondContact OG-O 3.42Å; S718-E722 CarbonylContact C-O 3.38Å; S718-E722 VanDerWaalsContact CA-O 3.32Å; S718-E722 WeakPolarHBondContact CA-O 3.49Å; S718-C743 WeakPolarHBondContact O-CA 3.32Å; S718-S744 WeakPolarHBondContact CB-O 3.4Å; S718-S744 PolarHBondContact O-N 3.47Å
719	V	83.9	Confident	88.9	Confident	0 Å²	0	43 Å²	43	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	128.2	176.4	-177	0	0	0	0	108	L715 G717 G721 E722 L726 T739 H742 C743 F932	L715-V719 HydrophobicContact CD2-CG2 3.8Å; G717-V719 PolarHBondContact O-N 3.36Å; V719-G721 PolarHBondContact O-N 3.5Å; V719-E722 PolarHBondContact N-O 3.33Å; V719-E722 PolarHBondContact O-N 3.4Å; V719-E722 VanDerWaalsContact O-O 3.13Å; V719-L726 HydrophobicContact CB-CD1 4.3Å; V719-L726 HydrophobicContact CG1-CD1 4.11Å; V719-L726 HydrophobicContact CG2-CD1 4.14Å; V719-T739 HydrophobicContact CG1-CG2 4.48Å; V719-H742 WeakPolarHBondContact CA-O 3.39Å; V719-C743 HydrophobicContact CG2-CB 4.2Å; V719-F932 HydrophobicContact CG1-CZ 4.32Å
720	R	80.3	Confident	88.8	Confident	123 Å²	123	47.6 Å²	47.6	46%	0.464	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.6	14.2	-165.2	-63.6	-163.6	-74.2	-122.5	17	115	W738 H742	R720-W738 HydrophobicContact CG-CH2 3.79Å; R720-W738 HydrophobicContact CG-CZ3 4.49Å; R720-H742 HydrophobicContact CG-CB 4.46Å; R720-H742 PolarHBondContact N-O 2.65Å
721	G	75.2	Confident	88.7	Confident	55 Å²	55	47.6 Å²	47.6	57%	0.567	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	91.9	-1.5	-174.8	0	0	0	0	0	114.9	S718 V719	S718-G721 VanDerWaalsContact OG-C 3.22Å; S718-G721 VanDerWaalsContact OG-CA 3.29Å; S718-G721 WeakPolarHBondContact OG-CA 3.3Å; S718-G721 PolarHBondContact OG-O 3.42Å; V719-G721 PolarHBondContact O-N 3.5Å
722	E	82.5	Confident	88.7	Confident	107 Å²	107	47.5 Å²	47.5	50%	0.5	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	140.8	173.6	-66.8	177.7	170	0	0	110.1	S718 V719 Q724	S718-E722 CarbonylContact C-O 3.38Å; S718-E722 VanDerWaalsContact CA-O 3.32Å; S718-E722 WeakPolarHBondContact CA-O 3.49Å; V719-E722 PolarHBondContact N-O 3.33Å; V719-E722 PolarHBondContact O-N 3.4Å; V719-E722 VanDerWaalsContact O-O 3.13Å; E722-Q724 HydrophobicContact CB-CG 4.14Å; E722-Q724 PolarHBondContact O-N 3.03Å; E722-Q724 PolarHBondContact OE2-NE2 3.31Å
723	N	85.2	Confident	88.6	Confident	143 Å²	143	48.7 Å²	48.7	77%	0.765	28%	0.276	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.8	113.4	173.5	-74.6	-12.1	0	0	0	109.8	G717	G717-N723 WeakPolarHBondContact O-CA 3.35Å
724	Q	88.1	Confident	88.6	Confident	48 Å²	48	48.9 Å²	48.9	22%	0.224	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	157.8	-177.5	-59.7	-173.6	1	0	0	110.4	E716 G717 E722 L726	E716-Q724 WeakPolarHBondContact CA-O 3.21Å; G717-Q724 PolarHBondContact N-O 2.65Å; G717-Q724 PolarHBondContact O-N 3.15Å; E722-Q724 HydrophobicContact CB-CG 4.14Å; E722-Q724 PolarHBondContact O-N 3.03Å; E722-Q724 PolarHBondContact OE2-NE2 3.31Å; Q724-L726 HydrophobicContact CB-CD1 4.5Å; Q724-L726 HydrophobicContact CB-CD2 4.39Å; Q724-L726 HydrophobicContact CB-CG 4.17Å
725	S	88.5	Confident	88.4	Confident	64 Å²	64	50.2 Å²	50.2	45%	0.448	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	114.9	170.8	-173.5	0	0	0	0	107.5	L715 E716	L715-S725 CarbonylContact O-C 3.59Å; L715-S725 WeakPolarHBondContact O-CA 3.42Å; E716-S725 WeakPolarHBondContact CG-OG 3.19Å; E716-S725 WeakPolarHBondContact OE1-CB 3.49Å; E716-S725 PolarHBondContact OE1-OG 3.35Å
726	L	89.2	Confident	88.4	Confident	34 Å²	34	50.2 Å²	50.2	18%	0.178	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	121.3	-165.3	-64.5	176.3	0	0	0	110.5	L714 L715 V719 Q724 T739 F932	L714-L726 WeakPolarHBondContact CA-O 3.41Å; L715-L726 PolarHBondContact N-O 3.14Å; L715-L726 PolarHBondContact O-N 3.24Å; V719-L726 HydrophobicContact CB-CD1 4.3Å; V719-L726 HydrophobicContact CG1-CD1 4.11Å; V719-L726 HydrophobicContact CG2-CD1 4.14Å; Q724-L726 HydrophobicContact CB-CD1 4.5Å; Q724-L726 HydrophobicContact CB-CD2 4.39Å; Q724-L726 HydrophobicContact CB-CG 4.17Å; L726-T739 HydrophobicContact CD1-CG2 3.61Å; L726-F932 HydrophobicContact CD1-CE1 4.44Å; L726-F932 HydrophobicContact CD1-CE2 4.24Å; L726-F932 HydrophobicContact CD1-CZ 3.7Å
727	S	91.4	Very high	88.4	Confident	63 Å²	63	49.6 Å²	49.6	44%	0.441	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	133.8	175.7	-174.1	0	0	0	0	110.7	S731	S727-S731 PolarHBondContact O-OG 2.91Å
728	L	92.5	Very high	88.4	Confident	0 Å²	0	52.7 Å²	52.7	0%	0	29%	0.286	C	S	.	.			trans	-111.5	-15.1	172.9	-63.1	175.9	0	0	0	112.3	I690 L712 L713 L715 T730 S731 A736 L740 L749	I690-L728 WeakPolarHBondContact CG1-O 3.42Å; L712-L728 HydrophobicContact CB-CB 4.33Å; L712-L728 HydrophobicContact CB-CD1 3.91Å; L712-L728 HydrophobicContact CD1-CD1 4.28Å; L713-L728 PolarHBondContact O-N 3.33Å; L715-L728 HydrophobicContact CB-CD1 4.14Å; L728-T730 PolarHBondContact O-N 3.11Å; L728-T730 VanDerWaalsContact O-N 3.17Å; L728-S731 WeakPolarHBondContact CA-OG 3.3Å; L728-S731 PolarHBondContact O-N 3.48Å; L728-A736 HydrophobicContact CD2-CB 4.09Å; L728-L740 HydrophobicContact CD1-CD1 4.38Å; L728-L749 HydrophobicContact CD1-CD2 4.2Å
729	D	88.1	Confident	88.7	Confident	73 Å²	73	51.9 Å²	51.9	39%	0.39	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-26.9	-176.6	-168.8	60.6	0	0	0	113.2	H711 L713	H711-D729 IonicContact CE1-OD1 3.87Å; H711-D729 PolarHBondContact CE1-OD1 3.11Å; H711-D729 VanDerWaalsContact CE1-OD1 3.3Å; H711-D729 IonicContact ND1-OD1 3.87Å; L713-D729 HydrophobicContact CD2-CB 4.15Å; L713-D729 WeakPolarHBondContact CD2-OD1 3.44Å; L713-D729 PolarHBondContact O-N 2.9Å
730	T	88	Confident	89	Confident	97 Å²	97	51.9 Å²	51.9	60%	0.595	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-127.5	15.4	178.9	67.2	0	0	0	0	113.7	L728	L728-T730 PolarHBondContact O-N 3.11Å; L728-T730 VanDerWaalsContact O-N 3.17Å
731	S	92.6	Very high	89.5	Confident	13 Å²	13	51.7 Å²	51.7	9%	0.091	28%	0.284	C	S	.	.			trans	-74.5	146.3	178.4	-65.5	0	0	0	0	111.7	G685 N686 S727 L728	G685-S731 CarbonylContact C-O 3.53Å; G685-S731 VanDerWaalsContact C-O 3.32Å; N686-S731 VanDerWaalsContact CA-O 3.29Å; N686-S731 WeakPolarHBondContact CA-O 3.41Å; N686-S731 PolarHBondContact N-O 2.88Å; N686-S731 VanDerWaalsContact N-O 3.14Å; S727-S731 PolarHBondContact O-OG 2.91Å; L728-S731 WeakPolarHBondContact CA-OG 3.3Å; L728-S731 PolarHBondContact O-N 3.48Å
732	T	94.5	Very high	90.1	Very high	13 Å²	13	52.4 Å²	52.4	8%	0.08	27%	0.273	C	S	.	.			trans	-65.9	159.9	162.5	59.7	0	0	0	0	111.5	N686 E734 E735 A736 D774 F776 T806	N686-T732 HydrophobicContact CB-CG2 4.03Å; T732-E734 PolarHBondContact O-N 2.99Å; T732-E735 WeakPolarHBondContact CB-OE2 3.47Å; T732-E735 WeakPolarHBondContact CG2-OE2 3.49Å; T732-E735 PolarHBondContact N-OE2 3.23Å; T732-E735 PolarHBondContact O-N 3.39Å; T732-E735 WeakPolarHBondContact OG1-CB 3.48Å; T732-E735 VanDerWaalsContact OG1-CD 3.23Å; T732-E735 VanDerWaalsContact OG1-CG 3.22Å; T732-E735 WeakPolarHBondContact OG1-CG 3.29Å; T732-E735 PolarHBondContact OG1-N 2.92Å; T732-E735 PolarHBondContact OG1-OE2 3.33Å; T732-A736 PolarHBondContact O-N 2.71Å; T732-D774 WeakPolarHBondContact CA-OD1 3.47Å; T732-D774 WeakPolarHBondContact CB-OD1 2.94Å; T732-F776 HydrophobicContact CG2-CD1 4.23Å; T732-F776 HydrophobicContact CG2-CE1 3.59Å; T732-F776 HydrophobicContact CG2-CZ 4.1Å; T732-T806 HydrophobicContact CG2-CG2 4.03Å
733	Q	92.7	Very high	90.4	Very high	27 Å²	27	47.6 Å²	47.6	13%	0.126	25%	0.251	C	S	.	.	H	α-helix	trans	-60.3	-35.3	177.9	-152.5	-173.5	12.5	0	0	111.9	L682 G684 H737 S772 D774 T806 R807	L682-Q733 PolarHBondContact O-NE2 3.44Å; G684-Q733 WeakPolarHBondContact O-CB 3.5Å; G684-Q733 VanDerWaalsContact O-CG 3.28Å; G684-Q733 WeakPolarHBondContact O-CG 3.18Å; Q733-H737 VanDerWaalsContact O-CB 3.24Å; Q733-H737 WeakPolarHBondContact O-CB 3.41Å; Q733-H737 PolarHBondContact O-N 3.12Å; Q733-H737 VanDerWaalsContact O-N 3.1Å; Q733-S772 PolarHBondContact OE1-OG 2.95Å; Q733-D774 WeakPolarHBondContact CB-OD2 3.33Å; Q733-D774 PolarHBondContact N-OD1 2.97Å; Q733-D774 PolarHBondContact N-OD2 3.09Å; Q733-T806 PolarHBondContact N-OG1 3.26Å; Q733-R807 HydrophobicContact CB-CG 4.22Å; Q733-R807 HydrophobicContact CG-CG 4.44Å; Q733-R807 VanDerWaalsContact O-CD 3.23Å; Q733-R807 WeakPolarHBondContact O-CD 3.34Å
734	E	93.1	Very high	90.6	Very high	21 Å²	21	42.8 Å²	42.8	10%	0.098	23%	0.229	C	C	.	.	H	α-helix	trans	-64.2	-49.3	173.3	-174	172.2	-147.8	0	0	111.7	T732 W738 T806 R807 C812 W814 S835	T732-E734 PolarHBondContact O-N 2.99Å; E734-W738 WeakPolarHBondContact O-CB 3.43Å; E734-W738 PolarHBondContact O-N 3.44Å; E734-T806 WeakPolarHBondContact CB-OG1 3.31Å; E734-T806 PolarHBondContact N-OG1 2.89Å; E734-R807 HydrophobicContact CB-CG 3.99Å; E734-C812 VanDerWaalsContact OE1-CB 3.32Å; E734-C812 WeakPolarHBondContact OE1-CB 3.48Å; E734-C812 PolarHBondContact OE1-SG 2.79Å; E734-W814 PolarHBondContact OE2-NE1 3.33Å; E734-S835 WeakPolarHBondContact OE1-CB 3.46Å; E734-S835 WeakPolarHBondContact OE2-CB 3.23Å
735	E	91.9	Very high	90.6	Very high	75 Å²	75	41.3 Å²	41.3	35%	0.35	23%	0.226	S	C	.	.	H	α-helix	trans	-62.5	-45.4	179.6	-71.9	164.3	134.6	0	0	112.4	T732 W738 T739	T732-E735 WeakPolarHBondContact CB-OE2 3.47Å; T732-E735 WeakPolarHBondContact CG2-OE2 3.49Å; T732-E735 PolarHBondContact N-OE2 3.23Å; T732-E735 PolarHBondContact O-N 3.39Å; T732-E735 WeakPolarHBondContact OG1-CB 3.48Å; T732-E735 VanDerWaalsContact OG1-CD 3.23Å; T732-E735 VanDerWaalsContact OG1-CG 3.22Å; T732-E735 WeakPolarHBondContact OG1-CG 3.29Å; T732-E735 PolarHBondContact OG1-N 2.92Å; T732-E735 PolarHBondContact OG1-OE2 3.33Å; E735-W738 PolarHBondContact O-N 3Å; E735-T739 VanDerWaalsContact O-CB 3.29Å; E735-T739 WeakPolarHBondContact O-CB 3.39Å; E735-T739 PolarHBondContact O-N 2.96Å; E735-T739 PolarHBondContact O-OG1 3.28Å
736	A	92.3	Very high	90.7	Very high	1 Å²	1	43.6 Å²	43.6	1%	0.008	24%	0.239	C	C	.	.	H	α-helix	trans	-64.8	-46.1	-179.7	0	0	0	0	0	111.9	I690 L728 T732 T739 L740	I690-A736 HydrophobicContact CD1-CB 3.6Å; I690-A736 HydrophobicContact CG1-CB 3.77Å; I690-A736 HydrophobicContact CG2-CB 4.09Å; L728-A736 HydrophobicContact CD2-CB 4.09Å; T732-A736 PolarHBondContact O-N 2.71Å; A736-T739 PolarHBondContact O-N 2.83Å; A736-L740 WeakPolarHBondContact O-CB 3.32Å; A736-L740 WeakPolarHBondContact O-CG 3.32Å; A736-L740 PolarHBondContact O-N 3.48Å
737	H	91.5	Very high	91	Very high	48 Å²	48	42.1 Å²	42.1	22%	0.222	23%	0.232	C	C	.	.	H	α-helix	trans	-66.1	-39.7	175.1	-176.3	-55.2	0	0	0	111.6	L677 Q733 T739 Q741 R807	L677-H737 WeakPolarHBondContact CD1-O 3.3Å; Q733-H737 VanDerWaalsContact O-CB 3.24Å; Q733-H737 WeakPolarHBondContact O-CB 3.41Å; Q733-H737 PolarHBondContact O-N 3.12Å; Q733-H737 VanDerWaalsContact O-N 3.1Å; H737-T739 VanDerWaalsContact C-N 3.33Å; H737-T739 PolarHBondContact O-N 2.82Å; H737-Q741 VanDerWaalsContact O-CB 3.3Å; H737-Q741 WeakPolarHBondContact O-CB 3.11Å; H737-Q741 PolarHBondContact O-N 2.86Å; H737-R807 VanDerWaalsContact CD2-CZ 3.4Å; H737-R807 PolarHBondContact CD2-NE 3.29Å; H737-R807 VanDerWaalsContact CG-CZ 3.46Å; H737-R807 PolarHBondContact NE2-NH2 2.92Å
738	W	89.6	Confident	91.1	Very high	80 Å²	80	42.8 Å²	42.8	30%	0.303	23%	0.227	S	C	.	.	H	α-helix	trans	-63.9	-42.1	177.5	-172.4	96.8	0	0	0	110.7	R720 E734 E735 Q741 H742 F932	R720-W738 HydrophobicContact CG-CH2 3.79Å; R720-W738 HydrophobicContact CG-CZ3 4.49Å; E734-W738 WeakPolarHBondContact O-CB 3.43Å; E734-W738 PolarHBondContact O-N 3.44Å; E735-W738 PolarHBondContact O-N 3Å; W738-Q741 WeakPolarHBondContact O-CB 3.34Å; W738-Q741 PolarHBondContact O-N 2.9Å; W738-H742 AromaticContact CD1-CE1 3.91Å; W738-H742 AromaticContact CD2-CE1 3.96Å; W738-H742 AromaticContact CD2-ND1 3.61Å; W738-H742 AromaticContact CE2-CE1 3.34Å; W738-H742 AromaticContact CE2-ND1 3.37Å; W738-H742 AromaticContact CE3-ND1 3.97Å; W738-H742 HydrophobicContact CH2-CB 4.01Å; W738-H742 AromaticContact CH2-CG 3.74Å; W738-H742 AromaticContact CH2-ND1 3.7Å; W738-H742 AromaticContact CZ2-CE1 3.51Å; W738-H742 AromaticContact CZ2-CG 3.77Å; W738-H742 AromaticContact CZ2-ND1 3.43Å; W738-H742 WeakPolarHBondContact CZ2-ND1 3.45Å; W738-H742 AromaticContact CZ2-NE2 3.88Å; W738-H742 HydrophobicContact CZ3-CB 4.22Å; W738-H742 AromaticContact CZ3-ND1 4Å; W738-H742 AromaticContact NE1-CE1 3.39Å; W738-H742 PolarHBondContact NE1-CE1 2.88Å; W738-H742 AromaticContact NE1-ND1 3.84Å; W738-H742 PolarHBondContact O-N 2.86Å; W738-H742 PolarHBondContact O-ND1 2.88Å; W738-F932 AromaticContact CE3-CE2 3.92Å; W738-F932 HydrophobicContact CE3-CE2 3.92Å; W738-F932 HydrophobicContact CE3-CZ 4.12Å; W738-F932 HydrophobicContact CZ3-CE1 4.11Å; W738-F932 AromaticContact CZ3-CE2 3.88Å; W738-F932 HydrophobicContact CZ3-CE2 3.88Å; W738-F932 AromaticContact CZ3-CZ 3.6Å; W738-F932 HydrophobicContact CZ3-CZ 3.6Å
739	T	90.7	Very high	91.2	Very high	4 Å²	4	42.9 Å²	42.9	3%	0.025	23%	0.227	C	C	.	.	H	α-helix	trans	-60.6	-51.8	177.4	-58.5	0	0	0	0	111.6	L715 V719 L726 E735 A736 H737 Q741 H742 C743 F932	L715-T739 HydrophobicContact CD2-CG2 3.59Å; V719-T739 HydrophobicContact CG1-CG2 4.48Å; L726-T739 HydrophobicContact CD1-CG2 3.61Å; E735-T739 VanDerWaalsContact O-CB 3.29Å; E735-T739 WeakPolarHBondContact O-CB 3.39Å; E735-T739 PolarHBondContact O-N 2.96Å; E735-T739 PolarHBondContact O-OG1 3.28Å; A736-T739 PolarHBondContact O-N 2.83Å; H737-T739 VanDerWaalsContact C-N 3.33Å; H737-T739 PolarHBondContact O-N 2.82Å; T739-Q741 PolarHBondContact O-N 3.26Å; T739-H742 PolarHBondContact O-N 3.31Å; T739-C743 PolarHBondContact O-N 3.12Å; T739-F932 WeakPolarHBondContact OG1-CE2 3.42Å
740	L	90.9	Very high	91.4	Very high	1 Å²	1	41 Å²	41	1%	0.005	22%	0.216	C	C	.	.	H	α-helix	trans	-74.4	-6	-178.2	-63.7	164.7	0	0	0	113.4	L676 L677 L682 L712 L715 L728 A736 C743 L749	L676-L740 HydrophobicContact CD2-CD2 3.86Å; L677-L740 HydrophobicContact CD1-CB 4.32Å; L677-L740 HydrophobicContact CD2-CB 3.96Å; L677-L740 HydrophobicContact CG-CB 4.07Å; L682-L740 HydrophobicContact CD1-CD1 3.59Å; L682-L740 HydrophobicContact CD2-CD1 4.49Å; L712-L740 HydrophobicContact CD1-CD1 4.01Å; L715-L740 HydrophobicContact CD1-CD2 4.3Å; L715-L740 HydrophobicContact CD2-CD2 4Å; L728-L740 HydrophobicContact CD1-CD1 4.38Å; A736-L740 WeakPolarHBondContact O-CB 3.32Å; A736-L740 WeakPolarHBondContact O-CG 3.32Å; A736-L740 PolarHBondContact O-N 3.48Å; L740-C743 PolarHBondContact O-SG 3.45Å; L740-C743 VanDerWaalsContact O-SG 3.36Å; L740-L749 HydrophobicContact CD2-CD2 4.22Å
741	Q	90.6	Very high	91.7	Very high	119 Å²	119	37.2 Å²	37.2	56%	0.556	19%	0.191	S	C	*	.	H	α-helix	trans	-85.3	-23.9	168.1	-174.5	172.5	-4.5	0	0	112.8	L677 H737 W738 T739	L677-Q741 HydrophobicContact CD1-CB 3.74Å; H737-Q741 VanDerWaalsContact O-CB 3.3Å; H737-Q741 WeakPolarHBondContact O-CB 3.11Å; H737-Q741 PolarHBondContact O-N 2.86Å; W738-Q741 WeakPolarHBondContact O-CB 3.34Å; W738-Q741 PolarHBondContact O-N 2.9Å; T739-Q741 PolarHBondContact O-N 3.26Å
742	H	87.9	Confident	91.8	Very high	69 Å²	69	40.1 Å²	40.1	32%	0.319	20%	0.2	S	C	.	.	S	Bend	trans	-115.3	12.3	-173.8	-61.4	89.1	0	0	0	113.6	V719 R720 W738 T739	V719-H742 WeakPolarHBondContact CA-O 3.39Å; R720-H742 HydrophobicContact CG-CB 4.46Å; R720-H742 PolarHBondContact N-O 2.65Å; W738-H742 AromaticContact CD1-CE1 3.91Å; W738-H742 AromaticContact CD2-CE1 3.96Å; W738-H742 AromaticContact CD2-ND1 3.61Å; W738-H742 AromaticContact CE2-CE1 3.34Å; W738-H742 AromaticContact CE2-ND1 3.37Å; W738-H742 AromaticContact CE3-ND1 3.97Å; W738-H742 HydrophobicContact CH2-CB 4.01Å; W738-H742 AromaticContact CH2-CG 3.74Å; W738-H742 AromaticContact CH2-ND1 3.7Å; W738-H742 AromaticContact CZ2-CE1 3.51Å; W738-H742 AromaticContact CZ2-CG 3.77Å; W738-H742 AromaticContact CZ2-ND1 3.43Å; W738-H742 WeakPolarHBondContact CZ2-ND1 3.45Å; W738-H742 AromaticContact CZ2-NE2 3.88Å; W738-H742 HydrophobicContact CZ3-CB 4.22Å; W738-H742 AromaticContact CZ3-ND1 4Å; W738-H742 AromaticContact NE1-CE1 3.39Å; W738-H742 PolarHBondContact NE1-CE1 2.88Å; W738-H742 AromaticContact NE1-ND1 3.84Å; W738-H742 PolarHBondContact O-N 2.86Å; W738-H742 PolarHBondContact O-ND1 2.88Å; T739-H742 PolarHBondContact O-N 3.31Å
743	C	89.5	Confident	91.7	Very high	6 Å²	6	40.2 Å²	40.2	4%	0.041	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	143.9	165.8	62.4	0	0	0	0	111.3	G673 L715 S718 V719 T739 L740 I747	G673-C743 PolarHBondContact O-SG 2.63Å; G673-C743 VanDerWaalsContact O-SG 3.4Å; L715-C743 HydrophobicContact CD2-CB 4.26Å; S718-C743 WeakPolarHBondContact O-CA 3.32Å; V719-C743 HydrophobicContact CG2-CB 4.2Å; T739-C743 PolarHBondContact O-N 3.12Å; L740-C743 PolarHBondContact O-SG 3.45Å; L740-C743 VanDerWaalsContact O-SG 3.36Å; C743-I747 HydrophobicContact CB-CG2 4.23Å
744	S	88.6	Confident	91.5	Very high	43 Å²	43	40.6 Å²	40.6	30%	0.301	21%	0.207	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	152.6	-178.8	54.8	0	0	0	0	111.6	D674 S718	D674-S744 WeakPolarHBondContact OD1-CA 3.4Å; D674-S744 WeakPolarHBondContact OD1-CB 3.48Å; S718-S744 WeakPolarHBondContact CB-O 3.4Å; S718-S744 PolarHBondContact O-N 3.47Å
745	G	89.2	Confident	91.4	Very high	17 Å²	17	43.5 Å²	43.5	18%	0.175	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	68.8	-162	-177.9	0	0	0	0	0	113.3	Q672 G673 D674 I747	Q672-G745 PolarHBondContact OE1-O 3.23Å; G673-G745 PolarHBondContact N-O 2.8Å; D674-G745 PolarHBondContact OD1-N 3.12Å; G745-I747 PolarHBondContact O-N 2.97Å
746	P	90.6	Very high	91.2	Very high	111 Å²	111	44.8 Å²	44.8	72%	0.721	23%	0.229	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-67.8	128.8	-179.5	28.6	-33.8	0	0	0	111.5	L671	L671-P746 WeakPolarHBondContact O-CA 3.31Å
747	I	93.9	Very high	91.1	Very high	4 Å²	4	46.7 Å²	46.7	2%	0.021	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	155.9	177.2	62.1	169.2	0	0	0	111.1	A670 L671 L676 L715 E716 C743 G745	A670-I747 WeakPolarHBondContact CA-O 3.34Å; L671-I747 HydrophobicContact CD1-CD1 4.5Å; L671-I747 HydrophobicContact CD2-CD1 4.45Å; L671-I747 HydrophobicContact CD2-CG1 4.25Å; L671-I747 HydrophobicContact CG-CD1 4.2Å; L671-I747 HydrophobicContact CG-CG1 3.96Å; L671-I747 PolarHBondContact N-O 2.74Å; L671-I747 PolarHBondContact O-N 2.74Å; L676-I747 HydrophobicContact CD2-CD1 3.9Å; L715-I747 HydrophobicContact CD1-CB 3.92Å; L715-I747 HydrophobicContact CD1-CD1 3.75Å; L715-I747 HydrophobicContact CD1-CG1 4.34Å; L715-I747 HydrophobicContact CD1-CG2 4.27Å; E716-I747 CarbonylContact O-C 3.52Å; E716-I747 VanDerWaalsContact O-CA 3.32Å; E716-I747 WeakPolarHBondContact O-CA 3.38Å; C743-I747 HydrophobicContact CB-CG2 4.23Å; G745-I747 PolarHBondContact O-N 2.97Å
748	K	93.9	Very high	91.2	Very high	77 Å²	77	44.8 Å²	44.8	34%	0.335	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	131.3	168.7	-68.3	151.6	148.7	-91.1	0	108.7	E668 V669 L715 E716	E668-K748 VanDerWaalsContact CD-NZ 3.29Å; E668-K748 HydrophobicContact CG-CB 4.38Å; E668-K748 WeakPolarHBondContact OE1-CE 3.44Å; E668-K748 IonicContact OE1-NZ 3.05Å; E668-K748 PolarHBondContact OE1-NZ 3.32Å; E668-K748 IonicContact OE2-NZ 3.44Å; E668-K748 PolarHBondContact OE2-NZ 2.89Å; V669-K748 CarbonylContact O-C 3.56Å; V669-K748 WeakPolarHBondContact O-CA 3.39Å; L715-K748 WeakPolarHBondContact CA-O 3.16Å; E716-K748 HydrophobicContact CB-CB 4.19Å; E716-K748 HydrophobicContact CB-CD 4.3Å; E716-K748 PolarHBondContact N-O 3.27Å; E716-K748 PolarHBondContact O-N 3.44Å
749	L	94.3	Very high	91.3	Very high	2 Å²	2	48.1 Å²	48.1	1%	0.01	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	124.9	168	-79.6	173.2	0	0	0	109.8	E668 V669 L671 L676 L706 L712 L715 L728 L740	E668-L749 CarbonylContact C-O 3.42Å; E668-L749 WeakPolarHBondContact CA-O 3.4Å; V669-L749 HydrophobicContact CG1-CB 3.93Å; V669-L749 PolarHBondContact N-O 2.72Å; V669-L749 PolarHBondContact O-N 2.97Å; L671-L749 HydrophobicContact CD2-CB 4.47Å; L671-L749 HydrophobicContact CD2-CD1 4.14Å; L671-L749 HydrophobicContact CD2-CG 4.39Å; L676-L749 HydrophobicContact CD2-CD1 3.89Å; L706-L749 HydrophobicContact CD1-CD1 4.03Å; L712-L749 HydrophobicContact CD2-CD1 4.42Å; L715-L749 HydrophobicContact CB-CD2 3.95Å; L715-L749 HydrophobicContact CD1-CD2 3.66Å; L715-L749 HydrophobicContact CD1-CG 4.13Å; L715-L749 HydrophobicContact CG-CD2 4.41Å; L728-L749 HydrophobicContact CD1-CD2 4.2Å; L740-L749 HydrophobicContact CD2-CD2 4.22Å
750	H	94.2	Very high	91.4	Very high	32 Å²	32	54.3 Å²	54.3	15%	0.148	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	129	169.4	-57.7	-98.4	0	0	0	109	V666 Q667 E668 L713 L714 E716	V666-H750 HydrophobicContact CG1-CB 3.96Å; Q667-H750 CarbonylContact O-C 3.55Å; Q667-H750 WeakPolarHBondContact O-CA 3.24Å; E668-H750 IonicContact OE2-CE1 3.38Å; E668-H750 PolarHBondContact OE2-CE1 3.47Å; E668-H750 VanDerWaalsContact OE2-CE1 3.23Å; E668-H750 IonicContact OE2-NE2 2.81Å; L713-H750 WeakPolarHBondContact CB-O 3.38Å; L713-H750 PolarHBondContact N-O 3.2Å; L714-H750 HydrophobicContact CB-CB 3.97Å; L714-H750 PolarHBondContact N-O 3.32Å; L714-H750 PolarHBondContact O-N 3.38Å; E716-H750 IonicContact OE2-NE2 3.37Å
751	Y	94.3	Very high	91.4	Very high	19 Å²	19	54.6 Å²	54.6	8%	0.075	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	165.6	-174.3	70.2	-86.6	0	0	0	112.5	Q667 V669 L706 H710 H711	Q667-Y751 HydrophobicContact CB-CD1 4.29Å; Q667-Y751 HydrophobicContact CB-CD2 4.35Å; Q667-Y751 HydrophobicContact CB-CE1 3.78Å; Q667-Y751 HydrophobicContact CB-CE2 3.83Å; Q667-Y751 PolarHBondContact N-O 3.34Å; Q667-Y751 WeakPolarHBondContact O-CD1 3.49Å; Q667-Y751 PolarHBondContact O-N 3.45Å; V669-Y751 HydrophobicContact CB-CE1 3.97Å; V669-Y751 HydrophobicContact CG1-CD1 3.91Å; V669-Y751 HydrophobicContact CG1-CE1 3.69Å; L706-Y751 HydrophobicContact CD2-CD1 4.2Å; L706-Y751 HydrophobicContact CD2-CE1 4.35Å; H710-Y751 HydrophobicContact CB-CD2 3.97Å; H710-Y751 AromaticContact CE1-CD2 3.9Å; H710-Y751 AromaticContact CE1-CE2 3.27Å; H710-Y751 WeakPolarHBondContact CE1-CE2 3.41Å; H710-Y751 AromaticContact CE1-CZ 3.9Å; H710-Y751 AromaticContact CG-CD2 3.69Å; H710-Y751 AromaticContact CG-CE2 3.88Å; H710-Y751 AromaticContact ND1-CD2 3.29Å; H710-Y751 VanDerWaalsContact ND1-CD2 3.29Å; H710-Y751 WeakPolarHBondContact ND1-CD2 3.42Å; H710-Y751 AromaticContact ND1-CE2 3.12Å; H710-Y751 WeakPolarHBondContact ND1-CE2 3.44Å; H710-Y751 AromaticContact ND1-CZ 3.83Å; H711-Y751 CarbonylContact O-C 3.56Å; H711-Y751 WeakPolarHBondContact O-CA 3.32Å; H711-Y751 VanDerWaalsContact O-CB 3.25Å; H711-Y751 WeakPolarHBondContact O-CB 3.41Å
752	R	93.9	Very high	91.5	Very high	74 Å²	74	52.4 Å²	52.4	28%	0.279	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	120.8	174.7	-168.5	-176.9	-64.2	128.4	2.2	109.6	V666 H711 L713 S754	V666-R752 VanDerWaalsContact CG2-NH2 3.33Å; H711-R752 VanDerWaalsContact CB-O 3.29Å; H711-R752 WeakPolarHBondContact CB-O 3.23Å; H711-R752 PolarHBondContact N-O 3.45Å; H711-R752 PolarHBondContact O-N 2.85Å; L713-R752 HydrophobicContact CD1-CB 4.12Å; R752-S754 PolarHBondContact O-N 3.12Å; R752-S754 VanDerWaalsContact O-N 3.09Å
753	A	91.4	Very high	91.6	Very high	14 Å²	14	51.6 Å²	51.6	12%	0.116	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	106.6	178.4	0	0	0	0	0	110.8	F755	A753-F755 HydrophobicContact CB-CE2 3.84Å; A753-F755 HydrophobicContact CB-CZ 4.17Å
754	S	88.8	Confident	91.7	Very high	35 Å²	35	54.2 Å²	54.2	25%	0.245	28%	0.276	C	S	.	.			trans	-133.6	52.4	-163.8	-166.1	0	0	0	0	112	G709 R752 D756 S757 Y758	G709-S754 PolarHBondContact O-N 3Å; R752-S754 PolarHBondContact O-N 3.12Å; R752-S754 VanDerWaalsContact O-N 3.09Å; S754-D756 PolarHBondContact O-N 3.24Å; S754-D756 VanDerWaalsContact O-N 3.08Å; S754-S757 PolarHBondContact O-N 3.07Å; S754-S757 VanDerWaalsContact O-N 3.13Å; S754-Y758 PolarHBondContact O-N 2.84Å
755	F	90.7	Very high	91.7	Very high	83 Å²	83	54.5 Å²	54.5	36%	0.364	27%	0.274	S	S	.	.	H	α-helix	trans	-53.9	-28.5	-174.5	-53.9	-77.9	0	0	0	114.9	E708 A753 R759	E708-F755 VanDerWaalsContact O-CE1 3.27Å; E708-F755 WeakPolarHBondContact O-CE1 3.38Å; A753-F755 HydrophobicContact CB-CE2 3.84Å; A753-F755 HydrophobicContact CB-CZ 4.17Å; F755-R759 WeakPolarHBondContact O-CB 3.35Å; F755-R759 VanDerWaalsContact O-CG 3.3Å; F755-R759 WeakPolarHBondContact O-CG 3.39Å; F755-R759 PolarHBondContact O-N 2.85Å
756	D	89.3	Confident	91.7	Very high	101 Å²	101	58.2 Å²	58.2	54%	0.54	30%	0.297	S	S	.	.	H	α-helix	trans	-82.9	-25.8	-178.2	-60.2	-49.1	0	0	0	113.4	S754 R759 R760	S754-D756 PolarHBondContact O-N 3.24Å; S754-D756 VanDerWaalsContact O-N 3.08Å; D756-R759 IonicContact OD1-CZ 3.66Å; D756-R759 IonicContact OD1-NE 3.84Å; D756-R759 IonicContact OD1-NH2 2.69Å; D756-R759 PolarHBondContact OD1-NH2 3.25Å; D756-R760 VanDerWaalsContact O-CG 3.31Å; D756-R760 WeakPolarHBondContact O-CG 3.44Å; D756-R760 PolarHBondContact O-NE 3.45Å
757	S	89.9	Confident	91.5	Very high	41 Å²	41	58.1 Å²	58.1	29%	0.287	29%	0.29	S	S	.	.	H	α-helix	trans	-76.3	-42.7	165.2	-66.6	0	0	0	0	110.5	S754 R759 R760 L761	S754-S757 PolarHBondContact O-N 3.07Å; S754-S757 VanDerWaalsContact O-N 3.13Å; S757-R759 PolarHBondContact O-N 2.89Å; S757-R760 PolarHBondContact O-N 3.29Å; S757-R760 PolarHBondContact OG-NH2 3.5Å; S757-L761 PolarHBondContact O-N 3.17Å
758	Y	92.8	Very high	90.9	Very high	8 Å²	8	60.6 Å²	60.6	3%	0.031	32%	0.316	C	S	.	.	H	α-helix	trans	-58.5	-47.6	177.6	177.8	-108	0	0	0	113.1	V683 F691 S693 E708 S754 R760 L761 Q762	V683-Y758 HydrophobicContact CG1-CD2 4.29Å; V683-Y758 HydrophobicContact CG1-CE2 3.68Å; F691-Y758 HydrophobicContact CB-CD2 3.62Å; F691-Y758 HydrophobicContact CB-CE2 4.1Å; F691-Y758 AromaticContact CD1-CD2 3.9Å; F691-Y758 HydrophobicContact CD1-CD2 3.9Å; F691-Y758 HydrophobicContact CD1-CG 4.23Å; F691-Y758 AromaticContact CG-CD2 3.83Å; F691-Y758 HydrophobicContact CG-CD2 3.83Å; S693-Y758 WeakPolarHBondContact CA-OH 3.18Å; S693-Y758 PolarHBondContact O-OH 3.45Å; E708-Y758 HydrophobicContact CG-CD1 4.42Å; E708-Y758 HydrophobicContact CG-CE1 3.44Å; E708-Y758 VanDerWaalsContact CG-CE1 3.44Å; E708-Y758 VanDerWaalsContact CG-OH 3.32Å; E708-Y758 WeakPolarHBondContact CG-OH 3.41Å; E708-Y758 WeakPolarHBondContact OE1-CE1 3.24Å; E708-Y758 VanDerWaalsContact OE1-CZ 3.31Å; E708-Y758 PolarHBondContact OE1-OH 3.21Å; S754-Y758 PolarHBondContact O-N 2.84Å; Y758-R760 VanDerWaalsContact C-N 3.33Å; Y758-R760 PolarHBondContact O-N 2.85Å; Y758-L761 WeakPolarHBondContact O-CB 3.43Å; Y758-L761 PolarHBondContact O-N 2.96Å; Y758-Q762 HydrophobicContact CD1-CG 4.43Å; Y758-Q762 HydrophobicContact CE1-CG 3.99Å; Y758-Q762 VanDerWaalsContact CE1-NE2 3.27Å; Y758-Q762 HydrophobicContact CE2-CG 4.24Å; Y758-Q762 VanDerWaalsContact CZ-NE2 3.3Å; Y758-Q762 WeakPolarHBondContact O-CG 3.47Å; Y758-Q762 PolarHBondContact O-N 3.1Å; Y758-Q762 PolarHBondContact OH-NE2 3.16Å
759	R	92.6	Very high	90.4	Very high	150 Å²	150	61.2 Å²	61.2	57%	0.566	33%	0.331	S	S	*	.	H	α-helix	trans	-65.4	-32.3	177	-74.5	-173.5	-64.2	179.1	0.5	113.5	F755 D756 S757 S763	F755-R759 WeakPolarHBondContact O-CB 3.35Å; F755-R759 VanDerWaalsContact O-CG 3.3Å; F755-R759 WeakPolarHBondContact O-CG 3.39Å; F755-R759 PolarHBondContact O-N 2.85Å; D756-R759 IonicContact OD1-CZ 3.66Å; D756-R759 IonicContact OD1-NE 3.84Å; D756-R759 IonicContact OD1-NH2 2.69Å; D756-R759 PolarHBondContact OD1-NH2 3.25Å; S757-R759 PolarHBondContact O-N 2.89Å; R759-S763 PolarHBondContact O-N 3.11Å
760	R	91.5	Very high	89.9	Confident	134 Å²	134	63.5 Å²	63.5	51%	0.506	34%	0.342	S	S	.	.	H	α-helix	trans	-68.6	-41.2	173.1	-75.1	-179.7	-66.4	154.4	3.5	111.4	D756 S757 Y758 S763 N764	D756-R760 VanDerWaalsContact O-CG 3.31Å; D756-R760 WeakPolarHBondContact O-CG 3.44Å; D756-R760 PolarHBondContact O-NE 3.45Å; S757-R760 PolarHBondContact O-N 3.29Å; S757-R760 PolarHBondContact OG-NH2 3.5Å; Y758-R760 VanDerWaalsContact C-N 3.33Å; Y758-R760 PolarHBondContact O-N 2.85Å; R760-S763 PolarHBondContact O-N 3.17Å; R760-N764 WeakPolarHBondContact O-CB 3.23Å; R760-N764 PolarHBondContact O-N 3.19Å; R760-N764 PolarHBondContact O-OD1 2.61Å
761	L	92.3	Very high	89.4	Confident	7 Å²	7	63.8 Å²	63.8	4%	0.037	35%	0.35	C	S	.	.	H	α-helix	trans	-60.8	-48	172.1	176.3	63.3	0	0	0	111.1	V683 F691 S757 Y758 S763 N764 L765	V683-L761 HydrophobicContact CG1-CD2 4.14Å; V683-L761 HydrophobicContact CG2-CD2 4.47Å; F691-L761 HydrophobicContact CD2-CD2 3.73Å; F691-L761 HydrophobicContact CE2-CD2 4.1Å; S757-L761 PolarHBondContact O-N 3.17Å; Y758-L761 WeakPolarHBondContact O-CB 3.43Å; Y758-L761 PolarHBondContact O-N 2.96Å; L761-S763 PolarHBondContact O-N 3.19Å; L761-N764 PolarHBondContact O-N 2.85Å; L761-L765 HydrophobicContact CD1-CD1 3.83Å; L761-L765 HydrophobicContact CD1-CG 4.12Å; L761-L765 HydrophobicContact CG-CD1 3.9Å; L761-L765 WeakPolarHBondContact O-CB 3.23Å; L761-L765 VanDerWaalsContact O-CG 3.23Å; L761-L765 WeakPolarHBondContact O-CG 3.39Å; L761-L765 PolarHBondContact O-N 2.81Å
762	Q	91.5	Very high	89.2	Confident	73 Å²	73	63.1 Å²	63.1	34%	0.341	35%	0.349	S	S	.	.	H	α-helix	trans	-54.7	-49.1	174.8	-75	-179.2	-49.2	0	0	112.3	E708 Y758 L765 S766	E708-Q762 PolarHBondContact OE1-NE2 2.92Å; E708-Q762 VanDerWaalsContact OE1-NE2 3.14Å; Y758-Q762 HydrophobicContact CD1-CG 4.43Å; Y758-Q762 HydrophobicContact CE1-CG 3.99Å; Y758-Q762 VanDerWaalsContact CE1-NE2 3.27Å; Y758-Q762 HydrophobicContact CE2-CG 4.24Å; Y758-Q762 VanDerWaalsContact CZ-NE2 3.3Å; Y758-Q762 WeakPolarHBondContact O-CG 3.47Å; Y758-Q762 PolarHBondContact O-N 3.1Å; Y758-Q762 PolarHBondContact OH-NE2 3.16Å; Q762-L765 PolarHBondContact O-N 2.88Å; Q762-S766 PolarHBondContact O-N 3.4Å; Q762-S766 PolarHBondContact O-OG 2.72Å
763	S	90.9	Very high	89	Confident	52 Å²	52	59.7 Å²	59.7	36%	0.364	34%	0.336	S	S	.	.	H	α-helix	trans	-60.7	-51.5	177.7	-157.3	0	0	0	0	111.1	R759 R760 L761 L765 S766 D767	R759-S763 PolarHBondContact O-N 3.11Å; R760-S763 PolarHBondContact O-N 3.17Å; L761-S763 PolarHBondContact O-N 3.19Å; S763-L765 PolarHBondContact O-N 3.22Å; S763-L765 VanDerWaalsContact O-N 3.1Å; S763-S766 WeakPolarHBondContact CA-OG 3.43Å; S763-S766 PolarHBondContact O-N 2.97Å; S763-S766 PolarHBondContact O-OG 3.11Å; S763-D767 VanDerWaalsContact O-CB 3.23Å; S763-D767 WeakPolarHBondContact O-CB 3.41Å; S763-D767 PolarHBondContact O-N 3.33Å; S763-D767 PolarHBondContact OG-OD2 3.07Å
764	N	90.8	Very high	89.1	Confident	62 Å²	62	59 Å²	59	33%	0.332	33%	0.33	S	S	.	.	H	α-helix	trans	-60.3	-29.1	-177.6	-66	-7.7	0	0	0	113	R760 L761 G768 S769 L770	R760-N764 WeakPolarHBondContact O-CB 3.23Å; R760-N764 PolarHBondContact O-N 3.19Å; R760-N764 PolarHBondContact O-OD1 2.61Å; L761-N764 PolarHBondContact O-N 2.85Å; N764-G768 PolarHBondContact O-N 3.49Å; N764-S769 PolarHBondContact O-N 3.23Å; N764-L770 HydrophobicContact CB-CB 4.23Å; N764-L770 HydrophobicContact CB-CD1 3.83Å; N764-L770 HydrophobicContact CB-CG 4.38Å; N764-L770 PolarHBondContact O-N 3.23Å
765	L	89.3	Confident	89.4	Confident	49 Å²	49	58.5 Å²	58.5	26%	0.257	33%	0.327	S	S	.	.	H	α-helix	trans	-78.4	-41.8	173.7	-66.4	169.4	0	0	0	112.3	V683 L761 Q762 S763 D767 G768 L770 A771	V683-L765 HydrophobicContact CG2-CD1 3.52Å; L761-L765 HydrophobicContact CD1-CD1 3.83Å; L761-L765 HydrophobicContact CD1-CG 4.12Å; L761-L765 HydrophobicContact CG-CD1 3.9Å; L761-L765 WeakPolarHBondContact O-CB 3.23Å; L761-L765 VanDerWaalsContact O-CG 3.23Å; L761-L765 WeakPolarHBondContact O-CG 3.39Å; L761-L765 PolarHBondContact O-N 2.81Å; Q762-L765 PolarHBondContact O-N 2.88Å; S763-L765 PolarHBondContact O-N 3.22Å; S763-L765 VanDerWaalsContact O-N 3.1Å; L765-D767 VanDerWaalsContact C-N 3.31Å; L765-D767 PolarHBondContact O-N 2.93Å; L765-G768 PolarHBondContact O-N 3.01Å; L765-L770 HydrophobicContact CD2-CB 4.24Å; L765-A771 WeakPolarHBondContact CD2-O 3.36Å
766	S	88.6	Confident	89.6	Confident	94 Å²	94	56.5 Å²	56.5	66%	0.657	32%	0.318	S	S	*	.	H	α-helix	trans	-67.3	-33.7	175.8	61.5	0	0	0	0	112.8	Q762 S763 G768	Q762-S766 PolarHBondContact O-N 3.4Å; Q762-S766 PolarHBondContact O-OG 2.72Å; S763-S766 WeakPolarHBondContact CA-OG 3.43Å; S763-S766 PolarHBondContact O-N 2.97Å; S763-S766 PolarHBondContact O-OG 3.11Å; S766-G768 VanDerWaalsContact C-N 3.26Å; S766-G768 PolarHBondContact O-N 3.08Å
767	D	87.1	Confident	90	Very high	110 Å²	110	54.1 Å²	54.1	59%	0.588	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.3	-2.9	-178.6	-53.3	-24.7	0	0	0	111.6	S763 L765 S769	S763-D767 VanDerWaalsContact O-CB 3.23Å; S763-D767 WeakPolarHBondContact O-CB 3.41Å; S763-D767 PolarHBondContact O-N 3.33Å; S763-D767 PolarHBondContact OG-OD2 3.07Å; L765-D767 VanDerWaalsContact C-N 3.31Å; L765-D767 PolarHBondContact O-N 2.93Å; D767-S769 PolarHBondContact O-N 3.44Å
768	G	81.8	Confident	90.3	Very high	55 Å²	55	52.3 Å²	52.3	57%	0.567	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.4	10.7	178.6	0	0	0	0	0	115.2	N764 L765 S766 L770	N764-G768 PolarHBondContact O-N 3.49Å; L765-G768 PolarHBondContact O-N 3.01Å; S766-G768 VanDerWaalsContact C-N 3.26Å; S766-G768 PolarHBondContact O-N 3.08Å; G768-L770 VanDerWaalsContact C-N 3.33Å
769	S	82.3	Confident	90.4	Very high	91 Å²	91	52 Å²	52	64%	0.636	29%	0.288	S	S	*	.	S	Bend	trans	-73.2	-25.6	179.5	-174.2	0	0	0	0	112.9	N764 D767	N764-S769 PolarHBondContact O-N 3.23Å; D767-S769 PolarHBondContact O-N 3.44Å
770	L	84.8	Confident	90.5	Very high	49 Å²	49	44.9 Å²	44.9	26%	0.257	26%	0.261	S	S	.	.			trans	-126	149.4	173	-87.5	163.2	0	0	0	109	N764 L765 G768	N764-L770 HydrophobicContact CB-CB 4.23Å; N764-L770 HydrophobicContact CB-CD1 3.83Å; N764-L770 HydrophobicContact CB-CG 4.38Å; N764-L770 PolarHBondContact O-N 3.23Å; L765-L770 HydrophobicContact CD2-CB 4.24Å; G768-L770 VanDerWaalsContact C-N 3.33Å
771	A	82.7	Confident	90.6	Very high	38 Å²	38	38.5 Å²	38.5	31%	0.314	24%	0.237	S	C	.	.	S	Bend	trans	-91.7	-46	177.7	0	0	0	0	0	111.6	L765 L804 D805 L815	L765-A771 WeakPolarHBondContact CD2-O 3.36Å; A771-L804 HydrophobicContact CB-CB 4.13Å; A771-D805 HydrophobicContact CB-CB 4.29Å; A771-L815 HydrophobicContact CB-CD2 3.78Å
772	S	90.8	Very high	90.6	Very high	6 Å²	6	38.2 Å²	38.2	4%	0.042	24%	0.235	C	C	.	.	S	Bend	trans	-137.8	-163.4	163.1	-168.1	0	0	0	0	109	G684 Q733 L804	G684-S772 PolarHBondContact O-OG 3.03Å; Q733-S772 PolarHBondContact OE1-OG 2.95Å; S772-L804 PolarHBondContact N-O 3.3Å; S772-L804 VanDerWaalsContact N-O 3.12Å
773	G	88.5	Confident	90.5	Very high	1 Å²	1	36.1 Å²	36.1	1%	0.01	23%	0.226	C	C	.	.	S	Bend	trans	-91.8	5.5	168	0	0	0	0	0	114.6	G684 G685 N686 E687 S688	G684-G773 VanDerWaalsContact C-CA 3.5Å; G685-G773 CarbonylContact C-O 3.6Å; G685-G773 VanDerWaalsContact CA-C 3.46Å; G685-G773 WeakPolarHBondContact CA-O 3.48Å; N686-G773 PolarHBondContact N-O 3.2Å; E687-G773 PolarHBondContact N-O 3.06Å; S688-G773 PolarHBondContact N-O 3.1Å; S688-G773 VanDerWaalsContact N-O 3.17Å; S688-G773 WeakPolarHBondContact OG-CA 3.22Å
774	D	94.8	Very high	90.4	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	21%	0.21	C	C	.	.			trans	-83.4	141.3	172.9	-68.1	-39.8	0	0	0	111	G685 N686 T732 Q733 L804 T806	G685-D774 WeakPolarHBondContact CA-OD1 3.3Å; N686-D774 PolarHBondContact N-OD1 3.04Å; N686-D774 VanDerWaalsContact N-OD1 3.14Å; N686-D774 WeakPolarHBondContact OD1-CA 3.04Å; T732-D774 WeakPolarHBondContact CA-OD1 3.47Å; T732-D774 WeakPolarHBondContact CB-OD1 2.94Å; Q733-D774 WeakPolarHBondContact CB-OD2 3.33Å; Q733-D774 PolarHBondContact N-OD1 2.97Å; Q733-D774 PolarHBondContact N-OD2 3.09Å; D774-L804 CarbonylContact O-C 3.54Å; D774-T806 HydrophobicContact CB-CG2 4.33Å; D774-T806 VanDerWaalsContact OD2-CB 3.31Å; D774-T806 WeakPolarHBondContact OD2-CB 3.43Å; D774-T806 WeakPolarHBondContact OD2-CG2 3.3Å; D774-T806 PolarHBondContact OD2-N 2.94Å; D774-T806 PolarHBondContact OD2-OG1 3.36Å
775	S	94.9	Very high	90	Very high	24 Å²	24	33.3 Å²	33.3	17%	0.168	21%	0.211	C	C	.	.			trans	-165.7	101.7	-176.9	172.7	0	0	0	0	108.7	N686 E687 H802 V803	N686-S775 PolarHBondContact ND2-O 2.69Å; N686-S775 PolarHBondContact OD1-N 2.85Å; E687-S775 WeakPolarHBondContact OE2-CB 3.49Å; E687-S775 PolarHBondContact OE2-OG 2.95Å; S775-H802 PolarHBondContact OG-NE2 2.83Å; S775-V803 WeakPolarHBondContact CA-O 3.46Å
776	F	95.4	Very high	89.1	Confident	42 Å²	42	31.7 Å²	31.7	18%	0.184	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-160.5	153.8	175.7	64.3	-78.7	0	0	0	112.1	N686 T732 I778 H802 V803 T806 W814	N686-F776 VanDerWaalsContact OD1-CD1 3.3Å; N686-F776 WeakPolarHBondContact OD1-CD1 3.35Å; T732-F776 HydrophobicContact CG2-CD1 4.23Å; T732-F776 HydrophobicContact CG2-CE1 3.59Å; T732-F776 HydrophobicContact CG2-CZ 4.1Å; F776-I778 HydrophobicContact CD2-CG2 3.76Å; F776-I778 HydrophobicContact CE2-CG2 3.62Å; F776-H802 PolarHBondContact O-CD2 3.06Å; F776-V803 HydrophobicContact CD1-CB 3.98Å; F776-V803 HydrophobicContact CD1-CG1 4.36Å; F776-V803 HydrophobicContact CD2-CB 4.37Å; F776-V803 HydrophobicContact CD2-CG2 4.16Å; F776-V803 HydrophobicContact CE1-CB 3.7Å; F776-V803 HydrophobicContact CE1-CG1 3.65Å; F776-V803 HydrophobicContact CE1-CG2 4.25Å; F776-V803 HydrophobicContact CE2-CB 4.11Å; F776-V803 HydrophobicContact CE2-CG2 3.75Å; F776-V803 HydrophobicContact CG-CB 4.32Å; F776-V803 HydrophobicContact CZ-CB 3.77Å; F776-V803 HydrophobicContact CZ-CG1 3.74Å; F776-V803 HydrophobicContact CZ-CG2 3.81Å; F776-V803 PolarHBondContact N-O 2.93Å; F776-V803 WeakPolarHBondContact O-CB 3.11Å; F776-V803 PolarHBondContact O-N 3.01Å; F776-T806 HydrophobicContact CE1-CG2 3.71Å; F776-T806 HydrophobicContact CZ-CG2 3.99Å; F776-W814 HydrophobicContact CE2-CH2 4.09Å; F776-W814 AromaticContact CE2-CZ3 3.93Å; F776-W814 HydrophobicContact CE2-CZ3 3.93Å; F776-W814 HydrophobicContact CZ-CE3 4.35Å; F776-W814 AromaticContact CZ-CH2 3.77Å; F776-W814 HydrophobicContact CZ-CH2 3.77Å; F776-W814 HydrophobicContact CZ-CZ2 4.35Å; F776-W814 AromaticContact CZ-CZ3 3.78Å; F776-W814 HydrophobicContact CZ-CZ3 3.78Å
777	Y	96.5	Very high	88	Confident	51 Å²	51	36.2 Å²	36.2	20%	0.2	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	139.8	-177	-61.5	-95.6	0	0	0	111.3	H802 V819 V959 W1140	Y777-H802 HydrophobicContact CD1-CB 3.77Å; Y777-H802 AromaticContact CD1-CD2 3.99Å; Y777-H802 HydrophobicContact CE1-CB 3.56Å; Y777-H802 AromaticContact CE1-CD2 3.73Å; Y777-H802 AromaticContact CE1-CG 3.55Å; Y777-H802 AromaticContact CE2-CD2 3.79Å; Y777-H802 AromaticContact CE2-NE2 3.88Å; Y777-H802 AromaticContact CZ-CD2 3.59Å; Y777-H802 AromaticContact CZ-CG 3.73Å; Y777-H802 AromaticContact CZ-ND1 3.98Å; Y777-H802 AromaticContact CZ-NE2 3.78Å; Y777-V819 HydrophobicContact CD1-CG2 3.92Å; Y777-V819 HydrophobicContact CE1-CG1 4.42Å; Y777-V819 HydrophobicContact CE1-CG2 3.82Å; Y777-V959 PolarHBondContact O-N 2.81Å; Y777-W1140 AromaticContact CD1-CH2 3.35Å; Y777-W1140 HydrophobicContact CD1-CH2 3.35Å; Y777-W1140 HydrophobicContact CD1-CZ2 4.38Å; Y777-W1140 AromaticContact CD1-CZ3 3.57Å; Y777-W1140 HydrophobicContact CD1-CZ3 3.57Å; Y777-W1140 HydrophobicContact CD2-CH2 4.33Å; Y777-W1140 HydrophobicContact CD2-CZ3 4.03Å; Y777-W1140 AromaticContact CE1-CH2 3.64Å; Y777-W1140 HydrophobicContact CE1-CH2 3.64Å; Y777-W1140 HydrophobicContact CE1-CZ3 4.24Å; Y777-W1140 AromaticContact CG-CH2 3.74Å; Y777-W1140 HydrophobicContact CG-CH2 3.74Å; Y777-W1140 AromaticContact CG-CZ3 3.44Å; Y777-W1140 HydrophobicContact CG-CZ3 3.44Å; Y777-W1140 VanDerWaalsContact CG-CZ3 3.44Å
778	I	96.3	Very high	86.9	Confident	3 Å²	3	34.7 Å²	34.7	2%	0.015	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	142	177.3	59.5	174.8	0	0	0	111.7	F776 V780 V800 V801 V803 W814 I833 Y956 S957	F776-I778 HydrophobicContact CD2-CG2 3.76Å; F776-I778 HydrophobicContact CE2-CG2 3.62Å; I778-V780 HydrophobicContact CD1-CG2 4.39Å; I778-V780 HydrophobicContact CG1-CG2 4.49Å; I778-V800 VanDerWaalsContact O-CA 3.27Å; I778-V800 WeakPolarHBondContact O-CA 3.19Å; I778-V801 HydrophobicContact CD1-CG2 3.82Å; I778-V801 HydrophobicContact CG1-CG2 3.52Å; I778-V801 PolarHBondContact N-O 2.96Å; I778-V801 PolarHBondContact O-N 3.2Å; I778-V803 HydrophobicContact CD1-CG2 3.7Å; I778-V803 HydrophobicContact CG1-CG2 3.88Å; I778-V803 HydrophobicContact CG2-CG2 4.17Å; I778-W814 HydrophobicContact CD1-CE3 4.25Å; I778-W814 HydrophobicContact CD1-CZ3 4.13Å; I778-I833 HydrophobicContact CD1-CD1 3.85Å; I778-Y956 HydrophobicContact CD1-CD1 3.83Å; I778-Y956 HydrophobicContact CD1-CD2 4.09Å; I778-Y956 HydrophobicContact CD1-CE1 4.26Å; I778-Y956 HydrophobicContact CD1-CE2 4.48Å; I778-Y956 HydrophobicContact CD1-CG 3.74Å; I778-S957 CarbonylContact C-O 3.53Å; I778-S957 VanDerWaalsContact CA-O 3.28Å; I778-S957 WeakPolarHBondContact CA-O 3.38Å
779	R	95.3	Very high	86.5	Confident	2 Å²	2	32.8 Å²	32.8	1%	0.008	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	125.6	162.1	175.6	-176.7	177.6	169.7	5.9	108.1	D798 E799 V800 R918 S957 V959 I1105 C1107 L1108 E1142	R779-D798 IonicContact CZ-OD1 2.67Å; R779-D798 IonicContact NE-OD1 2.68Å; R779-D798 PolarHBondContact NE-OD1 2.92Å; R779-D798 VanDerWaalsContact NH2-CG 3.26Å; R779-D798 IonicContact NH2-OD1 3.99Å; R779-D798 PolarHBondContact NH2-OD1 3.27Å; R779-D798 IonicContact NH2-OD2 2.68Å; R779-E799 WeakPolarHBondContact CA-O 3.45Å; R779-V800 HydrophobicContact CB-CG2 4.23Å; R779-R918 VanDerWaalsContact CZ-CZ 3.48Å; R779-S957 PolarHBondContact N-O 2.87Å; R779-S957 PolarHBondContact O-N 3.04Å; R779-V959 HydrophobicContact CB-CG1 3.76Å; R779-I1105 PolarHBondContact NH1-O 2.76Å; R779-C1107 PolarHBondContact NH1-O 3.23Å; R779-L1108 HydrophobicContact CG-CD2 4.39Å; R779-E1142 WeakPolarHBondContact CD-OE1 3.07Å; R779-E1142 IonicContact CZ-OE1 3.57Å; R779-E1142 IonicContact NE-OE1 3.99Å; R779-E1142 IonicContact NH1-OE1 3.66Å; R779-E1142 PolarHBondContact NH1-OE1 3.24Å
780	V	94.6	Very high	86.1	Confident	0 Å²	0	32.4 Å²	32.4	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	128.1	-176.3	-175.9	0	0	0	0	110.5	I778 L782 I784 V795 C797 D798 E799 V801 Y956	I778-V780 HydrophobicContact CD1-CG2 4.39Å; I778-V780 HydrophobicContact CG1-CG2 4.49Å; V780-L782 HydrophobicContact CG1-CD2 3.95Å; V780-L782 HydrophobicContact CG1-CG 4.46Å; V780-L782 WeakPolarHBondContact CG1-O 3.36Å; V780-I784 HydrophobicContact CG1-CD1 3.9Å; V780-I784 HydrophobicContact CG1-CG1 4.37Å; V780-V795 HydrophobicContact CB-CG1 4.1Å; V780-V795 HydrophobicContact CG1-CG1 4.47Å; V780-V795 HydrophobicContact CG2-CG1 3.81Å; V780-C797 CarbonylContact O-C 3.06Å; V780-C797 VanDerWaalsContact O-CA 3.3Å; V780-C797 WeakPolarHBondContact O-CA 3.43Å; V780-D798 PolarHBondContact O-N 2.96Å; V780-E799 PolarHBondContact N-O 2.84Å; V780-V801 HydrophobicContact CG2-CG2 4.1Å; V780-Y956 HydrophobicContact CB-CD1 4.39Å; V780-Y956 HydrophobicContact CG1-CD1 4.04Å; V780-Y956 HydrophobicContact CG1-CE1 3.91Å; V780-Y956 HydrophobicContact CG2-CD1 4.06Å; V780-Y956 HydrophobicContact CG2-CE1 4.18Å
781	N	93.2	Very high	86	Confident	0 Å²	0	30.7 Å²	30.7	0%	0	18%	0.181	C	C	.	.	S	Bend	trans	-97.7	12.4	-175.7	-62	-40.8	0	0	0	113.5	C797 V917 R918 I920 I954 P955 S957	N781-C797 PolarHBondContact O-SG 3.33Å; N781-C797 VanDerWaalsContact O-SG 3.41Å; N781-V917 CarbonylContact O-C 3.58Å; N781-V917 VanDerWaalsContact O-CA 3.31Å; N781-V917 WeakPolarHBondContact O-CA 3.32Å; N781-R918 HydrophobicContact CB-CB 4.21Å; N781-R918 PolarHBondContact O-N 3.35Å; N781-R918 WeakPolarHBondContact OD1-CD 3.46Å; N781-R918 PolarHBondContact OD1-NH1 3.32Å; N781-I920 WeakPolarHBondContact ND2-CD1 3.45Å; N781-I954 WeakPolarHBondContact CB-O 3.46Å; N781-I954 PolarHBondContact ND2-O 2.9Å; N781-P955 WeakPolarHBondContact CB-O 3.37Å; N781-P955 PolarHBondContact N-O 2.88Å; N781-S957 PolarHBondContact ND2-OG 3.29Å
782	L	91.9	Very high	86.2	Confident	0 Å²	0	33 Å²	33	0%	0	20%	0.195	C	C	.	.	B	Isolated β-bridge	trans	-145.7	150.7	175.1	67.1	163.4	0	0	0	112	V780 I784 L842 L843 K846 V917 P955 Y956	V780-L782 HydrophobicContact CG1-CD2 3.95Å; V780-L782 HydrophobicContact CG1-CG 4.46Å; V780-L782 WeakPolarHBondContact CG1-O 3.36Å; L782-I784 HydrophobicContact CD1-CG1 4.34Å; L782-I784 HydrophobicContact CG-CD1 4.47Å; L782-I784 HydrophobicContact CG-CG1 3.99Å; L782-I784 PolarHBondContact O-N 3.5Å; L782-L842 HydrophobicContact CD1-CB 4.07Å; L782-L843 HydrophobicContact CB-CD1 4.48Å; L782-L843 HydrophobicContact CD1-CB 4.32Å; L782-K846 HydrophobicContact CD1-CD 4.41Å; L782-V917 HydrophobicContact CB-CG1 3.8Å; L782-P955 HydrophobicContact CD2-CB 3.75Å; L782-P955 WeakPolarHBondContact CD2-O 3.43Å; L782-Y956 HydrophobicContact CD2-CE1 4.39Å
783	N	90.8	Very high	86.2	Confident	29 Å²	29	32.9 Å²	32.9	16%	0.155	19%	0.193	C	C	.	.			trans	-69.8	129.3	165.1	-70.8	-0.7	0	0	0	109.8	C797 K846 N914 R916	N783-C797 WeakPolarHBondContact OD1-CB 3.44Å; N783-C797 PolarHBondContact OD1-N 3.09Å; N783-K846 PolarHBondContact O-NZ 2.84Å; N783-N914 PolarHBondContact ND2-O 2.92Å; N783-R916 PolarHBondContact N-O 2.97Å; N783-R916 PolarHBondContact ND2-N 3.48Å
784	I	89.3	Confident	86.3	Confident	5 Å²	5	37 Å²	37	3%	0.026	22%	0.215	C	C	.	.	B	Isolated β-bridge	trans	-115.6	124	176.5	-58.7	176.9	0	0	0	108.4	V780 L782 D789 V795 I833 Y956	V780-I784 HydrophobicContact CG1-CD1 3.9Å; V780-I784 HydrophobicContact CG1-CG1 4.37Å; L782-I784 HydrophobicContact CD1-CG1 4.34Å; L782-I784 HydrophobicContact CG-CD1 4.47Å; L782-I784 HydrophobicContact CG-CG1 3.99Å; L782-I784 PolarHBondContact O-N 3.5Å; I784-D789 WeakPolarHBondContact CA-OD2 3.43Å; I784-D789 HydrophobicContact CG2-CB 4.45Å; I784-V795 PolarHBondContact N-O 3.48Å; I784-V795 PolarHBondContact O-N 2.7Å; I784-V795 VanDerWaalsContact O-N 3.12Å; I784-I833 HydrophobicContact CD1-CB 4.41Å; I784-Y956 HydrophobicContact CD1-CE1 3.97Å
785	C	81.6	Confident	86.1	Confident	50 Å²	50	37 Å²	37	34%	0.338	22%	0.216	S	C	.	.			trans	-121	118.2	-179.5	-179.5	0	0	0	0	109.9	Q787 S788 D789	C785-Q787 PolarHBondContact O-N 3.05Å; C785-Q787 VanDerWaalsContact O-N 3.15Å; C785-S788 PolarHBondContact O-N 2.64Å; C785-S788 VanDerWaalsContact O-N 3.1Å; C785-S788 PolarHBondContact O-OG 3.22Å; C785-D789 PolarHBondContact N-OD2 2.81Å; C785-D789 VanDerWaalsContact O-CB 3.31Å; C785-D789 WeakPolarHBondContact O-CB 3.24Å; C785-D789 PolarHBondContact O-N 3.46Å
786	G	69.8	Low	86	Confident	15 Å²	15	43.8 Å²	43.8	16%	0.155	24%	0.237	C	C	.	.	H	α-helix	trans	-58.2	-32.2	-175.2	0	0	0	0	0	114.3	S790 C791 N794	G786-S790 WeakPolarHBondContact O-CA 3.45Å; G786-S790 PolarHBondContact O-N 3.43Å; G786-C791 CarbonylContact C-O 3.32Å; G786-C791 WeakPolarHBondContact CA-O 3.36Å; G786-C791 PolarHBondContact O-N 2.9Å; G786-N794 PolarHBondContact N-OD1 2.65Å
787	Q	64.9	Low	85.8	Confident	190 Å²	190	42.3 Å²	42.3	89%	0.888	23%	0.232	S	C	*	.	H	α-helix	trans	-69.4	-33.3	178.3	-66.6	-177.2	-12.6	0	0	113.7	C785	C785-Q787 PolarHBondContact O-N 3.05Å; C785-Q787 VanDerWaalsContact O-N 3.15Å
788	S	65.6	Low	85.5	Confident	78 Å²	78	41.2 Å²	41.2	55%	0.545	23%	0.23	S	C	.	.	H	α-helix	trans	-99.5	-31.4	-179.5	62.6	0	0	0	0	113.5	C785	C785-S788 PolarHBondContact O-N 2.64Å; C785-S788 VanDerWaalsContact O-N 3.1Å; C785-S788 PolarHBondContact O-OG 3.22Å
789	D	72.8	Confident	85.4	Confident	14 Å²	14	42.8 Å²	42.8	8%	0.075	24%	0.237	C	C	.	.	H	α-helix	trans	-102.9	3.9	-169	-50.6	-20.8	0	0	0	112	I784 C785 C791 R838 L842 K846	I784-D789 WeakPolarHBondContact CA-OD2 3.43Å; I784-D789 HydrophobicContact CG2-CB 4.45Å; C785-D789 PolarHBondContact N-OD2 2.81Å; C785-D789 VanDerWaalsContact O-CB 3.31Å; C785-D789 WeakPolarHBondContact O-CB 3.24Å; C785-D789 PolarHBondContact O-N 3.46Å; D789-C791 PolarHBondContact O-SG 2.87Å; D789-R838 PolarHBondContact O-NH2 3.11Å; D789-L842 HydrophobicContact CB-CD1 4.44Å; D789-K846 IonicContact OD1-NZ 3.74Å; D789-K846 PolarHBondContact OD1-NZ 2.61Å; D789-K846 IonicContact OD2-NZ 2.7Å; D789-K846 PolarHBondContact OD2-NZ 3.42Å
790	S	73.6	Confident	85.4	Confident	83 Å²	83	43.5 Å²	43.5	58%	0.58	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	56.8	42.1	-179.7	99.7	0	0	0	0	115.3	G786 R838	G786-S790 WeakPolarHBondContact O-CA 3.45Å; G786-S790 PolarHBondContact O-N 3.43Å; S790-R838 PolarHBondContact OG-NH2 3.38Å
791	C	82.9	Confident	85.5	Confident	13 Å²	13	43.5 Å²	43.5	9%	0.088	24%	0.241	C	C	.	.			trans	-119	158.5	-176.9	-65.4	0	0	0	0	110.3	G786 D789 T832 P834	G786-C791 CarbonylContact C-O 3.32Å; G786-C791 WeakPolarHBondContact CA-O 3.36Å; G786-C791 PolarHBondContact O-N 2.9Å; D789-C791 PolarHBondContact O-SG 2.87Å; C791-T832 WeakPolarHBondContact CB-O 3.39Å; C791-P834 WeakPolarHBondContact SG-CD 3.33Å
792	S	86.8	Confident	85.6	Confident	87 Å²	87	44.1 Å²	44.1	61%	0.608	24%	0.244	S	C	*	.	S	Bend	trans	-92.3	-21	177.6	66	0	0	0	0	114.4	G831 T832	S792-G831 VanDerWaalsContact OG-CA 3.28Å; S792-G831 WeakPolarHBondContact OG-CA 3.45Å; S792-T832 PolarHBondContact N-O 3.34Å; S792-T832 PolarHBondContact N-OG1 2.95Å; S792-T832 PolarHBondContact OG-N 3.38Å; S792-T832 PolarHBondContact OG-OG1 3.03Å
793	L	90.4	Very high	85.9	Confident	3 Å²	3	44.1 Å²	44.1	2%	0.016	24%	0.244	C	C	.	.			trans	-97.5	131.8	175.6	-166.6	64.3	0	0	0	111.7	V795 V801 C816 E829 T832 I833	L793-V795 HydrophobicContact CB-CG2 4.41Å; L793-V795 HydrophobicContact CD2-CG2 3.68Å; L793-V795 HydrophobicContact CG-CG2 3.72Å; L793-V801 HydrophobicContact CD2-CG1 4.45Å; L793-C816 HydrophobicContact CD2-CB 4.13Å; L793-E829 HydrophobicContact CD1-CG 4.02Å; L793-T832 PolarHBondContact N-O 3.03Å; L793-I833 HydrophobicContact CB-CG2 4.06Å; L793-I833 HydrophobicContact CD2-CG2 4.16Å
794	N	90.8	Very high	86.1	Confident	87 Å²	87	43.2 Å²	43.2	47%	0.465	24%	0.24	S	C	.	.			trans	-88.6	129.3	165.8	-69.2	-42.8	0	0	0	109.2	G786 R818	G786-N794 PolarHBondContact N-OD1 2.65Å; N794-R818 PolarHBondContact O-NH2 3.01Å
795	V	91.8	Very high	86.3	Confident	2 Å²	2	43.6 Å²	43.6	1%	0.012	24%	0.241	C	C	.	.	B	Isolated β-bridge	trans	-139.4	137.9	-179.6	-169	0	0	0	0	109.5	V780 I784 L793 E799 V801 I833	V780-V795 HydrophobicContact CB-CG1 4.1Å; V780-V795 HydrophobicContact CG1-CG1 4.47Å; V780-V795 HydrophobicContact CG2-CG1 3.81Å; I784-V795 PolarHBondContact N-O 3.48Å; I784-V795 PolarHBondContact O-N 2.7Å; I784-V795 VanDerWaalsContact O-N 3.12Å; L793-V795 HydrophobicContact CB-CG2 4.41Å; L793-V795 HydrophobicContact CD2-CG2 3.68Å; L793-V795 HydrophobicContact CG-CG2 3.72Å; V795-E799 WeakPolarHBondContact CA-OE2 2.82Å; V795-E799 HydrophobicContact CG1-CB 3.89Å; V795-V801 HydrophobicContact CG1-CG1 3.96Å; V795-V801 HydrophobicContact CG2-CG1 4.15Å; V795-I833 HydrophobicContact CG2-CG2 3.99Å
796	R	91.3	Very high	86.9	Confident	165 Å²	165	41.2 Å²	41.2	62%	0.623	23%	0.225	S	C	*	.			trans	-100.4	156	176.7	-61.8	176.7	-64.1	165.9	4.9	111.5	D798 E799	R796-D798 PolarHBondContact O-N 2.68Å; R796-E799 HydrophobicContact CB-CG 4.04Å; R796-E799 IonicContact CZ-OE1 3.5Å; R796-E799 PolarHBondContact N-OE2 3.12Å; R796-E799 IonicContact NE-OE1 2.85Å; R796-E799 PolarHBondContact NE-OE1 2.9Å; R796-E799 IonicContact NH2-OE1 3.19Å; R796-E799 PolarHBondContact NH2-OE1 3.18Å; R796-E799 VanDerWaalsContact O-CB 3.29Å; R796-E799 WeakPolarHBondContact O-CB 3.19Å; R796-E799 PolarHBondContact O-N 2.89Å
797	C	91.2	Very high	88	Confident	11 Å²	11	42 Å²	42	7%	0.074	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.4	133.9	173.5	-174.4	0	0	0	0	110.7	V780 N781 N783 R916	V780-C797 CarbonylContact O-C 3.06Å; V780-C797 VanDerWaalsContact O-CA 3.3Å; V780-C797 WeakPolarHBondContact O-CA 3.43Å; N781-C797 PolarHBondContact O-SG 3.33Å; N781-C797 VanDerWaalsContact O-SG 3.41Å; N783-C797 WeakPolarHBondContact OD1-CB 3.44Å; N783-C797 PolarHBondContact OD1-N 3.09Å; C797-R916 HydrophobicContact CB-CB 4.34Å; C797-R916 HydrophobicContact CB-CG 4.09Å; C797-R916 PolarHBondContact O-NH1 2.92Å; C797-R916 VanDerWaalsContact O-NH1 3.11Å; C797-R916 PolarHBondContact SG-NH1 3.07Å
798	D	91.4	Very high	89.1	Confident	29 Å²	29	34.8 Å²	34.8	16%	0.155	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	72.4	5	-166.6	-60.6	-35.5	0	0	0	117.1	R779 V780 R796 R916 R918 L1108	R779-D798 IonicContact CZ-OD1 2.67Å; R779-D798 IonicContact NE-OD1 2.68Å; R779-D798 PolarHBondContact NE-OD1 2.92Å; R779-D798 VanDerWaalsContact NH2-CG 3.26Å; R779-D798 IonicContact NH2-OD1 3.99Å; R779-D798 PolarHBondContact NH2-OD1 3.27Å; R779-D798 IonicContact NH2-OD2 2.68Å; V780-D798 PolarHBondContact O-N 2.96Å; R796-D798 PolarHBondContact O-N 2.68Å; D798-R916 VanDerWaalsContact CG-NH1 3.27Å; D798-R916 IonicContact OD2-CZ 3.79Å; D798-R916 IonicContact OD2-NH1 3.68Å; D798-R916 PolarHBondContact OD2-NH1 3.37Å; D798-R916 IonicContact OD2-NH2 3.82Å; D798-R916 PolarHBondContact OD2-NH2 3.17Å; D798-R918 WeakPolarHBondContact OD1-CD 3.45Å; D798-L1108 HydrophobicContact CB-CD2 4.34Å; D798-L1108 WeakPolarHBondContact O-CD2 3.38Å
799	E	93.2	Very high	90.1	Very high	36 Å²	36	38.1 Å²	38.1	17%	0.168	20%	0.197	C	C	.	.			trans	-77	148.6	165	-65.7	-178.5	165	0	0	111.3	R779 V780 V795 R796	R779-E799 WeakPolarHBondContact CA-O 3.45Å; V780-E799 PolarHBondContact N-O 2.84Å; V795-E799 WeakPolarHBondContact CA-OE2 2.82Å; V795-E799 HydrophobicContact CG1-CB 3.89Å; R796-E799 HydrophobicContact CB-CG 4.04Å; R796-E799 IonicContact CZ-OE1 3.5Å; R796-E799 PolarHBondContact N-OE2 3.12Å; R796-E799 IonicContact NE-OE1 2.85Å; R796-E799 PolarHBondContact NE-OE1 2.9Å; R796-E799 IonicContact NH2-OE1 3.19Å; R796-E799 PolarHBondContact NH2-OE1 3.18Å; R796-E799 VanDerWaalsContact O-CB 3.29Å; R796-E799 WeakPolarHBondContact O-CB 3.19Å; R796-E799 PolarHBondContact O-N 2.89Å
800	V	95.4	Very high	90.5	Very high	16 Å²	16	40 Å²	40	10%	0.097	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	131.9	175.1	175.6	0	0	0	0	109.7	I778 R779 V959 L1108 W1140	I778-V800 VanDerWaalsContact O-CA 3.27Å; I778-V800 WeakPolarHBondContact O-CA 3.19Å; R779-V800 HydrophobicContact CB-CG2 4.23Å; V800-V959 HydrophobicContact CG1-CG2 3.91Å; V800-V959 HydrophobicContact CG2-CG2 4.33Å; V800-L1108 HydrophobicContact CG2-CD1 4.22Å; V800-W1140 HydrophobicContact CB-CD2 4.47Å; V800-W1140 HydrophobicContact CB-CG 4.47Å; V800-W1140 HydrophobicContact CG1-CD2 3.83Å; V800-W1140 HydrophobicContact CG1-CE3 3.99Å; V800-W1140 HydrophobicContact CG1-CG 4.29Å; V800-W1140 HydrophobicContact CG1-CH2 4.39Å; V800-W1140 HydrophobicContact CG1-CZ2 4.28Å; V800-W1140 HydrophobicContact CG1-CZ3 4.25Å; V800-W1140 HydrophobicContact CG2-CB 4.1Å; V800-W1140 HydrophobicContact CG2-CD2 4.3Å; V800-W1140 HydrophobicContact CG2-CG 3.88Å
801	V	96.3	Very high	91	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	152.8	175.4	-60.6	0	0	0	0	110.4	I778 V780 L793 V795 C816 A817 I833	I778-V801 HydrophobicContact CD1-CG2 3.82Å; I778-V801 HydrophobicContact CG1-CG2 3.52Å; I778-V801 PolarHBondContact N-O 2.96Å; I778-V801 PolarHBondContact O-N 3.2Å; V780-V801 HydrophobicContact CG2-CG2 4.1Å; L793-V801 HydrophobicContact CD2-CG1 4.45Å; V795-V801 HydrophobicContact CG1-CG1 3.96Å; V795-V801 HydrophobicContact CG2-CG1 4.15Å; V801-C816 HydrophobicContact CB-CB 4.14Å; V801-C816 HydrophobicContact CG2-CB 4.13Å; V801-A817 WeakPolarHBondContact CA-O 3.3Å; V801-A817 WeakPolarHBondContact CB-O 3.49Å; V801-I833 HydrophobicContact CG2-CD1 4.33Å
802	H	96.8	Very high	90.9	Very high	13 Å²	13	45.2 Å²	45.2	6%	0.06	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	120.4	175.7	-175	-158.6	0	0	0	108.8	S775 F776 Y777 L804 C816 A817 V819 D826	S775-H802 PolarHBondContact OG-NE2 2.83Å; F776-H802 PolarHBondContact O-CD2 3.06Å; Y777-H802 HydrophobicContact CD1-CB 3.77Å; Y777-H802 AromaticContact CD1-CD2 3.99Å; Y777-H802 HydrophobicContact CE1-CB 3.56Å; Y777-H802 AromaticContact CE1-CD2 3.73Å; Y777-H802 AromaticContact CE1-CG 3.55Å; Y777-H802 AromaticContact CE2-CD2 3.79Å; Y777-H802 AromaticContact CE2-NE2 3.88Å; Y777-H802 AromaticContact CZ-CD2 3.59Å; Y777-H802 AromaticContact CZ-CG 3.73Å; Y777-H802 AromaticContact CZ-ND1 3.98Å; Y777-H802 AromaticContact CZ-NE2 3.78Å; H802-L804 VanDerWaalsContact CE1-CD2 3.47Å; H802-L804 WeakPolarHBondContact CE1-CD2 3.43Å; H802-L804 WeakPolarHBondContact ND1-CD2 3.24Å; H802-C816 CarbonylContact O-C 3.55Å; H802-C816 WeakPolarHBondContact O-CA 3.41Å; H802-C816 WeakPolarHBondContact O-CB 3.1Å; H802-A817 PolarHBondContact N-O 3.24Å; H802-A817 PolarHBondContact O-N 3.12Å; H802-V819 HydrophobicContact CB-CG2 3.8Å; H802-D826 IonicContact CE1-OD1 3.35Å; H802-D826 IonicContact CG-OD1 2.71Å; H802-D826 IonicContact ND1-OD1 3.42Å; H802-D826 PolarHBondContact ND1-OD1 3.24Å; H802-D826 IonicContact ND1-OD2 3.65Å
803	V	96.6	Very high	91.1	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	125.1	175.5	-170.5	0	0	0	0	108.6	S775 F776 I778 T806 W814	S775-V803 WeakPolarHBondContact CA-O 3.46Å; F776-V803 HydrophobicContact CD1-CB 3.98Å; F776-V803 HydrophobicContact CD1-CG1 4.36Å; F776-V803 HydrophobicContact CD2-CB 4.37Å; F776-V803 HydrophobicContact CD2-CG2 4.16Å; F776-V803 HydrophobicContact CE1-CB 3.7Å; F776-V803 HydrophobicContact CE1-CG1 3.65Å; F776-V803 HydrophobicContact CE1-CG2 4.25Å; F776-V803 HydrophobicContact CE2-CB 4.11Å; F776-V803 HydrophobicContact CE2-CG2 3.75Å; F776-V803 HydrophobicContact CG-CB 4.32Å; F776-V803 HydrophobicContact CZ-CB 3.77Å; F776-V803 HydrophobicContact CZ-CG1 3.74Å; F776-V803 HydrophobicContact CZ-CG2 3.81Å; F776-V803 PolarHBondContact N-O 2.93Å; F776-V803 WeakPolarHBondContact O-CB 3.11Å; F776-V803 PolarHBondContact O-N 3.01Å; I778-V803 HydrophobicContact CD1-CG2 3.7Å; I778-V803 HydrophobicContact CG1-CG2 3.88Å; I778-V803 HydrophobicContact CG2-CG2 4.17Å; V803-T806 HydrophobicContact CG1-CG2 3.93Å; V803-W814 HydrophobicContact CG1-CB 4.28Å; V803-W814 HydrophobicContact CG1-CD2 4.2Å; V803-W814 HydrophobicContact CG1-CE3 4Å; V803-W814 HydrophobicContact CG1-CG 4.37Å; V803-W814 HydrophobicContact CG2-CE3 3.92Å; V803-W814 HydrophobicContact CG2-CZ3 4.17Å
804	L	94.9	Very high	91.3	Very high	11 Å²	11	43 Å²	43	6%	0.058	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	-13.3	-171.8	-67.2	171.5	0	0	0	113.9	A771 S772 D774 H802 L815 A817	A771-L804 HydrophobicContact CB-CB 4.13Å; S772-L804 PolarHBondContact N-O 3.3Å; S772-L804 VanDerWaalsContact N-O 3.12Å; D774-L804 CarbonylContact O-C 3.54Å; H802-L804 VanDerWaalsContact CE1-CD2 3.47Å; H802-L804 WeakPolarHBondContact CE1-CD2 3.43Å; H802-L804 WeakPolarHBondContact ND1-CD2 3.24Å; L804-L815 PolarHBondContact N-O 2.93Å; L804-A817 HydrophobicContact CD1-CB 4.01Å
805	D	94.6	Very high	91.5	Very high	12 Å²	12	39.9 Å²	39.9	6%	0.064	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-170	114.7	-174.7	167.9	9	0	0	0	107.8	A771 R807 H808 W814 L815	A771-D805 HydrophobicContact CB-CB 4.29Å; D805-R807 WeakPolarHBondContact OD1-CA 3.15Å; D805-R807 PolarHBondContact OD1-N 3.49Å; D805-H808 PolarHBondContact OD1-N 3.49Å; D805-H808 VanDerWaalsContact OD2-CA 3.24Å; D805-H808 WeakPolarHBondContact OD2-CA 3.43Å; D805-H808 IonicContact OD2-CE1 2.67Å; D805-H808 IonicContact OD2-CG 2.71Å; D805-H808 IonicContact OD2-ND1 3.71Å; D805-H808 PolarHBondContact OD2-ND1 2.83Å; D805-W814 CarbonylContact O-C 3.55Å; D805-W814 WeakPolarHBondContact O-CA 3.34Å; D805-L815 HydrophobicContact CB-CB 3.96Å; D805-L815 PolarHBondContact O-N 3.37Å
806	T	94.6	Very high	91.7	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	19%	0.194	C	C	.	.	S	Bend	trans	-87.3	-4.7	178.9	59.1	0	0	0	0	113.8	T732 Q733 E734 D774 F776 V803 W814	T732-T806 HydrophobicContact CG2-CG2 4.03Å; Q733-T806 PolarHBondContact N-OG1 3.26Å; E734-T806 WeakPolarHBondContact CB-OG1 3.31Å; E734-T806 PolarHBondContact N-OG1 2.89Å; D774-T806 HydrophobicContact CB-CG2 4.33Å; D774-T806 VanDerWaalsContact OD2-CB 3.31Å; D774-T806 WeakPolarHBondContact OD2-CB 3.43Å; D774-T806 WeakPolarHBondContact OD2-CG2 3.3Å; D774-T806 PolarHBondContact OD2-N 2.94Å; D774-T806 PolarHBondContact OD2-OG1 3.36Å; F776-T806 HydrophobicContact CE1-CG2 3.71Å; F776-T806 HydrophobicContact CZ-CG2 3.99Å; V803-T806 HydrophobicContact CG1-CG2 3.93Å; T806-W814 HydrophobicContact CG2-CD2 4.27Å; T806-W814 HydrophobicContact CG2-CG 4.43Å; T806-W814 HydrophobicContact CG2-CZ2 4.25Å; T806-W814 VanDerWaalsContact O-CD1 3.25Å
807	R	91.2	Very high	91.9	Very high	33 Å²	33	31.9 Å²	31.9	13%	0.125	17%	0.165	C	C	.	.	S	Bend	trans	-128.1	47.1	-177.3	-68.1	-166	63.5	76.1	5.3	112.2	Q733 E734 H737 D805 Q809 G810 R811	Q733-R807 HydrophobicContact CB-CG 4.22Å; Q733-R807 HydrophobicContact CG-CG 4.44Å; Q733-R807 VanDerWaalsContact O-CD 3.23Å; Q733-R807 WeakPolarHBondContact O-CD 3.34Å; E734-R807 HydrophobicContact CB-CG 3.99Å; H737-R807 VanDerWaalsContact CD2-CZ 3.4Å; H737-R807 PolarHBondContact CD2-NE 3.29Å; H737-R807 VanDerWaalsContact CG-CZ 3.46Å; H737-R807 PolarHBondContact NE2-NH2 2.92Å; D805-R807 WeakPolarHBondContact OD1-CA 3.15Å; D805-R807 PolarHBondContact OD1-N 3.49Å; R807-Q809 PolarHBondContact O-N 3.39Å; R807-G810 PolarHBondContact NH2-O 2.95Å; R807-G810 WeakPolarHBondContact O-CA 3.24Å; R807-G810 PolarHBondContact O-N 3.31Å; R807-R811 CarbonylContact C-O 3.18Å; R807-R811 WeakPolarHBondContact CA-O 3.39Å
808	H	89.8	Confident	92	Very high	38 Å²	38	34 Å²	34	18%	0.176	17%	0.171	C	C	.	.	G	3₁₀ helix	trans	-58.2	124.8	-166.3	-164.2	56.3	0	0	0	113.5	D805 G810 R811 E813 L815 T832	D805-H808 PolarHBondContact OD1-N 3.49Å; D805-H808 VanDerWaalsContact OD2-CA 3.24Å; D805-H808 WeakPolarHBondContact OD2-CA 3.43Å; D805-H808 IonicContact OD2-CE1 2.67Å; D805-H808 IonicContact OD2-CG 2.71Å; D805-H808 IonicContact OD2-ND1 3.71Å; D805-H808 PolarHBondContact OD2-ND1 2.83Å; H808-G810 PolarHBondContact O-N 3.41Å; H808-R811 PolarHBondContact N-O 3.48Å; H808-R811 WeakPolarHBondContact O-CB 3.35Å; H808-R811 PolarHBondContact O-N 3.21Å; H808-E813 WeakPolarHBondContact CB-O 3.4Å; H808-E813 PolarHBondContact N-O 3.5Å; H808-L815 HydrophobicContact CB-CB 4.29Å; H808-T832 HydrophobicContact CB-CG2 4.47Å
809	Q	86.4	Confident	92.1	Very high	148 Å²	148	33 Å²	33	69%	0.692	17%	0.166	S	C	*	.	G	3₁₀ helix	trans	54	30.9	-174.2	-57.6	170.7	31.2	0	0	113.4	R807 R811	R807-Q809 PolarHBondContact O-N 3.39Å; Q809-R811 VanDerWaalsContact C-N 3.31Å; Q809-R811 PolarHBondContact O-N 2.73Å
810	G	81.1	Confident	92.1	Very high	53 Å²	53	33.2 Å²	33.2	55%	0.546	17%	0.168	S	C	.	.	G	3₁₀ helix	trans	79.7	4.3	-177.1	0	0	0	0	0	115	R807 H808	R807-G810 PolarHBondContact NH2-O 2.95Å; R807-G810 WeakPolarHBondContact O-CA 3.24Å; R807-G810 PolarHBondContact O-N 3.31Å; H808-G810 PolarHBondContact O-N 3.41Å
811	R	83.3	Confident	91.8	Very high	149 Å²	149	35.6 Å²	35.6	56%	0.562	18%	0.184	S	C	*	.	S	Bend	trans	-100.5	156.8	-179	-54.1	178.9	-179.9	-174.4	0.2	111	R807 H808 Q809 E813	R807-R811 CarbonylContact C-O 3.18Å; R807-R811 WeakPolarHBondContact CA-O 3.39Å; H808-R811 PolarHBondContact N-O 3.48Å; H808-R811 WeakPolarHBondContact O-CB 3.35Å; H808-R811 PolarHBondContact O-N 3.21Å; Q809-R811 VanDerWaalsContact C-N 3.31Å; Q809-R811 PolarHBondContact O-N 2.73Å; R811-E813 HydrophobicContact CB-CG 4.32Å; R811-E813 IonicContact NH1-OE2 3.84Å; R811-E813 PolarHBondContact O-N 2.95Å
812	C	81.7	Confident	91.5	Very high	56 Å²	56	40.6 Å²	40.6	38%	0.378	20%	0.204	S	C	.	.	S	Bend	trans	-76	63.1	168.1	-69.4	0	0	0	0	111.3	E734 S835	E734-C812 VanDerWaalsContact OE1-CB 3.32Å; E734-C812 WeakPolarHBondContact OE1-CB 3.48Å; E734-C812 PolarHBondContact OE1-SG 2.79Å; C812-S835 WeakPolarHBondContact O-CB 3.33Å; C812-S835 PolarHBondContact O-OG 2.93Å
813	E	89.8	Confident	91.1	Very high	31 Å²	31	41.8 Å²	41.8	15%	0.145	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	134.2	172.9	-61.2	-171.8	135	0	0	107.2	H808 R811 R838	H808-E813 WeakPolarHBondContact CB-O 3.4Å; H808-E813 PolarHBondContact N-O 3.5Å; R811-E813 HydrophobicContact CB-CG 4.32Å; R811-E813 IonicContact NH1-OE2 3.84Å; R811-E813 PolarHBondContact O-N 2.95Å; E813-R838 IonicContact OE1-CZ 2.88Å; E813-R838 IonicContact OE1-NH1 3.2Å; E813-R838 PolarHBondContact OE1-NH1 3.31Å
814	W	94.6	Very high	90.6	Very high	13 Å²	13	42.3 Å²	42.3	5%	0.049	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	124.2	-173.4	-71.6	8.3	0	0	0	109.7	E734 F776 I778 V803 D805 T806 T832 I833 N836 Y956	E734-W814 PolarHBondContact OE2-NE1 3.33Å; F776-W814 HydrophobicContact CE2-CH2 4.09Å; F776-W814 AromaticContact CE2-CZ3 3.93Å; F776-W814 HydrophobicContact CE2-CZ3 3.93Å; F776-W814 HydrophobicContact CZ-CE3 4.35Å; F776-W814 AromaticContact CZ-CH2 3.77Å; F776-W814 HydrophobicContact CZ-CH2 3.77Å; F776-W814 HydrophobicContact CZ-CZ2 4.35Å; F776-W814 AromaticContact CZ-CZ3 3.78Å; F776-W814 HydrophobicContact CZ-CZ3 3.78Å; I778-W814 HydrophobicContact CD1-CE3 4.25Å; I778-W814 HydrophobicContact CD1-CZ3 4.13Å; V803-W814 HydrophobicContact CG1-CB 4.28Å; V803-W814 HydrophobicContact CG1-CD2 4.2Å; V803-W814 HydrophobicContact CG1-CE3 4Å; V803-W814 HydrophobicContact CG1-CG 4.37Å; V803-W814 HydrophobicContact CG2-CE3 3.92Å; V803-W814 HydrophobicContact CG2-CZ3 4.17Å; D805-W814 CarbonylContact O-C 3.55Å; D805-W814 WeakPolarHBondContact O-CA 3.34Å; T806-W814 HydrophobicContact CG2-CD2 4.27Å; T806-W814 HydrophobicContact CG2-CG 4.43Å; T806-W814 HydrophobicContact CG2-CZ2 4.25Å; T806-W814 VanDerWaalsContact O-CD1 3.25Å; W814-T832 CarbonylContact O-C 3.44Å; W814-T832 VanDerWaalsContact O-CA 3.25Å; W814-T832 WeakPolarHBondContact O-CA 3.48Å; W814-I833 HydrophobicContact CB-CG1 3.9Å; W814-I833 PolarHBondContact N-O 3.03Å; W814-I833 PolarHBondContact O-N 3.41Å; W814-N836 HydrophobicContact CH2-CB 3.79Å; W814-N836 HydrophobicContact CZ2-CB 3.75Å; W814-Y956 HydrophobicContact CE3-CD2 4.06Å; W814-Y956 AromaticContact CE3-CE2 3.9Å; W814-Y956 HydrophobicContact CE3-CE2 3.9Å; W814-Y956 HydrophobicContact CH2-CD2 4.13Å; W814-Y956 AromaticContact CZ3-CD2 3.55Å; W814-Y956 HydrophobicContact CZ3-CD2 3.55Å; W814-Y956 AromaticContact CZ3-CE2 3.87Å; W814-Y956 HydrophobicContact CZ3-CE2 3.87Å; W814-Y956 HydrophobicContact CZ3-CG 4.47Å
815	L	94.9	Very high	90.4	Very high	21 Å²	21	45.5 Å²	45.5	11%	0.11	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	131.3	169.2	-170.9	71	0	0	0	109.1	A771 L804 D805 H808 T832	A771-L815 HydrophobicContact CB-CD2 3.78Å; L804-L815 PolarHBondContact N-O 2.93Å; D805-L815 HydrophobicContact CB-CB 3.96Å; D805-L815 PolarHBondContact O-N 3.37Å; H808-L815 HydrophobicContact CB-CB 4.29Å; L815-T832 HydrophobicContact CD1-CG2 4.44Å
816	C	95.9	Very high	90.3	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134	150.3	177.9	-60.8	0	0	0	0	112.7	L793 V801 H802 R830 G831 I833	L793-C816 HydrophobicContact CD2-CB 4.13Å; V801-C816 HydrophobicContact CB-CB 4.14Å; V801-C816 HydrophobicContact CG2-CB 4.13Å; H802-C816 CarbonylContact O-C 3.55Å; H802-C816 WeakPolarHBondContact O-CA 3.41Å; H802-C816 WeakPolarHBondContact O-CB 3.1Å; C816-R830 CarbonylContact O-C 3.53Å; C816-R830 VanDerWaalsContact O-CA 3.27Å; C816-R830 WeakPolarHBondContact O-CA 3.42Å; C816-G831 PolarHBondContact N-O 2.8Å; C816-G831 PolarHBondContact O-N 3.46Å; C816-I833 WeakPolarHBondContact SG-CD1 3.39Å
817	A	95.1	Very high	90.1	Very high	0 Å²	0	50.5 Å²	50.5	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	142.6	162.4	0	0	0	0	0	110	V801 H802 L804 D826 R830	V801-A817 WeakPolarHBondContact CA-O 3.3Å; V801-A817 WeakPolarHBondContact CB-O 3.49Å; H802-A817 PolarHBondContact N-O 3.24Å; H802-A817 PolarHBondContact O-N 3.12Å; L804-A817 HydrophobicContact CD1-CB 4.01Å; A817-D826 HydrophobicContact CB-CB 3.97Å; A817-D826 WeakPolarHBondContact CB-OD2 3.46Å; A817-R830 HydrophobicContact CB-CG 3.88Å
818	R	93.9	Very high	89.9	Confident	55 Å²	55	54 Å²	54	21%	0.208	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	138.5	163.9	-164.3	-179.9	-63.1	117.5	11	108.9	N794 L827 E829	N794-R818 PolarHBondContact O-NH2 3.01Å; R818-L827 HydrophobicContact CB-CD1 4.35Å; R818-L827 HydrophobicContact CG-CD1 4.44Å; R818-L827 VanDerWaalsContact O-CB 3.26Å; R818-L827 WeakPolarHBondContact O-CB 3.49Å; R818-L827 WeakPolarHBondContact O-CG 3.21Å; R818-L827 PolarHBondContact O-N 2.97Å; R818-E829 IonicContact CZ-OE1 3.44Å; R818-E829 IonicContact CZ-OE2 3.54Å; R818-E829 PolarHBondContact N-O 3.14Å; R818-E829 VanDerWaalsContact N-O 3.11Å; R818-E829 IonicContact NH1-OE1 2.72Å; R818-E829 PolarHBondContact NH1-OE1 3.42Å; R818-E829 IonicContact NH1-OE2 2.63Å; R818-E829 PolarHBondContact NH1-OE2 2.93Å; R818-E829 IonicContact NH2-OE1 2.67Å; R818-E829 PolarHBondContact NH2-OE1 3.35Å; R818-E829 IonicContact NH2-OE2 3.63Å
819	V	94.6	Very high	89.9	Confident	9 Å²	9	56.5 Å²	56.5	6%	0.055	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	140.9	-176.4	-172.9	0	0	0	0	110.4	Y777 H802 P821 W1140	Y777-V819 HydrophobicContact CD1-CG2 3.92Å; Y777-V819 HydrophobicContact CE1-CG1 4.42Å; Y777-V819 HydrophobicContact CE1-CG2 3.82Å; H802-V819 HydrophobicContact CB-CG2 3.8Å; V819-P821 WeakPolarHBondContact O-CD 3.49Å; V819-W1140 HydrophobicContact CG1-CH2 4.38Å; V819-W1140 HydrophobicContact CG1-CZ2 3.85Å
820	D	92.1	Very high	90.2	Very high	40 Å²	40	55.4 Å²	55.4	21%	0.214	30%	0.303	C	S	.	.	P	Polyproline II helix	trans	-67.3	123.4	170.5	174.2	37.9	0	0	0	110.8	Y822 S823 G824 T825 L827	D820-Y822 PolarHBondContact O-N 3.38Å; D820-Y822 VanDerWaalsContact O-N 3.11Å; D820-Y822 PolarHBondContact OD1-N 3.43Å; D820-Y822 WeakPolarHBondContact OD2-CB 3.1Å; D820-Y822 PolarHBondContact OD2-N 2.7Å; D820-S823 WeakPolarHBondContact CB-OG 3.44Å; D820-S823 WeakPolarHBondContact OD2-CB 3.5Å; D820-S823 PolarHBondContact OD2-N 3.43Å; D820-S823 PolarHBondContact OD2-OG 3.26Å; D820-S823 VanDerWaalsContact OD2-OG 3.12Å; D820-G824 VanDerWaalsContact O-CA 3.32Å; D820-G824 WeakPolarHBondContact O-CA 3.07Å; D820-G824 PolarHBondContact O-N 3.25Å; D820-T825 PolarHBondContact N-O 3.28Å; D820-L827 HydrophobicContact CB-CD2 4.04Å; D820-L827 HydrophobicContact CB-CG 4.42Å
821	P	89.5	Confident	90.7	Very high	65 Å²	65	53 Å²	53	42%	0.422	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59	-22.7	178	-26.9	36.4	0	0	0	115	V819 K1137 T1138	V819-P821 WeakPolarHBondContact O-CD 3.49Å; P821-K1137 HydrophobicContact CB-CD 4.29Å; P821-K1137 HydrophobicContact CB-CG 4.37Å; P821-K1137 CarbonylContact O-C 3.12Å; P821-K1137 WeakPolarHBondContact O-CA 3.49Å; P821-K1137 VanDerWaalsContact O-CB 3.31Å; P821-K1137 WeakPolarHBondContact O-CB 3.49Å; P821-T1138 PolarHBondContact O-N 2.83Å
822	Y	90.3	Very high	91.2	Very high	105 Å²	105	46.7 Å²	46.7	41%	0.412	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.1	-65.6	-178.5	-59.4	-78.5	0	0	0	111.9	D820 G824 K1136 K1137 T1138	D820-Y822 PolarHBondContact O-N 3.38Å; D820-Y822 VanDerWaalsContact O-N 3.11Å; D820-Y822 PolarHBondContact OD1-N 3.43Å; D820-Y822 WeakPolarHBondContact OD2-CB 3.1Å; D820-Y822 PolarHBondContact OD2-N 2.7Å; Y822-G824 VanDerWaalsContact C-N 3.33Å; Y822-G824 PolarHBondContact O-N 3.3Å; Y822-K1136 HydrophobicContact CD1-CB 3.96Å; Y822-K1136 HydrophobicContact CE1-CB 4.19Å; Y822-K1137 HydrophobicContact CD1-CG 3.91Å; Y822-K1137 HydrophobicContact CE1-CG 3.75Å; Y822-T1138 PolarHBondContact O-N 2.72Å; Y822-T1138 PolarHBondContact O-OG1 3.32Å
823	S	87.9	Confident	91.8	Very high	39 Å²	39	44 Å²	44	27%	0.273	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.8	-29.1	-179	74.1	0	0	0	0	113	D820 T825 R963	D820-S823 WeakPolarHBondContact CB-OG 3.44Å; D820-S823 WeakPolarHBondContact OD2-CB 3.5Å; D820-S823 PolarHBondContact OD2-N 3.43Å; D820-S823 PolarHBondContact OD2-OG 3.26Å; D820-S823 VanDerWaalsContact OD2-OG 3.12Å; S823-T825 VanDerWaalsContact C-N 3.3Å; S823-T825 WeakPolarHBondContact OG-CB 3.44Å; S823-T825 PolarHBondContact OG-N 3.42Å; S823-T825 PolarHBondContact OG-OG1 2.83Å; S823-R963 PolarHBondContact O-NH2 2.93Å
824	G	86.5	Confident	92	Very high	11 Å²	11	42.5 Å²	42.5	11%	0.113	23%	0.231	C	C	.	.			trans	72	20.5	-168.8	0	0	0	0	0	113.9	D820 Y822	D820-G824 VanDerWaalsContact O-CA 3.32Å; D820-G824 WeakPolarHBondContact O-CA 3.07Å; D820-G824 PolarHBondContact O-N 3.25Å; Y822-G824 VanDerWaalsContact C-N 3.33Å; Y822-G824 PolarHBondContact O-N 3.3Å
825	T	90.7	Very high	91.8	Very high	78 Å²	78	42 Å²	42	48%	0.479	23%	0.229	S	C	.	.			trans	-104	155.6	177	64	0	0	0	0	112.1	D820 S823	D820-T825 PolarHBondContact N-O 3.28Å; S823-T825 VanDerWaalsContact C-N 3.3Å; S823-T825 WeakPolarHBondContact OG-CB 3.44Å; S823-T825 PolarHBondContact OG-N 3.42Å; S823-T825 PolarHBondContact OG-OG1 2.83Å
826	D	92.4	Very high	91.6	Very high	46 Å²	46	44.2 Å²	44.2	25%	0.246	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-51.6	137.5	171.8	-75.1	13.5	0	0	0	112.8	H802 A817 R830	H802-D826 IonicContact CE1-OD1 3.35Å; H802-D826 IonicContact CG-OD1 2.71Å; H802-D826 IonicContact ND1-OD1 3.42Å; H802-D826 PolarHBondContact ND1-OD1 3.24Å; H802-D826 IonicContact ND1-OD2 3.65Å; A817-D826 HydrophobicContact CB-CB 3.97Å; A817-D826 WeakPolarHBondContact CB-OD2 3.46Å; D826-R830 IonicContact OD2-CZ 2.76Å; D826-R830 IonicContact OD2-NE 2.68Å; D826-R830 IonicContact OD2-NH2 3.29Å; D826-R830 PolarHBondContact OD2-NH2 3.09Å
827	L	91.1	Very high	91.2	Very high	70 Å²	70	47.3 Å²	47.3	37%	0.366	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	162.8	162.2	-61.4	170.8	0	0	0	110.1	R818 D820 E829	R818-L827 HydrophobicContact CB-CD1 4.35Å; R818-L827 HydrophobicContact CG-CD1 4.44Å; R818-L827 VanDerWaalsContact O-CB 3.26Å; R818-L827 WeakPolarHBondContact O-CB 3.49Å; R818-L827 WeakPolarHBondContact O-CG 3.21Å; R818-L827 PolarHBondContact O-N 2.97Å; D820-L827 HydrophobicContact CB-CD2 4.04Å; D820-L827 HydrophobicContact CB-CG 4.42Å; L827-E829 PolarHBondContact O-N 3.49Å
828	A	86.1	Confident	90.9	Very high	107 Å²	107	50.4 Å²	50.4	88%	0.884	28%	0.275	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-66.1	-13.6	174.8	0	0	0	0	0	113.8	R830	A828-R830 PolarHBondContact O-N 3.25Å; A828-R830 VanDerWaalsContact O-N 3.17Å
829	E	90	Very high	90.7	Very high	91 Å²	91	47.9 Å²	47.9	43%	0.425	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	99.3	175.3	-167.1	179.1	149.2	0	0	110.4	L793 R818 L827	L793-E829 HydrophobicContact CD1-CG 4.02Å; R818-E829 IonicContact CZ-OE1 3.44Å; R818-E829 IonicContact CZ-OE2 3.54Å; R818-E829 PolarHBondContact N-O 3.14Å; R818-E829 VanDerWaalsContact N-O 3.11Å; R818-E829 IonicContact NH1-OE1 2.72Å; R818-E829 PolarHBondContact NH1-OE1 3.42Å; R818-E829 IonicContact NH1-OE2 2.63Å; R818-E829 PolarHBondContact NH1-OE2 2.93Å; R818-E829 IonicContact NH2-OE1 2.67Å; R818-E829 PolarHBondContact NH2-OE1 3.35Å; R818-E829 IonicContact NH2-OE2 3.63Å; L827-E829 PolarHBondContact O-N 3.49Å
830	R	91.9	Very high	90.4	Very high	125 Å²	125	51.4 Å²	51.4	47%	0.472	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	145.6	175	-67.7	-178.6	170	-176.5	-8.2	110.8	C816 A817 D826 A828	C816-R830 CarbonylContact O-C 3.53Å; C816-R830 VanDerWaalsContact O-CA 3.27Å; C816-R830 WeakPolarHBondContact O-CA 3.42Å; A817-R830 HydrophobicContact CB-CG 3.88Å; D826-R830 IonicContact OD2-CZ 2.76Å; D826-R830 IonicContact OD2-NE 2.68Å; D826-R830 IonicContact OD2-NH2 3.29Å; D826-R830 PolarHBondContact OD2-NH2 3.09Å; A828-R830 PolarHBondContact O-N 3.25Å; A828-R830 VanDerWaalsContact O-N 3.17Å
831	G	92.5	Very high	90	Very high	3 Å²	3	55.7 Å²	55.7	3%	0.031	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-173.4	175.3	175.7	0	0	0	0	0	112.4	S792 C816	S792-G831 VanDerWaalsContact OG-CA 3.28Å; S792-G831 WeakPolarHBondContact OG-CA 3.45Å; C816-G831 PolarHBondContact N-O 2.8Å; C816-G831 PolarHBondContact O-N 3.46Å
832	T	93.7	Very high	89.9	Confident	15 Å²	15	54.2 Å²	54.2	9%	0.092	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	147.2	-179.6	56.1	0	0	0	0	112.1	C791 S792 L793 H808 W814 L815	C791-T832 WeakPolarHBondContact CB-O 3.39Å; S792-T832 PolarHBondContact N-O 3.34Å; S792-T832 PolarHBondContact N-OG1 2.95Å; S792-T832 PolarHBondContact OG-N 3.38Å; S792-T832 PolarHBondContact OG-OG1 3.03Å; L793-T832 PolarHBondContact N-O 3.03Å; H808-T832 HydrophobicContact CB-CG2 4.47Å; W814-T832 CarbonylContact O-C 3.44Å; W814-T832 VanDerWaalsContact O-CA 3.25Å; W814-T832 WeakPolarHBondContact O-CA 3.48Å; L815-T832 HydrophobicContact CD1-CG2 4.44Å
833	I	94.8	Very high	89.7	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	165.6	163.7	69.1	176.6	0	0	0	109	I778 I784 L793 V795 V801 W814 C816 Y956	I778-I833 HydrophobicContact CD1-CD1 3.85Å; I784-I833 HydrophobicContact CD1-CB 4.41Å; L793-I833 HydrophobicContact CB-CG2 4.06Å; L793-I833 HydrophobicContact CD2-CG2 4.16Å; V795-I833 HydrophobicContact CG2-CG2 3.99Å; V801-I833 HydrophobicContact CG2-CD1 4.33Å; W814-I833 HydrophobicContact CB-CG1 3.9Å; W814-I833 PolarHBondContact N-O 3.03Å; W814-I833 PolarHBondContact O-N 3.41Å; C816-I833 WeakPolarHBondContact SG-CD1 3.39Å; I833-Y956 HydrophobicContact CD1-CE1 4.03Å; I833-Y956 HydrophobicContact CD1-CE2 4.32Å; I833-Y956 WeakPolarHBondContact CD1-OH 3.49Å
834	P	92.8	Very high	89.5	Confident	0 Å²	0	50.3 Å²	50.3	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.1	146.5	175.8	-17.5	30.3	0	0	0	111.7	C791 R838 A839 L842 Y956	C791-P834 WeakPolarHBondContact SG-CD 3.33Å; P834-R838 HydrophobicContact CB-CB 3.92Å; P834-R838 HydrophobicContact CB-CG 3.82Å; P834-A839 HydrophobicContact CB-CB 4.19Å; P834-L842 HydrophobicContact CB-CD1 4Å; P834-L842 HydrophobicContact CG-CD1 3.47Å; P834-L842 VanDerWaalsContact CG-CD1 3.47Å; P834-Y956 WeakPolarHBondContact CD-OH 3.35Å; P834-Y956 WeakPolarHBondContact O-CE2 3.44Å; P834-Y956 PolarHBondContact O-OH 3.37Å
835	S	91.4	Very high	89.3	Confident	2 Å²	2	53 Å²	53	1%	0.014	29%	0.285	C	S	.	.			trans	-60.4	161.2	166.6	66.1	0	0	0	0	111.7	E734 C812 S837 R838 A839	E734-S835 WeakPolarHBondContact OE1-CB 3.46Å; E734-S835 WeakPolarHBondContact OE2-CB 3.23Å; C812-S835 WeakPolarHBondContact O-CB 3.33Å; C812-S835 PolarHBondContact O-OG 2.93Å; S835-S837 VanDerWaalsContact C-N 3.3Å; S835-S837 PolarHBondContact O-N 2.85Å; S835-S837 PolarHBondContact OG-OG 3.16Å; S835-R838 PolarHBondContact O-N 2.84Å; S835-A839 WeakPolarHBondContact O-CB 3.49Å; S835-A839 PolarHBondContact O-N 2.92Å
836	N	90.1	Very high	88.9	Confident	67 Å²	67	49.7 Å²	49.7	36%	0.358	26%	0.264	S	S	.	.	H	α-helix	trans	-51.6	-45.7	-174.5	-167.4	-1.3	0	0	0	112.8	W814 R838 A839 Q840 P955 Y956	W814-N836 HydrophobicContact CH2-CB 3.79Å; W814-N836 HydrophobicContact CZ2-CB 3.75Å; N836-R838 PolarHBondContact O-N 3.2Å; N836-A839 PolarHBondContact O-N 3.44Å; N836-Q840 WeakPolarHBondContact O-CB 3.3Å; N836-Q840 PolarHBondContact O-N 3.3Å; N836-P955 WeakPolarHBondContact OD1-CG 3.27Å; N836-Y956 HydrophobicContact CB-CD2 4.32Å
837	S	87.2	Confident	88.2	Confident	65 Å²	65	47.6 Å²	47.6	46%	0.455	25%	0.253	S	S	.	.	H	α-helix	trans	-63	-41	178.2	56.7	0	0	0	0	113.3	S835 Q841	S835-S837 VanDerWaalsContact C-N 3.3Å; S835-S837 PolarHBondContact O-N 2.85Å; S835-S837 PolarHBondContact OG-OG 3.16Å; S837-Q841 WeakPolarHBondContact O-CG 3.34Å; S837-Q841 PolarHBondContact O-N 3.35Å
838	R	88.8	Confident	87.2	Confident	66 Å²	66	48 Å²	48	25%	0.249	25%	0.253	C	S	.	.	H	α-helix	trans	-71.5	-36	175.1	-175.2	-179.6	161.1	-177.9	-2.9	111.8	D789 S790 E813 P834 S835 N836 Q840 Q841 L842	D789-R838 PolarHBondContact O-NH2 3.11Å; S790-R838 PolarHBondContact OG-NH2 3.38Å; E813-R838 IonicContact OE1-CZ 2.88Å; E813-R838 IonicContact OE1-NH1 3.2Å; E813-R838 PolarHBondContact OE1-NH1 3.31Å; P834-R838 HydrophobicContact CB-CB 3.92Å; P834-R838 HydrophobicContact CB-CG 3.82Å; S835-R838 PolarHBondContact O-N 2.84Å; N836-R838 PolarHBondContact O-N 3.2Å; R838-Q840 VanDerWaalsContact C-N 3.35Å; R838-Q841 PolarHBondContact O-N 3.42Å; R838-L842 HydrophobicContact CG-CD1 4.39Å; R838-L842 WeakPolarHBondContact O-CG 3.5Å; R838-L842 PolarHBondContact O-N 2.88Å
839	A	90.6	Very high	86.6	Confident	1 Å²	1	47.2 Å²	47.2	1%	0.008	23%	0.229	C	C	.	.	H	α-helix	trans	-67	-36.1	175.4	0	0	0	0	0	111.9	P834 S835 N836 L842 L843 P955 Y956	P834-A839 HydrophobicContact CB-CB 4.19Å; S835-A839 WeakPolarHBondContact O-CB 3.49Å; S835-A839 PolarHBondContact O-N 2.92Å; N836-A839 PolarHBondContact O-N 3.44Å; A839-L842 PolarHBondContact O-N 2.85Å; A839-L843 WeakPolarHBondContact O-CB 3.41Å; A839-L843 PolarHBondContact O-N 2.89Å; A839-P955 HydrophobicContact CB-CB 3.64Å; A839-P955 HydrophobicContact CB-CG 3.81Å; A839-Y956 HydrophobicContact CB-CD2 4.31Å; A839-Y956 HydrophobicContact CB-CE1 4.08Å; A839-Y956 HydrophobicContact CB-CE2 3.55Å; A839-Y956 VanDerWaalsContact CB-CZ 3.41Å; A839-Y956 WeakPolarHBondContact CB-OH 3.34Å
840	Q	87.8	Confident	85.5	Confident	84 Å²	84	44.2 Å²	44.2	39%	0.393	22%	0.215	S	C	.	.	H	α-helix	trans	-64.9	-42	174.9	-170.3	179.5	56.5	0	0	111.5	N836 R838 L843 L844 L953 P955	N836-Q840 WeakPolarHBondContact O-CB 3.3Å; N836-Q840 PolarHBondContact O-N 3.3Å; R838-Q840 VanDerWaalsContact C-N 3.35Å; Q840-L843 PolarHBondContact O-N 3.39Å; Q840-L844 PolarHBondContact O-N 3.09Å; Q840-L953 HydrophobicContact CG-CB 3.96Å; Q840-L953 WeakPolarHBondContact CG-O 3.47Å; Q840-L953 PolarHBondContact NE2-O 3.41Å; Q840-P955 HydrophobicContact CB-CG 4.1Å
841	Q	85.2	Confident	84.1	Confident	130 Å²	130	39.5 Å²	39.5	61%	0.607	20%	0.2	S	C	*	.	H	α-helix	trans	-63.3	-43	172.1	-67.1	172.5	14.3	0	0	111.9	S837 R838 L843 L844 V845	S837-Q841 WeakPolarHBondContact O-CG 3.34Å; S837-Q841 PolarHBondContact O-N 3.35Å; R838-Q841 PolarHBondContact O-N 3.42Å; Q841-L843 PolarHBondContact O-N 3.32Å; Q841-L844 PolarHBondContact O-N 2.92Å; Q841-V845 WeakPolarHBondContact O-CG2 3.36Å; Q841-V845 PolarHBondContact O-N 2.98Å
842	L	86.6	Confident	82.2	Confident	33 Å²	33	43.6 Å²	43.6	17%	0.173	23%	0.227	C	C	.	.	H	α-helix	trans	-63.4	-38.8	175.5	-77.2	163.6	0	0	0	112.5	L782 D789 P834 R838 A839 V845 K846	L782-L842 HydrophobicContact CD1-CB 4.07Å; D789-L842 HydrophobicContact CB-CD1 4.44Å; P834-L842 HydrophobicContact CB-CD1 4Å; P834-L842 HydrophobicContact CG-CD1 3.47Å; P834-L842 VanDerWaalsContact CG-CD1 3.47Å; R838-L842 HydrophobicContact CG-CD1 4.39Å; R838-L842 WeakPolarHBondContact O-CG 3.5Å; R838-L842 PolarHBondContact O-N 2.88Å; A839-L842 PolarHBondContact O-N 2.85Å; L842-V845 PolarHBondContact O-N 3.22Å; L842-K846 WeakPolarHBondContact O-CB 3.29Å; L842-K846 VanDerWaalsContact O-CG 3.32Å; L842-K846 WeakPolarHBondContact O-CG 3.33Å; L842-K846 PolarHBondContact O-N 3.26Å
843	L	85.6	Confident	80.3	Confident	3 Å²	3	50.6 Å²	50.6	2%	0.016	25%	0.252	C	S	.	.	H	α-helix	trans	-62.1	-46.9	173.7	174.5	54.3	0	0	0	110.9	L782 A839 Q840 Q841 V845 K846 I847 V917 L953 P955	L782-L843 HydrophobicContact CB-CD1 4.48Å; L782-L843 HydrophobicContact CD1-CB 4.32Å; A839-L843 WeakPolarHBondContact O-CB 3.41Å; A839-L843 PolarHBondContact O-N 2.89Å; Q840-L843 PolarHBondContact O-N 3.39Å; Q841-L843 PolarHBondContact O-N 3.32Å; L843-V845 PolarHBondContact O-N 2.87Å; L843-K846 PolarHBondContact O-N 2.96Å; L843-I847 HydrophobicContact CD1-CD1 3.83Å; L843-I847 HydrophobicContact CD1-CG1 4.18Å; L843-I847 HydrophobicContact CG-CD1 4.06Å; L843-I847 VanDerWaalsContact O-CG1 3.3Å; L843-I847 WeakPolarHBondContact O-CG1 3.44Å; L843-I847 PolarHBondContact O-N 2.68Å; L843-V917 HydrophobicContact CD1-CB 3.67Å; L843-V917 HydrophobicContact CD1-CG1 3.72Å; L843-V917 HydrophobicContact CD1-CG2 4.22Å; L843-L953 HydrophobicContact CD2-CB 3.97Å; L843-L953 HydrophobicContact CD2-CD2 4.34Å; L843-L953 HydrophobicContact CG-CB 4.48Å; L843-L953 HydrophobicContact CG-CD1 4.49Å; L843-L953 HydrophobicContact CG-CD2 4.43Å; L843-P955 HydrophobicContact CB-CB 4.46Å; L843-P955 HydrophobicContact CD2-CB 4.21Å
844	L	83.5	Confident	77.9	Confident	60 Å²	60	52.9 Å²	52.9	31%	0.314	28%	0.275	S	S	.	.	H	α-helix	trans	-59.2	-45.1	175.2	-178.7	62.9	0	0	0	112	Q840 Q841 I847 Q848 F893 I897 L953	Q840-L844 PolarHBondContact O-N 3.09Å; Q841-L844 PolarHBondContact O-N 2.92Å; L844-I847 PolarHBondContact O-N 2.82Å; L844-Q848 WeakPolarHBondContact O-CB 3.06Å; L844-Q848 PolarHBondContact O-N 3.21Å; L844-F893 HydrophobicContact CD1-CE1 4.19Å; L844-I897 HydrophobicContact CD1-CD1 3.83Å; L844-L953 HydrophobicContact CB-CD1 3.77Å; L844-L953 HydrophobicContact CD1-CD1 3.94Å; L844-L953 HydrophobicContact CG-CD1 4.41Å
845	V	82	Confident	75.3	Confident	68 Å²	68	56.4 Å²	56.4	41%	0.412	31%	0.312	S	S	.	.	H	α-helix	trans	-66.4	-38.1	178.1	170	0	0	0	0	111.9	Q841 L842 L843 Q848 K849	Q841-V845 WeakPolarHBondContact O-CG2 3.36Å; Q841-V845 PolarHBondContact O-N 2.98Å; L842-V845 PolarHBondContact O-N 3.22Å; L843-V845 PolarHBondContact O-N 2.87Å; V845-Q848 WeakPolarHBondContact O-CB 2.93Å; V845-Q848 PolarHBondContact O-N 2.97Å; V845-K849 PolarHBondContact O-N 3.03Å
846	K	82.5	Confident	72.8	Confident	8 Å²	8	64.6 Å²	64.6	4%	0.035	35%	0.348	C	S	.	.	H	α-helix	trans	-69.1	-39.5	176	-71.7	175	-174.3	-179.2	0	111	L782 N783 D789 L842 L843 Q848 K849 F850 V917	L782-K846 HydrophobicContact CD1-CD 4.41Å; N783-K846 PolarHBondContact O-NZ 2.84Å; D789-K846 IonicContact OD1-NZ 3.74Å; D789-K846 PolarHBondContact OD1-NZ 2.61Å; D789-K846 IonicContact OD2-NZ 2.7Å; D789-K846 PolarHBondContact OD2-NZ 3.42Å; L842-K846 WeakPolarHBondContact O-CB 3.29Å; L842-K846 VanDerWaalsContact O-CG 3.32Å; L842-K846 WeakPolarHBondContact O-CG 3.33Å; L842-K846 PolarHBondContact O-N 3.26Å; L843-K846 PolarHBondContact O-N 2.96Å; K846-Q848 VanDerWaalsContact C-N 3.33Å; K846-Q848 PolarHBondContact O-N 3.09Å; K846-K849 PolarHBondContact O-N 3.23Å; K846-F850 WeakPolarHBondContact O-CD2 3.38Å; K846-F850 PolarHBondContact O-N 3.31Å; K846-V917 HydrophobicContact CB-CG1 4.08Å
847	I	77.6	Confident	70.3	Confident	1 Å²	1	66.9 Å²	66.9	1%	0.005	36%	0.356	C	S	.	.	H	α-helix	trans	-58.2	-44.6	168.4	-67.9	166.6	0	0	0	110.7	L843 L844 K849 F850 V851 I897 V901 V917 I919 L953	L843-I847 HydrophobicContact CD1-CD1 3.83Å; L843-I847 HydrophobicContact CD1-CG1 4.18Å; L843-I847 HydrophobicContact CG-CD1 4.06Å; L843-I847 VanDerWaalsContact O-CG1 3.3Å; L843-I847 WeakPolarHBondContact O-CG1 3.44Å; L843-I847 PolarHBondContact O-N 2.68Å; L844-I847 PolarHBondContact O-N 2.82Å; I847-K849 PolarHBondContact O-N 3.09Å; I847-F850 PolarHBondContact O-N 3.05Å; I847-V851 WeakPolarHBondContact O-CG2 3.33Å; I847-V851 PolarHBondContact O-N 2.89Å; I847-V851 VanDerWaalsContact O-N 3.1Å; I847-I897 HydrophobicContact CG2-CG1 4.24Å; I847-I897 HydrophobicContact CG2-CG2 3.91Å; I847-V901 HydrophobicContact CG2-CG2 4.24Å; I847-V917 HydrophobicContact CG1-CG2 4.05Å; I847-I919 HydrophobicContact CD1-CD1 3.92Å; I847-I919 HydrophobicContact CD1-CG1 4.36Å; I847-I919 HydrophobicContact CG1-CD1 4.24Å; I847-L953 HydrophobicContact CD1-CD1 4.44Å; I847-L953 HydrophobicContact CD1-CD2 3.74Å
848	Q	71.1	Confident	67.8	Low	78 Å²	78	71.8 Å²	71.8	36%	0.364	37%	0.372	S	S	.	.	H	α-helix	trans	-59.2	-43.8	177.4	-169.5	170.9	11.4	0	0	113.1	L844 V845 K846 F850 V851 C852 F893	L844-Q848 WeakPolarHBondContact O-CB 3.06Å; L844-Q848 PolarHBondContact O-N 3.21Å; V845-Q848 WeakPolarHBondContact O-CB 2.93Å; V845-Q848 PolarHBondContact O-N 2.97Å; K846-Q848 VanDerWaalsContact C-N 3.33Å; K846-Q848 PolarHBondContact O-N 3.09Å; Q848-F850 VanDerWaalsContact C-N 3.26Å; Q848-F850 PolarHBondContact O-N 3.27Å; Q848-V851 WeakPolarHBondContact O-CB 3.31Å; Q848-V851 PolarHBondContact O-N 3.29Å; Q848-V851 VanDerWaalsContact O-N 3.12Å; Q848-C852 PolarHBondContact O-N 3.24Å; Q848-F893 HydrophobicContact CB-CE2 4.32Å; Q848-F893 HydrophobicContact CB-CZ 3.72Å; Q848-F893 HydrophobicContact CG-CE2 3.81Å; Q848-F893 HydrophobicContact CG-CZ 3.51Å
849	K	72.6	Confident	65.1	Low	91 Å²	91	75.9 Å²	75.9	40%	0.396	40%	0.399	S	S	.	.	H	α-helix	trans	-54.9	-42.7	176.1	-74.8	-178.4	179.7	-173.6	0	111.8	V845 K846 I847 R853 E915	V845-K849 PolarHBondContact O-N 3.03Å; K846-K849 PolarHBondContact O-N 3.23Å; I847-K849 PolarHBondContact O-N 3.09Å; K849-R853 PolarHBondContact O-N 2.91Å; K849-R853 VanDerWaalsContact O-N 3.09Å; K849-E915 WeakPolarHBondContact CD-OE2 3.46Å; K849-E915 IonicContact NZ-OE1 3.42Å; K849-E915 PolarHBondContact NZ-OE1 2.85Å; K849-E915 IonicContact NZ-OE2 2.82Å
850	F	66.8	Low	62.2	Low	29 Å²	29	83.8 Å²	83.8	13%	0.127	44%	0.435	C	S	.	.	H	α-helix	trans	-65	-46.8	175.7	-67.8	-67.9	0	0	0	111.6	K846 I847 Q848 C852 R853 G854 F900 R910 S913 E915	K846-F850 WeakPolarHBondContact O-CD2 3.38Å; K846-F850 PolarHBondContact O-N 3.31Å; I847-F850 PolarHBondContact O-N 3.05Å; Q848-F850 VanDerWaalsContact C-N 3.26Å; Q848-F850 PolarHBondContact O-N 3.27Å; F850-C852 VanDerWaalsContact C-N 3.26Å; F850-C852 PolarHBondContact O-N 3.36Å; F850-R853 PolarHBondContact O-N 3.37Å; F850-G854 PolarHBondContact O-N 3.1Å; F850-F900 HydrophobicContact CB-CE1 3.59Å; F850-F900 HydrophobicContact CB-CZ 3.68Å; F850-F900 WeakPolarHBondContact O-CE2 3.44Å; F850-F900 WeakPolarHBondContact O-CZ 3.5Å; F850-R910 HydrophobicContact CD1-CG 4.44Å; F850-R910 HydrophobicContact CD2-CG 3.84Å; F850-R910 HydrophobicContact CE1-CG 4.37Å; F850-R910 HydrophobicContact CE2-CG 3.78Å; F850-R910 HydrophobicContact CG-CG 4.19Å; F850-R910 HydrophobicContact CZ-CG 4.06Å; F850-S913 VanDerWaalsContact CZ-OG 3.22Å; F850-S913 WeakPolarHBondContact CZ-OG 3.46Å; F850-E915 HydrophobicContact CE2-CB 4.3Å; F850-E915 WeakPolarHBondContact CE2-O 3.31Å; F850-E915 HydrophobicContact CZ-CB 3.83Å; F850-E915 WeakPolarHBondContact CZ-O 3.39Å
851	V	62.3	Low	59.5	Low	26 Å²	26	82.4 Å²	82.4	16%	0.158	44%	0.444	C	S	.	.	H	α-helix	trans	-52.1	-46.6	177.4	177.3	0	0	0	0	110.7	I847 Q848 I897 F900	I847-V851 WeakPolarHBondContact O-CG2 3.33Å; I847-V851 PolarHBondContact O-N 2.89Å; I847-V851 VanDerWaalsContact O-N 3.1Å; Q848-V851 WeakPolarHBondContact O-CB 3.31Å; Q848-V851 PolarHBondContact O-N 3.29Å; Q848-V851 VanDerWaalsContact O-N 3.12Å; V851-I897 HydrophobicContact CG2-CG1 4.26Å; V851-F900 HydrophobicContact CB-CD1 4.33Å; V851-F900 HydrophobicContact CB-CD2 4.43Å; V851-F900 HydrophobicContact CB-CG 4.3Å; V851-F900 HydrophobicContact CG2-CB 4.08Å; V851-F900 HydrophobicContact CG2-CD1 3.49Å; V851-F900 VanDerWaalsContact CG2-CD1 3.49Å; V851-F900 HydrophobicContact CG2-CD2 4.32Å; V851-F900 HydrophobicContact CG2-CE1 3.96Å; V851-F900 HydrophobicContact CG2-CG 3.71Å
852	C	54	Low	57	Low	88 Å²	88	84.9 Å²	84.9	60%	0.595	46%	0.455	S	S	*	.	H	α-helix	trans	-77.1	-23.7	-177.2	-62.7	0	0	0	0	114.9	Q848 F850	Q848-C852 PolarHBondContact O-N 3.24Å; F850-C852 VanDerWaalsContact C-N 3.26Å; F850-C852 PolarHBondContact O-N 3.36Å
853	R	54	Low	54.4	Low	162 Å²	162	94.5 Å²	94.5	61%	0.611	49%	0.489	S	S	*	.	H	α-helix	trans	-72.2	-32.1	174.1	-93.9	-166.1	-178.8	-102.7	1.4	113.2	K849 F850 G855 K856 E857	K849-R853 PolarHBondContact O-N 2.91Å; K849-R853 VanDerWaalsContact O-N 3.09Å; F850-R853 PolarHBondContact O-N 3.37Å; R853-G855 PolarHBondContact O-N 3.25Å; R853-K856 PolarHBondContact O-N 3.47Å; R853-E857 IonicContact CZ-OE1 2.59Å; R853-E857 IonicContact NH1-OE1 2.68Å; R853-E857 PolarHBondContact NH1-OE1 2.91Å
854	G	44.3	Very low	51.7	Low	48 Å²	48	101.2 Å²	101.2	50%	0.495	53%	0.53	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-16.4	-170	0	0	0	0	0	116.3	F850	F850-G854 PolarHBondContact O-N 3.1Å
855	G	37.8	Very low	49	Very low	75 Å²	75	103.4 Å²	103.4	77%	0.773	55%	0.551	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.8	7.5	-177.7	0	0	0	0	0	116.6	R853	R853-G855 PolarHBondContact O-N 3.25Å
856	K	39	Very low	46.6	Very low	174 Å²	174	111.7 Å²	111.7	76%	0.757	58%	0.575	S	S	*	*	T	Hydrogen-bonded Turn	trans	-121.5	-21.2	-175.2	-73.2	-165.1	173.2	-169.7	0	116.8	R853	R853-K856 PolarHBondContact O-N 3.47Å
857	E	37.3	Very low	44	Very low	115 Å²	115	116 Å²	116	54%	0.537	61%	0.612	S	S	.	*	S	Bend	trans	-89.5	-7	-167.7	-68.8	174.9	-172.6	0	0	114.8	R853	R853-E857 IonicContact CZ-OE1 2.59Å; R853-E857 IonicContact NH1-OE1 2.68Å; R853-E857 PolarHBondContact NH1-OE1 2.91Å
858	E	34.4	Very low	41.6	Very low	168 Å²	168	121.9 Å²	121.9	79%	0.785	65%	0.653	S	S	*	*	S	Bend	trans	-91.1	-12.3	-176	-66.4	-173.5	161.3	0	0	114.8
859	N	32.8	Very low	39.5	Very low	152 Å²	152	123.1 Å²	123.1	81%	0.813	67%	0.67	S	S	*	*	S	Bend	trans	-97.4	-10.4	-174.7	-151.5	20.5	0	0	0	114.7	G861	N859-G861 VanDerWaalsContact C-N 3.26Å; N859-G861 PolarHBondContact O-N 3.39Å
860	E	30	Very low	37.6	Very low	166 Å²	166	127 Å²	127	78%	0.776	69%	0.694	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.6	29.4	-179.1	-75.5	-64.5	159.4	0	0	113.3
861	G	29.7	Very low	35.7	Very low	56 Å²	56	134.3 Å²	134.3	58%	0.577	73%	0.729	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.7	-14.5	-177.6	0	0	0	0	0	116.1	N859	N859-G861 VanDerWaalsContact C-N 3.26Å; N859-G861 PolarHBondContact O-N 3.39Å
862	H	32.5	Very low	34.5	Very low	181 Å²	181	138.2 Å²	138.2	84%	0.838	75%	0.754	S	S	*	*	S	Bend	trans	-133	19.5	-157.3	-76.2	105.4	0	0	0	116.9
863	R	32.9	Very low	33.2	Very low	236 Å²	236	143 Å²	143	89%	0.891	77%	0.768	S	S	*	*			trans	-138	68.2	176.7	-69.8	-166.8	176	-171.5	0.2	115.3
864	T	28.1	Very low	31.9	Very low	143 Å²	143	143.6 Å²	143.6	88%	0.877	78%	0.778	S	S	*	*			trans	-115.6	72.5	173.6	37.8	0	0	0	0	113.5
865	S	28.6	Very low	31.3	Very low	106 Å²	106	146 Å²	146	74%	0.741	79%	0.793	S	S	*	*			trans	-162.6	137.3	155.4	-155.4	0	0	0	0	112.8
866	R	30.8	Very low	30.7	Very low	243 Å²	243	146.4 Å²	146.4	92%	0.917	80%	0.797	S	S	*	*			trans	65.7	127.9	177.9	-51	173.6	-178.8	173.9	-1	113.8
867	A	27.9	Very low	30.2	Very low	98 Å²	98	143.5 Å²	143.5	81%	0.81	80%	0.799	S	S	*	*			cis	-152.1	169.7	5.7	0	0	0	0	0	111.2
868	S	27	Very low	30	Very low	124 Å²	124	143.8 Å²	143.8	87%	0.867	81%	0.81	S	S	*	*			trans	-127.7	125.4	179.2	-50.2	0	0	0	0	110.9
869	S	27.4	Very low	29.9	Very low	105 Å²	105	141.4 Å²	141.4	73%	0.734	81%	0.81	S	S	*	*			trans	-171	100.1	158.3	-178.5	0	0	0	0	114.4
870	L	31.2	Very low	29.7	Very low	171 Å²	171	139.9 Å²	139.9	90%	0.895	80%	0.802	S	S	*	*			trans	67.6	166.2	143.1	-55.3	176.1	0	0	0	120.9
871	Q	27.7	Very low	29.9	Very low	184 Å²	184	139.8 Å²	139.8	86%	0.86	80%	0.804	S	S	*	*			trans	-115.6	-171.4	-162.8	-64.2	-171.7	-62.8	0	0	111.1
872	P	37.6	Very low	30.2	Very low	107 Å²	107	144.9 Å²	144.9	70%	0.695	81%	0.811	S	S	*	*			cis	-139.2	164.6	3	42.3	-24.1	0	0	0	119
873	E	25.5	Very low	30	Very low	190 Å²	190	140.5 Å²	140.5	89%	0.888	81%	0.806	S	S	*	*			trans	51.3	160.5	158.1	-61.7	-160.1	113.3	0	0	119.3
874	E	26.5	Very low	29.7	Very low	174 Å²	174	132.9 Å²	132.9	81%	0.813	79%	0.789	S	S	*	*			cis	-148.7	161.3	21.7	-162.3	-178.3	-163.5	0	0	112.5
875	A	31.8	Very low	30.1	Very low	98 Å²	98	128.7 Å²	128.7	81%	0.81	76%	0.764	S	S	*	*			trans	41.3	120.6	160.2	0	0	0	0	0	122.6
876	G	26.3	Very low	30.6	Very low	83 Å²	83	132.2 Å²	132.2	86%	0.856	76%	0.761	S	S	*	*			trans	-168.1	127.5	161.6	0	0	0	0	0	114
877	S	29.3	Very low	30.7	Very low	113 Å²	113	125.1 Å²	125.1	79%	0.79	74%	0.741	S	S	*	*	P	Polyproline II helix	trans	-82.9	150.1	-177.7	55.3	0	0	0	0	113.7
878	P	31.3	Very low	31.4	Very low	121 Å²	121	123.3 Å²	123.3	79%	0.786	72%	0.722	S	S	*	*	P	Polyproline II helix	trans	-72	139	-179.7	30	-35.4	0	0	0	112.8
879	P	32.2	Very low	32.4	Very low	118 Å²	118	125.6 Å²	125.6	77%	0.766	71%	0.712	S	S	*	*	P	Polyproline II helix	trans	-76.6	139.7	174.6	30.6	-33.9	0	0	0	112.3
880	D	30.4	Very low	33.3	Very low	121 Å²	121	123.1 Å²	123.1	65%	0.647	70%	0.697	S	S	*	*	P	Polyproline II helix	trans	-78.1	136.7	-178.3	-170	5.9	0	0	0	112.1	K882	D880-K882 PolarHBondContact O-N 2.85Å; D880-K882 IonicContact OD1-NZ 2.69Å; D880-K882 PolarHBondContact OD1-NZ 3.18Å; D880-K882 IonicContact OD2-NZ 2.71Å; D880-K882 PolarHBondContact OD2-NZ 3.17Å
881	I	34.1	Very low	34	Very low	163 Å²	163	116 Å²	116	84%	0.836	66%	0.662	S	S	*	*			trans	-102.6	82.6	-175	-55.3	-179.3	0	0	0	110.4
882	K	34.5	Very low	35.3	Very low	164 Å²	164	111 Å²	111	71%	0.713	64%	0.64	S	S	*	*			trans	-144.9	143	170.7	-57.2	-176.9	-170	72.1	0	108.6	D880	D880-K882 PolarHBondContact O-N 2.85Å; D880-K882 IonicContact OD1-NZ 2.69Å; D880-K882 PolarHBondContact OD1-NZ 3.18Å; D880-K882 IonicContact OD2-NZ 2.71Å; D880-K882 PolarHBondContact OD2-NZ 3.17Å
883	A	29.9	Very low	36.2	Very low	89 Å²	89	107.8 Å²	107.8	74%	0.736	62%	0.616	S	S	*	*			cis	-142.9	151.5	-0.4	0	0	0	0	0	112.3
884	S	24.8	Very low	37.7	Very low	75 Å²	75	99.8 Å²	99.8	52%	0.524	58%	0.579	S	S	.	*			trans	-154.7	154.1	170.8	-48.8	0	0	0	0	106.9	R889	S884-R889 PolarHBondContact O-NH1 3.42Å
885	P	37.8	Very low	39.2	Very low	55 Å²	55	94.8 Å²	94.8	36%	0.357	56%	0.557	S	S	.	*				-132.3	-155.4	-104.5	45.6	-33.3	0	0	0	116.3	D376 R889	D376-P885 HydrophobicContact CB-CB 3.24Å; D376-P885 HydrophobicContact CB-CG 3.3Å; D376-P885 WeakPolarHBondContact OD1-CB 3.47Å; D376-P885 VanDerWaalsContact OD1-CG 3.28Å; D376-P885 WeakPolarHBondContact OD1-CG 3.49Å; P885-R889 WeakPolarHBondContact O-CG 3.23Å
886	R	39	Very low	40.7	Very low	181 Å²	181	95 Å²	95	68%	0.683	54%	0.541	S	S	*	.			trans	-118.5	49.5	-143.9	-69.9	-172.9	175.9	174.2	-1.2	115.8	D376	D376-R886 PolarHBondContact OD1-N 2.91Å
887	L	32.2	Very low	42.5	Very low	93 Å²	93	91.1 Å²	91.1	49%	0.487	50%	0.501	S	S	.	.	S	Bend		-63.1	145.9	125.9	-78.9	168.9	0	0	0	107.3	R889 I892	L887-R889 PolarHBondContact O-N 3.07Å; L887-I892 HydrophobicContact CB-CD1 3.92Å; L887-I892 HydrophobicContact CD1-CD1 4.44Å
888	S	43.9	Very low	44.1	Very low	60 Å²	60	88.9 Å²	88.9	42%	0.42	48%	0.48	S	S	.	.			trans	-49.4	108.5	-172	178.1	0	0	0	0	110.8	A890 S891 I892	S888-A890 CarbonylContact O-C 3.57Å; S888-A890 PolarHBondContact O-N 2.96Å; S888-S891 PolarHBondContact O-N 3.27Å; S888-S891 PolarHBondContact O-OG 3.39Å; S888-S891 PolarHBondContact OG-N 3.44Å; S888-I892 PolarHBondContact O-N 3.25Å
889	R	46.6	Very low	45.6	Very low	173 Å²	173	88.7 Å²	88.7	65%	0.653	47%	0.469	S	S	*	.	H	α-helix	trans	-61.2	-22.9	-177.9	-81.4	-179.9	61.3	160.8	-7	110.6	S884 P885 L887 F893	S884-R889 PolarHBondContact O-NH1 3.42Å; P885-R889 WeakPolarHBondContact O-CG 3.23Å; L887-R889 PolarHBondContact O-N 3.07Å; R889-F893 WeakPolarHBondContact O-CB 3.31Å; R889-F893 PolarHBondContact O-N 2.9Å
890	A	46	Very low	47.1	Very low	52 Å²	52	84.2 Å²	84.2	43%	0.43	44%	0.437	S	S	.	.	H	α-helix	trans	-66.6	-54.4	166.8	0	0	0	0	0	112.5	S888 I892 F893 L894	S888-A890 CarbonylContact O-C 3.57Å; S888-A890 PolarHBondContact O-N 2.96Å; A890-I892 PolarHBondContact O-N 3.4Å; A890-F893 CarbonylContact O-C 3.54Å; A890-F893 PolarHBondContact O-N 3.48Å; A890-F893 VanDerWaalsContact O-N 3.11Å; A890-L894 HydrophobicContact CB-CD1 4.33Å; A890-L894 VanDerWaalsContact O-CB 3.31Å; A890-L894 WeakPolarHBondContact O-CB 3.2Å; A890-L894 WeakPolarHBondContact O-CG 3.46Å; A890-L894 PolarHBondContact O-N 2.95Å
891	S	46	Very low	48.6	Very low	21 Å²	21	79.5 Å²	79.5	15%	0.147	41%	0.413	C	S	.	.	H	α-helix	trans	-63.9	-37.9	-172.9	68.4	0	0	0	0	113.7	S888 N895	S888-S891 PolarHBondContact O-N 3.27Å; S888-S891 PolarHBondContact O-OG 3.39Å; S888-S891 PolarHBondContact OG-N 3.44Å; S891-N895 PolarHBondContact O-N 3.13Å; S891-N895 PolarHBondContact O-ND2 3.34Å
892	I	55.3	Low	49.9	Very low	80 Å²	80	75 Å²	75	41%	0.41	40%	0.396	S	S	.	.	H	α-helix	trans	-67.3	-44.7	172.7	-61.8	176.6	0	0	0	110.6	L887 S888 A890 N895 Q896	L887-I892 HydrophobicContact CB-CD1 3.92Å; L887-I892 HydrophobicContact CD1-CD1 4.44Å; S888-I892 PolarHBondContact O-N 3.25Å; A890-I892 PolarHBondContact O-N 3.4Å; I892-N895 PolarHBondContact O-N 3.19Å; I892-Q896 WeakPolarHBondContact O-CG 3.29Å; I892-Q896 PolarHBondContact O-N 3.21Å
893	F	57.1	Low	51.4	Low	40 Å²	40	74.9 Å²	74.9	18%	0.175	39%	0.391	C	S	.	.	H	α-helix	trans	-67.3	-35.5	179.6	176.6	-126.9	0	0	0	113.1	L844 Q848 R889 A890 Q896 I897	L844-F893 HydrophobicContact CD1-CE1 4.19Å; Q848-F893 HydrophobicContact CB-CE2 4.32Å; Q848-F893 HydrophobicContact CB-CZ 3.72Å; Q848-F893 HydrophobicContact CG-CE2 3.81Å; Q848-F893 HydrophobicContact CG-CZ 3.51Å; R889-F893 WeakPolarHBondContact O-CB 3.31Å; R889-F893 PolarHBondContact O-N 2.9Å; A890-F893 CarbonylContact O-C 3.54Å; A890-F893 PolarHBondContact O-N 3.48Å; A890-F893 VanDerWaalsContact O-N 3.11Å; F893-Q896 CarbonylContact O-C 3.55Å; F893-Q896 PolarHBondContact O-N 2.98Å; F893-I897 HydrophobicContact CD1-CD1 3.72Å; F893-I897 HydrophobicContact CD2-CD1 4.13Å; F893-I897 HydrophobicContact CD2-CG1 4.14Å; F893-I897 HydrophobicContact CE1-CD1 3.39Å; F893-I897 HydrophobicContact CE1-CG1 4.31Å; F893-I897 HydrophobicContact CE2-CD1 3.82Å; F893-I897 HydrophobicContact CE2-CG1 3.8Å; F893-I897 HydrophobicContact CG-CD1 4.07Å; F893-I897 HydrophobicContact CG-CG1 4.5Å; F893-I897 HydrophobicContact CZ-CD1 3.43Å; F893-I897 VanDerWaalsContact CZ-CD1 3.43Å; F893-I897 HydrophobicContact CZ-CG1 3.89Å; F893-I897 WeakPolarHBondContact O-CB 3.47Å; F893-I897 VanDerWaalsContact O-CG1 3.24Å; F893-I897 WeakPolarHBondContact O-CG1 3.01Å; F893-I897 PolarHBondContact O-N 3.31Å
894	L	57.4	Low	52.7	Low	21 Å²	21	73.1 Å²	73.1	11%	0.11	37%	0.371	C	S	.	.	H	α-helix	trans	-66.1	-43.2	175.7	-72	166.6	0	0	0	110.7	A890 I897 L898 L947 L951	A890-L894 HydrophobicContact CB-CD1 4.33Å; A890-L894 VanDerWaalsContact O-CB 3.31Å; A890-L894 WeakPolarHBondContact O-CB 3.2Å; A890-L894 WeakPolarHBondContact O-CG 3.46Å; A890-L894 PolarHBondContact O-N 2.95Å; L894-I897 PolarHBondContact O-N 3.33Å; L894-L898 WeakPolarHBondContact O-CB 3.38Å; L894-L898 WeakPolarHBondContact O-CG 3.09Å; L894-L898 PolarHBondContact O-N 3.23Å; L894-L947 HydrophobicContact CD1-CB 4.48Å; L894-L951 HydrophobicContact CD2-CB 4.41Å; L894-L951 HydrophobicContact CD2-CD1 3.46Å; L894-L951 VanDerWaalsContact CD2-CD1 3.46Å; L894-L951 HydrophobicContact CD2-CG 3.98Å
895	N	56.9	Low	54.4	Low	69 Å²	69	74.1 Å²	74.1	37%	0.369	37%	0.371	S	S	.	.	H	α-helix	trans	-64	-41.4	172.1	-81.6	-80	0	0	0	111.9	S891 I892 L898 Q899	S891-N895 PolarHBondContact O-N 3.13Å; S891-N895 PolarHBondContact O-ND2 3.34Å; I892-N895 PolarHBondContact O-N 3.19Å; N895-L898 PolarHBondContact O-N 3.34Å; N895-Q899 WeakPolarHBondContact O-CB 3.33Å; N895-Q899 VanDerWaalsContact O-CG 3.31Å; N895-Q899 WeakPolarHBondContact O-CG 3.17Å; N895-Q899 PolarHBondContact O-N 2.97Å
896	Q	63.1	Low	55.6	Low	102 Å²	102	73.2 Å²	73.2	48%	0.477	36%	0.362	S	S	.	.	H	α-helix	trans	-64.6	-38.6	173.3	-73.5	176.1	-4.5	0	0	112.4	I892 F893 F900	I892-Q896 WeakPolarHBondContact O-CG 3.29Å; I892-Q896 PolarHBondContact O-N 3.21Å; F893-Q896 CarbonylContact O-C 3.55Å; F893-Q896 PolarHBondContact O-N 2.98Å; Q896-F900 WeakPolarHBondContact O-CB 3.44Å; Q896-F900 PolarHBondContact O-N 3.19Å
897	I	64.4	Low	56.8	Low	2 Å²	2	66.8 Å²	66.8	1%	0.01	34%	0.339	C	S	.	.	H	α-helix	trans	-60.8	-52.5	172	-74.3	160.8	0	0	0	109.3	L844 I847 V851 F893 L894 Q899 F900 V901 L951	L844-I897 HydrophobicContact CD1-CD1 3.83Å; I847-I897 HydrophobicContact CG2-CG1 4.24Å; I847-I897 HydrophobicContact CG2-CG2 3.91Å; V851-I897 HydrophobicContact CG2-CG1 4.26Å; F893-I897 HydrophobicContact CD1-CD1 3.72Å; F893-I897 HydrophobicContact CD2-CD1 4.13Å; F893-I897 HydrophobicContact CD2-CG1 4.14Å; F893-I897 HydrophobicContact CE1-CD1 3.39Å; F893-I897 HydrophobicContact CE1-CG1 4.31Å; F893-I897 HydrophobicContact CE2-CD1 3.82Å; F893-I897 HydrophobicContact CE2-CG1 3.8Å; F893-I897 HydrophobicContact CG-CD1 4.07Å; F893-I897 HydrophobicContact CG-CG1 4.5Å; F893-I897 HydrophobicContact CZ-CD1 3.43Å; F893-I897 VanDerWaalsContact CZ-CD1 3.43Å; F893-I897 HydrophobicContact CZ-CG1 3.89Å; F893-I897 WeakPolarHBondContact O-CB 3.47Å; F893-I897 VanDerWaalsContact O-CG1 3.24Å; F893-I897 WeakPolarHBondContact O-CG1 3.01Å; F893-I897 PolarHBondContact O-N 3.31Å; L894-I897 PolarHBondContact O-N 3.33Å; I897-Q899 VanDerWaalsContact C-N 3.34Å; I897-Q899 PolarHBondContact O-N 3Å; I897-F900 PolarHBondContact O-N 3.43Å; I897-V901 HydrophobicContact CG2-CG2 3.76Å; I897-V901 WeakPolarHBondContact O-CA 3.28Å; I897-V901 WeakPolarHBondContact O-CB 3.17Å; I897-V901 WeakPolarHBondContact O-CG2 3.07Å; I897-V901 PolarHBondContact O-N 3.41Å; I897-L951 HydrophobicContact CB-CD1 4.32Å; I897-L951 HydrophobicContact CD1-CD1 4.3Å; I897-L951 HydrophobicContact CG2-CD1 3.71Å
898	L	62.7	Low	58.2	Low	66 Å²	66	64.5 Å²	64.5	35%	0.346	33%	0.325	S	S	.	.	H	α-helix	trans	-58	-45.7	-179	-75.3	163.8	0	0	0	111.6	L894 N895 S902 L951	L894-L898 WeakPolarHBondContact O-CB 3.38Å; L894-L898 WeakPolarHBondContact O-CG 3.09Å; L894-L898 PolarHBondContact O-N 3.23Å; N895-L898 PolarHBondContact O-N 3.34Å; L898-S902 WeakPolarHBondContact O-CB 3.47Å; L898-S902 PolarHBondContact O-N 2.94Å; L898-S902 PolarHBondContact O-OG 3.25Å; L898-L951 HydrophobicContact CD2-CD2 3.64Å; L898-L951 HydrophobicContact CG-CD2 4.13Å
899	Q	62.8	Low	59.2	Low	117 Å²	117	67.9 Å²	67.9	55%	0.547	33%	0.332	S	S	.	.	H	α-helix	trans	-64.2	-47.8	175.8	-70.3	178.9	10.3	0	0	112.2	N895 I897 S902 R903	N895-Q899 WeakPolarHBondContact O-CB 3.33Å; N895-Q899 VanDerWaalsContact O-CG 3.31Å; N895-Q899 WeakPolarHBondContact O-CG 3.17Å; N895-Q899 PolarHBondContact O-N 2.97Å; I897-Q899 VanDerWaalsContact C-N 3.34Å; I897-Q899 PolarHBondContact O-N 3Å; Q899-S902 PolarHBondContact O-N 2.65Å; Q899-S902 PolarHBondContact O-OG 2.85Å; Q899-R903 PolarHBondContact O-N 3.12Å
900	F	64.5	Low	60.4	Low	24 Å²	24	59.8 Å²	59.8	11%	0.105	30%	0.301	C	S	.	.	H	α-helix	trans	-64.3	-42.4	178.5	177.5	-90.6	0	0	0	112.5	F850 V851 Q896 I897 S902 I906	F850-F900 HydrophobicContact CB-CE1 3.59Å; F850-F900 HydrophobicContact CB-CZ 3.68Å; F850-F900 WeakPolarHBondContact O-CE2 3.44Å; F850-F900 WeakPolarHBondContact O-CZ 3.5Å; V851-F900 HydrophobicContact CB-CD1 4.33Å; V851-F900 HydrophobicContact CB-CD2 4.43Å; V851-F900 HydrophobicContact CB-CG 4.3Å; V851-F900 HydrophobicContact CG2-CB 4.08Å; V851-F900 HydrophobicContact CG2-CD1 3.49Å; V851-F900 VanDerWaalsContact CG2-CD1 3.49Å; V851-F900 HydrophobicContact CG2-CD2 4.32Å; V851-F900 HydrophobicContact CG2-CE1 3.96Å; V851-F900 HydrophobicContact CG2-CG 3.71Å; Q896-F900 WeakPolarHBondContact O-CB 3.44Å; Q896-F900 PolarHBondContact O-N 3.19Å; I897-F900 PolarHBondContact O-N 3.43Å; F900-S902 VanDerWaalsContact C-N 3.28Å; F900-S902 PolarHBondContact O-N 3.4Å; F900-I906 HydrophobicContact CD1-CG2 3.88Å; F900-I906 HydrophobicContact CD2-CD1 3.71Å; F900-I906 HydrophobicContact CD2-CG2 3.97Å; F900-I906 HydrophobicContact CE1-CG2 3.37Å; F900-I906 HydrophobicContact CE2-CD1 3.67Å; F900-I906 HydrophobicContact CE2-CG1 4.49Å; F900-I906 HydrophobicContact CE2-CG2 3.48Å; F900-I906 VanDerWaalsContact CE2-CG2 3.48Å; F900-I906 HydrophobicContact CG-CD1 4.48Å; F900-I906 HydrophobicContact CG-CG2 4.14Å; F900-I906 HydrophobicContact CZ-CD1 4.42Å; F900-I906 HydrophobicContact CZ-CG2 3.13Å
901	V	62.8	Low	61.2	Low	22 Å²	22	58.1 Å²	58.1	13%	0.133	29%	0.285	C	S	.	.	H	α-helix	trans	-63.9	-36	178.3	163.6	0	0	0	0	110.6	I847 I897 K907 R910 I919	I847-V901 HydrophobicContact CG2-CG2 4.24Å; I897-V901 HydrophobicContact CG2-CG2 3.76Å; I897-V901 WeakPolarHBondContact O-CA 3.28Å; I897-V901 WeakPolarHBondContact O-CB 3.17Å; I897-V901 WeakPolarHBondContact O-CG2 3.07Å; I897-V901 PolarHBondContact O-N 3.41Å; V901-K907 WeakPolarHBondContact O-CE 3.35Å; V901-K907 WeakPolarHBondContact O-CG 3.39Å; V901-R910 PolarHBondContact O-NH2 2.73Å; V901-R910 VanDerWaalsContact O-NH2 3.08Å; V901-I919 HydrophobicContact CB-CD1 4.37Å; V901-I919 HydrophobicContact CG1-CD1 3.7Å; V901-I919 HydrophobicContact CG1-CG2 4.39Å; V901-I919 HydrophobicContact CG2-CD1 3.66Å
902	S	60.8	Low	62	Low	69 Å²	69	59.9 Å²	59.9	48%	0.483	29%	0.293	S	S	.	.	H	α-helix	trans	-72.1	-33.4	-177.2	72.4	0	0	0	0	114.8	L898 Q899 F900 K907	L898-S902 WeakPolarHBondContact O-CB 3.47Å; L898-S902 PolarHBondContact O-N 2.94Å; L898-S902 PolarHBondContact O-OG 3.25Å; Q899-S902 PolarHBondContact O-N 2.65Å; Q899-S902 PolarHBondContact O-OG 2.85Å; F900-S902 VanDerWaalsContact C-N 3.28Å; F900-S902 PolarHBondContact O-N 3.4Å; S902-K907 VanDerWaalsContact O-CE 3.24Å; S902-K907 WeakPolarHBondContact O-CE 3.49Å; S902-K907 PolarHBondContact O-NZ 2.93Å
903	R	66.1	Low	62.9	Low	161 Å²	161	57.5 Å²	57.5	61%	0.608	28%	0.283	S	S	*	.			trans	-59.6	130.7	-176.9	-73.4	-179.3	-178.2	-164.6	4	112.8	Q899 I906 K907	Q899-R903 PolarHBondContact O-N 3.12Å; R903-I906 HydrophobicContact CB-CB 4.11Å; R903-I906 HydrophobicContact CB-CD1 3.94Å; R903-I906 HydrophobicContact CB-CG1 4.01Å; R903-I906 HydrophobicContact CG-CD1 4.43Å; R903-I906 PolarHBondContact O-N 2.95Å; R903-K907 WeakPolarHBondContact O-CG 3.29Å; R903-K907 PolarHBondContact O-N 2.88Å
904	V	57.1	Low	63.5	Low	52 Å²	52	63.1 Å²	63.1	32%	0.315	32%	0.315	S	S	.	.	H	α-helix	trans	-63.3	-53.4	-170.6	174.9	0	0	0	0	113	I906 K907 Y908 R1096 A1097	V904-I906 PolarHBondContact O-N 3.48Å; V904-K907 WeakPolarHBondContact O-CB 3.44Å; V904-K907 PolarHBondContact O-N 3.41Å; V904-K907 VanDerWaalsContact O-N 3.12Å; V904-Y908 PolarHBondContact O-N 2.87Å; V904-R1096 HydrophobicContact CG1-CB 4.3Å; V904-A1097 HydrophobicContact CG1-CB 4.27Å
905	D	59.9	Low	64.3	Low	97 Å²	97	65.1 Å²	65.1	52%	0.519	32%	0.324	S	S	.	.	H	α-helix	trans	-66.6	-27.6	-175.8	-51.7	-82.6	0	0	0	112.2	Y908 K909	D905-Y908 PolarHBondContact O-N 3.42Å; D905-K909 WeakPolarHBondContact O-CB 3.31Å; D905-K909 WeakPolarHBondContact O-CG 3.46Å; D905-K909 PolarHBondContact O-N 2.89Å
906	I	63.4	Low	65.6	Low	36 Å²	36	63.4 Å²	63.4	19%	0.185	31%	0.312	C	S	.	.	H	α-helix	trans	-73.4	-41.6	174.7	-59	-171	0	0	0	110.8	F900 R903 V904 Y908 K909 R910	F900-I906 HydrophobicContact CD1-CG2 3.88Å; F900-I906 HydrophobicContact CD2-CD1 3.71Å; F900-I906 HydrophobicContact CD2-CG2 3.97Å; F900-I906 HydrophobicContact CE1-CG2 3.37Å; F900-I906 HydrophobicContact CE2-CD1 3.67Å; F900-I906 HydrophobicContact CE2-CG1 4.49Å; F900-I906 HydrophobicContact CE2-CG2 3.48Å; F900-I906 VanDerWaalsContact CE2-CG2 3.48Å; F900-I906 HydrophobicContact CG-CD1 4.48Å; F900-I906 HydrophobicContact CG-CG2 4.14Å; F900-I906 HydrophobicContact CZ-CD1 4.42Å; F900-I906 HydrophobicContact CZ-CG2 3.13Å; R903-I906 HydrophobicContact CB-CB 4.11Å; R903-I906 HydrophobicContact CB-CD1 3.94Å; R903-I906 HydrophobicContact CB-CG1 4.01Å; R903-I906 HydrophobicContact CG-CD1 4.43Å; R903-I906 PolarHBondContact O-N 2.95Å; V904-I906 PolarHBondContact O-N 3.48Å; I906-Y908 VanDerWaalsContact C-N 3.34Å; I906-K909 PolarHBondContact O-N 3.28Å; I906-R910 VanDerWaalsContact O-CB 3.32Å; I906-R910 WeakPolarHBondContact O-CB 3.31Å; I906-R910 PolarHBondContact O-N 3.2Å
907	K	63.8	Low	66.7	Low	45 Å²	45	58.5 Å²	58.5	20%	0.196	29%	0.289	C	S	.	.	H	α-helix	trans	-57.1	-47.9	168.3	-71.2	174.9	179.3	178.4	0	111	V901 S902 R903 V904 K909 R910 L911 K1100	V901-K907 WeakPolarHBondContact O-CE 3.35Å; V901-K907 WeakPolarHBondContact O-CG 3.39Å; S902-K907 VanDerWaalsContact O-CE 3.24Å; S902-K907 WeakPolarHBondContact O-CE 3.49Å; S902-K907 PolarHBondContact O-NZ 2.93Å; R903-K907 WeakPolarHBondContact O-CG 3.29Å; R903-K907 PolarHBondContact O-N 2.88Å; V904-K907 WeakPolarHBondContact O-CB 3.44Å; V904-K907 PolarHBondContact O-N 3.41Å; V904-K907 VanDerWaalsContact O-N 3.12Å; K907-K909 PolarHBondContact O-N 3.37Å; K907-R910 WeakPolarHBondContact O-CB 3.38Å; K907-R910 PolarHBondContact O-N 2.91Å; K907-R910 VanDerWaalsContact O-N 3.17Å; K907-L911 WeakPolarHBondContact O-CB 3.35Å; K907-L911 PolarHBondContact O-N 2.68Å; K907-K1100 HydrophobicContact CD-CB 4.15Å
908	Y	61.5	Low	67.8	Low	46 Å²	46	58.5 Å²	58.5	18%	0.18	29%	0.289	C	S	.	.	H	α-helix	trans	-60.5	-47.1	-179.8	179.8	-97.8	0	0	0	112.1	V904 D905 I906 R910 N912 R1096 E1099	V904-Y908 PolarHBondContact O-N 2.87Å; D905-Y908 PolarHBondContact O-N 3.42Å; I906-Y908 VanDerWaalsContact C-N 3.34Å; Y908-R910 VanDerWaalsContact C-N 3.35Å; Y908-R910 PolarHBondContact O-N 3.16Å; Y908-N912 WeakPolarHBondContact O-CB 3.46Å; Y908-N912 PolarHBondContact O-N 3.47Å; Y908-N912 PolarHBondContact O-ND2 3.23Å; Y908-R1096 HydrophobicContact CD2-CB 4.37Å; Y908-R1096 HydrophobicContact CD2-CG 3.66Å; Y908-R1096 HydrophobicContact CE2-CG 3.9Å; Y908-R1096 HydrophobicContact CG-CG 4.09Å; Y908-E1099 WeakPolarHBondContact CD2-OE1 3.44Å; Y908-E1099 WeakPolarHBondContact CD2-OE2 3.37Å
909	K	64.8	Low	68.7	Low	130 Å²	130	56.8 Å²	56.8	57%	0.565	28%	0.28	S	S	*	.	H	α-helix	trans	-58.6	-42.8	173.1	-75.6	179.8	-179.8	-178.1	0	111.9	D905 I906 K907 S913	D905-K909 WeakPolarHBondContact O-CB 3.31Å; D905-K909 WeakPolarHBondContact O-CG 3.46Å; D905-K909 PolarHBondContact O-N 2.89Å; I906-K909 PolarHBondContact O-N 3.28Å; K907-K909 PolarHBondContact O-N 3.37Å; K909-S913 WeakPolarHBondContact O-CB 3.33Å; K909-S913 PolarHBondContact O-N 3.39Å
910	R	71.3	Confident	69.4	Low	3 Å²	3	52.1 Å²	52.1	1%	0.011	26%	0.258	C	S	.	.	H	α-helix	trans	-65.7	-49.3	179.8	-164.7	-159.9	-41.7	131	5.3	112.7	F850 V901 I906 K907 Y908 N912 S913 V917 E1103	F850-R910 HydrophobicContact CD1-CG 4.44Å; F850-R910 HydrophobicContact CD2-CG 3.84Å; F850-R910 HydrophobicContact CE1-CG 4.37Å; F850-R910 HydrophobicContact CE2-CG 3.78Å; F850-R910 HydrophobicContact CG-CG 4.19Å; F850-R910 HydrophobicContact CZ-CG 4.06Å; V901-R910 PolarHBondContact O-NH2 2.73Å; V901-R910 VanDerWaalsContact O-NH2 3.08Å; I906-R910 VanDerWaalsContact O-CB 3.32Å; I906-R910 WeakPolarHBondContact O-CB 3.31Å; I906-R910 PolarHBondContact O-N 3.2Å; K907-R910 WeakPolarHBondContact O-CB 3.38Å; K907-R910 PolarHBondContact O-N 2.91Å; K907-R910 VanDerWaalsContact O-N 3.17Å; Y908-R910 VanDerWaalsContact C-N 3.35Å; Y908-R910 PolarHBondContact O-N 3.16Å; R910-N912 PolarHBondContact O-N 2.99Å; R910-S913 WeakPolarHBondContact O-CB 3.38Å; R910-S913 PolarHBondContact O-N 3.42Å; R910-S913 PolarHBondContact O-OG 3.49Å; R910-V917 VanDerWaalsContact CD-CG2 3.5Å; R910-V917 HydrophobicContact CG-CG2 4.09Å; R910-E1103 IonicContact NH1-OE1 3.1Å
911	L	62.8	Low	69.4	Low	18 Å²	18	56.6 Å²	56.6	9%	0.094	28%	0.283	C	S	.	.	H	α-helix	trans	-63.8	-29.6	-177	-160.8	77.9	0	0	0	112	K907 R916 E1099 E1103	K907-L911 WeakPolarHBondContact O-CB 3.35Å; K907-L911 PolarHBondContact O-N 2.68Å; L911-R916 WeakPolarHBondContact O-CD 3.23Å; L911-R916 PolarHBondContact O-NE 3.38Å; L911-E1099 HydrophobicContact CD2-CG 3.9Å; L911-E1099 WeakPolarHBondContact CD2-OE1 2.99Å; L911-E1103 HydrophobicContact CD1-CG 4.17Å
912	N	64.3	Low	68.6	Low	58 Å²	58	57.8 Å²	57.8	31%	0.31	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.5	24.1	-178.2	-65.5	-78.9	0	0	0	113.1	Y908 R910 K1069 E1099	Y908-N912 WeakPolarHBondContact O-CB 3.46Å; Y908-N912 PolarHBondContact O-N 3.47Å; Y908-N912 PolarHBondContact O-ND2 3.23Å; R910-N912 PolarHBondContact O-N 2.99Å; N912-K1069 WeakPolarHBondContact OD1-CE 3.49Å; N912-K1069 PolarHBondContact OD1-NZ 2.69Å; N912-E1099 PolarHBondContact ND2-OE1 2.93Å
913	S	73.6	Confident	67.4	Low	29 Å²	29	58.9 Å²	58.9	20%	0.203	30%	0.298	C	S	.	.	S	Bend	trans	-107.7	160.4	-178.3	72.5	0	0	0	0	114	F850 K909 R910 E915 R916	F850-S913 VanDerWaalsContact CZ-OG 3.22Å; F850-S913 WeakPolarHBondContact CZ-OG 3.46Å; K909-S913 WeakPolarHBondContact O-CB 3.33Å; K909-S913 PolarHBondContact O-N 3.39Å; R910-S913 WeakPolarHBondContact O-CB 3.38Å; R910-S913 PolarHBondContact O-N 3.42Å; R910-S913 PolarHBondContact O-OG 3.49Å; S913-E915 PolarHBondContact O-N 2.85Å; S913-R916 WeakPolarHBondContact O-CB 3.5Å; S913-R916 PolarHBondContact O-N 3.3Å; S913-R916 PolarHBondContact OG-N 3.09Å
914	N	68.9	Low	65.7	Low	158 Å²	158	56.9 Å²	56.9	85%	0.845	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71	-13.9	175.6	-66.1	-4	0	0	0	113.6	N783	N783-N914 PolarHBondContact ND2-O 2.92Å
915	E	75.8	Confident	64.2	Low	63 Å²	63	57.3 Å²	57.3	29%	0.294	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.2	34	171.1	-66	-165.9	131.9	0	0	111.4	K849 F850 S913 V917	K849-E915 WeakPolarHBondContact CD-OE2 3.46Å; K849-E915 IonicContact NZ-OE1 3.42Å; K849-E915 PolarHBondContact NZ-OE1 2.85Å; K849-E915 IonicContact NZ-OE2 2.82Å; F850-E915 HydrophobicContact CE2-CB 4.3Å; F850-E915 WeakPolarHBondContact CE2-O 3.31Å; F850-E915 HydrophobicContact CZ-CB 3.83Å; F850-E915 WeakPolarHBondContact CZ-O 3.39Å; S913-E915 PolarHBondContact O-N 2.85Å; E915-V917 PolarHBondContact O-N 2.67Å
916	R	83.9	Confident	63	Low	33 Å²	33	59.1 Å²	59.1	13%	0.125	33%	0.332	C	S	.	.			trans	-48	134.5	-177	-176.3	177.9	-176.6	-105.3	1.8	112.6	N783 C797 D798 L911 S913 Y1109	N783-R916 PolarHBondContact N-O 2.97Å; N783-R916 PolarHBondContact ND2-N 3.48Å; C797-R916 HydrophobicContact CB-CB 4.34Å; C797-R916 HydrophobicContact CB-CG 4.09Å; C797-R916 PolarHBondContact O-NH1 2.92Å; C797-R916 VanDerWaalsContact O-NH1 3.11Å; C797-R916 PolarHBondContact SG-NH1 3.07Å; D798-R916 VanDerWaalsContact CG-NH1 3.27Å; D798-R916 IonicContact OD2-CZ 3.79Å; D798-R916 IonicContact OD2-NH1 3.68Å; D798-R916 PolarHBondContact OD2-NH1 3.37Å; D798-R916 IonicContact OD2-NH2 3.82Å; D798-R916 PolarHBondContact OD2-NH2 3.17Å; L911-R916 WeakPolarHBondContact O-CD 3.23Å; L911-R916 PolarHBondContact O-NE 3.38Å; S913-R916 WeakPolarHBondContact O-CB 3.5Å; S913-R916 PolarHBondContact O-N 3.3Å; S913-R916 PolarHBondContact OG-N 3.09Å; R916-Y1109 PolarHBondContact NH2-OH 2.88Å
917	V	86.2	Confident	61.5	Low	0 Å²	0	65 Å²	65	0%	0	36%	0.363	C	S	.	.	B	Isolated β-bridge	trans	-131.7	143.4	167.9	-58.6	0	0	0	0	109.5	N781 L782 L843 K846 I847 R910 E915	N781-V917 CarbonylContact O-C 3.58Å; N781-V917 VanDerWaalsContact O-CA 3.31Å; N781-V917 WeakPolarHBondContact O-CA 3.32Å; L782-V917 HydrophobicContact CB-CG1 3.8Å; L843-V917 HydrophobicContact CD1-CB 3.67Å; L843-V917 HydrophobicContact CD1-CG1 3.72Å; L843-V917 HydrophobicContact CD1-CG2 4.22Å; K846-V917 HydrophobicContact CB-CG1 4.08Å; I847-V917 HydrophobicContact CG1-CG2 4.05Å; R910-V917 VanDerWaalsContact CD-CG2 3.5Å; R910-V917 HydrophobicContact CG-CG2 4.09Å; E915-V917 PolarHBondContact O-N 2.67Å
918	R	86.6	Confident	59.7	Low	2 Å²	2	66.7 Å²	66.7	1%	0.008	39%	0.386	C	S	.	.			trans	-101.9	129.9	174.4	167.8	178.2	172.7	-129.4	10.5	108.1	R779 N781 D798 E1103 I1105 E1142	R779-R918 VanDerWaalsContact CZ-CZ 3.48Å; N781-R918 HydrophobicContact CB-CB 4.21Å; N781-R918 PolarHBondContact O-N 3.35Å; N781-R918 WeakPolarHBondContact OD1-CD 3.46Å; N781-R918 PolarHBondContact OD1-NH1 3.32Å; D798-R918 WeakPolarHBondContact OD1-CD 3.45Å; R918-E1103 HydrophobicContact CG-CB 4.3Å; R918-E1103 PolarHBondContact NE-O 3.22Å; R918-E1103 PolarHBondContact NH2-O 2.92Å; R918-I1105 PolarHBondContact NH2-O 2.95Å; R918-E1142 IonicContact CZ-OE1 2.92Å; R918-E1142 IonicContact CZ-OE2 3.23Å; R918-E1142 IonicContact NH1-OE1 3.31Å; R918-E1142 PolarHBondContact NH1-OE1 2.98Å; R918-E1142 IonicContact NH1-OE2 2.99Å; R918-E1142 PolarHBondContact NH1-OE2 3.4Å; R918-E1142 VanDerWaalsContact NH2-CD 3.34Å; R918-E1142 IonicContact NH2-OE1 2.76Å; R918-E1142 PolarHBondContact NH2-OE1 3.06Å; R918-E1142 IonicContact NH2-OE2 3.24Å; R918-E1142 PolarHBondContact NH2-OE2 2.9Å
919	I	82.3	Confident	58.3	Low	30 Å²	30	72.1 Å²	72.1	15%	0.154	41%	0.406	C	S	.	.			trans	-109.2	115.8	-179.8	-59.6	-178.3	0	0	0	110.1	I847 V901 E1103	I847-I919 HydrophobicContact CD1-CD1 3.92Å; I847-I919 HydrophobicContact CD1-CG1 4.36Å; I847-I919 HydrophobicContact CG1-CD1 4.24Å; V901-I919 HydrophobicContact CB-CD1 4.37Å; V901-I919 HydrophobicContact CG1-CD1 3.7Å; V901-I919 HydrophobicContact CG1-CG2 4.39Å; V901-I919 HydrophobicContact CG2-CD1 3.66Å; I919-E1103 PolarHBondContact N-OE1 3.45Å
920	I	77.4	Confident	56.7	Low	18 Å²	18	75 Å²	75	9%	0.092	42%	0.421	C	S	.	.			trans	-92.4	126.8	176.1	-60	169.1	0	0	0	108	N781 I954 S957 L1145	N781-I920 WeakPolarHBondContact ND2-CD1 3.45Å; I920-I954 HydrophobicContact CB-CD1 4.37Å; I920-I954 HydrophobicContact CD1-CB 4.29Å; I920-I954 HydrophobicContact CD1-CG2 4.18Å; I920-I954 HydrophobicContact CG2-CD1 4.1Å; I920-S957 WeakPolarHBondContact CD1-OG 3.33Å; I920-L1145 HydrophobicContact CD1-CD1 4.31Å; I920-L1145 HydrophobicContact CG2-CD1 4.19Å; I920-L1145 HydrophobicContact CG2-CD2 3.81Å
921	N	63.6	Low	54.7	Low	118 Å²	118	79 Å²	79	63%	0.631	45%	0.449	S	S	*	.			trans	-105.9	96.6	-173.8	-167.9	94.2	0	0	0	110.9	C923	N921-C923 VanDerWaalsContact C-N 3.28Å; N921-C923 PolarHBondContact O-N 3.4Å
922	T	45.7	Very low	53.5	Low	48 Å²	48	80.8 Å²	80.8	29%	0.294	46%	0.457	S	S	.	.			trans	-75.8	-1.5	-169.6	54.7	0	0	0	0	115.7	S924 A925 N952 I954	T922-S924 PolarHBondContact O-N 3.43Å; T922-A925 PolarHBondContact O-N 3.11Å; T922-N952 HydrophobicContact CG2-CB 4.25Å; T922-I954 HydrophobicContact CG2-CD1 3.8Å
923	C	36.5	Very low	52.2	Low	92 Å²	92	84 Å²	84	62%	0.622	47%	0.47	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.6	15	-174.3	-48.2	0	0	0	0	116.1	N921	N921-C923 VanDerWaalsContact C-N 3.28Å; N921-C923 PolarHBondContact O-N 3.4Å
924	S	30.3	Very low	49.9	Very low	119 Å²	119	89.4 Å²	89.4	83%	0.832	50%	0.496	S	S	*	.	T	Hydrogen-bonded Turn	trans	-157.8	56.6	174.8	-69.4	0	0	0	0	111.5	T922	T922-S924 PolarHBondContact O-N 3.43Å
925	A	26.4	Very low	48	Very low	61 Å²	61	88.8 Å²	88.8	50%	0.504	49%	0.492	S	S	.	.			trans	-149	118.3	162	0	0	0	0	0	109.8	T922	T922-A925 PolarHBondContact O-N 3.11Å
926	T	33.6	Very low	45.7	Very low	135 Å²	135	94.2 Å²	94.2	83%	0.828	51%	0.51	S	S	*	.			trans	-73.7	158	159.6	42.1	0	0	0	0	109.2
927	L	32	Very low	42.9	Very low	158 Å²	158	100.1 Å²	100.1	83%	0.827	54%	0.538	S	S	*	.			trans	69.8	70.4	-174.5	-53.5	172.4	0	0	0	114.9
928	A	27.2	Very low	40.2	Very low	82 Å²	82	108 Å²	108	68%	0.678	58%	0.576	S	S	*	*			trans	-65.4	137.8	145.3	0	0	0	0	0	108.9
929	R	32.1	Very low	37.4	Very low	159 Å²	159	114.5 Å²	114.5	60%	0.6	61%	0.61	S	S	*	*			trans	-60.6	155.8	162.2	-74.6	171.9	75.8	178.5	2.6	109	S931 D1144	R929-S931 PolarHBondContact O-N 2.93Å; R929-D1144 WeakPolarHBondContact CD-OD1 3.27Å; R929-D1144 IonicContact NH1-OD1 3.89Å
930	Q	29.9	Very low	35.5	Very low	190 Å²	190	118 Å²	118	89%	0.888	64%	0.644	S	S	*	*	S	Bend	trans	-74.2	43.2	-168.4	-66.5	174.7	-48.4	0	0	114.7	F932	Q930-F932 VanDerWaalsContact C-N 3.3Å; Q930-F932 PolarHBondContact O-N 2.95Å
931	S	30.2	Very low	33.5	Very low	87 Å²	87	121.9 Å²	121.9	61%	0.608	68%	0.679	S	S	*	*	S	Bend	trans	-78.1	78.4	169.7	61.9	0	0	0	0	111	R929 E933	R929-S931 PolarHBondContact O-N 2.93Å; S931-E933 PolarHBondContact O-N 2.93Å
932	F	37.6	Very low	32.1	Very low	56 Å²	56	120.9 Å²	120.9	25%	0.246	67%	0.673	C	S	.	*	S	Bend	trans	62.2	26.7	155.3	-121.8	-53.3	0	0	0	121.3	V719 L726 W738 T739 Q930	V719-F932 HydrophobicContact CG1-CZ 4.32Å; L726-F932 HydrophobicContact CD1-CE1 4.44Å; L726-F932 HydrophobicContact CD1-CE2 4.24Å; L726-F932 HydrophobicContact CD1-CZ 3.7Å; W738-F932 AromaticContact CE3-CE2 3.92Å; W738-F932 HydrophobicContact CE3-CE2 3.92Å; W738-F932 HydrophobicContact CE3-CZ 4.12Å; W738-F932 HydrophobicContact CZ3-CE1 4.11Å; W738-F932 AromaticContact CZ3-CE2 3.88Å; W738-F932 HydrophobicContact CZ3-CE2 3.88Å; W738-F932 AromaticContact CZ3-CZ 3.6Å; W738-F932 HydrophobicContact CZ3-CZ 3.6Å; T739-F932 WeakPolarHBondContact OG1-CE2 3.42Å; Q930-F932 VanDerWaalsContact C-N 3.3Å; Q930-F932 PolarHBondContact O-N 2.95Å
933	E	36.8	Very low	31.7	Very low	125 Å²	125	121.5 Å²	121.5	58%	0.584	68%	0.678	S	S	*	*			trans	-152.5	99.6	156	-135.9	-179.7	-83.2	0	0	113.7	S931 R949	S931-E933 PolarHBondContact O-N 2.93Å; E933-R949 IonicContact OE2-CZ 3.75Å; E933-R949 VanDerWaalsContact OE2-CZ 3.26Å; E933-R949 IonicContact OE2-NE 2.61Å; E933-R949 PolarHBondContact OE2-NE 3.33Å; E933-R949 IonicContact OE2-NH2 2.64Å; E933-R949 PolarHBondContact OE2-NH2 2.85Å
934	L	25.7	Very low	31.6	Very low	144 Å²	144	122 Å²	122	75%	0.754	68%	0.675	S	S	*	*			trans	-161.1	83.4	170.3	-131.8	175.9	0	0	0	114.3
935	L	28	Very low	31.8	Very low	145 Å²	145	120.5 Å²	120.5	76%	0.759	66%	0.657	S	S	*	*			trans	-175.3	105.4	139.8	-107.4	168.1	0	0	0	112.1
936	R	28.6	Very low	32.2	Very low	177 Å²	177	124.4 Å²	124.4	67%	0.668	67%	0.665	S	S	*	*			trans	-148.1	108.1	142.7	-81.9	-152.3	71.3	179.5	-2.9	108.1	D939	R936-D939 PolarHBondContact NH2-O 3.02Å
937	Q	25	Very low	32.3	Very low	156 Å²	156	120.1 Å²	120.1	73%	0.729	64%	0.637	S	S	*	*			trans	-110.4	136.2	155.8	-176.6	165.4	-13.9	0	0	107
938	E	30	Very low	32.5	Very low	167 Å²	167	116.2 Å²	116.2	78%	0.78	62%	0.623	S	S	*	*			trans	52	89	172.3	-72.7	161.2	-140.8	0	0	116.6
939	D	27	Very low	33	Very low	137 Å²	137	118.7 Å²	118.7	73%	0.733	62%	0.615	S	S	*	*				-151.6	124.7	119.7	-133.2	-17.1	0	0	0	109	R936	R936-D939 PolarHBondContact NH2-O 3.02Å
940	A	41.2	Very low	33.5	Very low	104 Å²	104	113.1 Å²	113.1	86%	0.86	60%	0.6	S	S	*	*			trans	-102.2	99.1	-156.5	0	0	0	0	0	114.2
941	A	37	Very low	34.6	Very low	100 Å²	100	106 Å²	106	83%	0.826	57%	0.567	S	S	*	*			trans	-174.7	60.9	157.8	0	0	0	0	0	115.2
942	D	33.4	Very low	36.3	Very low	96 Å²	96	106.1 Å²	106.1	51%	0.513	56%	0.561	S	S	.	*			trans	-158.8	105.2	158.7	-171.3	-3	0	0	0	113	D944	D942-D944 PolarHBondContact OD1-N 2.92Å
943	P	37.8	Very low	38.4	Very low	62 Å²	62	104.3 Å²	104.3	40%	0.403	55%	0.554	S	S	.	*	S	Bend	trans	-87.9	-13.3	177.1	34.1	-32.5	0	0	0	114.6	Y199 N945	Y199-P943 WeakPolarHBondContact OH-CG 3.35Å; P943-N945 VanDerWaalsContact C-N 3.34Å
944	D	33.7	Very low	40.9	Very low	102 Å²	102	100.8 Å²	100.8	55%	0.545	54%	0.539	S	S	.	.	H	α-helix	trans	-77.9	-24.3	-178.9	-108.3	-13.5	0	0	0	111.4	D942	D942-D944 PolarHBondContact OD1-N 2.92Å
945	N	34.5	Very low	44	Very low	88 Å²	88	94 Å²	94	47%	0.471	50%	0.503	S	S	.	.	H	α-helix	trans	-82.7	-16.9	-179.6	-153.8	5.9	0	0	0	114.1	P943 L947 S948	P943-N945 VanDerWaalsContact C-N 3.34Å; N945-L947 VanDerWaalsContact C-N 3.32Å; N945-S948 WeakPolarHBondContact O-CB 3.46Å; N945-S948 PolarHBondContact O-N 2.97Å; N945-S948 PolarHBondContact O-OG 3.17Å; N945-S948 PolarHBondContact OD1-OG 3.34Å
946	E	34.5	Very low	47.1	Very low	142 Å²	142	87.5 Å²	87.5	66%	0.664	47%	0.469	S	S	*	.	H	α-helix	trans	-66.1	-35.1	172.3	-66.6	-166.7	123.2	0	0	112	S948 R949 S950	E946-S948 VanDerWaalsContact C-N 3.27Å; E946-S948 PolarHBondContact O-N 3.23Å; E946-R949 PolarHBondContact O-N 3.5Å; E946-R949 VanDerWaalsContact O-N 3.11Å; E946-S950 PolarHBondContact O-N 2.89Å; E946-S950 VanDerWaalsContact O-N 3.14Å
947	L	36.5	Very low	50.2	Low	46 Å²	46	79.2 Å²	79.2	24%	0.241	44%	0.438	C	S	.	.	H	α-helix	trans	-62.8	-33.2	178.1	-80.4	161.7	0	0	0	112.2	L894 N945 R949 S950	L894-L947 HydrophobicContact CD1-CB 4.48Å; N945-L947 VanDerWaalsContact C-N 3.32Å; L947-R949 VanDerWaalsContact C-N 3.31Å; L947-R949 PolarHBondContact O-N 3.05Å; L947-S950 WeakPolarHBondContact O-CB 3.5Å; L947-S950 PolarHBondContact O-N 3.41Å; L947-S950 VanDerWaalsContact O-N 3.15Å; L947-S950 PolarHBondContact O-OG 3.33Å
948	S	35.9	Very low	53.5	Low	75 Å²	75	74.3 Å²	74.3	52%	0.524	42%	0.42	S	S	.	.	H	α-helix	trans	-57.9	-42.1	173	-48.9	0	0	0	0	112.1	N945 E946 S950	N945-S948 WeakPolarHBondContact O-CB 3.46Å; N945-S948 PolarHBondContact O-N 2.97Å; N945-S948 PolarHBondContact O-OG 3.17Å; N945-S948 PolarHBondContact OD1-OG 3.34Å; E946-S948 VanDerWaalsContact C-N 3.27Å; E946-S948 PolarHBondContact O-N 3.23Å; S948-S950 VanDerWaalsContact C-N 3.34Å
949	R	38.6	Very low	56.6	Low	135 Å²	135	66.8 Å²	66.8	51%	0.509	39%	0.385	S	S	.	.	H	α-helix	trans	-79.8	-10.7	178	-72.5	179.3	165.8	146.9	-1.8	114	E933 E946 L947 L951	E933-R949 IonicContact OE2-CZ 3.75Å; E933-R949 VanDerWaalsContact OE2-CZ 3.26Å; E933-R949 IonicContact OE2-NE 2.61Å; E933-R949 PolarHBondContact OE2-NE 3.33Å; E933-R949 IonicContact OE2-NH2 2.64Å; E933-R949 PolarHBondContact OE2-NH2 2.85Å; E946-R949 PolarHBondContact O-N 3.5Å; E946-R949 VanDerWaalsContact O-N 3.11Å; L947-R949 VanDerWaalsContact C-N 3.31Å; L947-R949 PolarHBondContact O-N 3.05Å; R949-L951 VanDerWaalsContact C-N 3.28Å; R949-L951 PolarHBondContact O-N 3.35Å
950	S	41.6	Very low	59.8	Low	42 Å²	42	62 Å²	62	29%	0.294	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.8	-17.4	-174.7	73.9	0	0	0	0	114.6	E946 L947 S948	E946-S950 PolarHBondContact O-N 2.89Å; E946-S950 VanDerWaalsContact O-N 3.14Å; L947-S950 WeakPolarHBondContact O-CB 3.5Å; L947-S950 PolarHBondContact O-N 3.41Å; L947-S950 VanDerWaalsContact O-N 3.15Å; L947-S950 PolarHBondContact O-OG 3.33Å; S948-S950 VanDerWaalsContact C-N 3.34Å
951	L	53.6	Low	62.3	Low	39 Å²	39	60 Å²	60	20%	0.204	34%	0.339	C	S	.	.			trans	-116.7	78.3	174.8	-68.9	-168.9	0	0	0	111.9	L894 I897 L898 R949 L953	L894-L951 HydrophobicContact CD2-CB 4.41Å; L894-L951 HydrophobicContact CD2-CD1 3.46Å; L894-L951 VanDerWaalsContact CD2-CD1 3.46Å; L894-L951 HydrophobicContact CD2-CG 3.98Å; I897-L951 HydrophobicContact CB-CD1 4.32Å; I897-L951 HydrophobicContact CD1-CD1 4.3Å; I897-L951 HydrophobicContact CG2-CD1 3.71Å; L898-L951 HydrophobicContact CD2-CD2 3.64Å; L898-L951 HydrophobicContact CG-CD2 4.13Å; R949-L951 VanDerWaalsContact C-N 3.28Å; R949-L951 PolarHBondContact O-N 3.35Å; L951-L953 HydrophobicContact CB-CG 4.36Å; L951-L953 PolarHBondContact O-N 3.02Å
952	N	64.8	Low	64.9	Low	90 Å²	90	57.4 Å²	57.4	48%	0.481	31%	0.31	S	S	.	.			trans	-67.6	78.9	163	-76.4	-5.2	0	0	0	110.1	T922 I954	T922-N952 HydrophobicContact CG2-CB 4.25Å; N952-I954 PolarHBondContact O-N 3.09Å
953	L	82	Confident	67.4	Low	18 Å²	18	61.6 Å²	61.6	9%	0.094	32%	0.319	C	S	.	.			trans	-70.1	112.4	174	-68.5	-178.7	0	0	0	109.2	Q840 L843 L844 I847 L951 P955	Q840-L953 HydrophobicContact CG-CB 3.96Å; Q840-L953 WeakPolarHBondContact CG-O 3.47Å; Q840-L953 PolarHBondContact NE2-O 3.41Å; L843-L953 HydrophobicContact CD2-CB 3.97Å; L843-L953 HydrophobicContact CD2-CD2 4.34Å; L843-L953 HydrophobicContact CG-CB 4.48Å; L843-L953 HydrophobicContact CG-CD1 4.49Å; L843-L953 HydrophobicContact CG-CD2 4.43Å; L844-L953 HydrophobicContact CB-CD1 3.77Å; L844-L953 HydrophobicContact CD1-CD1 3.94Å; L844-L953 HydrophobicContact CG-CD1 4.41Å; I847-L953 HydrophobicContact CD1-CD1 4.44Å; I847-L953 HydrophobicContact CD1-CD2 3.74Å; L951-L953 HydrophobicContact CB-CG 4.36Å; L951-L953 PolarHBondContact O-N 3.02Å; L953-P955 VanDerWaalsContact O-CD 3.23Å; L953-P955 WeakPolarHBondContact O-CD 3.41Å
954	I	88.9	Confident	69.6	Low	51 Å²	51	60.9 Å²	60.9	26%	0.262	31%	0.313	S	S	.	.			trans	-100.3	96.5	178.3	-61.6	168.5	0	0	0	108	N781 I920 T922 N952 Y956	N781-I954 WeakPolarHBondContact CB-O 3.46Å; N781-I954 PolarHBondContact ND2-O 2.9Å; I920-I954 HydrophobicContact CB-CD1 4.37Å; I920-I954 HydrophobicContact CD1-CB 4.29Å; I920-I954 HydrophobicContact CD1-CG2 4.18Å; I920-I954 HydrophobicContact CG2-CD1 4.1Å; T922-I954 HydrophobicContact CG2-CD1 3.8Å; N952-I954 PolarHBondContact O-N 3.09Å; I954-Y956 VanDerWaalsContact C-N 3.33Å; I954-Y956 WeakPolarHBondContact CG2-O 3.48Å
955	P	91.2	Very high	72	Confident	1 Å²	1	65.2 Å²	65.2	1%	0.006	33%	0.33	C	S	.	.	S	Bend	trans	-73.4	-27.5	179.2	32.7	-37.9	0	0	0	112.6	N781 L782 N836 A839 Q840 L843 L953	N781-P955 WeakPolarHBondContact CB-O 3.37Å; N781-P955 PolarHBondContact N-O 2.88Å; L782-P955 HydrophobicContact CD2-CB 3.75Å; L782-P955 WeakPolarHBondContact CD2-O 3.43Å; N836-P955 WeakPolarHBondContact OD1-CG 3.27Å; A839-P955 HydrophobicContact CB-CB 3.64Å; A839-P955 HydrophobicContact CB-CG 3.81Å; Q840-P955 HydrophobicContact CB-CG 4.1Å; L843-P955 HydrophobicContact CB-CB 4.46Å; L843-P955 HydrophobicContact CD2-CB 4.21Å; L953-P955 VanDerWaalsContact O-CD 3.23Å; L953-P955 WeakPolarHBondContact O-CD 3.41Å
956	Y	94.1	Very high	74.6	Confident	9 Å²	9	67.1 Å²	67.1	4%	0.035	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	122.2	179.6	-55.2	-42	0	0	0	108.5	I778 V780 L782 I784 W814 I833 P834 N836 A839 I954	I778-Y956 HydrophobicContact CD1-CD1 3.83Å; I778-Y956 HydrophobicContact CD1-CD2 4.09Å; I778-Y956 HydrophobicContact CD1-CE1 4.26Å; I778-Y956 HydrophobicContact CD1-CE2 4.48Å; I778-Y956 HydrophobicContact CD1-CG 3.74Å; V780-Y956 HydrophobicContact CB-CD1 4.39Å; V780-Y956 HydrophobicContact CG1-CD1 4.04Å; V780-Y956 HydrophobicContact CG1-CE1 3.91Å; V780-Y956 HydrophobicContact CG2-CD1 4.06Å; V780-Y956 HydrophobicContact CG2-CE1 4.18Å; L782-Y956 HydrophobicContact CD2-CE1 4.39Å; I784-Y956 HydrophobicContact CD1-CE1 3.97Å; W814-Y956 HydrophobicContact CE3-CD2 4.06Å; W814-Y956 AromaticContact CE3-CE2 3.9Å; W814-Y956 HydrophobicContact CE3-CE2 3.9Å; W814-Y956 HydrophobicContact CH2-CD2 4.13Å; W814-Y956 AromaticContact CZ3-CD2 3.55Å; W814-Y956 HydrophobicContact CZ3-CD2 3.55Å; W814-Y956 AromaticContact CZ3-CE2 3.87Å; W814-Y956 HydrophobicContact CZ3-CE2 3.87Å; W814-Y956 HydrophobicContact CZ3-CG 4.47Å; I833-Y956 HydrophobicContact CD1-CE1 4.03Å; I833-Y956 HydrophobicContact CD1-CE2 4.32Å; I833-Y956 WeakPolarHBondContact CD1-OH 3.49Å; P834-Y956 WeakPolarHBondContact CD-OH 3.35Å; P834-Y956 WeakPolarHBondContact O-CE2 3.44Å; P834-Y956 PolarHBondContact O-OH 3.37Å; N836-Y956 HydrophobicContact CB-CD2 4.32Å; A839-Y956 HydrophobicContact CB-CD2 4.31Å; A839-Y956 HydrophobicContact CB-CE1 4.08Å; A839-Y956 HydrophobicContact CB-CE2 3.55Å; A839-Y956 VanDerWaalsContact CB-CZ 3.41Å; A839-Y956 WeakPolarHBondContact CB-OH 3.34Å; I954-Y956 VanDerWaalsContact C-N 3.33Å; I954-Y956 WeakPolarHBondContact CG2-O 3.48Å
957	S	93.4	Very high	77.5	Confident	4 Å²	4	63.7 Å²	63.7	3%	0.028	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	128.2	168.8	-58.7	0	0	0	0	109.4	I778 R779 N781 I920 E1142	I778-S957 CarbonylContact C-O 3.53Å; I778-S957 VanDerWaalsContact CA-O 3.28Å; I778-S957 WeakPolarHBondContact CA-O 3.38Å; R779-S957 PolarHBondContact N-O 2.87Å; R779-S957 PolarHBondContact O-N 3.04Å; N781-S957 PolarHBondContact ND2-OG 3.29Å; I920-S957 WeakPolarHBondContact CD1-OG 3.33Å; S957-E1142 WeakPolarHBondContact CB-OE2 3.48Å; S957-E1142 PolarHBondContact OG-OE2 3.41Å
958	P	93.9	Very high	80.3	Confident	52 Å²	52	62.3 Å²	62.3	34%	0.338	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.2	139.1	169.4	28.9	-34.1	0	0	0	110	D1144	P958-D1144 WeakPolarHBondContact CG-OD2 3.46Å
959	V	95.1	Very high	83.2	Confident	9 Å²	9	59.1 Å²	59.1	6%	0.055	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	147.5	179.1	-71.2	0	0	0	0	111.8	Y777 R779 V800 W1140 V1141 E1142	Y777-V959 PolarHBondContact O-N 2.81Å; R779-V959 HydrophobicContact CB-CG1 3.76Å; V800-V959 HydrophobicContact CG1-CG2 3.91Å; V800-V959 HydrophobicContact CG2-CG2 4.33Å; V959-W1140 HydrophobicContact CB-CB 4.26Å; V959-W1140 HydrophobicContact CB-CE3 4.17Å; V959-W1140 HydrophobicContact CG1-CB 4.48Å; V959-W1140 HydrophobicContact CG2-CB 4.42Å; V959-W1140 HydrophobicContact CG2-CD2 4.37Å; V959-W1140 HydrophobicContact CG2-CE3 3.66Å; V959-W1140 HydrophobicContact CG2-CZ3 4.34Å; V959-V1141 WeakPolarHBondContact CA-O 3.44Å; V959-E1142 HydrophobicContact CG1-CG 3.56Å
960	T	93.4	Very high	86	Confident	36 Å²	36	52.7 Å²	52.7	22%	0.221	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	139.7	171.3	60.2	0	0	0	0	111.3	Q962 V1141 Q1143	T960-Q962 PolarHBondContact OG1-NE2 3.42Å; T960-V1141 PolarHBondContact N-O 2.88Å; T960-V1141 PolarHBondContact O-N 3.48Å; T960-V1141 VanDerWaalsContact O-N 3.14Å; T960-Q1143 HydrophobicContact CG2-CG 4.23Å; T960-Q1143 PolarHBondContact OG1-NE2 3.38Å
961	P	94.3	Very high	88.6	Confident	63 Å²	63	50.7 Å²	50.7	41%	0.409	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	129.2	174.1	28.3	-29.6	0	0	0	110.3	T1138 I1139 W1140	P961-T1138 HydrophobicContact CB-CG2 3.92Å; P961-I1139 CarbonylContact C-O 3.45Å; P961-W1140 HydrophobicContact CB-CE3 4.08Å; P961-W1140 HydrophobicContact CB-CH2 3.72Å; P961-W1140 HydrophobicContact CB-CZ2 4.33Å; P961-W1140 HydrophobicContact CB-CZ3 3.58Å; P961-W1140 HydrophobicContact CG-CH2 4.25Å; P961-W1140 HydrophobicContact CG-CZ3 3.95Å
962	Q	92.2	Very high	90.5	Very high	46 Å²	46	49 Å²	49	22%	0.215	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	143	178	-55	-60.3	-25.5	0	0	109.3	T960 Y1062 I1139 V1141	T960-Q962 PolarHBondContact OG1-NE2 3.42Å; Q962-Y1062 HydrophobicContact CB-CD1 4.26Å; Q962-Y1062 HydrophobicContact CB-CE1 3.86Å; Q962-Y1062 HydrophobicContact CB-CE2 4.36Å; Q962-Y1062 HydrophobicContact CG-CD1 4.47Å; Q962-Y1062 HydrophobicContact CG-CE1 3.75Å; Q962-I1139 HydrophobicContact CB-CB 4.13Å; Q962-I1139 PolarHBondContact N-O 3.35Å; Q962-I1139 WeakPolarHBondContact O-CB 3.4Å; Q962-I1139 PolarHBondContact O-N 2.75Å; Q962-V1141 HydrophobicContact CB-CG2 4.49Å; Q962-V1141 HydrophobicContact CG-CB 4.31Å; Q962-V1141 HydrophobicContact CG-CG2 3.84Å
963	R	84.7	Confident	91.8	Very high	184 Å²	184	45.1 Å²	45.1	69%	0.694	21%	0.213	S	C	*	.			trans	-135.2	132.6	-179.2	-71.2	-178.4	174.5	170	-0.3	109.9	S823	S823-R963 PolarHBondContact O-NH2 2.93Å
964	T	84.9	Confident	92.2	Very high	47 Å²	47	44.6 Å²	44.6	29%	0.288	21%	0.211	S	C	.	.			trans	-132.7	136.8	176.3	-174.1	0	0	0	0	111.3	R966 R968 I1139	T964-R966 PolarHBondContact OG1-N 2.91Å; T964-R968 HydrophobicContact CG2-CG 3.75Å; T964-I1139 HydrophobicContact CG2-CD1 3.97Å
965	Q	83.5	Confident	92.2	Very high	192 Å²	192	44 Å²	44	90%	0.897	21%	0.213	S	C	*	.	S	Bend	trans	-87.3	-11.7	176.2	-56.8	-63	-11.6	0	0	112.3
966	R	90.3	Very high	91.9	Very high	129 Å²	129	46.3 Å²	46.3	49%	0.487	23%	0.233	S	C	.	.	S	Bend	trans	-81.6	151.3	176.3	-65	-178.5	178.3	-171.1	-1.5	109.8	T964 R968 E1035 Q1135	T964-R966 PolarHBondContact OG1-N 2.91Å; R966-R968 PolarHBondContact O-N 2.88Å; R966-E1035 IonicContact CZ-OE2 2.78Å; R966-E1035 VanDerWaalsContact NH1-CD 3.27Å; R966-E1035 IonicContact NH1-OE1 2.87Å; R966-E1035 IonicContact NH1-OE2 2.65Å; R966-E1035 PolarHBondContact NH1-OE2 3.28Å; R966-E1035 IonicContact NH2-OE2 3.55Å; R966-Q1135 PolarHBondContact O-NE2 2.86Å
967	R	94.1	Very high	91.6	Very high	70 Å²	70	46.1 Å²	46.1	26%	0.264	23%	0.232	S	C	.	.	P	Polyproline II helix	trans	-64.7	124.4	168.8	-66.4	-55.6	-163.5	120.8	10.9	109	D993 G1041 K1042 H1043	R967-D993 IonicContact CZ-OD1 2.72Å; R967-D993 IonicContact NH1-OD1 3.35Å; R967-D993 IonicContact NH2-OD1 3.8Å; R967-D993 PolarHBondContact NH2-OD1 3.06Å; R967-G1041 WeakPolarHBondContact CG-O 3.31Å; R967-K1042 WeakPolarHBondContact CB-O 2.81Å; R967-H1043 PolarHBondContact NH1-CD2 3.39Å; R967-H1043 PolarHBondContact NH1-NE2 3.42Å
968	R	95.9	Very high	91.5	Very high	17 Å²	17	46 Å²	46	6%	0.064	23%	0.231	C	C	.	.	P	Polyproline II helix	trans	-69.8	145.3	-178.6	-66.5	163.9	67.9	-172.6	-2.9	110.6	T964 R966 H1043 Y1062 P1063 I1064 E1134	T964-R968 HydrophobicContact CG2-CG 3.75Å; R966-R968 PolarHBondContact O-N 2.88Å; R968-H1043 PolarHBondContact O-ND1 3.06Å; R968-Y1062 WeakPolarHBondContact CB-O 3.43Å; R968-Y1062 VanDerWaalsContact CG-O 3.26Å; R968-Y1062 WeakPolarHBondContact CG-O 3.41Å; R968-Y1062 PolarHBondContact NE-O 2.96Å; R968-P1063 PolarHBondContact NH2-O 3.01Å; R968-I1064 HydrophobicContact CB-CD1 3.89Å; R968-I1064 HydrophobicContact CB-CG1 3.81Å; R968-I1064 HydrophobicContact CG-CG1 4.47Å; R968-I1064 VanDerWaalsContact CZ-CG1 3.47Å; R968-E1134 PolarHBondContact NH1-O 3.12Å
969	P	96.4	Very high	91.3	Very high	7 Å²	7	47.9 Å²	47.9	5%	0.045	23%	0.234	C	C	.	.	P	Polyproline II helix	trans	-65.5	158.9	168.4	28.3	-31.6	0	0	0	110.6	I1034 C1044 L1046 I1061 P1063 I1064	P969-I1034 HydrophobicContact CB-CG2 4.06Å; P969-I1034 HydrophobicContact CG-CG2 4.22Å; P969-C1044 CarbonylContact C-O 3.37Å; P969-C1044 WeakPolarHBondContact CA-O 3.43Å; P969-C1044 HydrophobicContact CB-CB 4.12Å; P969-C1044 WeakPolarHBondContact CB-O 2.75Å; P969-L1046 HydrophobicContact CB-CD1 3.88Å; P969-L1046 HydrophobicContact CB-CG 4.26Å; P969-I1061 HydrophobicContact CG-CG2 3.58Å; P969-P1063 HydrophobicContact CG-CB 4.28Å; P969-P1063 CarbonylContact O-C 3.57Å; P969-P1063 WeakPolarHBondContact O-CA 3.13Å; P969-I1064 PolarHBondContact O-N 2.9Å
970	V	97.2	Very high	91	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	127.1	-175.4	-173.3	0	0	0	0	110.1	F972 H1043 C1044 L1045 L1046 I1064 V1066 I1131	V970-F972 HydrophobicContact CG1-CD1 4.44Å; V970-F972 HydrophobicContact CG1-CE1 3.76Å; V970-F972 HydrophobicContact CG1-CE2 4.12Å; V970-F972 HydrophobicContact CG1-CZ 3.58Å; V970-H1043 HydrophobicContact CG2-CB 4.07Å; V970-C1044 PolarHBondContact N-O 3.3Å; V970-L1045 HydrophobicContact CB-CD2 3.83Å; V970-L1045 HydrophobicContact CG1-CD2 4.39Å; V970-L1045 HydrophobicContact CG2-CD2 4.09Å; V970-L1046 PolarHBondContact O-N 2.73Å; V970-I1064 WeakPolarHBondContact CA-O 3.27Å; V970-I1064 HydrophobicContact CG2-CB 4.46Å; V970-V1066 HydrophobicContact CG1-CG2 4.36Å; V970-I1131 HydrophobicContact CG1-CD1 3.8Å; V970-I1131 HydrophobicContact CG1-CG1 4.03Å; V970-I1131 HydrophobicContact CG2-CD1 4.27Å; V970-I1131 HydrophobicContact CG2-CG1 4.38Å; V970-I1131 HydrophobicContact CG2-CG2 3.83Å
971	L	96.1	Very high	90.8	Very high	1 Å²	1	47.2 Å²	47.2	1%	0.005	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	138.8	171.7	-75.2	162.3	0	0	0	109.8	L1046 A1048 V1053 L1056 P1063 I1064 I1065 V1066	L971-L1046 HydrophobicContact CD2-CB 3.63Å; L971-L1046 HydrophobicContact CD2-CD1 3.98Å; L971-L1046 HydrophobicContact CD2-CG 4.45Å; L971-L1046 HydrophobicContact CG-CB 4.28Å; L971-L1046 HydrophobicContact CG-CD1 4.02Å; L971-A1048 HydrophobicContact CD2-CB 4.06Å; L971-V1053 HydrophobicContact CD1-CG2 3.55Å; L971-L1056 HydrophobicContact CD1-CD1 3.93Å; L971-P1063 HydrophobicContact CD1-CB 4.09Å; L971-P1063 HydrophobicContact CD1-CG 4.39Å; L971-I1064 PolarHBondContact N-O 2.88Å; L971-I1065 HydrophobicContact CB-CG1 4.44Å; L971-I1065 HydrophobicContact CD1-CG1 4.47Å; L971-V1066 PolarHBondContact O-N 2.98Å
972	F	94.7	Very high	90.8	Very high	3 Å²	3	44.2 Å²	44.2	1%	0.013	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	129.6	174.9	-60.7	-67.4	0	0	0	110.1	V970 A978 I981 I982 I985 L1045 V1066 I1127 I1131	V970-F972 HydrophobicContact CG1-CD1 4.44Å; V970-F972 HydrophobicContact CG1-CE1 3.76Å; V970-F972 HydrophobicContact CG1-CE2 4.12Å; V970-F972 HydrophobicContact CG1-CZ 3.58Å; F972-A978 HydrophobicContact CB-CB 3.84Å; F972-A978 HydrophobicContact CD2-CB 4.42Å; F972-I981 HydrophobicContact CD1-CG2 3.99Å; F972-I981 HydrophobicContact CD2-CG2 3.99Å; F972-I981 HydrophobicContact CE1-CG2 3.85Å; F972-I981 HydrophobicContact CE2-CG2 3.82Å; F972-I981 HydrophobicContact CG-CG2 4.07Å; F972-I981 HydrophobicContact CZ-CG2 3.76Å; F972-I982 HydrophobicContact CD2-CD1 4.24Å; F972-I982 HydrophobicContact CD2-CG1 3.9Å; F972-I982 HydrophobicContact CE2-CD1 4.39Å; F972-I982 HydrophobicContact CE2-CG1 3.72Å; F972-I985 HydrophobicContact CE2-CD1 4.22Å; F972-I985 HydrophobicContact CZ-CD1 3.68Å; F972-L1045 HydrophobicContact CE2-CD2 4.06Å; F972-L1045 HydrophobicContact CZ-CD2 4.16Å; F972-V1066 HydrophobicContact CD1-CB 3.97Å; F972-V1066 HydrophobicContact CD1-CG1 4.48Å; F972-V1066 HydrophobicContact CE1-CB 4.19Å; F972-V1066 HydrophobicContact CE1-CG2 4.34Å; F972-I1127 HydrophobicContact CE1-CG2 3.56Å; F972-I1127 HydrophobicContact CZ-CG2 4.08Å; F972-I1131 HydrophobicContact CE1-CD1 4.18Å; F972-I1131 HydrophobicContact CZ-CD1 4.11Å
973	T	92.1	Very high	90.7	Very high	8 Å²	8	46.5 Å²	46.5	5%	0.049	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	138.2	174.5	174.6	0	0	0	0	109.9	L1050 I1065 V1066 Y1067 V1068 L1102	T973-L1050 HydrophobicContact CG2-CD1 4.19Å; T973-L1050 HydrophobicContact CG2-CD2 4.02Å; T973-I1065 HydrophobicContact CG2-CG2 4.11Å; T973-V1066 PolarHBondContact N-O 3Å; T973-Y1067 HydrophobicContact CG2-CD2 4.08Å; T973-Y1067 HydrophobicContact CG2-CG 4.42Å; T973-Y1067 CarbonylContact O-C 3.6Å; T973-Y1067 WeakPolarHBondContact O-CA 3.33Å; T973-V1068 PolarHBondContact O-N 2.71Å; T973-L1102 HydrophobicContact CG2-CD2 3.92Å
974	P	90.3	Very high	90.9	Very high	7 Å²	7	40.4 Å²	40.4	5%	0.045	20%	0.199	C	C	.	.	S	Bend	cis	-63.5	136.5	-0.1	-23.7	35.6	0	0	0	114.1	A976 L977 V1068 C1095	P974-A976 PolarHBondContact O-N 3.35Å; P974-L977 PolarHBondContact O-N 3.13Å; P974-V1068 WeakPolarHBondContact CD-O 3.47Å; P974-C1095 HydrophobicContact CG-CB 3.87Å
975	A	87.8	Confident	91.2	Very high	39 Å²	39	38.1 Å²	38.1	32%	0.322	19%	0.186	S	C	.	.	H	α-helix	trans	-59.3	-25.2	-172.5	0	0	0	0	0	113.9	L977 A978	A975-L977 PolarHBondContact O-N 3.27Å; A975-A978 VanDerWaalsContact O-CB 3.24Å; A975-A978 WeakPolarHBondContact O-CB 3.17Å; A975-A978 PolarHBondContact O-N 3.16Å
976	A	86.5	Confident	91.5	Very high	50 Å²	50	31.1 Å²	31.1	41%	0.413	15%	0.154	S	C	.	.	H	α-helix	trans	-57.3	-28.1	172.9	0	0	0	0	0	113.7	P974 L1083 F1091	P974-A976 PolarHBondContact O-N 3.35Å; A976-L1083 VanDerWaalsContact O-CD2 3.29Å; A976-L1083 WeakPolarHBondContact O-CD2 3.44Å; A976-F1091 HydrophobicContact CB-CE2 3.92Å
977	L	87.9	Confident	91.4	Very high	4 Å²	4	31.6 Å²	31.6	2%	0.021	17%	0.166	C	C	.	.	H	α-helix	trans	-84.9	-22.7	176	-60.9	179.2	0	0	0	113.1	P974 A975 K979 T980 I981 V1068 I1070 L1078 L1081 L1083 F1091	P974-L977 PolarHBondContact O-N 3.13Å; A975-L977 PolarHBondContact O-N 3.27Å; L977-K979 PolarHBondContact O-N 3.4Å; L977-T980 PolarHBondContact O-N 2.98Å; L977-I981 HydrophobicContact CB-CD1 3.71Å; L977-I981 HydrophobicContact CB-CG1 4.39Å; L977-I981 WeakPolarHBondContact O-CG1 3.45Å; L977-I981 PolarHBondContact O-N 2.96Å; L977-V1068 HydrophobicContact CD1-CB 4.32Å; L977-V1068 HydrophobicContact CD1-CG1 4.42Å; L977-I1070 HydrophobicContact CD1-CD1 4.01Å; L977-I1070 HydrophobicContact CD1-CG1 4.21Å; L977-L1078 HydrophobicContact CD1-CD1 4.42Å; L977-L1078 HydrophobicContact CD2-CD1 4.13Å; L977-L1081 HydrophobicContact CD2-CD1 3.48Å; L977-L1081 VanDerWaalsContact CD2-CD1 3.48Å; L977-L1083 HydrophobicContact CD2-CD1 4.15Å; L977-F1091 HydrophobicContact CD2-CE1 4.08Å; L977-F1091 HydrophobicContact CD2-CZ 3.62Å; L977-F1091 HydrophobicContact CG-CZ 3.98Å
978	A	90.5	Very high	90.9	Very high	1 Å²	1	31.6 Å²	31.6	1%	0.008	17%	0.17	C	C	.	.	H	α-helix	trans	-54	-51.5	-168.2	0	0	0	0	0	112	F972 A975 T980 I981 I982	F972-A978 HydrophobicContact CB-CB 3.84Å; F972-A978 HydrophobicContact CD2-CB 4.42Å; A975-A978 VanDerWaalsContact O-CB 3.24Å; A975-A978 WeakPolarHBondContact O-CB 3.17Å; A975-A978 PolarHBondContact O-N 3.16Å; A978-T980 PolarHBondContact O-N 3.16Å; A978-I981 PolarHBondContact O-N 2.82Å; A978-I982 WeakPolarHBondContact O-CB 3.47Å; A978-I982 WeakPolarHBondContact O-CG1 3.29Å; A978-I982 PolarHBondContact O-N 3.32Å
979	K	89.1	Confident	89.9	Confident	93 Å²	93	33.8 Å²	33.8	40%	0.404	20%	0.197	S	C	.	.	H	α-helix	trans	-54.3	-47.5	-178.4	-175.8	168.6	-162.9	150	0	113.5	L977 I982 Q983 E1047	L977-K979 PolarHBondContact O-N 3.4Å; K979-I982 PolarHBondContact O-N 2.79Å; K979-Q983 WeakPolarHBondContact O-CG 3.34Å; K979-Q983 PolarHBondContact O-N 2.7Å; K979-E1047 HydrophobicContact CB-CG 4.45Å; K979-E1047 WeakPolarHBondContact CG-OE2 3.21Å; K979-E1047 IonicContact NZ-OE1 3.98Å
980	T	88.6	Confident	89.1	Confident	19 Å²	19	34 Å²	34	12%	0.117	20%	0.2	C	C	.	.	H	α-helix	trans	-77.1	-33.2	-177.7	-41.6	0	0	0	0	112	L977 A978 Q983 K984 L1081	L977-T980 PolarHBondContact O-N 2.98Å; A978-T980 PolarHBondContact O-N 3.16Å; T980-Q983 PolarHBondContact O-N 2.84Å; T980-K984 VanDerWaalsContact O-CB 3.32Å; T980-K984 WeakPolarHBondContact O-CB 3.26Å; T980-K984 PolarHBondContact O-N 3Å; T980-L1081 HydrophobicContact CG2-CD2 3.44Å; T980-L1081 VanDerWaalsContact CG2-CD2 3.44Å
981	I	90.9	Very high	88.1	Confident	11 Å²	11	36.5 Å²	36.5	6%	0.056	22%	0.221	C	C	.	.	H	α-helix	trans	-59.2	-47.9	170.4	-71.6	169.3	0	0	0	110.1	F972 L977 A978 K984 I985 V1068 I1124 I1127	F972-I981 HydrophobicContact CD1-CG2 3.99Å; F972-I981 HydrophobicContact CD2-CG2 3.99Å; F972-I981 HydrophobicContact CE1-CG2 3.85Å; F972-I981 HydrophobicContact CE2-CG2 3.82Å; F972-I981 HydrophobicContact CG-CG2 4.07Å; F972-I981 HydrophobicContact CZ-CG2 3.76Å; L977-I981 HydrophobicContact CB-CD1 3.71Å; L977-I981 HydrophobicContact CB-CG1 4.39Å; L977-I981 WeakPolarHBondContact O-CG1 3.45Å; L977-I981 PolarHBondContact O-N 2.96Å; A978-I981 PolarHBondContact O-N 2.82Å; I981-K984 PolarHBondContact O-N 3.33Å; I981-I985 HydrophobicContact CG2-CD1 3.7Å; I981-I985 HydrophobicContact CG2-CG1 4.38Å; I981-I985 VanDerWaalsContact O-CG1 3.3Å; I981-I985 WeakPolarHBondContact O-CG1 3.42Å; I981-I985 PolarHBondContact O-N 3.43Å; I981-V1068 HydrophobicContact CD1-CG2 4.29Å; I981-I1124 HydrophobicContact CB-CD1 4.28Å; I981-I1124 HydrophobicContact CG1-CD1 4.29Å; I981-I1124 HydrophobicContact CG2-CD1 4.03Å; I981-I1127 HydrophobicContact CD1-CD1 3.99Å; I981-I1127 HydrophobicContact CG1-CD1 4.28Å; I981-I1127 HydrophobicContact CG2-CD1 3.93Å
982	I	92.4	Very high	87.5	Confident	1 Å²	1	43.6 Å²	43.6	1%	0.005	26%	0.256	C	S	.	.	H	α-helix	trans	-60.1	-50.2	178.7	-68.7	170.7	0	0	0	110.9	F972 A978 K979 K984 I985 L986 I996 L1045 E1047	F972-I982 HydrophobicContact CD2-CD1 4.24Å; F972-I982 HydrophobicContact CD2-CG1 3.9Å; F972-I982 HydrophobicContact CE2-CD1 4.39Å; F972-I982 HydrophobicContact CE2-CG1 3.72Å; A978-I982 WeakPolarHBondContact O-CB 3.47Å; A978-I982 WeakPolarHBondContact O-CG1 3.29Å; A978-I982 PolarHBondContact O-N 3.32Å; K979-I982 PolarHBondContact O-N 2.79Å; I982-K984 VanDerWaalsContact C-N 3.32Å; I982-K984 PolarHBondContact O-N 3.32Å; I982-I985 PolarHBondContact O-N 2.81Å; I982-L986 HydrophobicContact CG2-CD1 4.17Å; I982-L986 WeakPolarHBondContact O-CG 3.32Å; I982-L986 PolarHBondContact O-N 2.93Å; I982-L986 VanDerWaalsContact O-N 3.15Å; I982-I996 HydrophobicContact CG2-CB 4.21Å; I982-I996 HydrophobicContact CG2-CD1 3.77Å; I982-I996 HydrophobicContact CG2-CG1 3.94Å; I982-L1045 HydrophobicContact CB-CD1 4.36Å; I982-L1045 HydrophobicContact CD1-CB 4.11Å; I982-L1045 HydrophobicContact CG1-CB 3.96Å; I982-L1045 HydrophobicContact CG1-CD1 4.19Å; I982-L1045 HydrophobicContact CG2-CB 4.21Å; I982-L1045 HydrophobicContact CG2-CD1 3.97Å; I982-E1047 HydrophobicContact CD1-CB 4.38Å
983	Q	90.1	Very high	87.3	Confident	93 Å²	93	46.2 Å²	46.2	44%	0.435	27%	0.27	S	S	.	.	H	α-helix	trans	-58.7	-42.3	176.4	-73.5	176.3	-18.6	0	0	112.2	K979 T980 N987	K979-Q983 WeakPolarHBondContact O-CG 3.34Å; K979-Q983 PolarHBondContact O-N 2.7Å; T980-Q983 PolarHBondContact O-N 2.84Å; Q983-N987 WeakPolarHBondContact O-CB 3.48Å; Q983-N987 PolarHBondContact O-N 3.41Å; Q983-N987 PolarHBondContact O-ND2 2.95Å; Q983-N987 PolarHBondContact O-OD1 3.24Å
984	K	89.6	Confident	87.4	Confident	56 Å²	56	46 Å²	46	24%	0.243	27%	0.268	C	S	.	.	H	α-helix	trans	-66.4	-43.3	177.1	-87.4	-71.1	-164.3	164.9	0	113.2	T980 I981 I982 L986 N987 M988 M1120 E1121 I1124	T980-K984 VanDerWaalsContact O-CB 3.32Å; T980-K984 WeakPolarHBondContact O-CB 3.26Å; T980-K984 PolarHBondContact O-N 3Å; I981-K984 PolarHBondContact O-N 3.33Å; I982-K984 VanDerWaalsContact C-N 3.32Å; I982-K984 PolarHBondContact O-N 3.32Å; K984-L986 VanDerWaalsContact C-N 3.32Å; K984-L986 PolarHBondContact O-N 2.99Å; K984-N987 PolarHBondContact O-N 2.95Å; K984-M988 WeakPolarHBondContact O-CB 3.46Å; K984-M988 VanDerWaalsContact O-CG 3.23Å; K984-M988 WeakPolarHBondContact O-CG 3.29Å; K984-M988 PolarHBondContact O-N 3Å; K984-M1120 HydrophobicContact CG-SD 4.42Å; K984-E1121 IonicContact NZ-OE1 2.68Å; K984-E1121 PolarHBondContact NZ-OE1 3.03Å; K984-E1121 IonicContact NZ-OE2 2.73Å; K984-E1121 PolarHBondContact NZ-OE2 3.17Å; K984-I1124 HydrophobicContact CB-CD1 3.65Å; K984-I1124 HydrophobicContact CB-CG1 3.88Å
985	I	91.5	Very high	87.6	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-55.4	-49.8	176.1	-73.1	166.5	0	0	0	110.2	F972 I981 I982 M988 A990 F994 L1045 I1124 I1127	F972-I985 HydrophobicContact CE2-CD1 4.22Å; F972-I985 HydrophobicContact CZ-CD1 3.68Å; I981-I985 HydrophobicContact CG2-CD1 3.7Å; I981-I985 HydrophobicContact CG2-CG1 4.38Å; I981-I985 VanDerWaalsContact O-CG1 3.3Å; I981-I985 WeakPolarHBondContact O-CG1 3.42Å; I981-I985 PolarHBondContact O-N 3.43Å; I982-I985 PolarHBondContact O-N 2.81Å; I985-M988 PolarHBondContact O-N 3.2Å; I985-A990 HydrophobicContact CG2-CB 3.94Å; I985-A990 WeakPolarHBondContact O-CB 3.38Å; I985-A990 PolarHBondContact O-N 2.86Å; I985-F994 HydrophobicContact CG2-CB 3.97Å; I985-F994 HydrophobicContact CG2-CD1 4.44Å; I985-F994 HydrophobicContact CG2-CD2 3.89Å; I985-F994 HydrophobicContact CG2-CG 3.84Å; I985-L1045 HydrophobicContact CB-CD1 4.39Å; I985-L1045 HydrophobicContact CD1-CD1 4.38Å; I985-L1045 HydrophobicContact CG2-CD1 4.07Å; I985-I1124 HydrophobicContact CG1-CD1 4.33Å; I985-I1124 HydrophobicContact CG1-CG2 3.82Å; I985-I1127 HydrophobicContact CD1-CG2 4.07Å
986	L	89.8	Confident	87.9	Confident	44 Å²	44	49 Å²	49	23%	0.23	28%	0.278	C	S	.	.	H	α-helix	trans	-65.5	-45.8	-178.8	-64.6	172	0	0	0	112.2	I982 K984 M988 G989 I996	I982-L986 HydrophobicContact CG2-CD1 4.17Å; I982-L986 WeakPolarHBondContact O-CG 3.32Å; I982-L986 PolarHBondContact O-N 2.93Å; I982-L986 VanDerWaalsContact O-N 3.15Å; K984-L986 VanDerWaalsContact C-N 3.32Å; K984-L986 PolarHBondContact O-N 2.99Å; L986-M988 VanDerWaalsContact C-N 3.29Å; L986-M988 PolarHBondContact O-N 3.09Å; L986-G989 PolarHBondContact O-N 3.48Å; L986-I996 HydrophobicContact CD1-CB 4.18Å; L986-I996 HydrophobicContact CD1-CG2 4.38Å
987	N	87.9	Confident	88.2	Confident	140 Å²	140	47 Å²	47	75%	0.749	26%	0.26	S	S	*	.	H	α-helix	trans	-66	-30.2	180	-69.4	-5.1	0	0	0	112.7	Q983 K984 G989	Q983-N987 WeakPolarHBondContact O-CB 3.48Å; Q983-N987 PolarHBondContact O-N 3.41Å; Q983-N987 PolarHBondContact O-ND2 2.95Å; Q983-N987 PolarHBondContact O-OD1 3.24Å; K984-N987 PolarHBondContact O-N 2.95Å; N987-G989 PolarHBondContact O-N 3.41Å
988	M	83.9	Confident	88.3	Confident	70 Å²	70	54.5 Å²	54.5	35%	0.345	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.3	42.8	174.1	-65	175.9	84.8	0	0	112.6	K984 I985 L986 A990 E1121 I1124 K1128	K984-M988 WeakPolarHBondContact O-CB 3.46Å; K984-M988 VanDerWaalsContact O-CG 3.23Å; K984-M988 WeakPolarHBondContact O-CG 3.29Å; K984-M988 PolarHBondContact O-N 3Å; I985-M988 PolarHBondContact O-N 3.2Å; L986-M988 VanDerWaalsContact C-N 3.29Å; L986-M988 PolarHBondContact O-N 3.09Å; M988-A990 PolarHBondContact O-N 3.32Å; M988-E1121 HydrophobicContact CE-CB 3.96Å; M988-I1124 HydrophobicContact SD-CB 3.8Å; M988-I1124 HydrophobicContact SD-CG1 4.35Å; M988-I1124 HydrophobicContact SD-CG2 3.43Å; M988-I1124 WeakPolarHBondContact SD-CG2 3.43Å; M988-K1128 PolarHBondContact O-NZ 2.95Å
989	G	75.2	Confident	88.2	Confident	62 Å²	62	56.7 Å²	56.7	64%	0.639	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.8	2.7	172.9	0	0	0	0	0	116.8	L986 N987 A991	L986-G989 PolarHBondContact O-N 3.48Å; N987-G989 PolarHBondContact O-N 3.41Å; G989-A991 PolarHBondContact O-N 2.97Å
990	A	78.9	Confident	88.3	Confident	12 Å²	12	55 Å²	55	10%	0.099	30%	0.302	C	S	.	.	G	3₁₀ helix	trans	-81.2	15.2	-169.4	0	0	0	0	0	114.3	I985 M988 M992 D993 F994 K1128	I985-A990 HydrophobicContact CG2-CB 3.94Å; I985-A990 WeakPolarHBondContact O-CB 3.38Å; I985-A990 PolarHBondContact O-N 2.86Å; M988-A990 PolarHBondContact O-N 3.32Å; A990-M992 PolarHBondContact O-N 3.34Å; A990-D993 PolarHBondContact O-N 2.95Å; A990-F994 HydrophobicContact CB-CD2 3.78Å; A990-F994 HydrophobicContact CB-CE2 4.35Å; A990-F994 WeakPolarHBondContact O-CD2 3.43Å; A990-F994 PolarHBondContact O-N 3.15Å; A990-F994 VanDerWaalsContact O-N 3.11Å; A990-K1128 HydrophobicContact CB-CD 4.47Å
991	A	76.2	Confident	88.4	Confident	53 Å²	53	58.2 Å²	58.2	44%	0.438	32%	0.322	S	S	.	.	G	3₁₀ helix	trans	-63.7	-4.7	178.5	0	0	0	0	0	114	G989 K1042	G989-A991 PolarHBondContact O-N 2.97Å; A991-K1042 PolarHBondContact O-NZ 3.39Å
992	M	84.1	Confident	88.3	Confident	149 Å²	149	58.1 Å²	58.1	73%	0.734	32%	0.322	S	S	*	.	G	3₁₀ helix	trans	-74.3	-54.6	171.2	-65.5	-56.6	-69.9	0	0	111.9	A990 K1042	A990-M992 PolarHBondContact O-N 3.34Å; M992-K1042 VanDerWaalsContact O-CD 3.23Å; M992-K1042 WeakPolarHBondContact O-CD 3.39Å; M992-K1042 WeakPolarHBondContact O-CE 3.39Å; M992-K1042 WeakPolarHBondContact O-CG 3.46Å
993	D	89.4	Confident	88.2	Confident	58 Å²	58	60.7 Å²	60.7	31%	0.31	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.7	-21.7	-178.1	-68.6	-87.6	0	0	0	114.2	R967 A990 K1042 H1043	R967-D993 IonicContact CZ-OD1 2.72Å; R967-D993 IonicContact NH1-OD1 3.35Å; R967-D993 IonicContact NH2-OD1 3.8Å; R967-D993 PolarHBondContact NH2-OD1 3.06Å; A990-D993 PolarHBondContact O-N 2.95Å; D993-K1042 CarbonylContact O-C 3.59Å; D993-K1042 WeakPolarHBondContact O-CA 3.13Å; D993-K1042 WeakPolarHBondContact O-CB 3.19Å; D993-H1043 PolarHBondContact O-N 3.11Å
994	F	94.8	Very high	88.1	Confident	5 Å²	5	61.7 Å²	61.7	2%	0.022	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	149.2	-171.2	-57.5	-84.6	0	0	0	112.3	I985 A990 H1043 L1045 K1128 I1131	I985-F994 HydrophobicContact CG2-CB 3.97Å; I985-F994 HydrophobicContact CG2-CD1 4.44Å; I985-F994 HydrophobicContact CG2-CD2 3.89Å; I985-F994 HydrophobicContact CG2-CG 3.84Å; A990-F994 HydrophobicContact CB-CD2 3.78Å; A990-F994 HydrophobicContact CB-CE2 4.35Å; A990-F994 WeakPolarHBondContact O-CD2 3.43Å; A990-F994 PolarHBondContact O-N 3.15Å; A990-F994 VanDerWaalsContact O-N 3.11Å; F994-H1043 HydrophobicContact CD1-CB 3.61Å; F994-H1043 HydrophobicContact CE1-CB 3.93Å; F994-L1045 HydrophobicContact CB-CD1 4.12Å; F994-L1045 HydrophobicContact CB-CG 4.36Å; F994-L1045 HydrophobicContact CD1-CD2 3.78Å; F994-L1045 HydrophobicContact CD1-CG 4.42Å; F994-K1128 HydrophobicContact CE2-CG 4.03Å; F994-K1128 HydrophobicContact CZ-CB 4.46Å; F994-K1128 HydrophobicContact CZ-CG 4.23Å; F994-I1131 HydrophobicContact CE1-CB 4.34Å; F994-I1131 HydrophobicContact CE1-CD1 3.83Å; F994-I1131 HydrophobicContact CE1-CG2 3.93Å; F994-I1131 HydrophobicContact CZ-CD1 4.32Å; F994-I1131 HydrophobicContact CZ-CG2 4.42Å
995	N	94.5	Very high	87.8	Confident	56 Å²	56	65.3 Å²	65.3	30%	0.299	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.3	150.8	167.7	-172.1	28.7	0	0	0	110.4	V1037 K1042 H1043 L1045	N995-V1037 HydrophobicContact CB-CG1 3.86Å; N995-K1042 HydrophobicContact CB-CD 4.35Å; N995-H1043 PolarHBondContact N-O 3.35Å; N995-L1045 PolarHBondContact O-N 3.47Å
996	I	93.7	Very high	87.6	Confident	52 Å²	52	69.8 Å²	69.8	27%	0.267	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	140.5	176.6	-167.3	173.2	0	0	0	111.2	I982 L986 K998	I982-I996 HydrophobicContact CG2-CB 4.21Å; I982-I996 HydrophobicContact CG2-CD1 3.77Å; I982-I996 HydrophobicContact CG2-CG1 3.94Å; L986-I996 HydrophobicContact CD1-CB 4.18Å; L986-I996 HydrophobicContact CD1-CG2 4.38Å; I996-K998 PolarHBondContact O-N 2.92Å
997	C	92.9	Very high	87.5	Confident	7 Å²	7	68 Å²	68	5%	0.047	37%	0.37	C	S	.	.	P	Polyproline II helix	trans	-68.3	117.9	165.4	-161	0	0	0	0	109	C1044 L1045 L1046	C997-C1044 WeakPolarHBondContact CB-SG 3.49Å; C997-L1045 WeakPolarHBondContact CB-O 3.07Å; C997-L1045 PolarHBondContact N-O 3.02Å; C997-L1046 HydrophobicContact CB-CD2 3.66Å
998	K	89.5	Confident	87.3	Confident	162 Å²	162	65.4 Å²	65.4	70%	0.704	35%	0.353	S	S	*	.	P	Polyproline II helix	trans	-83	122.6	168.9	-66.2	-171.3	176.2	-170.7	0	107.9	I996 N1033	I996-K998 PolarHBondContact O-N 2.92Å; K998-N1033 PolarHBondContact O-ND2 3.03Å
999	P	90.1	Very high	87.3	Confident	48 Å²	48	67.9 Å²	67.9	31%	0.312	37%	0.367	S	S	.	.	P	Polyproline II helix	trans	-72.5	150.2	169	31.2	-33.5	0	0	0	110.3	E1027 C1028 I1029	P999-E1027 HydrophobicContact CB-CB 4.03Å; P999-E1027 HydrophobicContact CG-CB 4.07Å; P999-E1027 HydrophobicContact CG-CG 4.18Å; P999-C1028 CarbonylContact C-O 3.45Å; P999-C1028 WeakPolarHBondContact CA-O 3.45Å; P999-C1028 VanDerWaalsContact CB-O 3.24Å; P999-C1028 WeakPolarHBondContact CB-O 3.45Å; P999-I1029 HydrophobicContact CB-CG1 4.11Å
1000	D	89.7	Confident	87.6	Confident	56 Å²	56	69.1 Å²	69.1	30%	0.299	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	140.4	163	-76.2	15.3	0	0	0	108.8	L1002 K1010 E1027 C1028 N1033	D1000-L1002 HydrophobicContact CB-CD2 4.34Å; D1000-K1010 IonicContact OD2-NZ 2.68Å; D1000-E1027 CarbonylContact O-C 3.59Å; D1000-E1027 WeakPolarHBondContact O-CA 3.22Å; D1000-C1028 PolarHBondContact N-O 2.92Å; D1000-C1028 PolarHBondContact O-N 2.96Å; D1000-N1033 PolarHBondContact OD1-ND2 3.4Å
1001	T	91.1	Very high	87.8	Confident	87 Å²	87	72.1 Å²	72.1	53%	0.534	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	126.1	168.3	-53.1	0	0	0	0	108.8	T1025 F1026	T1001-T1025 HydrophobicContact CG2-CG2 4.35Å; T1001-F1026 CarbonylContact C-O 3.5Å; T1001-F1026 WeakPolarHBondContact CA-O 3.41Å
1002	L	89.4	Confident	87.8	Confident	9 Å²	9	76 Å²	76	5%	0.047	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	150.6	-177.4	-53.6	177.5	0	0	0	111.1	D1000 E1006 F1007 K1010 F1016 T1025 F1026 C1028	D1000-L1002 HydrophobicContact CB-CD2 4.34Å; L1002-E1006 WeakPolarHBondContact CA-OE2 3.43Å; L1002-E1006 HydrophobicContact CB-CB 4.05Å; L1002-F1007 HydrophobicContact CB-CB 4.45Å; L1002-K1010 HydrophobicContact CD1-CD 3.77Å; L1002-K1010 HydrophobicContact CD2-CD 4.03Å; L1002-F1016 HydrophobicContact CD1-CE1 3.93Å; L1002-F1016 HydrophobicContact CD1-CZ 3.57Å; L1002-T1025 WeakPolarHBondContact O-CA 3.5Å; L1002-T1025 WeakPolarHBondContact O-CB 3.46Å; L1002-F1026 PolarHBondContact N-O 2.87Å; L1002-F1026 PolarHBondContact O-N 3.27Å; L1002-C1028 HydrophobicContact CD1-CB 4.18Å
1003	T	90.1	Very high	87.6	Confident	56 Å²	56	75 Å²	75	34%	0.344	38%	0.382	S	S	.	.			trans	-69.7	171.3	162.7	86.3	0	0	0	0	110.8	E1005 E1006 F1007	T1003-E1005 VanDerWaalsContact C-N 3.29Å; T1003-E1005 VanDerWaalsContact CB-OE2 3.23Å; T1003-E1005 WeakPolarHBondContact CB-OE2 3.32Å; T1003-E1005 PolarHBondContact O-N 2.88Å; T1003-E1005 PolarHBondContact OG1-N 3.44Å; T1003-E1005 PolarHBondContact OG1-OE2 2.93Å; T1003-E1006 HydrophobicContact CG2-CG 4.43Å; T1003-E1006 PolarHBondContact N-OE2 3.17Å; T1003-E1006 PolarHBondContact OG1-N 3.27Å; T1003-F1007 VanDerWaalsContact O-CB 3.23Å; T1003-F1007 WeakPolarHBondContact O-CB 3.47Å; T1003-F1007 PolarHBondContact O-N 3.24Å
1004	K	86.9	Confident	86.8	Confident	113 Å²	113	75.8 Å²	75.8	49%	0.491	38%	0.384	S	S	.	.	H	α-helix	trans	-64.5	-35.8	177.2	-177.3	172.5	-178.3	177.7	0	112.3	H1008 F1026	K1004-H1008 PolarHBondContact O-CD2 2.98Å; K1004-H1008 PolarHBondContact O-N 2.91Å; K1004-H1008 VanDerWaalsContact O-N 3.12Å; K1004-F1026 HydrophobicContact CB-CE2 4.03Å; K1004-F1026 HydrophobicContact CG-CE2 4.06Å
1005	E	84.9	Confident	86	Confident	132 Å²	132	79.3 Å²	79.3	62%	0.617	41%	0.407	S	S	*	.	H	α-helix	trans	-70.3	-47.4	179.6	-55.9	66	-139.8	0	0	110	T1003 F1007 H1008 L1009	T1003-E1005 VanDerWaalsContact C-N 3.29Å; T1003-E1005 VanDerWaalsContact CB-OE2 3.23Å; T1003-E1005 WeakPolarHBondContact CB-OE2 3.32Å; T1003-E1005 PolarHBondContact O-N 2.88Å; T1003-E1005 PolarHBondContact OG1-N 3.44Å; T1003-E1005 PolarHBondContact OG1-OE2 2.93Å; E1005-F1007 VanDerWaalsContact C-N 3.34Å; E1005-F1007 PolarHBondContact O-N 2.84Å; E1005-H1008 PolarHBondContact O-N 3.42Å; E1005-L1009 WeakPolarHBondContact O-CB 3.48Å; E1005-L1009 PolarHBondContact O-N 3.3Å
1006	E	86.6	Confident	85.6	Confident	94 Å²	94	77.7 Å²	77.7	44%	0.439	40%	0.398	S	S	.	.	H	α-helix	trans	-62.5	-39.2	174.2	-67.7	179.8	143.8	0	0	112.5	L1002 T1003 L1009 K1010	L1002-E1006 WeakPolarHBondContact CA-OE2 3.43Å; L1002-E1006 HydrophobicContact CB-CB 4.05Å; T1003-E1006 HydrophobicContact CG2-CG 4.43Å; T1003-E1006 PolarHBondContact N-OE2 3.17Å; T1003-E1006 PolarHBondContact OG1-N 3.27Å; E1006-L1009 PolarHBondContact O-N 3.48Å; E1006-K1010 WeakPolarHBondContact O-CB 3.29Å; E1006-K1010 PolarHBondContact O-N 2.88Å
1007	F	86.6	Confident	85.3	Confident	7 Å²	7	75.6 Å²	75.6	3%	0.031	39%	0.387	C	S	.	.	H	α-helix	trans	-59.7	-53.9	176.5	175.2	-96.2	0	0	0	111.1	L1002 T1003 E1005 L1009 K1010 Q1011 F1016 Y1019 F1026 C1028	L1002-F1007 HydrophobicContact CB-CB 4.45Å; T1003-F1007 VanDerWaalsContact O-CB 3.23Å; T1003-F1007 WeakPolarHBondContact O-CB 3.47Å; T1003-F1007 PolarHBondContact O-N 3.24Å; E1005-F1007 VanDerWaalsContact C-N 3.34Å; E1005-F1007 PolarHBondContact O-N 2.84Å; F1007-L1009 VanDerWaalsContact C-N 3.35Å; F1007-L1009 PolarHBondContact O-N 3.5Å; F1007-K1010 PolarHBondContact O-N 2.88Å; F1007-Q1011 VanDerWaalsContact CE1-OE1 3.31Å; F1007-Q1011 WeakPolarHBondContact O-CB 3.49Å; F1007-Q1011 PolarHBondContact O-N 3.34Å; F1007-F1016 HydrophobicContact CD2-CD2 4.07Å; F1007-F1016 AromaticContact CD2-CE2 3.43Å; F1007-F1016 HydrophobicContact CD2-CE2 3.43Å; F1007-F1016 VanDerWaalsContact CD2-CE2 3.43Å; F1007-F1016 HydrophobicContact CD2-CZ 4.05Å; F1007-F1016 AromaticContact CE2-CD2 3.51Å; F1007-F1016 HydrophobicContact CE2-CD2 3.51Å; F1007-F1016 AromaticContact CE2-CE2 3.36Å; F1007-F1016 HydrophobicContact CE2-CE2 3.36Å; F1007-F1016 HydrophobicContact CE2-CZ 4.34Å; F1007-F1016 HydrophobicContact CG-CE2 4.26Å; F1007-F1016 HydrophobicContact CZ-CD2 4.17Å; F1007-F1016 HydrophobicContact CZ-CE2 4.15Å; F1007-Y1019 HydrophobicContact CE2-CD1 4.3Å; F1007-Y1019 AromaticContact CE2-CD2 3.76Å; F1007-Y1019 HydrophobicContact CE2-CD2 3.76Å; F1007-Y1019 HydrophobicContact CE2-CE2 4.36Å; F1007-Y1019 AromaticContact CE2-CG 3.73Å; F1007-Y1019 HydrophobicContact CE2-CG 3.73Å; F1007-Y1019 HydrophobicContact CZ-CD1 4.23Å; F1007-Y1019 AromaticContact CZ-CD2 3.67Å; F1007-Y1019 HydrophobicContact CZ-CD2 3.67Å; F1007-Y1019 HydrophobicContact CZ-CE1 4.34Å; F1007-Y1019 AromaticContact CZ-CE2 3.79Å; F1007-Y1019 HydrophobicContact CZ-CE2 3.79Å; F1007-Y1019 AromaticContact CZ-CG 3.91Å; F1007-Y1019 HydrophobicContact CZ-CG 3.91Å; F1007-F1026 HydrophobicContact CB-CB 4.2Å; F1007-F1026 HydrophobicContact CB-CD2 3.74Å; F1007-F1026 HydrophobicContact CB-CE2 4.41Å; F1007-F1026 HydrophobicContact CB-CG 4.04Å; F1007-F1026 HydrophobicContact CD1-CD1 4.4Å; F1007-F1026 HydrophobicContact CD1-CD2 4.26Å; F1007-F1026 HydrophobicContact CD1-CE1 4.49Å; F1007-F1026 HydrophobicContact CD1-CE2 4.35Å; F1007-F1026 HydrophobicContact CD1-CG 4.3Å; F1007-F1026 HydrophobicContact CD1-CZ 4.47Å; F1007-F1026 HydrophobicContact CD2-CB 3.62Å; F1007-F1026 HydrophobicContact CD2-CD1 4.01Å; F1007-F1026 HydrophobicContact CD2-CD2 4.25Å; F1007-F1026 AromaticContact CD2-CG 3.68Å; F1007-F1026 HydrophobicContact CD2-CG 3.68Å; F1007-F1026 HydrophobicContact CE1-CD1 4.47Å; F1007-F1026 HydrophobicContact CE1-CE1 4.46Å; F1007-F1026 HydrophobicContact CE2-CB 4.29Å; F1007-F1026 HydrophobicContact CE2-CD1 4.08Å; F1007-F1026 HydrophobicContact CE2-CG 4.22Å; F1007-F1026 HydrophobicContact CG-CB 4.05Å; F1007-F1026 HydrophobicContact CG-CD1 4.18Å; F1007-F1026 AromaticContact CG-CD2 3.81Å; F1007-F1026 HydrophobicContact CG-CD2 3.81Å; F1007-F1026 HydrophobicContact CG-CE2 4.36Å; F1007-F1026 AromaticContact CG-CG 3.73Å; F1007-F1026 HydrophobicContact CG-CG 3.73Å; F1007-F1026 HydrophobicContact CZ-CD1 4.32Å; F1007-C1028 VanDerWaalsContact CD2-SG 3.52Å
1008	H	84.9	Confident	85.1	Confident	85 Å²	85	77.1 Å²	77.1	39%	0.394	39%	0.393	S	S	.	.	H	α-helix	trans	-64.8	-37.6	178.9	-70.7	-51.5	0	0	0	112.3	K1004 E1005 N1012	K1004-H1008 PolarHBondContact O-CD2 2.98Å; K1004-H1008 PolarHBondContact O-N 2.91Å; K1004-H1008 VanDerWaalsContact O-N 3.12Å; E1005-H1008 PolarHBondContact O-N 3.42Å; H1008-N1012 VanDerWaalsContact O-CG 3.3Å; H1008-N1012 PolarHBondContact O-N 3.37Å; H1008-N1012 PolarHBondContact O-ND2 3.32Å
1009	L	84.7	Confident	85.1	Confident	123 Å²	123	75 Å²	75	64%	0.644	38%	0.382	S	S	*	.	H	α-helix	trans	-64.1	-47.3	176.4	-176.1	63.2	0	0	0	112	E1005 E1006 F1007 N1012	E1005-L1009 WeakPolarHBondContact O-CB 3.48Å; E1005-L1009 PolarHBondContact O-N 3.3Å; E1006-L1009 PolarHBondContact O-N 3.48Å; F1007-L1009 VanDerWaalsContact C-N 3.35Å; F1007-L1009 PolarHBondContact O-N 3.5Å; L1009-N1012 PolarHBondContact O-N 3.33Å
1010	K	81.4	Confident	85	Confident	87 Å²	87	77.8 Å²	77.8	38%	0.378	39%	0.389	S	S	.	.	H	α-helix	trans	-67.2	-39.8	176.8	-82.3	-177.1	171	-178.9	0	112.3	D1000 L1002 E1006 F1007 N1012 V1013 E1014 F1016	D1000-K1010 IonicContact OD2-NZ 2.68Å; L1002-K1010 HydrophobicContact CD1-CD 3.77Å; L1002-K1010 HydrophobicContact CD2-CD 4.03Å; E1006-K1010 WeakPolarHBondContact O-CB 3.29Å; E1006-K1010 PolarHBondContact O-N 2.88Å; F1007-K1010 PolarHBondContact O-N 2.88Å; K1010-N1012 PolarHBondContact O-N 2.73Å; K1010-V1013 PolarHBondContact O-N 3.14Å; K1010-E1014 PolarHBondContact O-N 2.94Å; K1010-E1014 VanDerWaalsContact O-O 3.13Å; K1010-F1016 HydrophobicContact CB-CE1 4.29Å; K1010-F1016 HydrophobicContact CB-CE2 4.5Å; K1010-F1016 HydrophobicContact CB-CZ 3.65Å; K1010-F1016 HydrophobicContact CD-CZ 4.43Å
1011	Q	82.3	Confident	84.9	Confident	75 Å²	75	81.2 Å²	81.2	35%	0.35	40%	0.403	S	S	.	.	H	α-helix	trans	-57.5	-32.6	178.8	-174.4	177.6	18.1	0	0	112.8	F1007 V1013 F1016	F1007-Q1011 VanDerWaalsContact CE1-OE1 3.31Å; F1007-Q1011 WeakPolarHBondContact O-CB 3.49Å; F1007-Q1011 PolarHBondContact O-N 3.34Å; Q1011-V1013 VanDerWaalsContact C-N 3.31Å; Q1011-F1016 HydrophobicContact CB-CD2 4.49Å; Q1011-F1016 HydrophobicContact CB-CE2 4.03Å
1012	N	76.5	Confident	84.5	Confident	136 Å²	136	80.8 Å²	80.8	73%	0.727	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.3	-12.3	176.2	-67.5	-23	0	0	0	113.9	H1008 L1009 K1010	H1008-N1012 VanDerWaalsContact O-CG 3.3Å; H1008-N1012 PolarHBondContact O-N 3.37Å; H1008-N1012 PolarHBondContact O-ND2 3.32Å; L1009-N1012 PolarHBondContact O-N 3.33Å; K1010-N1012 PolarHBondContact O-N 2.73Å
1013	V	80.1	Confident	83.8	Confident	127 Å²	127	89.9 Å²	89.9	77%	0.77	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.2	-46	-178.7	178	0	0	0	0	111.5	K1010 Q1011	K1010-V1013 PolarHBondContact O-N 3.14Å; Q1011-V1013 VanDerWaalsContact C-N 3.31Å
1014	E	72.4	Confident	83.3	Confident	74 Å²	74	90.9 Å²	90.9	35%	0.346	45%	0.45	S	S	.	.	S	Bend	trans	-142.1	134.5	170.2	-170.4	179.2	164.4	0	0	110.5	K1010 R1059	K1010-E1014 PolarHBondContact O-N 2.94Å; K1010-E1014 VanDerWaalsContact O-O 3.13Å; E1014-R1059 IonicContact OE1-NE 3.84Å
1015	P	77.8	Confident	83.3	Confident	79 Å²	79	88 Å²	88	51%	0.513	44%	0.442	S	S	.	.			trans	-69.7	136.2	175.8	-8.2	21.8	0	0	0	111.1	R1059	P1015-R1059 PolarHBondContact O-NH2 2.97Å
1016	F	86.1	Confident	83.5	Confident	22 Å²	22	82.6 Å²	82.6	10%	0.096	42%	0.417	C	S	.	.			trans	-66.9	150.8	173.2	-60.1	-67.6	0	0	0	112.2	L1002 F1007 K1010 Q1011 Y1019 C1028 T1030	L1002-F1016 HydrophobicContact CD1-CE1 3.93Å; L1002-F1016 HydrophobicContact CD1-CZ 3.57Å; F1007-F1016 HydrophobicContact CD2-CD2 4.07Å; F1007-F1016 AromaticContact CD2-CE2 3.43Å; F1007-F1016 HydrophobicContact CD2-CE2 3.43Å; F1007-F1016 VanDerWaalsContact CD2-CE2 3.43Å; F1007-F1016 HydrophobicContact CD2-CZ 4.05Å; F1007-F1016 AromaticContact CE2-CD2 3.51Å; F1007-F1016 HydrophobicContact CE2-CD2 3.51Å; F1007-F1016 AromaticContact CE2-CE2 3.36Å; F1007-F1016 HydrophobicContact CE2-CE2 3.36Å; F1007-F1016 HydrophobicContact CE2-CZ 4.34Å; F1007-F1016 HydrophobicContact CG-CE2 4.26Å; F1007-F1016 HydrophobicContact CZ-CD2 4.17Å; F1007-F1016 HydrophobicContact CZ-CE2 4.15Å; K1010-F1016 HydrophobicContact CB-CE1 4.29Å; K1010-F1016 HydrophobicContact CB-CE2 4.5Å; K1010-F1016 HydrophobicContact CB-CZ 3.65Å; K1010-F1016 HydrophobicContact CD-CZ 4.43Å; Q1011-F1016 HydrophobicContact CB-CD2 4.49Å; Q1011-F1016 HydrophobicContact CB-CE2 4.03Å; F1016-Y1019 HydrophobicContact CB-CD1 4.42Å; F1016-C1028 HydrophobicContact CD1-CB 3.62Å; F1016-C1028 HydrophobicContact CE1-CB 3.66Å; F1016-C1028 HydrophobicContact CG-CB 4.19Å; F1016-C1028 HydrophobicContact CZ-CB 4.25Å; F1016-T1030 HydrophobicContact CD1-CG2 4.1Å; F1016-T1030 HydrophobicContact CE1-CG2 4.2Å
1017	I	87.4	Confident	83.7	Confident	9 Å²	9	80.5 Å²	80.5	5%	0.046	41%	0.407	C	S	.	.	S	Bend	trans	-79.8	-40.1	174.9	-64.3	174.8	0	0	0	110.3	I1029 R1031 I1034 C1052 L1056 I1061	I1017-I1029 WeakPolarHBondContact CB-O 3.44Å; I1017-I1029 PolarHBondContact N-O 3.36Å; I1017-R1031 HydrophobicContact CD1-CB 4.42Å; I1017-I1034 HydrophobicContact CD1-CD1 3.82Å; I1017-C1052 HydrophobicContact CG2-CB 4.04Å; I1017-C1052 WeakPolarHBondContact O-CB 3.41Å; I1017-L1056 HydrophobicContact CD1-CD2 4.2Å; I1017-L1056 HydrophobicContact CG2-CD2 3.75Å; I1017-L1056 HydrophobicContact CG2-CG 3.72Å; I1017-I1061 HydrophobicContact CD1-CD1 4.06Å
1018	H	89.6	Confident	83.9	Confident	38 Å²	38	80.2 Å²	80.2	18%	0.176	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.4	149.9	169.9	-176.3	58.3	0	0	0	109	I1029 A1048 C1052	H1018-I1029 HydrophobicContact CB-CB 4.37Å; H1018-I1029 HydrophobicContact CB-CD1 4.4Å; H1018-I1029 PolarHBondContact N-O 3.05Å; H1018-I1029 PolarHBondContact O-N 3.4Å; H1018-A1048 HydrophobicContact CB-CB 3.94Å; H1018-C1052 HydrophobicContact CB-CB 4.4Å
1019	Y	89.1	Confident	84.2	Confident	118 Å²	118	76.7 Å²	76.7	46%	0.463	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	158	171.8	68.2	-87.6	0	0	0	111.6	F1007 F1016 F1026 E1027	F1007-Y1019 HydrophobicContact CE2-CD1 4.3Å; F1007-Y1019 AromaticContact CE2-CD2 3.76Å; F1007-Y1019 HydrophobicContact CE2-CD2 3.76Å; F1007-Y1019 HydrophobicContact CE2-CE2 4.36Å; F1007-Y1019 AromaticContact CE2-CG 3.73Å; F1007-Y1019 HydrophobicContact CE2-CG 3.73Å; F1007-Y1019 HydrophobicContact CZ-CD1 4.23Å; F1007-Y1019 AromaticContact CZ-CD2 3.67Å; F1007-Y1019 HydrophobicContact CZ-CD2 3.67Å; F1007-Y1019 HydrophobicContact CZ-CE1 4.34Å; F1007-Y1019 AromaticContact CZ-CE2 3.79Å; F1007-Y1019 HydrophobicContact CZ-CE2 3.79Å; F1007-Y1019 AromaticContact CZ-CG 3.91Å; F1007-Y1019 HydrophobicContact CZ-CG 3.91Å; F1016-Y1019 HydrophobicContact CB-CD1 4.42Å; Y1019-F1026 HydrophobicContact CD2-CD1 4.21Å; Y1019-E1027 CarbonylContact C-O 3.53Å; Y1019-E1027 WeakPolarHBondContact CA-O 3.44Å
1020	K	88.1	Confident	84.4	Confident	106 Å²	106	71.5 Å²	71.5	46%	0.461	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.4	127.6	-177.3	-174.4	170.9	-172.3	163.6	0	111.2	E1027	K1020-E1027 PolarHBondContact N-O 3.06Å; K1020-E1027 PolarHBondContact O-N 2.89Å
1021	E	86.7	Confident	84.9	Confident	129 Å²	129	71.3 Å²	71.3	60%	0.603	36%	0.36	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.7	137.6	175.1	-167.4	178.4	170.8	0	0	111.4	F1026	E1021-F1026 HydrophobicContact CB-CD1 4.16Å; E1021-F1026 HydrophobicContact CB-CE1 3.86Å; E1021-F1026 HydrophobicContact CG-CD1 4.45Å; E1021-F1026 HydrophobicContact CG-CE1 3.98Å; E1021-F1026 HydrophobicContact CG-CZ 4.13Å
1022	K	83.4	Confident	85.2	Confident	78 Å²	78	72.3 Å²	72.3	34%	0.339	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	113.9	170.4	-75.5	-176.1	-179.1	166.1	0	109.8	A1024 T1025 E1027	K1022-A1024 PolarHBondContact O-N 3.22Å; K1022-T1025 PolarHBondContact N-O 3.04Å; K1022-T1025 PolarHBondContact O-N 2.96Å; K1022-T1025 VanDerWaalsContact O-O 3.12Å; K1022-T1025 PolarHBondContact O-OG1 2.83Å; K1022-E1027 HydrophobicContact CD-CG 4.32Å; K1022-E1027 WeakPolarHBondContact CD-OE1 3.28Å; K1022-E1027 WeakPolarHBondContact CE-OE1 3.37Å; K1022-E1027 WeakPolarHBondContact CE-OE2 3.22Å; K1022-E1027 IonicContact NZ-OE1 2.64Å; K1022-E1027 PolarHBondContact NZ-OE1 3.38Å; K1022-E1027 IonicContact NZ-OE2 2.73Å; K1022-E1027 PolarHBondContact NZ-OE2 2.66Å
1023	Q	74.6	Confident	86	Confident	199 Å²	199	67 Å²	67	93%	0.93	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.4	53.3	164.8	-61.7	178	-51.3	0	0	113.1	T1025	Q1023-T1025 VanDerWaalsContact C-N 3.32Å; Q1023-T1025 PolarHBondContact O-N 3.18Å
1024	A	79.4	Confident	86.6	Confident	78 Å²	78	61.2 Å²	61.2	65%	0.645	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.5	14.5	-176.9	0	0	0	0	0	117.2	K1022	K1022-A1024 PolarHBondContact O-N 3.22Å
1025	T	86.5	Confident	87.5	Confident	51 Å²	51	60 Å²	60	31%	0.313	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	159.5	167.8	61.6	0	0	0	0	111.3	T1001 L1002 K1022 Q1023	T1001-T1025 HydrophobicContact CG2-CG2 4.35Å; L1002-T1025 WeakPolarHBondContact O-CA 3.5Å; L1002-T1025 WeakPolarHBondContact O-CB 3.46Å; K1022-T1025 PolarHBondContact N-O 3.04Å; K1022-T1025 PolarHBondContact O-N 2.96Å; K1022-T1025 VanDerWaalsContact O-O 3.12Å; K1022-T1025 PolarHBondContact O-OG1 2.83Å; Q1023-T1025 VanDerWaalsContact C-N 3.32Å; Q1023-T1025 PolarHBondContact O-N 3.18Å
1026	F	88.8	Confident	88.3	Confident	20 Å²	20	58.6 Å²	58.6	9%	0.088	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	124.1	176.6	-68	-89.2	0	0	0	110.4	T1001 L1002 K1004 F1007 Y1019 E1021	T1001-F1026 CarbonylContact C-O 3.5Å; T1001-F1026 WeakPolarHBondContact CA-O 3.41Å; L1002-F1026 PolarHBondContact N-O 2.87Å; L1002-F1026 PolarHBondContact O-N 3.27Å; K1004-F1026 HydrophobicContact CB-CE2 4.03Å; K1004-F1026 HydrophobicContact CG-CE2 4.06Å; F1007-F1026 HydrophobicContact CB-CB 4.2Å; F1007-F1026 HydrophobicContact CB-CD2 3.74Å; F1007-F1026 HydrophobicContact CB-CE2 4.41Å; F1007-F1026 HydrophobicContact CB-CG 4.04Å; F1007-F1026 HydrophobicContact CD1-CD1 4.4Å; F1007-F1026 HydrophobicContact CD1-CD2 4.26Å; F1007-F1026 HydrophobicContact CD1-CE1 4.49Å; F1007-F1026 HydrophobicContact CD1-CE2 4.35Å; F1007-F1026 HydrophobicContact CD1-CG 4.3Å; F1007-F1026 HydrophobicContact CD1-CZ 4.47Å; F1007-F1026 HydrophobicContact CD2-CB 3.62Å; F1007-F1026 HydrophobicContact CD2-CD1 4.01Å; F1007-F1026 HydrophobicContact CD2-CD2 4.25Å; F1007-F1026 AromaticContact CD2-CG 3.68Å; F1007-F1026 HydrophobicContact CD2-CG 3.68Å; F1007-F1026 HydrophobicContact CE1-CD1 4.47Å; F1007-F1026 HydrophobicContact CE1-CE1 4.46Å; F1007-F1026 HydrophobicContact CE2-CB 4.29Å; F1007-F1026 HydrophobicContact CE2-CD1 4.08Å; F1007-F1026 HydrophobicContact CE2-CG 4.22Å; F1007-F1026 HydrophobicContact CG-CB 4.05Å; F1007-F1026 HydrophobicContact CG-CD1 4.18Å; F1007-F1026 AromaticContact CG-CD2 3.81Å; F1007-F1026 HydrophobicContact CG-CD2 3.81Å; F1007-F1026 HydrophobicContact CG-CE2 4.36Å; F1007-F1026 AromaticContact CG-CG 3.73Å; F1007-F1026 HydrophobicContact CG-CG 3.73Å; F1007-F1026 HydrophobicContact CZ-CD1 4.32Å; Y1019-F1026 HydrophobicContact CD2-CD1 4.21Å; E1021-F1026 HydrophobicContact CB-CD1 4.16Å; E1021-F1026 HydrophobicContact CB-CE1 3.86Å; E1021-F1026 HydrophobicContact CG-CD1 4.45Å; E1021-F1026 HydrophobicContact CG-CE1 3.98Å; E1021-F1026 HydrophobicContact CG-CZ 4.13Å
1027	E	91.1	Very high	88.6	Confident	50 Å²	50	57.9 Å²	57.9	23%	0.234	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	121.8	164.3	-76.7	-178.1	171.2	0	0	109.1	P999 D1000 Y1019 K1020 K1022	P999-E1027 HydrophobicContact CB-CB 4.03Å; P999-E1027 HydrophobicContact CG-CB 4.07Å; P999-E1027 HydrophobicContact CG-CG 4.18Å; D1000-E1027 CarbonylContact O-C 3.59Å; D1000-E1027 WeakPolarHBondContact O-CA 3.22Å; Y1019-E1027 CarbonylContact C-O 3.53Å; Y1019-E1027 WeakPolarHBondContact CA-O 3.44Å; K1020-E1027 PolarHBondContact N-O 3.06Å; K1020-E1027 PolarHBondContact O-N 2.89Å; K1022-E1027 HydrophobicContact CD-CG 4.32Å; K1022-E1027 WeakPolarHBondContact CD-OE1 3.28Å; K1022-E1027 WeakPolarHBondContact CE-OE1 3.37Å; K1022-E1027 WeakPolarHBondContact CE-OE2 3.22Å; K1022-E1027 IonicContact NZ-OE1 2.64Å; K1022-E1027 PolarHBondContact NZ-OE1 3.38Å; K1022-E1027 IonicContact NZ-OE2 2.73Å; K1022-E1027 PolarHBondContact NZ-OE2 2.66Å
1028	C	90.3	Very high	88.9	Confident	0 Å²	0	58.1 Å²	58.1	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	139.7	-173.5	-67.9	0	0	0	0	111.7	P999 D1000 L1002 F1007 F1016 N1033	P999-C1028 CarbonylContact C-O 3.45Å; P999-C1028 WeakPolarHBondContact CA-O 3.45Å; P999-C1028 VanDerWaalsContact CB-O 3.24Å; P999-C1028 WeakPolarHBondContact CB-O 3.45Å; D1000-C1028 PolarHBondContact N-O 2.92Å; D1000-C1028 PolarHBondContact O-N 2.96Å; L1002-C1028 HydrophobicContact CD1-CB 4.18Å; F1007-C1028 VanDerWaalsContact CD2-SG 3.52Å; F1016-C1028 HydrophobicContact CD1-CB 3.62Å; F1016-C1028 HydrophobicContact CE1-CB 3.66Å; F1016-C1028 HydrophobicContact CG-CB 4.19Å; F1016-C1028 HydrophobicContact CZ-CB 4.25Å; C1028-N1033 PolarHBondContact O-OD1 2.91Å
1029	I	91.4	Very high	89.1	Confident	11 Å²	11	60.3 Å²	60.3	6%	0.056	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	115.4	170.2	-60.3	179.5	0	0	0	107.8	P999 I1017 H1018 N1033 I1034 L1046	P999-I1029 HydrophobicContact CB-CG1 4.11Å; I1017-I1029 WeakPolarHBondContact CB-O 3.44Å; I1017-I1029 PolarHBondContact N-O 3.36Å; H1018-I1029 HydrophobicContact CB-CB 4.37Å; H1018-I1029 HydrophobicContact CB-CD1 4.4Å; H1018-I1029 PolarHBondContact N-O 3.05Å; H1018-I1029 PolarHBondContact O-N 3.4Å; I1029-N1033 WeakPolarHBondContact CA-OD1 3.41Å; I1029-I1034 HydrophobicContact CG2-CD1 4.04Å; I1029-I1034 HydrophobicContact CG2-CG1 3.98Å; I1029-L1046 HydrophobicContact CD1-CD2 4.27Å; I1029-L1046 HydrophobicContact CG2-CD2 4.36Å
1030	T	90.5	Very high	89.3	Confident	15 Å²	15	61.2 Å²	61.2	9%	0.092	32%	0.322	C	S	.	.			trans	-96.6	176.1	172.7	81.9	0	0	0	0	111.2	F1016 E1032 N1033	F1016-T1030 HydrophobicContact CD1-CG2 4.1Å; F1016-T1030 HydrophobicContact CE1-CG2 4.2Å; T1030-E1032 VanDerWaalsContact C-N 3.3Å; T1030-E1032 WeakPolarHBondContact CB-OE2 3.45Å; T1030-E1032 PolarHBondContact OG1-N 3.49Å; T1030-E1032 VanDerWaalsContact OG1-N 3.13Å; T1030-E1032 PolarHBondContact OG1-OE2 3.38Å; T1030-N1033 PolarHBondContact N-OD1 3.47Å; T1030-N1033 PolarHBondContact OG1-N 3.3Å; T1030-N1033 PolarHBondContact OG1-OD1 2.86Å
1031	R	89.9	Confident	89.5	Confident	83 Å²	83	58.3 Å²	58.3	31%	0.313	32%	0.322	S	S	.	.	H	α-helix	trans	-58.3	-42.8	170.2	172.4	176.8	-172.3	134.4	15.7	111.6	I1017 N1033 I1034 E1035 I1061	I1017-R1031 HydrophobicContact CD1-CB 4.42Å; R1031-N1033 PolarHBondContact O-N 2.93Å; R1031-I1034 PolarHBondContact O-N 2.85Å; R1031-I1034 VanDerWaalsContact O-N 3.15Å; R1031-E1035 HydrophobicContact CG-CG 4.24Å; R1031-E1035 IonicContact CZ-OE1 3.28Å; R1031-E1035 VanDerWaalsContact CZ-OE1 3.24Å; R1031-E1035 IonicContact NE-OE1 2.71Å; R1031-E1035 PolarHBondContact NE-OE1 2.87Å; R1031-E1035 IonicContact NH2-OE1 3.61Å; R1031-E1035 PolarHBondContact NH2-OE1 3.14Å; R1031-E1035 PolarHBondContact O-N 3.44Å; R1031-I1061 HydrophobicContact CG-CD1 4.38Å
1032	E	90.1	Very high	89.9	Confident	96 Å²	96	54.8 Å²	54.8	45%	0.449	30%	0.304	S	S	.	.	H	α-helix	trans	-64.9	-40	-174.8	-61.8	57.7	-115.3	0	0	111.2	T1030 I1034 E1035 A1036	T1030-E1032 VanDerWaalsContact C-N 3.3Å; T1030-E1032 WeakPolarHBondContact CB-OE2 3.45Å; T1030-E1032 PolarHBondContact OG1-N 3.49Å; T1030-E1032 VanDerWaalsContact OG1-N 3.13Å; T1030-E1032 PolarHBondContact OG1-OE2 3.38Å; E1032-I1034 PolarHBondContact O-N 2.79Å; E1032-E1035 PolarHBondContact O-N 3.05Å; E1032-A1036 WeakPolarHBondContact O-CB 3.23Å; E1032-A1036 PolarHBondContact O-N 2.82Å
1033	N	92.1	Very high	90.6	Very high	25 Å²	25	51 Å²	51	13%	0.134	29%	0.288	C	S	.	.	H	α-helix	trans	-59	-37.5	177.1	-56.1	130.8	0	0	0	111.3	K998 D1000 C1028 I1029 T1030 R1031	K998-N1033 PolarHBondContact O-ND2 3.03Å; D1000-N1033 PolarHBondContact OD1-ND2 3.4Å; C1028-N1033 PolarHBondContact O-OD1 2.91Å; I1029-N1033 WeakPolarHBondContact CA-OD1 3.41Å; T1030-N1033 PolarHBondContact N-OD1 3.47Å; T1030-N1033 PolarHBondContact OG1-N 3.3Å; T1030-N1033 PolarHBondContact OG1-OD1 2.86Å; R1031-N1033 PolarHBondContact O-N 2.93Å
1034	I	93.8	Very high	91.6	Very high	4 Å²	4	41.6 Å²	41.6	2%	0.021	24%	0.244	C	C	.	.	H	α-helix	trans	-77.7	-47.4	179.3	-55.2	-178.2	0	0	0	110.8	P969 I1017 I1029 R1031 E1032 A1036 V1037 A1038 C1044 L1046 L1056 I1061	P969-I1034 HydrophobicContact CB-CG2 4.06Å; P969-I1034 HydrophobicContact CG-CG2 4.22Å; I1017-I1034 HydrophobicContact CD1-CD1 3.82Å; I1029-I1034 HydrophobicContact CG2-CD1 4.04Å; I1029-I1034 HydrophobicContact CG2-CG1 3.98Å; R1031-I1034 PolarHBondContact O-N 2.85Å; R1031-I1034 VanDerWaalsContact O-N 3.15Å; E1032-I1034 PolarHBondContact O-N 2.79Å; I1034-A1036 VanDerWaalsContact C-N 3.31Å; I1034-A1036 PolarHBondContact O-N 3.21Å; I1034-V1037 PolarHBondContact O-N 3.39Å; I1034-V1037 VanDerWaalsContact O-N 3.09Å; I1034-A1038 PolarHBondContact O-N 3.39Å; I1034-C1044 HydrophobicContact CG2-CB 4.17Å; I1034-L1046 HydrophobicContact CD1-CD1 4.36Å; I1034-L1046 HydrophobicContact CD1-CD2 4.01Å; I1034-L1046 HydrophobicContact CG1-CD2 4.13Å; I1034-L1056 HydrophobicContact CD1-CD2 3.59Å; I1034-I1061 HydrophobicContact CG2-CG2 4.4Å
1035	E	91.6	Very high	92.4	Very high	50 Å²	50	37.9 Å²	37.9	23%	0.234	21%	0.214	C	C	.	.	H	α-helix	trans	-62.7	-36.2	178.8	-70.6	-151.2	-156.2	0	0	112.2	R966 R1031 E1032 V1037 A1038 A1039	R966-E1035 IonicContact CZ-OE2 2.78Å; R966-E1035 VanDerWaalsContact NH1-CD 3.27Å; R966-E1035 IonicContact NH1-OE1 2.87Å; R966-E1035 IonicContact NH1-OE2 2.65Å; R966-E1035 PolarHBondContact NH1-OE2 3.28Å; R966-E1035 IonicContact NH2-OE2 3.55Å; R1031-E1035 HydrophobicContact CG-CG 4.24Å; R1031-E1035 IonicContact CZ-OE1 3.28Å; R1031-E1035 VanDerWaalsContact CZ-OE1 3.24Å; R1031-E1035 IonicContact NE-OE1 2.71Å; R1031-E1035 PolarHBondContact NE-OE1 2.87Å; R1031-E1035 IonicContact NH2-OE1 3.61Å; R1031-E1035 PolarHBondContact NH2-OE1 3.14Å; R1031-E1035 PolarHBondContact O-N 3.44Å; E1032-E1035 PolarHBondContact O-N 3.05Å; E1035-V1037 PolarHBondContact O-N 3.03Å; E1035-V1037 VanDerWaalsContact O-N 3.17Å; E1035-A1038 PolarHBondContact O-N 2.96Å; E1035-A1039 WeakPolarHBondContact O-CB 3.29Å; E1035-A1039 PolarHBondContact O-N 3.38Å
1036	A	93.1	Very high	92.7	Very high	49 Å²	49	35.6 Å²	35.6	41%	0.405	20%	0.199	S	C	.	.	H	α-helix	trans	-67.1	-11.7	175.6	0	0	0	0	0	114.4	E1032 I1034 K1040	E1032-A1036 WeakPolarHBondContact O-CB 3.23Å; E1032-A1036 PolarHBondContact O-N 2.82Å; I1034-A1036 VanDerWaalsContact C-N 3.31Å; I1034-A1036 PolarHBondContact O-N 3.21Å; A1036-K1040 WeakPolarHBondContact O-CD 3.39Å; A1036-K1040 VanDerWaalsContact O-CE 3.27Å; A1036-K1040 WeakPolarHBondContact O-CE 3.36Å; A1036-K1040 PolarHBondContact O-NZ 2.91Å
1037	V	94.1	Very high	92.9	Very high	7 Å²	7	38 Å²	38	4%	0.042	21%	0.211	C	C	.	.	H	α-helix	trans	-96.3	-45.4	168.1	176.9	0	0	0	0	110.8	N995 I1034 E1035 A1039 K1040 K1042 C1044	N995-V1037 HydrophobicContact CB-CG1 3.86Å; I1034-V1037 PolarHBondContact O-N 3.39Å; I1034-V1037 VanDerWaalsContact O-N 3.09Å; E1035-V1037 PolarHBondContact O-N 3.03Å; E1035-V1037 VanDerWaalsContact O-N 3.17Å; V1037-A1039 VanDerWaalsContact C-N 3.29Å; V1037-A1039 PolarHBondContact O-N 3.41Å; V1037-K1040 WeakPolarHBondContact O-CB 3.23Å; V1037-K1040 PolarHBondContact O-N 2.98Å; V1037-K1042 HydrophobicContact CG1-CB 4.21Å; V1037-C1044 HydrophobicContact CB-CB 3.83Å; V1037-C1044 HydrophobicContact CG1-CB 3.68Å
1038	A	92.8	Very high	92.8	Very high	14 Å²	14	35.9 Å²	35.9	12%	0.116	20%	0.202	C	C	.	.	H	α-helix	trans	-60.4	-37.3	178.5	0	0	0	0	0	112.5	I1034 E1035 K1040 G1041	I1034-A1038 PolarHBondContact O-N 3.39Å; E1035-A1038 PolarHBondContact O-N 2.96Å; A1038-K1040 PolarHBondContact O-N 3.25Å; A1038-G1041 PolarHBondContact O-N 3.41Å
1039	A	93.2	Very high	92.8	Very high	84 Å²	84	39.8 Å²	39.8	69%	0.694	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.2	-18.5	175.2	0	0	0	0	0	113.9	E1035 V1037 G1041	E1035-A1039 WeakPolarHBondContact O-CB 3.29Å; E1035-A1039 PolarHBondContact O-N 3.38Å; V1037-A1039 VanDerWaalsContact C-N 3.29Å; V1037-A1039 PolarHBondContact O-N 3.41Å; A1039-G1041 VanDerWaalsContact C-N 3.27Å
1040	K	93.8	Very high	92.7	Very high	137 Å²	137	40.1 Å²	40.1	60%	0.596	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.7	7.8	173.9	-64.3	167.8	-177.5	137.9	0	112.5	A1036 V1037 A1038 K1042	A1036-K1040 WeakPolarHBondContact O-CD 3.39Å; A1036-K1040 VanDerWaalsContact O-CE 3.27Å; A1036-K1040 WeakPolarHBondContact O-CE 3.36Å; A1036-K1040 PolarHBondContact O-NZ 2.91Å; V1037-K1040 WeakPolarHBondContact O-CB 3.23Å; V1037-K1040 PolarHBondContact O-N 2.98Å; A1038-K1040 PolarHBondContact O-N 3.25Å; K1040-K1042 VanDerWaalsContact C-N 3.33Å; K1040-K1042 HydrophobicContact CB-CG 4.45Å; K1040-K1042 WeakPolarHBondContact O-CG 3.44Å
1041	G	93.4	Very high	92.6	Very high	44 Å²	44	43.2 Å²	43.2	45%	0.454	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	74.6	17.8	-178.6	0	0	0	0	0	114.4	R967 A1038 A1039	R967-G1041 WeakPolarHBondContact CG-O 3.31Å; A1038-G1041 PolarHBondContact O-N 3.41Å; A1039-G1041 VanDerWaalsContact C-N 3.27Å
1042	K	95.1	Very high	92.7	Very high	55 Å²	55	39.4 Å²	39.4	24%	0.239	23%	0.23	C	C	.	.			trans	-116.9	148	-171.8	-53.5	-166.2	-177	-171.2	0	112.7	R967 A991 M992 D993 N995 V1037 K1040 C1044	R967-K1042 WeakPolarHBondContact CB-O 2.81Å; A991-K1042 PolarHBondContact O-NZ 3.39Å; M992-K1042 VanDerWaalsContact O-CD 3.23Å; M992-K1042 WeakPolarHBondContact O-CD 3.39Å; M992-K1042 WeakPolarHBondContact O-CE 3.39Å; M992-K1042 WeakPolarHBondContact O-CG 3.46Å; D993-K1042 CarbonylContact O-C 3.59Å; D993-K1042 WeakPolarHBondContact O-CA 3.13Å; D993-K1042 WeakPolarHBondContact O-CB 3.19Å; N995-K1042 HydrophobicContact CB-CD 4.35Å; V1037-K1042 HydrophobicContact CG1-CB 4.21Å; K1040-K1042 VanDerWaalsContact C-N 3.33Å; K1040-K1042 HydrophobicContact CB-CG 4.45Å; K1040-K1042 WeakPolarHBondContact O-CG 3.44Å; K1042-C1044 PolarHBondContact O-N 3.47Å
1043	H	96.2	Very high	92.8	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.1	126.1	168.4	-74.5	-78.5	0	0	0	110.4	R967 R968 V970 D993 F994 N995 Q1135	R967-H1043 PolarHBondContact NH1-CD2 3.39Å; R967-H1043 PolarHBondContact NH1-NE2 3.42Å; R968-H1043 PolarHBondContact O-ND1 3.06Å; V970-H1043 HydrophobicContact CG2-CB 4.07Å; D993-H1043 PolarHBondContact O-N 3.11Å; F994-H1043 HydrophobicContact CD1-CB 3.61Å; F994-H1043 HydrophobicContact CE1-CB 3.93Å; N995-H1043 PolarHBondContact N-O 3.35Å; H1043-Q1135 PolarHBondContact CE1-OE1 3.04Å
1044	C	96.1	Very high	92.8	Very high	1 Å²	1	36.6 Å²	36.6	1%	0.007	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	110.9	178.1	-167.7	0	0	0	0	110.6	P969 V970 C997 I1034 V1037 K1042	P969-C1044 CarbonylContact C-O 3.37Å; P969-C1044 WeakPolarHBondContact CA-O 3.43Å; P969-C1044 HydrophobicContact CB-CB 4.12Å; P969-C1044 WeakPolarHBondContact CB-O 2.75Å; V970-C1044 PolarHBondContact N-O 3.3Å; C997-C1044 WeakPolarHBondContact CB-SG 3.49Å; I1034-C1044 HydrophobicContact CG2-CB 4.17Å; V1037-C1044 HydrophobicContact CB-CB 3.83Å; V1037-C1044 HydrophobicContact CG1-CB 3.68Å; K1042-C1044 PolarHBondContact O-N 3.47Å
1045	L	96	Very high	92.6	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	122.8	179.7	-56.1	-178.4	0	0	0	110.4	V970 F972 I982 I985 F994 N995 C997	V970-L1045 HydrophobicContact CB-CD2 3.83Å; V970-L1045 HydrophobicContact CG1-CD2 4.39Å; V970-L1045 HydrophobicContact CG2-CD2 4.09Å; F972-L1045 HydrophobicContact CE2-CD2 4.06Å; F972-L1045 HydrophobicContact CZ-CD2 4.16Å; I982-L1045 HydrophobicContact CB-CD1 4.36Å; I982-L1045 HydrophobicContact CD1-CB 4.11Å; I982-L1045 HydrophobicContact CG1-CB 3.96Å; I982-L1045 HydrophobicContact CG1-CD1 4.19Å; I982-L1045 HydrophobicContact CG2-CB 4.21Å; I982-L1045 HydrophobicContact CG2-CD1 3.97Å; I985-L1045 HydrophobicContact CB-CD1 4.39Å; I985-L1045 HydrophobicContact CD1-CD1 4.38Å; I985-L1045 HydrophobicContact CG2-CD1 4.07Å; F994-L1045 HydrophobicContact CB-CD1 4.12Å; F994-L1045 HydrophobicContact CB-CG 4.36Å; F994-L1045 HydrophobicContact CD1-CD2 3.78Å; F994-L1045 HydrophobicContact CD1-CG 4.42Å; N995-L1045 PolarHBondContact O-N 3.47Å; C997-L1045 WeakPolarHBondContact CB-O 3.07Å; C997-L1045 PolarHBondContact N-O 3.02Å
1046	L	94.3	Very high	92.7	Very high	2 Å²	2	36.1 Å²	36.1	1%	0.01	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	124.4	-175.3	-63.1	175.6	0	0	0	112	P969 V970 L971 C997 I1029 I1034 A1048 L1056	P969-L1046 HydrophobicContact CB-CD1 3.88Å; P969-L1046 HydrophobicContact CB-CG 4.26Å; V970-L1046 PolarHBondContact O-N 2.73Å; L971-L1046 HydrophobicContact CD2-CB 3.63Å; L971-L1046 HydrophobicContact CD2-CD1 3.98Å; L971-L1046 HydrophobicContact CD2-CG 4.45Å; L971-L1046 HydrophobicContact CG-CB 4.28Å; L971-L1046 HydrophobicContact CG-CD1 4.02Å; C997-L1046 HydrophobicContact CB-CD2 3.66Å; I1029-L1046 HydrophobicContact CD1-CD2 4.27Å; I1029-L1046 HydrophobicContact CG2-CD2 4.36Å; I1034-L1046 HydrophobicContact CD1-CD1 4.36Å; I1034-L1046 HydrophobicContact CD1-CD2 4.01Å; I1034-L1046 HydrophobicContact CG1-CD2 4.13Å; L1046-A1048 HydrophobicContact CB-CB 4.5Å; L1046-A1048 PolarHBondContact O-N 3.24Å; L1046-L1056 HydrophobicContact CD1-CD1 4.1Å
1047	E	91.3	Very high	92.7	Very high	70 Å²	70	34.1 Å²	34.1	33%	0.327	20%	0.197	S	C	.	.			trans	-90.5	71.1	166.3	-168.8	178.6	145.2	0	0	108.9	K979 I982	K979-E1047 HydrophobicContact CB-CG 4.45Å; K979-E1047 WeakPolarHBondContact CG-OE2 3.21Å; K979-E1047 IonicContact NZ-OE1 3.98Å; I982-E1047 HydrophobicContact CD1-CB 4.38Å
1048	A	90	Very high	92.6	Very high	7 Å²	7	39.9 Å²	39.9	6%	0.058	22%	0.218	C	C	.	.			trans	-139.3	160.8	-176.4	0	0	0	0	0	112.5	L971 H1018 L1046	L971-A1048 HydrophobicContact CD2-CB 4.06Å; H1018-A1048 HydrophobicContact CB-CB 3.94Å; L1046-A1048 HydrophobicContact CB-CB 4.5Å; L1046-A1048 PolarHBondContact O-N 3.24Å
1049	E	89.3	Confident	92.4	Very high	82 Å²	82	40.7 Å²	40.7	38%	0.383	22%	0.218	S	C	.	.			trans	-81.8	163.5	174.4	-65.2	-149	139.6	0	0	112.9	S1051 C1052 K1098	E1049-S1051 PolarHBondContact O-N 3.48Å; E1049-S1051 VanDerWaalsContact O-N 3.12Å; E1049-C1052 PolarHBondContact O-N 3.14Å; E1049-C1052 PolarHBondContact O-SG 3.26Å; E1049-K1098 IonicContact OE1-NZ 2.98Å; E1049-K1098 PolarHBondContact OE1-NZ 3.43Å; E1049-K1098 IonicContact OE2-NZ 2.71Å; E1049-K1098 PolarHBondContact OE2-NZ 3.43Å
1050	L	90.5	Very high	92.3	Very high	18 Å²	18	43.4 Å²	43.4	9%	0.094	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-16.9	-178.8	-67.6	174	0	0	0	114.4	T973 C1052 V1053 I1065 E1101 L1102 I1105	T973-L1050 HydrophobicContact CG2-CD1 4.19Å; T973-L1050 HydrophobicContact CG2-CD2 4.02Å; L1050-C1052 PolarHBondContact O-N 2.92Å; L1050-V1053 HydrophobicContact CD2-CG2 4.49Å; L1050-V1053 WeakPolarHBondContact O-CB 3.2Å; L1050-V1053 VanDerWaalsContact O-CG2 3.28Å; L1050-V1053 WeakPolarHBondContact O-CG2 3.47Å; L1050-V1053 PolarHBondContact O-N 3.18Å; L1050-I1065 HydrophobicContact CD2-CG2 3.94Å; L1050-E1101 HydrophobicContact CD1-CB 3.89Å; L1050-L1102 HydrophobicContact CD1-CD2 4.02Å; L1050-L1102 HydrophobicContact CD1-CG 4.49Å; L1050-I1105 HydrophobicContact CD1-CD1 4.19Å; L1050-I1105 HydrophobicContact CD2-CD1 3.92Å; L1050-I1105 HydrophobicContact CG-CD1 4.46Å
1051	S	88.3	Confident	92.3	Very high	80 Å²	80	37.7 Å²	37.7	56%	0.559	19%	0.192	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.8	-36.3	174.6	46.5	0	0	0	0	113.1	E1049 V1053	E1049-S1051 PolarHBondContact O-N 3.48Å; E1049-S1051 VanDerWaalsContact O-N 3.12Å; S1051-V1053 PolarHBondContact O-N 3.33Å; S1051-V1053 VanDerWaalsContact O-N 3.14Å
1052	C	90.9	Very high	92.4	Very high	2 Å²	2	37.1 Å²	37.1	1%	0.014	18%	0.177	C	C	.	.	H	α-helix	trans	-68.5	-10.3	-179.4	71.7	0	0	0	0	114.7	I1017 H1018 E1049 L1050 K1054 D1055 L1056	I1017-C1052 HydrophobicContact CG2-CB 4.04Å; I1017-C1052 WeakPolarHBondContact O-CB 3.41Å; H1018-C1052 HydrophobicContact CB-CB 4.4Å; E1049-C1052 PolarHBondContact O-N 3.14Å; E1049-C1052 PolarHBondContact O-SG 3.26Å; L1050-C1052 PolarHBondContact O-N 2.92Å; C1052-K1054 VanDerWaalsContact C-N 3.34Å; C1052-K1054 PolarHBondContact O-N 3.01Å; C1052-D1055 PolarHBondContact O-N 3.23Å; C1052-L1056 WeakPolarHBondContact O-CG 3.31Å; C1052-L1056 PolarHBondContact O-N 3.45Å
1053	V	93.3	Very high	92.4	Very high	1 Å²	1	34.6 Å²	34.6	1%	0.006	17%	0.166	C	C	.	.	H	α-helix	trans	-64.6	-36.6	-175	177	0	0	0	0	112.2	L971 L1050 S1051 L1057 P1063 I1065 I1105	L971-V1053 HydrophobicContact CD1-CG2 3.55Å; L1050-V1053 HydrophobicContact CD2-CG2 4.49Å; L1050-V1053 WeakPolarHBondContact O-CB 3.2Å; L1050-V1053 VanDerWaalsContact O-CG2 3.28Å; L1050-V1053 WeakPolarHBondContact O-CG2 3.47Å; L1050-V1053 PolarHBondContact O-N 3.18Å; S1051-V1053 PolarHBondContact O-N 3.33Å; S1051-V1053 VanDerWaalsContact O-N 3.14Å; V1053-L1057 HydrophobicContact CG1-CD1 3.72Å; V1053-L1057 HydrophobicContact CG1-CG 4.4Å; V1053-L1057 WeakPolarHBondContact O-CB 3.43Å; V1053-L1057 WeakPolarHBondContact O-CD1 3.49Å; V1053-L1057 VanDerWaalsContact O-CG 3.26Å; V1053-L1057 WeakPolarHBondContact O-CG 3.36Å; V1053-L1057 PolarHBondContact O-N 2.92Å; V1053-L1057 VanDerWaalsContact O-N 3.09Å; V1053-P1063 HydrophobicContact CG1-CG 4.15Å; V1053-I1065 HydrophobicContact CB-CD1 4.47Å; V1053-I1065 HydrophobicContact CG1-CD1 3.86Å; V1053-I1065 HydrophobicContact CG2-CD1 3.73Å; V1053-I1105 HydrophobicContact CG1-CG2 3.9Å
1054	K	91.9	Very high	92.5	Very high	61 Å²	61	34.7 Å²	34.7	27%	0.265	17%	0.166	S	C	.	.	H	α-helix	trans	-63.8	-45	174.5	-64.7	-158.7	177.2	-158.4	0	111	C1052 L1056 L1057 R1058 P1106 L1145	C1052-K1054 VanDerWaalsContact C-N 3.34Å; C1052-K1054 PolarHBondContact O-N 3.01Å; K1054-L1056 PolarHBondContact O-N 3.45Å; K1054-L1057 PolarHBondContact O-N 3.36Å; K1054-R1058 WeakPolarHBondContact O-CB 3.44Å; K1054-R1058 VanDerWaalsContact O-CG 3.26Å; K1054-R1058 WeakPolarHBondContact O-CG 3.41Å; K1054-R1058 PolarHBondContact O-N 2.89Å; K1054-P1106 HydrophobicContact CG-CG 4.31Å; K1054-L1145 WeakPolarHBondContact CD-O 3.45Å; K1054-L1145 WeakPolarHBondContact CE-O 3.17Å; K1054-L1145 PolarHBondContact NZ-O 2.89Å
1055	D	90.5	Very high	92.5	Very high	44 Å²	44	34.7 Å²	34.7	24%	0.235	17%	0.166	C	C	.	.	H	α-helix	trans	-72	-26.9	-178.3	-70.9	-64.7	0	0	0	114.6	C1052 R1058 R1059	C1052-D1055 PolarHBondContact O-N 3.23Å; D1055-R1058 VanDerWaalsContact CG-NH1 3.28Å; D1055-R1058 IonicContact OD1-CZ 3.75Å; D1055-R1058 IonicContact OD1-NH1 2.65Å; D1055-R1058 PolarHBondContact OD1-NH1 3.4Å; D1055-R1058 IonicContact OD2-NH1 3.46Å; D1055-R1058 PolarHBondContact OD2-NH1 3.47Å; D1055-R1059 WeakPolarHBondContact O-CD 3.45Å; D1055-R1059 WeakPolarHBondContact O-CG 3.42Å; D1055-R1059 PolarHBondContact O-NH1 3.13Å; D1055-R1059 IonicContact OD1-NH1 2.68Å
1056	L	92.9	Very high	92.5	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-63.6	-52.5	164.6	-75.8	164.6	0	0	0	110.7	L971 I1017 I1034 L1046 C1052 K1054 R1059 E1060 I1061 P1063	L971-L1056 HydrophobicContact CD1-CD1 3.93Å; I1017-L1056 HydrophobicContact CD1-CD2 4.2Å; I1017-L1056 HydrophobicContact CG2-CD2 3.75Å; I1017-L1056 HydrophobicContact CG2-CG 3.72Å; I1034-L1056 HydrophobicContact CD1-CD2 3.59Å; L1046-L1056 HydrophobicContact CD1-CD1 4.1Å; C1052-L1056 WeakPolarHBondContact O-CG 3.31Å; C1052-L1056 PolarHBondContact O-N 3.45Å; K1054-L1056 PolarHBondContact O-N 3.45Å; L1056-R1059 CarbonylContact O-C 3.6Å; L1056-R1059 WeakPolarHBondContact O-CA 3.49Å; L1056-R1059 PolarHBondContact O-N 2.89Å; L1056-E1060 PolarHBondContact O-N 2.91Å; L1056-I1061 CarbonylContact C-O 2.89Å; L1056-I1061 HydrophobicContact CB-CB 4.3Å; L1056-I1061 WeakPolarHBondContact CB-O 3.41Å; L1056-I1061 HydrophobicContact CD2-CB 3.98Å; L1056-I1061 HydrophobicContact CD2-CD1 4.29Å; L1056-I1061 HydrophobicContact CD2-CG2 3.7Å; L1056-I1061 WeakPolarHBondContact O-CA 3.4Å; L1056-I1061 WeakPolarHBondContact O-CB 3.48Å; L1056-I1061 PolarHBondContact O-N 3.39Å; L1056-P1063 HydrophobicContact CD1-CB 4.19Å; L1056-P1063 HydrophobicContact CD1-CG 4.02Å
1057	L	93.2	Very high	92.5	Very high	7 Å²	7	34.8 Å²	34.8	4%	0.037	17%	0.167	C	C	.	.	H	α-helix	trans	-68.9	-36.6	-174.1	-70.5	167.4	0	0	0	113.2	V1053 K1054 R1059 E1060 I1061 Y1062 P1106 C1107 V1141 L1146	V1053-L1057 HydrophobicContact CG1-CD1 3.72Å; V1053-L1057 HydrophobicContact CG1-CG 4.4Å; V1053-L1057 WeakPolarHBondContact O-CB 3.43Å; V1053-L1057 WeakPolarHBondContact O-CD1 3.49Å; V1053-L1057 VanDerWaalsContact O-CG 3.26Å; V1053-L1057 WeakPolarHBondContact O-CG 3.36Å; V1053-L1057 PolarHBondContact O-N 2.92Å; V1053-L1057 VanDerWaalsContact O-N 3.09Å; K1054-L1057 PolarHBondContact O-N 3.36Å; L1057-R1059 PolarHBondContact O-N 3.26Å; L1057-E1060 PolarHBondContact O-N 3.34Å; L1057-I1061 PolarHBondContact N-O 3.13Å; L1057-Y1062 HydrophobicContact CD2-CD1 3.41Å; L1057-Y1062 VanDerWaalsContact CD2-CD1 3.41Å; L1057-Y1062 HydrophobicContact CD2-CE1 4.06Å; L1057-Y1062 HydrophobicContact CD2-CG 4.26Å; L1057-P1106 HydrophobicContact CD1-CG 3.7Å; L1057-C1107 HydrophobicContact CD1-CB 4.2Å; L1057-V1141 HydrophobicContact CD2-CG1 4.5Å; L1057-V1141 HydrophobicContact CD2-CG2 4.21Å; L1057-L1146 HydrophobicContact CB-CD1 4.18Å; L1057-L1146 HydrophobicContact CB-CD2 3.5Å; L1057-L1146 VanDerWaalsContact CB-CD2 3.5Å; L1057-L1146 HydrophobicContact CD1-CD2 4.03Å; L1057-L1146 HydrophobicContact CG-CD2 4.42Å
1058	R	91.1	Very high	92.5	Very high	128 Å²	128	31.5 Å²	31.5	48%	0.483	15%	0.151	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.1	-21.2	169.6	-70.7	169.7	-169.5	150.5	-5.4	113.5	K1054 D1055 L1146	K1054-R1058 WeakPolarHBondContact O-CB 3.44Å; K1054-R1058 VanDerWaalsContact O-CG 3.26Å; K1054-R1058 WeakPolarHBondContact O-CG 3.41Å; K1054-R1058 PolarHBondContact O-N 2.89Å; D1055-R1058 VanDerWaalsContact CG-NH1 3.28Å; D1055-R1058 IonicContact OD1-CZ 3.75Å; D1055-R1058 IonicContact OD1-NH1 2.65Å; D1055-R1058 PolarHBondContact OD1-NH1 3.4Å; D1055-R1058 IonicContact OD2-NH1 3.46Å; D1055-R1058 PolarHBondContact OD2-NH1 3.47Å; R1058-L1146 HydrophobicContact CG-CB 4.25Å; R1058-L1146 PolarHBondContact NE-O 2.68Å; R1058-L1146 PolarHBondContact NH2-O 3.04Å
1059	R	89.8	Confident	92.5	Very high	31 Å²	31	32.3 Å²	32.3	12%	0.117	15%	0.153	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.7	13.8	176.7	-68.6	173.2	178.9	68.9	-0.3	113	E1014 P1015 D1055 L1056 L1057 I1061	E1014-R1059 IonicContact OE1-NE 3.84Å; P1015-R1059 PolarHBondContact O-NH2 2.97Å; D1055-R1059 WeakPolarHBondContact O-CD 3.45Å; D1055-R1059 WeakPolarHBondContact O-CG 3.42Å; D1055-R1059 PolarHBondContact O-NH1 3.13Å; D1055-R1059 IonicContact OD1-NH1 2.68Å; L1056-R1059 CarbonylContact O-C 3.6Å; L1056-R1059 WeakPolarHBondContact O-CA 3.49Å; L1056-R1059 PolarHBondContact O-N 2.89Å; L1057-R1059 PolarHBondContact O-N 3.26Å; R1059-I1061 HydrophobicContact CB-CD1 4.2Å; R1059-I1061 HydrophobicContact CB-CG1 4.11Å; R1059-I1061 PolarHBondContact O-N 2.8Å
1060	E	91.8	Very high	92.4	Very high	141 Å²	141	28.5 Å²	28.5	66%	0.659	14%	0.135	S	C	*	.	T	Hydrogen-bonded Turn	trans	61	22.5	-174.6	-52.2	179.2	151.3	0	0	113.6	L1056 L1057 Y1062	L1056-E1060 PolarHBondContact O-N 2.91Å; L1057-E1060 PolarHBondContact O-N 3.34Å; E1060-Y1062 HydrophobicContact CB-CE2 4.32Å; E1060-Y1062 VanDerWaalsContact O-CD2 3.29Å; E1060-Y1062 WeakPolarHBondContact O-CD2 3.21Å; E1060-Y1062 WeakPolarHBondContact O-CE2 3.44Å
1061	I	93.4	Very high	92.2	Very high	18 Å²	18	28.3 Å²	28.3	9%	0.092	14%	0.136	C	C	.	.			trans	-97.6	108.8	175.8	-50.4	178.5	0	0	0	108.2	P969 I1017 R1031 I1034 L1056 L1057 R1059 P1063	P969-I1061 HydrophobicContact CG-CG2 3.58Å; I1017-I1061 HydrophobicContact CD1-CD1 4.06Å; R1031-I1061 HydrophobicContact CG-CD1 4.38Å; I1034-I1061 HydrophobicContact CG2-CG2 4.4Å; L1056-I1061 CarbonylContact C-O 2.89Å; L1056-I1061 HydrophobicContact CB-CB 4.3Å; L1056-I1061 WeakPolarHBondContact CB-O 3.41Å; L1056-I1061 HydrophobicContact CD2-CB 3.98Å; L1056-I1061 HydrophobicContact CD2-CD1 4.29Å; L1056-I1061 HydrophobicContact CD2-CG2 3.7Å; L1056-I1061 WeakPolarHBondContact O-CA 3.4Å; L1056-I1061 WeakPolarHBondContact O-CB 3.48Å; L1056-I1061 PolarHBondContact O-N 3.39Å; L1057-I1061 PolarHBondContact N-O 3.13Å; R1059-I1061 HydrophobicContact CB-CD1 4.2Å; R1059-I1061 HydrophobicContact CB-CG1 4.11Å; R1059-I1061 PolarHBondContact O-N 2.8Å; I1061-P1063 WeakPolarHBondContact O-CD 3.24Å
1062	Y	95.1	Very high	92	Very high	32 Å²	32	29.5 Å²	29.5	13%	0.125	13%	0.132	C	C	.	.			trans	-98.1	93.6	-174.3	-52.4	-78.6	0	0	0	112.4	Q962 R968 L1057 E1060 I1139 V1141	Q962-Y1062 HydrophobicContact CB-CD1 4.26Å; Q962-Y1062 HydrophobicContact CB-CE1 3.86Å; Q962-Y1062 HydrophobicContact CB-CE2 4.36Å; Q962-Y1062 HydrophobicContact CG-CD1 4.47Å; Q962-Y1062 HydrophobicContact CG-CE1 3.75Å; R968-Y1062 WeakPolarHBondContact CB-O 3.43Å; R968-Y1062 VanDerWaalsContact CG-O 3.26Å; R968-Y1062 WeakPolarHBondContact CG-O 3.41Å; R968-Y1062 PolarHBondContact NE-O 2.96Å; L1057-Y1062 HydrophobicContact CD2-CD1 3.41Å; L1057-Y1062 VanDerWaalsContact CD2-CD1 3.41Å; L1057-Y1062 HydrophobicContact CD2-CE1 4.06Å; L1057-Y1062 HydrophobicContact CD2-CG 4.26Å; E1060-Y1062 HydrophobicContact CB-CE2 4.32Å; E1060-Y1062 VanDerWaalsContact O-CD2 3.29Å; E1060-Y1062 WeakPolarHBondContact O-CD2 3.21Å; E1060-Y1062 WeakPolarHBondContact O-CE2 3.44Å; Y1062-I1139 HydrophobicContact CD1-CG2 4.17Å; Y1062-I1139 HydrophobicContact CD2-CD1 4.38Å; Y1062-I1139 HydrophobicContact CG-CD1 4.04Å; Y1062-I1139 HydrophobicContact CG-CG2 4.32Å; Y1062-V1141 HydrophobicContact CD1-CG2 3.89Å; Y1062-V1141 HydrophobicContact CE1-CG2 3.96Å
1063	P	95.9	Very high	91.6	Very high	1 Å²	1	37.5 Å²	37.5	1%	0.006	17%	0.167	C	C	.	.			trans	-65.2	155.5	-177.7	28	-36.5	0	0	0	113.3	R968 P969 L971 V1053 L1056 I1061 I1065	R968-P1063 PolarHBondContact NH2-O 3.01Å; P969-P1063 HydrophobicContact CG-CB 4.28Å; P969-P1063 CarbonylContact O-C 3.57Å; P969-P1063 WeakPolarHBondContact O-CA 3.13Å; L971-P1063 HydrophobicContact CD1-CB 4.09Å; L971-P1063 HydrophobicContact CD1-CG 4.39Å; V1053-P1063 HydrophobicContact CG1-CG 4.15Å; L1056-P1063 HydrophobicContact CD1-CB 4.19Å; L1056-P1063 HydrophobicContact CD1-CG 4.02Å; I1061-P1063 WeakPolarHBondContact O-CD 3.24Å; P1063-I1065 HydrophobicContact CB-CG1 4.26Å; P1063-I1065 HydrophobicContact CG-CD1 4.3Å; P1063-I1065 HydrophobicContact CG-CG1 4.23Å
1064	I	97.2	Very high	91.2	Very high	2 Å²	2	37.5 Å²	37.5	1%	0.01	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	124.7	158	-65.4	169	0	0	0	106.7	R968 P969 V970 L971 V1066 I1131 E1134 Q1135	R968-I1064 HydrophobicContact CB-CD1 3.89Å; R968-I1064 HydrophobicContact CB-CG1 3.81Å; R968-I1064 HydrophobicContact CG-CG1 4.47Å; R968-I1064 VanDerWaalsContact CZ-CG1 3.47Å; P969-I1064 PolarHBondContact O-N 2.9Å; V970-I1064 WeakPolarHBondContact CA-O 3.27Å; V970-I1064 HydrophobicContact CG2-CB 4.46Å; L971-I1064 PolarHBondContact N-O 2.88Å; I1064-V1066 HydrophobicContact CG2-CG2 4.09Å; I1064-I1131 HydrophobicContact CD1-CG2 3.89Å; I1064-I1131 HydrophobicContact CG2-CG1 4.45Å; I1064-E1134 HydrophobicContact CD1-CB 4.15Å; I1064-E1134 HydrophobicContact CG1-CB 4.11Å; I1064-E1134 HydrophobicContact CG2-CB 3.75Å; I1064-E1134 HydrophobicContact CG2-CG 4.1Å; I1064-Q1135 HydrophobicContact CD1-CB 4.03Å
1065	I	96.8	Very high	90.9	Very high	2 Å²	2	35 Å²	35	1%	0.01	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	114.2	-177.2	-57	172.5	0	0	0	107.5	L971 T973 L1050 V1053 P1063 I1105 A1110	L971-I1065 HydrophobicContact CB-CG1 4.44Å; L971-I1065 HydrophobicContact CD1-CG1 4.47Å; T973-I1065 HydrophobicContact CG2-CG2 4.11Å; L1050-I1065 HydrophobicContact CD2-CG2 3.94Å; V1053-I1065 HydrophobicContact CB-CD1 4.47Å; V1053-I1065 HydrophobicContact CG1-CD1 3.86Å; V1053-I1065 HydrophobicContact CG2-CD1 3.73Å; P1063-I1065 HydrophobicContact CB-CG1 4.26Å; P1063-I1065 HydrophobicContact CG-CD1 4.3Å; P1063-I1065 HydrophobicContact CG-CG1 4.23Å; I1065-I1105 HydrophobicContact CD1-CD1 4.15Å; I1065-I1105 HydrophobicContact CD1-CG2 3.85Å; I1065-A1110 PolarHBondContact O-N 2.93Å
1066	V	96.3	Very high	90.5	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	111.9	179.7	-176.6	0	0	0	0	108.9	V970 L971 F972 T973 I1064 L1112 I1127 I1131	V970-V1066 HydrophobicContact CG1-CG2 4.36Å; L971-V1066 PolarHBondContact O-N 2.98Å; F972-V1066 HydrophobicContact CD1-CB 3.97Å; F972-V1066 HydrophobicContact CD1-CG1 4.48Å; F972-V1066 HydrophobicContact CE1-CB 4.19Å; F972-V1066 HydrophobicContact CE1-CG2 4.34Å; T973-V1066 PolarHBondContact N-O 3Å; I1064-V1066 HydrophobicContact CG2-CG2 4.09Å; V1066-L1112 HydrophobicContact CG1-CD1 3.83Å; V1066-L1112 HydrophobicContact CG1-CG 4.05Å; V1066-I1127 HydrophobicContact CG1-CG1 4.41Å; V1066-I1131 HydrophobicContact CG2-CG1 3.96Å
1067	Y	93.5	Very high	90	Very high	4 Å²	4	41.4 Å²	41.4	2%	0.016	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	118	174.5	170.9	-120.4	0	0	0	110.3	T973 K1069 E1099 L1102 Y1109 A1110 T1111 L1112	T973-Y1067 HydrophobicContact CG2-CD2 4.08Å; T973-Y1067 HydrophobicContact CG2-CG 4.42Å; T973-Y1067 CarbonylContact O-C 3.6Å; T973-Y1067 WeakPolarHBondContact O-CA 3.33Å; Y1067-K1069 HydrophobicContact CE1-CB 3.77Å; Y1067-K1069 HydrophobicContact CE1-CD 4.28Å; Y1067-K1069 HydrophobicContact CE1-CG 4.13Å; Y1067-E1099 HydrophobicContact CE2-CG 4.36Å; Y1067-E1099 PolarHBondContact OH-OE2 2.64Å; Y1067-L1102 HydrophobicContact CD1-CD1 3.9Å; Y1067-L1102 HydrophobicContact CD2-CD1 3.85Å; Y1067-L1102 HydrophobicContact CE1-CD1 4.21Å; Y1067-L1102 HydrophobicContact CE2-CD1 4.13Å; Y1067-L1102 HydrophobicContact CG-CD1 3.74Å; Y1067-Y1109 HydrophobicContact CD1-CE2 4.39Å; Y1067-A1110 PolarHBondContact N-O 3.32Å; Y1067-T1111 HydrophobicContact CD1-CG2 3.84Å; Y1067-T1111 HydrophobicContact CE1-CG2 4.19Å; Y1067-T1111 CarbonylContact O-C 3.54Å; Y1067-T1111 WeakPolarHBondContact O-CA 3.46Å; Y1067-L1112 PolarHBondContact O-N 2.8Å
1068	V	91.8	Very high	89.2	Confident	1 Å²	1	41.4 Å²	41.4	1%	0.006	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	108.7	176.2	-171.6	0	0	0	0	108.4	T973 P974 L977 I981 I1070 L1123 I1127	T973-V1068 PolarHBondContact O-N 2.71Å; P974-V1068 WeakPolarHBondContact CD-O 3.47Å; L977-V1068 HydrophobicContact CD1-CB 4.32Å; L977-V1068 HydrophobicContact CD1-CG1 4.42Å; I981-V1068 HydrophobicContact CD1-CG2 4.29Å; V1068-I1070 HydrophobicContact CG1-CD1 3.9Å; V1068-I1070 PolarHBondContact O-N 3.14Å; V1068-L1123 HydrophobicContact CG1-CD1 4.02Å; V1068-L1123 HydrophobicContact CG1-CD2 4.35Å; V1068-I1127 HydrophobicContact CG2-CD1 4.37Å
1069	K	89.5	Confident	88.1	Confident	24 Å²	24	44.1 Å²	44.1	10%	0.104	19%	0.193	C	C	.	.			trans	-78.1	119.1	-174.2	-176	163.4	152.8	-176.4	0	111.4	N912 Y1067 N1074 T1111 L1112 E1113 P1114	N912-K1069 WeakPolarHBondContact OD1-CE 3.49Å; N912-K1069 PolarHBondContact OD1-NZ 2.69Å; Y1067-K1069 HydrophobicContact CE1-CB 3.77Å; Y1067-K1069 HydrophobicContact CE1-CD 4.28Å; Y1067-K1069 HydrophobicContact CE1-CG 4.13Å; K1069-N1074 PolarHBondContact O-ND2 3.43Å; K1069-T1111 HydrophobicContact CB-CG2 4.44Å; K1069-T1111 HydrophobicContact CD-CG2 4.32Å; K1069-L1112 VanDerWaalsContact CB-O 3.3Å; K1069-L1112 WeakPolarHBondContact CB-O 3.44Å; K1069-L1112 PolarHBondContact N-O 2.81Å; K1069-L1112 VanDerWaalsContact N-O 3.11Å; K1069-E1113 WeakPolarHBondContact CD-OE1 3.41Å; K1069-E1113 WeakPolarHBondContact CD-OE2 3.41Å; K1069-E1113 WeakPolarHBondContact CE-OE2 3.26Å; K1069-E1113 IonicContact NZ-OE1 2.65Å; K1069-E1113 PolarHBondContact NZ-OE1 2.92Å; K1069-E1113 IonicContact NZ-OE2 3.41Å; K1069-E1113 PolarHBondContact NZ-OE2 2.92Å; K1069-P1114 HydrophobicContact CB-CG 4.39Å; K1069-P1114 HydrophobicContact CD-CG 4.48Å; K1069-P1114 HydrophobicContact CG-CG 4.03Å
1070	I	87.4	Confident	86.9	Confident	1 Å²	1	51.6 Å²	51.6	1%	0.005	23%	0.226	C	C	.	.			trans	-109.2	135.3	-173.7	-54.2	-52.3	0	0	0	111.2	L977 V1068 N1074 V1075 L1078 F1091 V1092 C1095	L977-I1070 HydrophobicContact CD1-CD1 4.01Å; L977-I1070 HydrophobicContact CD1-CG1 4.21Å; V1068-I1070 HydrophobicContact CG1-CD1 3.9Å; V1068-I1070 PolarHBondContact O-N 3.14Å; I1070-N1074 WeakPolarHBondContact CA-OD1 3.32Å; I1070-V1075 HydrophobicContact CG2-CB 4.26Å; I1070-L1078 HydrophobicContact CD1-CD1 3.77Å; I1070-F1091 HydrophobicContact CG2-CD1 4.33Å; I1070-F1091 HydrophobicContact CG2-CE1 4.25Å; I1070-V1092 HydrophobicContact CG2-CG2 4.21Å; I1070-C1095 HydrophobicContact CB-CB 4.24Å
1071	C	85.4	Confident	85.6	Confident	15 Å²	15	46.2 Å²	46.2	10%	0.101	20%	0.202	C	C	.	.			trans	-147.4	167.9	179.1	68.4	0	0	0	0	111.5	K1073 N1074 V1075	C1071-K1073 PolarHBondContact O-N 3.08Å; C1071-N1074 PolarHBondContact N-OD1 2.96Å; C1071-N1074 PolarHBondContact O-N 3.1Å; C1071-N1074 PolarHBondContact O-OD1 3.23Å; C1071-N1074 VanDerWaalsContact O-OD1 3.06Å; C1071-V1075 PolarHBondContact O-N 3.29Å
1072	E	84.7	Confident	84	Confident	104 Å²	104	50.3 Å²	50.3	49%	0.486	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.7	-26.1	-178.8	-56.9	100.7	-137.2	0	0	113.6	R1096	E1072-R1096 IonicContact OE1-CZ 3.59Å; E1072-R1096 IonicContact OE1-NH1 4Å; E1072-R1096 PolarHBondContact OE1-NH1 3.46Å; E1072-R1096 IonicContact OE1-NH2 2.77Å; E1072-R1096 PolarHBondContact OE1-NH2 3.27Å
1073	K	82.3	Confident	82.4	Confident	171 Å²	171	51.2 Å²	51.2	74%	0.743	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.4	-33.7	177.1	-59.5	-175.9	-177.6	179.6	0	113.4	C1071	C1071-K1073 PolarHBondContact O-N 3.08Å
1074	N	84.7	Confident	80.6	Confident	1 Å²	1	63.5 Å²	63.5	1%	0.005	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108	-17.2	-173.2	79.6	-3.6	0	0	0	114.5	K1069 I1070 C1071 K1076 K1077 P1114 W1117	K1069-N1074 PolarHBondContact O-ND2 3.43Å; I1070-N1074 WeakPolarHBondContact CA-OD1 3.32Å; C1071-N1074 PolarHBondContact N-OD1 2.96Å; C1071-N1074 PolarHBondContact O-N 3.1Å; C1071-N1074 PolarHBondContact O-OD1 3.23Å; C1071-N1074 VanDerWaalsContact O-OD1 3.06Å; N1074-K1076 PolarHBondContact O-N 3.33Å; N1074-K1077 HydrophobicContact CB-CD 4.02Å; N1074-K1077 WeakPolarHBondContact O-CB 3.46Å; N1074-K1077 WeakPolarHBondContact O-CG 3.5Å; N1074-K1077 PolarHBondContact O-N 3.21Å; N1074-P1114 HydrophobicContact CB-CB 4.33Å; N1074-P1114 WeakPolarHBondContact ND2-CA 3.45Å; N1074-P1114 WeakPolarHBondContact ND2-CB 3.42Å; N1074-W1117 HydrophobicContact CB-CH2 4.14Å; N1074-W1117 HydrophobicContact CB-CZ2 4.02Å; N1074-W1117 VanDerWaalsContact ND2-CZ2 3.3Å; N1074-W1117 WeakPolarHBondContact ND2-CZ2 3.3Å
1075	V	85.9	Confident	78.8	Confident	8 Å²	8	66 Å²	66	5%	0.048	30%	0.298	C	S	.	.	G	3₁₀ helix	trans	-55.8	-36.2	174.5	65.6	0	0	0	0	111.9	I1070 C1071 K1077 L1078 E1088 F1091 V1092	I1070-V1075 HydrophobicContact CG2-CB 4.26Å; C1071-V1075 PolarHBondContact O-N 3.29Å; V1075-K1077 PolarHBondContact O-N 2.95Å; V1075-K1077 VanDerWaalsContact O-N 3.12Å; V1075-L1078 WeakPolarHBondContact O-CA 3.43Å; V1075-L1078 WeakPolarHBondContact O-CB 3.49Å; V1075-L1078 PolarHBondContact O-N 3.38Å; V1075-E1088 HydrophobicContact CG1-CB 4.12Å; V1075-E1088 HydrophobicContact CG2-CB 4.02Å; V1075-E1088 HydrophobicContact CG2-CG 4.3Å; V1075-F1091 HydrophobicContact CG2-CD1 3.99Å; V1075-V1092 HydrophobicContact CB-CG2 3.91Å; V1075-V1092 HydrophobicContact CG1-CG2 3.93Å; V1075-V1092 HydrophobicContact CG2-CG2 4.23Å
1076	K	82.6	Confident	77	Confident	114 Å²	114	75.2 Å²	75.2	50%	0.496	34%	0.341	S	S	.	.	G	3₁₀ helix	trans	-63.8	-15.5	175.4	-73.1	171	-177	174.5	0	114.5	N1074 R1079 E1088	N1074-K1076 PolarHBondContact O-N 3.33Å; K1076-R1079 PolarHBondContact O-NE 3.44Å; K1076-R1079 PolarHBondContact O-NH2 3.15Å; K1076-E1088 WeakPolarHBondContact CE-OE2 3.43Å; K1076-E1088 WeakPolarHBondContact CG-OE1 3.12Å; K1076-E1088 WeakPolarHBondContact CG-OE2 3.28Å
1077	K	81.7	Confident	76.2	Confident	64 Å²	64	77.3 Å²	77.3	28%	0.278	36%	0.355	S	S	.	.	G	3₁₀ helix	trans	-79.3	-18.8	170.3	-54.3	173.4	-176.6	172.1	0	111.9	N1074 V1075 P1114 W1117 T1118	N1074-K1077 HydrophobicContact CB-CD 4.02Å; N1074-K1077 WeakPolarHBondContact O-CB 3.46Å; N1074-K1077 WeakPolarHBondContact O-CG 3.5Å; N1074-K1077 PolarHBondContact O-N 3.21Å; V1075-K1077 PolarHBondContact O-N 2.95Å; V1075-K1077 VanDerWaalsContact O-N 3.12Å; K1077-P1114 PolarHBondContact NZ-O 3.48Å; K1077-W1117 HydrophobicContact CB-CH2 3.99Å; K1077-W1117 HydrophobicContact CB-CZ3 3.53Å; K1077-W1117 HydrophobicContact CD-CE3 3.84Å; K1077-W1117 HydrophobicContact CD-CH2 3.94Å; K1077-W1117 HydrophobicContact CD-CZ3 3.49Å; K1077-W1117 VanDerWaalsContact CD-CZ3 3.49Å; K1077-W1117 HydrophobicContact CG-CZ3 4.15Å; K1077-W1117 PolarHBondContact NZ-O 3.11Å; K1077-T1118 WeakPolarHBondContact CD-O 3.3Å
1078	L	77.4	Confident	75.6	Confident	8 Å²	8	80 Å²	80	4%	0.042	37%	0.368	C	S	.	.			trans	-96	-0.4	-175.9	-58.1	-176.3	0	0	0	114.5	L977 I1070 V1075 K1080 L1081 F1091 W1117 L1123	L977-L1078 HydrophobicContact CD1-CD1 4.42Å; L977-L1078 HydrophobicContact CD2-CD1 4.13Å; I1070-L1078 HydrophobicContact CD1-CD1 3.77Å; V1075-L1078 WeakPolarHBondContact O-CA 3.43Å; V1075-L1078 WeakPolarHBondContact O-CB 3.49Å; V1075-L1078 PolarHBondContact O-N 3.38Å; L1078-K1080 PolarHBondContact O-N 3.22Å; L1078-L1081 HydrophobicContact CB-CD1 3.92Å; L1078-L1081 HydrophobicContact CB-CG 4.4Å; L1078-L1081 HydrophobicContact CD1-CD1 4.37Å; L1078-L1081 HydrophobicContact CD2-CD1 4.2Å; L1078-L1081 HydrophobicContact CG-CD1 4.39Å; L1078-L1081 WeakPolarHBondContact O-CB 3.38Å; L1078-L1081 WeakPolarHBondContact O-CG 3.26Å; L1078-L1081 PolarHBondContact O-N 3.29Å; L1078-F1091 HydrophobicContact CD1-CE1 4.27Å; L1078-W1117 HydrophobicContact CD2-CH2 3.61Å; L1078-W1117 HydrophobicContact CD2-CZ3 3.91Å; L1078-W1117 HydrophobicContact CG-CH2 3.98Å; L1078-L1123 HydrophobicContact CD2-CD2 4.23Å
1079	R	67.7	Low	75.1	Confident	184 Å²	184	86.4 Å²	86.4	69%	0.694	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.8	-5.9	179.8	-78	-177.9	-70.4	171	-4	117.3	K1076 E1088	K1076-R1079 PolarHBondContact O-NE 3.44Å; K1076-R1079 PolarHBondContact O-NH2 3.15Å; R1079-E1088 WeakPolarHBondContact CD-OE1 3.38Å; R1079-E1088 WeakPolarHBondContact CG-OE1 3.39Å; R1079-E1088 IonicContact NE-OE1 3.62Å
1080	K	64	Low	74.8	Confident	188 Å²	188	88 Å²	88	82%	0.817	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.8	3.8	175.4	-62.3	-171.7	178.5	-174.4	0	113.8	L1078 M1120	L1078-K1080 PolarHBondContact O-N 3.22Å; K1080-M1120 HydrophobicContact CB-CE 3.86Å
1081	L	63.9	Low	74.7	Confident	28 Å²	28	88.3 Å²	88.3	15%	0.147	41%	0.409	C	S	.	.	S	Bend	trans	-85	139.8	176.6	-61.3	177.5	0	0	0	111.2	L977 T980 L1078 L1083 M1120	L977-L1081 HydrophobicContact CD2-CD1 3.48Å; L977-L1081 VanDerWaalsContact CD2-CD1 3.48Å; T980-L1081 HydrophobicContact CG2-CD2 3.44Å; T980-L1081 VanDerWaalsContact CG2-CD2 3.44Å; L1078-L1081 HydrophobicContact CB-CD1 3.92Å; L1078-L1081 HydrophobicContact CB-CG 4.4Å; L1078-L1081 HydrophobicContact CD1-CD1 4.37Å; L1078-L1081 HydrophobicContact CD2-CD1 4.2Å; L1078-L1081 HydrophobicContact CG-CD1 4.39Å; L1078-L1081 WeakPolarHBondContact O-CB 3.38Å; L1078-L1081 WeakPolarHBondContact O-CG 3.26Å; L1078-L1081 PolarHBondContact O-N 3.29Å; L1081-L1083 HydrophobicContact CB-CD1 4.07Å; L1081-L1083 HydrophobicContact CB-CG 3.77Å; L1081-L1083 HydrophobicContact CD1-CD1 3.86Å; L1081-L1083 HydrophobicContact CD1-CG 4.25Å; L1081-L1083 PolarHBondContact O-N 3.01Å; L1081-M1120 HydrophobicContact CD2-CE 3.34Å; L1081-M1120 HydrophobicContact CD2-SD 3.94Å; L1081-M1120 HydrophobicContact CG-CE 3.68Å
1082	P	60.1	Low	74.7	Confident	105 Å²	105	87.7 Å²	87.7	68%	0.682	41%	0.405	S	S	*	.			trans	-79	62.2	172.6	34.7	-35.3	0	0	0	111.1
1083	L	62.2	Low	74.6	Confident	51 Å²	51	90.3 Å²	90.3	27%	0.267	41%	0.41	S	S	.	.			trans	-86.2	135.8	176.7	-65.4	174.3	0	0	0	110.6	A976 L977 L1081 V1085 F1091	A976-L1083 VanDerWaalsContact O-CD2 3.29Å; A976-L1083 WeakPolarHBondContact O-CD2 3.44Å; L977-L1083 HydrophobicContact CD2-CD1 4.15Å; L1081-L1083 HydrophobicContact CB-CD1 4.07Å; L1081-L1083 HydrophobicContact CB-CG 3.77Å; L1081-L1083 HydrophobicContact CD1-CD1 3.86Å; L1081-L1083 HydrophobicContact CD1-CG 4.25Å; L1081-L1083 PolarHBondContact O-N 3.01Å; L1083-V1085 HydrophobicContact CB-CG2 4.16Å; L1083-V1085 PolarHBondContact O-N 3.41Å; L1083-F1091 HydrophobicContact CD1-CD1 4.49Å; L1083-F1091 HydrophobicContact CD1-CD2 4.4Å; L1083-F1091 HydrophobicContact CD1-CE1 4.09Å; L1083-F1091 HydrophobicContact CD1-CE2 3.99Å; L1083-F1091 HydrophobicContact CD1-CZ 3.83Å
1084	R	57.3	Low	74.7	Confident	258 Å²	258	86.7 Å²	86.7	97%	0.974	40%	0.398	S	S	*	.			trans	-82.9	80.4	169.1	-70.8	-177.3	175.2	-176.9	-3.3	109.6
1085	V	60.6	Low	74.6	Confident	54 Å²	54	86.7 Å²	86.7	33%	0.327	40%	0.399	S	S	.	.			trans	-142.4	140	174.5	-163.3	0	0	0	0	109.3	L1083 S1087 D1090 F1091	L1083-V1085 HydrophobicContact CB-CG2 4.16Å; L1083-V1085 PolarHBondContact O-N 3.41Å; V1085-S1087 WeakPolarHBondContact CG1-O 3.45Å; V1085-D1090 HydrophobicContact CG1-CB 4.14Å; V1085-F1091 HydrophobicContact CG1-CB 4.03Å; V1085-F1091 HydrophobicContact CG2-CB 4.4Å; V1085-F1091 HydrophobicContact CG2-CD2 3.79Å; V1085-F1091 HydrophobicContact CG2-CG 4.42Å
1086	E	58.7	Low	74.4	Confident	197 Å²	197	88 Å²	88	92%	0.921	40%	0.403	S	S	*	.	S	Bend	trans	-85.5	-22.5	-171.1	-59.6	-179.9	168.9	0	0	112.9
1087	S	78.4	Confident	74.1	Confident	43 Å²	43	84.3 Å²	84.3	30%	0.301	39%	0.393	S	S	.	.			trans	-142.2	149.9	173.8	178.8	0	0	0	0	112.7	V1085 E1089 D1090 F1091	V1085-S1087 WeakPolarHBondContact CG1-O 3.45Å; S1087-E1089 PolarHBondContact O-N 2.93Å; S1087-E1089 PolarHBondContact OG-N 3.46Å; S1087-D1090 WeakPolarHBondContact CB-OD2 3.24Å; S1087-D1090 PolarHBondContact O-N 3.35Å; S1087-F1091 PolarHBondContact O-N 3.01Å
1088	E	80.6	Confident	73.9	Confident	60 Å²	60	83.9 Å²	83.9	28%	0.28	39%	0.391	S	S	.	.	H	α-helix	trans	-60.1	-35.2	169.5	-68.7	-169	150.6	0	0	111.6	V1075 K1076 R1079 F1091 V1092	V1075-E1088 HydrophobicContact CG1-CB 4.12Å; V1075-E1088 HydrophobicContact CG2-CB 4.02Å; V1075-E1088 HydrophobicContact CG2-CG 4.3Å; K1076-E1088 WeakPolarHBondContact CE-OE2 3.43Å; K1076-E1088 WeakPolarHBondContact CG-OE1 3.12Å; K1076-E1088 WeakPolarHBondContact CG-OE2 3.28Å; R1079-E1088 WeakPolarHBondContact CD-OE1 3.38Å; R1079-E1088 WeakPolarHBondContact CG-OE1 3.39Å; R1079-E1088 IonicContact NE-OE1 3.62Å; E1088-F1091 PolarHBondContact O-N 2.96Å; E1088-V1092 WeakPolarHBondContact O-CG2 3.49Å; E1088-V1092 PolarHBondContact O-N 3.2Å; E1088-V1092 VanDerWaalsContact O-N 3.1Å
1089	E	82.4	Confident	74	Confident	137 Å²	137	83.9 Å²	83.9	64%	0.64	39%	0.391	S	S	*	.	H	α-helix	trans	-71.2	-39.3	-177.7	-65.5	170.1	178.1	0	0	110.9	S1087 F1091 V1092 R1093	S1087-E1089 PolarHBondContact O-N 2.93Å; S1087-E1089 PolarHBondContact OG-N 3.46Å; E1089-F1091 VanDerWaalsContact C-N 3.31Å; E1089-F1091 PolarHBondContact O-N 3.1Å; E1089-V1092 PolarHBondContact O-N 2.96Å; E1089-R1093 WeakPolarHBondContact O-CG 3.33Å; E1089-R1093 PolarHBondContact O-N 3.07Å
1090	D	83.1	Confident	74.4	Confident	58 Å²	58	80 Å²	80	31%	0.31	38%	0.379	S	S	.	.	H	α-helix	trans	-65	-36.4	173.6	-65.7	-28.1	0	0	0	111.8	V1085 S1087 R1093 L1094	V1085-D1090 HydrophobicContact CG1-CB 4.14Å; S1087-D1090 WeakPolarHBondContact CB-OD2 3.24Å; S1087-D1090 PolarHBondContact O-N 3.35Å; D1090-R1093 PolarHBondContact O-N 3.3Å; D1090-R1093 IonicContact OD1-CZ 2.74Å; D1090-R1093 IonicContact OD1-NE 3.17Å; D1090-R1093 PolarHBondContact OD1-NE 2.69Å; D1090-R1093 IonicContact OD1-NH2 3.72Å; D1090-R1093 PolarHBondContact OD1-NH2 3.09Å; D1090-L1094 VanDerWaalsContact O-CB 3.29Å; D1090-L1094 WeakPolarHBondContact O-CB 3.34Å; D1090-L1094 PolarHBondContact O-N 3.33Å
1091	F	84.6	Confident	75.3	Confident	7 Å²	7	73.6 Å²	73.6	3%	0.031	35%	0.352	C	S	.	.	H	α-helix	trans	-63.6	-44.1	173.4	-171.1	-117.8	0	0	0	111.9	A976 L977 I1070 V1075 L1078 L1083 V1085 S1087 E1088 E1089 L1094 C1095	A976-F1091 HydrophobicContact CB-CE2 3.92Å; L977-F1091 HydrophobicContact CD2-CE1 4.08Å; L977-F1091 HydrophobicContact CD2-CZ 3.62Å; L977-F1091 HydrophobicContact CG-CZ 3.98Å; I1070-F1091 HydrophobicContact CG2-CD1 4.33Å; I1070-F1091 HydrophobicContact CG2-CE1 4.25Å; V1075-F1091 HydrophobicContact CG2-CD1 3.99Å; L1078-F1091 HydrophobicContact CD1-CE1 4.27Å; L1083-F1091 HydrophobicContact CD1-CD1 4.49Å; L1083-F1091 HydrophobicContact CD1-CD2 4.4Å; L1083-F1091 HydrophobicContact CD1-CE1 4.09Å; L1083-F1091 HydrophobicContact CD1-CE2 3.99Å; L1083-F1091 HydrophobicContact CD1-CZ 3.83Å; V1085-F1091 HydrophobicContact CG1-CB 4.03Å; V1085-F1091 HydrophobicContact CG2-CB 4.4Å; V1085-F1091 HydrophobicContact CG2-CD2 3.79Å; V1085-F1091 HydrophobicContact CG2-CG 4.42Å; S1087-F1091 PolarHBondContact O-N 3.01Å; E1088-F1091 PolarHBondContact O-N 2.96Å; E1089-F1091 VanDerWaalsContact C-N 3.31Å; E1089-F1091 PolarHBondContact O-N 3.1Å; F1091-L1094 PolarHBondContact O-N 3.18Å; F1091-C1095 WeakPolarHBondContact O-CB 3.48Å; F1091-C1095 PolarHBondContact O-N 3.3Å; F1091-C1095 PolarHBondContact O-SG 3.13Å
1092	V	85.4	Confident	76.3	Confident	2 Å²	2	72.3 Å²	72.3	1%	0.012	35%	0.346	C	S	.	.	H	α-helix	trans	-61.5	-45.2	175	176.1	0	0	0	0	110.7	I1070 V1075 E1088 E1089 L1094 C1095 R1096	I1070-V1092 HydrophobicContact CG2-CG2 4.21Å; V1075-V1092 HydrophobicContact CB-CG2 3.91Å; V1075-V1092 HydrophobicContact CG1-CG2 3.93Å; V1075-V1092 HydrophobicContact CG2-CG2 4.23Å; E1088-V1092 WeakPolarHBondContact O-CG2 3.49Å; E1088-V1092 PolarHBondContact O-N 3.2Å; E1088-V1092 VanDerWaalsContact O-N 3.1Å; E1089-V1092 PolarHBondContact O-N 2.96Å; V1092-L1094 PolarHBondContact O-N 2.59Å; V1092-C1095 PolarHBondContact O-N 3.04Å; V1092-R1096 VanDerWaalsContact CG1-CZ 3.49Å; V1092-R1096 WeakPolarHBondContact O-CG 3.43Å; V1092-R1096 PolarHBondContact O-N 3.45Å
1093	R	83.5	Confident	77.4	Confident	159 Å²	159	68 Å²	68	60%	0.6	32%	0.316	S	S	*	.	H	α-helix	trans	-60.7	-44.4	176.8	-70.3	-165.5	-69.9	179.8	-3.3	112.3	E1089 D1090 C1095 R1096 A1097	E1089-R1093 WeakPolarHBondContact O-CG 3.33Å; E1089-R1093 PolarHBondContact O-N 3.07Å; D1090-R1093 PolarHBondContact O-N 3.3Å; D1090-R1093 IonicContact OD1-CZ 2.74Å; D1090-R1093 IonicContact OD1-NE 3.17Å; D1090-R1093 PolarHBondContact OD1-NE 2.69Å; D1090-R1093 IonicContact OD1-NH2 3.72Å; D1090-R1093 PolarHBondContact OD1-NH2 3.09Å; R1093-C1095 PolarHBondContact O-N 2.93Å; R1093-R1096 PolarHBondContact O-N 2.95Å; R1093-A1097 WeakPolarHBondContact O-CB 3.25Å; R1093-A1097 PolarHBondContact O-N 3.48Å
1094	L	83	Confident	78.4	Confident	94 Å²	94	68.3 Å²	68.3	49%	0.492	33%	0.326	S	S	.	.	H	α-helix	trans	-61.6	-42.6	176.3	179	62.2	0	0	0	112.1	D1090 F1091 V1092 A1097 K1098	D1090-L1094 VanDerWaalsContact O-CB 3.29Å; D1090-L1094 WeakPolarHBondContact O-CB 3.34Å; D1090-L1094 PolarHBondContact O-N 3.33Å; F1091-L1094 PolarHBondContact O-N 3.18Å; V1092-L1094 PolarHBondContact O-N 2.59Å; L1094-A1097 PolarHBondContact O-N 2.95Å; L1094-K1098 PolarHBondContact O-N 3.03Å; L1094-K1098 VanDerWaalsContact O-N 3.14Å
1095	C	83.4	Confident	80	Confident	2 Å²	2	56.3 Å²	56.3	1%	0.014	28%	0.281	C	S	.	.	H	α-helix	trans	-61.3	-48.5	176.4	-66.3	0	0	0	0	111.4	P974 I1070 F1091 V1092 R1093 A1097 K1098 E1099	P974-C1095 HydrophobicContact CG-CB 3.87Å; I1070-C1095 HydrophobicContact CB-CB 4.24Å; F1091-C1095 WeakPolarHBondContact O-CB 3.48Å; F1091-C1095 PolarHBondContact O-N 3.3Å; F1091-C1095 PolarHBondContact O-SG 3.13Å; V1092-C1095 PolarHBondContact O-N 3.04Å; R1093-C1095 PolarHBondContact O-N 2.93Å; C1095-A1097 VanDerWaalsContact C-N 3.34Å; C1095-A1097 PolarHBondContact O-N 3.14Å; C1095-K1098 PolarHBondContact O-N 3.35Å; C1095-E1099 PolarHBondContact O-N 2.97Å
1096	R	82.2	Confident	81.5	Confident	36 Å²	36	53.8 Å²	53.8	14%	0.136	27%	0.266	C	S	.	.	H	α-helix	trans	-59.9	-40.3	175.7	-69.4	179.7	174.6	143.4	7.9	112.6	V904 Y908 E1072 V1092 R1093 K1098 E1099	V904-R1096 HydrophobicContact CG1-CB 4.3Å; Y908-R1096 HydrophobicContact CD2-CB 4.37Å; Y908-R1096 HydrophobicContact CD2-CG 3.66Å; Y908-R1096 HydrophobicContact CE2-CG 3.9Å; Y908-R1096 HydrophobicContact CG-CG 4.09Å; E1072-R1096 IonicContact OE1-CZ 3.59Å; E1072-R1096 IonicContact OE1-NH1 4Å; E1072-R1096 PolarHBondContact OE1-NH1 3.46Å; E1072-R1096 IonicContact OE1-NH2 2.77Å; E1072-R1096 PolarHBondContact OE1-NH2 3.27Å; V1092-R1096 VanDerWaalsContact CG1-CZ 3.49Å; V1092-R1096 WeakPolarHBondContact O-CG 3.43Å; V1092-R1096 PolarHBondContact O-N 3.45Å; R1093-R1096 PolarHBondContact O-N 2.95Å; R1096-K1098 VanDerWaalsContact C-N 3.3Å; R1096-K1098 PolarHBondContact O-N 2.68Å; R1096-E1099 WeakPolarHBondContact O-CB 3.43Å; R1096-E1099 PolarHBondContact O-N 2.97Å
1097	A	76.6	Confident	83.1	Confident	36 Å²	36	44.6 Å²	44.6	30%	0.298	22%	0.224	S	C	.	.	H	α-helix	trans	-67	-29.1	179.6	0	0	0	0	0	113.6	V904 R1093 L1094 C1095 K1100	V904-A1097 HydrophobicContact CG1-CB 4.27Å; R1093-A1097 WeakPolarHBondContact O-CB 3.25Å; R1093-A1097 PolarHBondContact O-N 3.48Å; L1094-A1097 PolarHBondContact O-N 2.95Å; C1095-A1097 VanDerWaalsContact C-N 3.34Å; C1095-A1097 PolarHBondContact O-N 3.14Å; A1097-K1100 WeakPolarHBondContact O-CD 3.36Å; A1097-K1100 WeakPolarHBondContact O-CE 3.48Å; A1097-K1100 WeakPolarHBondContact O-CG 3.41Å
1098	K	75.9	Confident	83.7	Confident	54 Å²	54	45 Å²	45	24%	0.235	22%	0.222	C	C	.	.	H	α-helix	trans	-86.6	-21.4	175.2	-84.1	-68.2	-158.2	163.9	0	113.7	E1049 L1094 C1095 R1096 K1100 E1101	E1049-K1098 IonicContact OE1-NZ 2.98Å; E1049-K1098 PolarHBondContact OE1-NZ 3.43Å; E1049-K1098 IonicContact OE2-NZ 2.71Å; E1049-K1098 PolarHBondContact OE2-NZ 3.43Å; L1094-K1098 PolarHBondContact O-N 3.03Å; L1094-K1098 VanDerWaalsContact O-N 3.14Å; C1095-K1098 PolarHBondContact O-N 3.35Å; R1096-K1098 VanDerWaalsContact C-N 3.3Å; R1096-K1098 PolarHBondContact O-N 2.68Å; K1098-K1100 PolarHBondContact O-N 3.02Å; K1098-K1100 VanDerWaalsContact O-N 3.09Å; K1098-E1101 VanDerWaalsContact CD-CD 3.4Å; K1098-E1101 WeakPolarHBondContact CD-OE1 3.37Å; K1098-E1101 WeakPolarHBondContact CD-OE2 3.46Å; K1098-E1101 WeakPolarHBondContact CE-OE1 3.5Å; K1098-E1101 IonicContact NZ-OE1 3.14Å; K1098-E1101 PolarHBondContact NZ-OE1 3.48Å; K1098-E1101 IonicContact NZ-OE2 3.71Å; K1098-E1101 PolarHBondContact NZ-OE2 3Å; K1098-E1101 WeakPolarHBondContact O-CB 3.09Å; K1098-E1101 PolarHBondContact O-N 3.15Å
1099	E	79.8	Confident	84.4	Confident	8 Å²	8	43.7 Å²	43.7	4%	0.037	22%	0.215	C	C	.	.	H	α-helix	trans	-54	-30.6	179	-159.5	168.1	137.2	0	0	113.4	Y908 L911 N912 Y1067 C1095 R1096 E1101 L1102	Y908-E1099 WeakPolarHBondContact CD2-OE1 3.44Å; Y908-E1099 WeakPolarHBondContact CD2-OE2 3.37Å; L911-E1099 HydrophobicContact CD2-CG 3.9Å; L911-E1099 WeakPolarHBondContact CD2-OE1 2.99Å; N912-E1099 PolarHBondContact ND2-OE1 2.93Å; Y1067-E1099 HydrophobicContact CE2-CG 4.36Å; Y1067-E1099 PolarHBondContact OH-OE2 2.64Å; C1095-E1099 PolarHBondContact O-N 2.97Å; R1096-E1099 WeakPolarHBondContact O-CB 3.43Å; R1096-E1099 PolarHBondContact O-N 2.97Å; E1099-E1101 PolarHBondContact O-N 2.77Å; E1099-E1101 VanDerWaalsContact O-N 3.1Å; E1099-L1102 HydrophobicContact CG-CD1 4.08Å; E1099-L1102 WeakPolarHBondContact O-CB 3.47Å; E1099-L1102 WeakPolarHBondContact O-CG 3.47Å; E1099-L1102 PolarHBondContact O-N 2.96Å; E1099-L1102 VanDerWaalsContact O-N 3.11Å
1100	K	76	Confident	84.9	Confident	103 Å²	103	37.3 Å²	37.3	45%	0.448	19%	0.186	S	C	.	.	G	3₁₀ helix	trans	-54.2	-26.1	173.4	73.1	-176.4	178.4	175.5	0	114.4	K907 A1097 K1098 L1102 E1103	K907-K1100 HydrophobicContact CD-CB 4.15Å; A1097-K1100 WeakPolarHBondContact O-CD 3.36Å; A1097-K1100 WeakPolarHBondContact O-CE 3.48Å; A1097-K1100 WeakPolarHBondContact O-CG 3.41Å; K1098-K1100 PolarHBondContact O-N 3.02Å; K1098-K1100 VanDerWaalsContact O-N 3.09Å; K1100-L1102 PolarHBondContact O-N 3.48Å; K1100-E1103 PolarHBondContact O-N 3.21Å
1101	E	82.4	Confident	85.3	Confident	54 Å²	54	36.5 Å²	36.5	25%	0.252	18%	0.183	S	C	.	.	G	3₁₀ helix	trans	-72.1	-19	-177.1	-67	174.6	-173.5	0	0	111.3	L1050 K1098 E1099 I1105	L1050-E1101 HydrophobicContact CD1-CB 3.89Å; K1098-E1101 VanDerWaalsContact CD-CD 3.4Å; K1098-E1101 WeakPolarHBondContact CD-OE1 3.37Å; K1098-E1101 WeakPolarHBondContact CD-OE2 3.46Å; K1098-E1101 WeakPolarHBondContact CE-OE1 3.5Å; K1098-E1101 IonicContact NZ-OE1 3.14Å; K1098-E1101 PolarHBondContact NZ-OE1 3.48Å; K1098-E1101 IonicContact NZ-OE2 3.71Å; K1098-E1101 PolarHBondContact NZ-OE2 3Å; K1098-E1101 WeakPolarHBondContact O-CB 3.09Å; K1098-E1101 PolarHBondContact O-N 3.15Å; E1099-E1101 PolarHBondContact O-N 2.77Å; E1099-E1101 VanDerWaalsContact O-N 3.1Å; E1101-I1105 WeakPolarHBondContact O-CG1 3.4Å
1102	L	85.8	Confident	85.7	Confident	0 Å²	0	36.2 Å²	36.2	0%	0	18%	0.182	C	C	.	.	G	3₁₀ helix	trans	-68.3	-34.5	175.4	-64.2	170.3	0	0	0	113.5	T973 L1050 Y1067 E1099 K1100 A1104 I1105 Y1109	T973-L1102 HydrophobicContact CG2-CD2 3.92Å; L1050-L1102 HydrophobicContact CD1-CD2 4.02Å; L1050-L1102 HydrophobicContact CD1-CG 4.49Å; Y1067-L1102 HydrophobicContact CD1-CD1 3.9Å; Y1067-L1102 HydrophobicContact CD2-CD1 3.85Å; Y1067-L1102 HydrophobicContact CE1-CD1 4.21Å; Y1067-L1102 HydrophobicContact CE2-CD1 4.13Å; Y1067-L1102 HydrophobicContact CG-CD1 3.74Å; E1099-L1102 HydrophobicContact CG-CD1 4.08Å; E1099-L1102 WeakPolarHBondContact O-CB 3.47Å; E1099-L1102 WeakPolarHBondContact O-CG 3.47Å; E1099-L1102 PolarHBondContact O-N 2.96Å; E1099-L1102 VanDerWaalsContact O-N 3.11Å; K1100-L1102 PolarHBondContact O-N 3.48Å; L1102-A1104 PolarHBondContact O-N 2.85Å; L1102-I1105 HydrophobicContact CD2-CD1 3.85Å; L1102-I1105 PolarHBondContact O-N 3.09Å; L1102-Y1109 HydrophobicContact CB-CE1 3.91Å; L1102-Y1109 HydrophobicContact CD1-CE2 3.94Å; L1102-Y1109 HydrophobicContact CD2-CD1 4.32Å; L1102-Y1109 HydrophobicContact CD2-CD2 4.12Å; L1102-Y1109 HydrophobicContact CD2-CE1 4.4Å; L1102-Y1109 HydrophobicContact CD2-CE2 4.2Å; L1102-Y1109 HydrophobicContact CD2-CG 4.19Å; L1102-Y1109 HydrophobicContact CG-CE2 4.47Å
1103	E	82.3	Confident	85.9	Confident	15 Å²	15	40.2 Å²	40.2	7%	0.07	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-33.6	-178.4	-63.6	-170.7	95.3	0	0	111.4	R910 L911 R918 I919 K1100 I1105	R910-E1103 IonicContact NH1-OE1 3.1Å; L911-E1103 HydrophobicContact CD1-CG 4.17Å; R918-E1103 HydrophobicContact CG-CB 4.3Å; R918-E1103 PolarHBondContact NE-O 3.22Å; R918-E1103 PolarHBondContact NH2-O 2.92Å; I919-E1103 PolarHBondContact N-OE1 3.45Å; K1100-E1103 PolarHBondContact O-N 3.21Å; E1103-I1105 VanDerWaalsContact C-N 3.34Å; E1103-I1105 PolarHBondContact O-N 3.39Å
1104	A	84.3	Confident	86	Confident	58 Å²	58	33.2 Å²	33.2	48%	0.479	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.8	1.6	-177.9	0	0	0	0	0	114.7	L1102	L1102-A1104 PolarHBondContact O-N 2.85Å
1105	I	90.2	Very high	86.2	Confident	5 Å²	5	35 Å²	35	3%	0.026	19%	0.185	C	C	.	.			trans	-78.1	125.6	-179.2	-61.2	-179.3	0	0	0	110	R779 R918 L1050 V1053 I1065 E1101 L1102 E1103 C1107	R779-I1105 PolarHBondContact NH1-O 2.76Å; R918-I1105 PolarHBondContact NH2-O 2.95Å; L1050-I1105 HydrophobicContact CD1-CD1 4.19Å; L1050-I1105 HydrophobicContact CD2-CD1 3.92Å; L1050-I1105 HydrophobicContact CG-CD1 4.46Å; V1053-I1105 HydrophobicContact CG1-CG2 3.9Å; I1065-I1105 HydrophobicContact CD1-CD1 4.15Å; I1065-I1105 HydrophobicContact CD1-CG2 3.85Å; E1101-I1105 WeakPolarHBondContact O-CG1 3.4Å; L1102-I1105 HydrophobicContact CD2-CD1 3.85Å; L1102-I1105 PolarHBondContact O-N 3.09Å; E1103-I1105 VanDerWaalsContact C-N 3.34Å; E1103-I1105 PolarHBondContact O-N 3.39Å; I1105-C1107 VanDerWaalsContact CG2-SG 3.59Å; I1105-C1107 PolarHBondContact O-N 2.92Å
1106	P	92	Very high	86.3	Confident	1 Å²	1	37.6 Å²	37.6	1%	0.006	20%	0.203	C	C	.	.	S	Bend	trans	-81.5	25.5	-176.6	36	-38.6	0	0	0	113.7	K1054 L1057 V1141 E1142 L1145 L1146	K1054-P1106 HydrophobicContact CG-CG 4.31Å; L1057-P1106 HydrophobicContact CD1-CG 3.7Å; P1106-V1141 WeakPolarHBondContact O-CA 3.43Å; P1106-E1142 HydrophobicContact CB-CB 4.14Å; P1106-E1142 PolarHBondContact O-N 3.31Å; P1106-L1145 HydrophobicContact CB-CB 3.68Å; P1106-L1145 HydrophobicContact CB-CD1 4.39Å; P1106-L1146 HydrophobicContact CB-CD2 4.18Å; P1106-L1146 HydrophobicContact CG-CD2 3.64Å
1107	C	92.6	Very high	86.7	Confident	4 Å²	4	36 Å²	36	3%	0.027	20%	0.197	C	C	.	.	B	Isolated β-bridge	trans	-154.8	170.3	176.2	68.2	0	0	0	0	110.9	R779 L1057 I1105 W1140	R779-C1107 PolarHBondContact NH1-O 3.23Å; L1057-C1107 HydrophobicContact CD1-CB 4.2Å; I1105-C1107 VanDerWaalsContact CG2-SG 3.59Å; I1105-C1107 PolarHBondContact O-N 2.92Å; C1107-W1140 WeakPolarHBondContact CA-O 3.45Å; C1107-W1140 WeakPolarHBondContact CB-O 3.45Å
1108	L	92.5	Very high	87.1	Confident	51 Å²	51	39.6 Å²	39.6	27%	0.267	22%	0.216	S	C	.	.			trans	-75.2	149.1	179.1	-59.1	177.9	0	0	0	112.2	R779 D798 V800 W1140	R779-L1108 HydrophobicContact CG-CD2 4.39Å; D798-L1108 HydrophobicContact CB-CD2 4.34Å; D798-L1108 WeakPolarHBondContact O-CD2 3.38Å; V800-L1108 HydrophobicContact CG2-CD1 4.22Å; L1108-W1140 HydrophobicContact CD1-CB 4.21Å; L1108-W1140 HydrophobicContact CD1-CG 4.39Å; L1108-W1140 HydrophobicContact CG-CB 4.42Å
1109	Y	93.6	Very high	87.6	Confident	34 Å²	34	38 Å²	38	13%	0.133	22%	0.215	C	C	.	.			trans	-131.1	156.1	177.5	65.8	-93.4	0	0	0	111.8	R916 Y1067 L1102 T1111	R916-Y1109 PolarHBondContact NH2-OH 2.88Å; Y1067-Y1109 HydrophobicContact CD1-CE2 4.39Å; L1102-Y1109 HydrophobicContact CB-CE1 3.91Å; L1102-Y1109 HydrophobicContact CD1-CE2 3.94Å; L1102-Y1109 HydrophobicContact CD2-CD1 4.32Å; L1102-Y1109 HydrophobicContact CD2-CD2 4.12Å; L1102-Y1109 HydrophobicContact CD2-CE1 4.4Å; L1102-Y1109 HydrophobicContact CD2-CE2 4.2Å; L1102-Y1109 HydrophobicContact CD2-CG 4.19Å; L1102-Y1109 HydrophobicContact CG-CE2 4.47Å; Y1109-T1111 WeakPolarHBondContact CE2-OG1 3.42Å
1110	A	94	Very high	87.8	Confident	3 Å²	3	39 Å²	39	3%	0.025	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	107.6	-174.8	0	0	0	0	0	111.9	I1065 Y1067 R1130 E1134	I1065-A1110 PolarHBondContact O-N 2.93Å; Y1067-A1110 PolarHBondContact N-O 3.32Å; A1110-R1130 HydrophobicContact CB-CG 3.82Å; A1110-E1134 HydrophobicContact CB-CG 3.75Å
1111	T	91.8	Very high	88.3	Confident	41 Å²	41	38.2 Å²	38.2	25%	0.252	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	136	173.2	-55.8	0	0	0	0	111.9	Y1067 K1069 Y1109 E1113 R1130	Y1067-T1111 HydrophobicContact CD1-CG2 3.84Å; Y1067-T1111 HydrophobicContact CE1-CG2 4.19Å; Y1067-T1111 CarbonylContact O-C 3.54Å; Y1067-T1111 WeakPolarHBondContact O-CA 3.46Å; K1069-T1111 HydrophobicContact CB-CG2 4.44Å; K1069-T1111 HydrophobicContact CD-CG2 4.32Å; Y1109-T1111 WeakPolarHBondContact CE2-OG1 3.42Å; T1111-E1113 WeakPolarHBondContact CG2-OE1 3.43Å; T1111-R1130 PolarHBondContact O-NH1 2.92Å; T1111-R1130 PolarHBondContact O-NH2 3.32Å
1112	L	92.6	Very high	88.7	Confident	1 Å²	1	36.9 Å²	36.9	1%	0.005	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	115.7	164.1	-59.6	-174.7	0	0	0	109.2	V1066 Y1067 K1069 L1123 V1126 I1127 R1130	V1066-L1112 HydrophobicContact CG1-CD1 3.83Å; V1066-L1112 HydrophobicContact CG1-CG 4.05Å; Y1067-L1112 PolarHBondContact O-N 2.8Å; K1069-L1112 VanDerWaalsContact CB-O 3.3Å; K1069-L1112 WeakPolarHBondContact CB-O 3.44Å; K1069-L1112 PolarHBondContact N-O 2.81Å; K1069-L1112 VanDerWaalsContact N-O 3.11Å; L1112-L1123 HydrophobicContact CD1-CD1 4.2Å; L1112-V1126 HydrophobicContact CD1-CG1 4.2Å; L1112-V1126 HydrophobicContact CD2-CG1 3.85Å; L1112-I1127 HydrophobicContact CD1-CD1 4.48Å; L1112-I1127 HydrophobicContact CD1-CG1 3.47Å; L1112-I1127 VanDerWaalsContact CD1-CG1 3.47Å; L1112-R1130 HydrophobicContact CD2-CB 4.12Å; L1112-R1130 HydrophobicContact CD2-CG 4.13Å
1113	E	89.6	Confident	88.9	Confident	86 Å²	86	37.1 Å²	37.1	40%	0.402	21%	0.214	S	C	.	.			trans	-75	154.4	-175.9	-74	-63.4	143.7	0	0	113.1	K1069 T1111 D1115 S1116 W1117	K1069-E1113 WeakPolarHBondContact CD-OE1 3.41Å; K1069-E1113 WeakPolarHBondContact CD-OE2 3.41Å; K1069-E1113 WeakPolarHBondContact CE-OE2 3.26Å; K1069-E1113 IonicContact NZ-OE1 2.65Å; K1069-E1113 PolarHBondContact NZ-OE1 2.92Å; K1069-E1113 IonicContact NZ-OE2 3.41Å; K1069-E1113 PolarHBondContact NZ-OE2 2.92Å; T1111-E1113 WeakPolarHBondContact CG2-OE1 3.43Å; E1113-D1115 PolarHBondContact O-N 3.48Å; E1113-S1116 PolarHBondContact O-N 3.39Å; E1113-S1116 VanDerWaalsContact O-N 3.13Å; E1113-S1116 PolarHBondContact O-OG 3.2Å; E1113-W1117 PolarHBondContact O-NE1 3.3Å
1114	P	85.6	Confident	89.4	Confident	11 Å²	11	36.6 Å²	36.6	7%	0.071	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.3	-25.7	-174.5	-29.8	38.2	0	0	0	116.7	K1069 N1074 K1077	K1069-P1114 HydrophobicContact CB-CG 4.39Å; K1069-P1114 HydrophobicContact CD-CG 4.48Å; K1069-P1114 HydrophobicContact CG-CG 4.03Å; N1074-P1114 HydrophobicContact CB-CB 4.33Å; N1074-P1114 WeakPolarHBondContact ND2-CA 3.45Å; N1074-P1114 WeakPolarHBondContact ND2-CB 3.42Å; K1077-P1114 PolarHBondContact NZ-O 3.48Å
1115	D	86	Confident	89.7	Confident	133 Å²	133	40.7 Å²	40.7	71%	0.711	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	-100.1	-5.7	-174.8	-56.8	-47.4	0	0	0	112.6	E1113 W1117	E1113-D1115 PolarHBondContact O-N 3.48Å; D1115-W1117 PolarHBondContact O-N 3.49Å
1116	S	86.9	Confident	89.9	Confident	56 Å²	56	41.9 Å²	41.9	39%	0.392	22%	0.222	S	C	.	.	S	Bend	trans	-78.3	-1.4	178.2	71.4	0	0	0	0	114.4	E1113	E1113-S1116 PolarHBondContact O-N 3.39Å; E1113-S1116 VanDerWaalsContact O-N 3.13Å; E1113-S1116 PolarHBondContact O-OG 3.2Å
1117	W	90.1	Very high	90.1	Very high	1 Å²	1	41.9 Å²	41.9	0%	0.004	22%	0.221	C	C	.	.			trans	-148.2	141	179.7	57	-81.9	0	0	0	111.6	N1074 K1077 L1078 E1113 D1115 L1123	N1074-W1117 HydrophobicContact CB-CH2 4.14Å; N1074-W1117 HydrophobicContact CB-CZ2 4.02Å; N1074-W1117 VanDerWaalsContact ND2-CZ2 3.3Å; N1074-W1117 WeakPolarHBondContact ND2-CZ2 3.3Å; K1077-W1117 HydrophobicContact CB-CH2 3.99Å; K1077-W1117 HydrophobicContact CB-CZ3 3.53Å; K1077-W1117 HydrophobicContact CD-CE3 3.84Å; K1077-W1117 HydrophobicContact CD-CH2 3.94Å; K1077-W1117 HydrophobicContact CD-CZ3 3.49Å; K1077-W1117 VanDerWaalsContact CD-CZ3 3.49Å; K1077-W1117 HydrophobicContact CG-CZ3 4.15Å; K1077-W1117 PolarHBondContact NZ-O 3.11Å; L1078-W1117 HydrophobicContact CD2-CH2 3.61Å; L1078-W1117 HydrophobicContact CD2-CZ3 3.91Å; L1078-W1117 HydrophobicContact CG-CH2 3.98Å; E1113-W1117 PolarHBondContact O-NE1 3.3Å; D1115-W1117 PolarHBondContact O-N 3.49Å; W1117-L1123 HydrophobicContact CB-CB 4.14Å; W1117-L1123 HydrophobicContact CD2-CB 3.95Å; W1117-L1123 HydrophobicContact CD2-CD1 3.99Å; W1117-L1123 HydrophobicContact CD2-CD2 4.28Å; W1117-L1123 HydrophobicContact CD2-CG 4.29Å; W1117-L1123 HydrophobicContact CE3-CB 3.84Å; W1117-L1123 HydrophobicContact CE3-CD2 4.18Å; W1117-L1123 HydrophobicContact CE3-CG 4.43Å; W1117-L1123 HydrophobicContact CG-CB 4.09Å; W1117-L1123 HydrophobicContact CG-CD1 3.91Å; W1117-L1123 HydrophobicContact CH2-CD2 4.28Å; W1117-L1123 HydrophobicContact CZ2-CD2 4.36Å; W1117-L1123 HydrophobicContact CZ3-CD2 4.17Å
1118	T	86	Confident	90.1	Very high	113 Å²	113	43.3 Å²	43.3	69%	0.693	23%	0.227	S	C	*	.	S	Bend	trans	-95.8	-30.9	-174.5	57.9	0	0	0	0	113.5	K1077 D1122	K1077-T1118 WeakPolarHBondContact CD-O 3.3Å; T1118-D1122 WeakPolarHBondContact CB-OD2 3.42Å; T1118-D1122 PolarHBondContact N-OD2 3.48Å; T1118-D1122 PolarHBondContact OG1-OD2 3.02Å
1119	G	85.3	Confident	90.2	Very high	20 Å²	20	45.2 Å²	45.2	21%	0.206	24%	0.238	C	C	.	.	S	Bend	trans	-162.6	-173.9	-178.4	0	0	0	0	0	112.7	D1122 L1123	G1119-D1122 WeakPolarHBondContact O-CB 3.23Å; G1119-D1122 PolarHBondContact O-N 3.02Å; G1119-L1123 WeakPolarHBondContact O-CB 3.44Å; G1119-L1123 PolarHBondContact O-N 2.77Å
1120	M	84.1	Confident	90.3	Very high	28 Å²	28	46.5 Å²	46.5	14%	0.138	24%	0.242	C	C	.	.	H	α-helix	trans	-65.5	-48.6	-169.3	-170.2	177.4	-62.6	0	0	114.3	K984 K1080 L1081 D1122 L1123 I1124	K984-M1120 HydrophobicContact CG-SD 4.42Å; K1080-M1120 HydrophobicContact CB-CE 3.86Å; L1081-M1120 HydrophobicContact CD2-CE 3.34Å; L1081-M1120 HydrophobicContact CD2-SD 3.94Å; L1081-M1120 HydrophobicContact CG-CE 3.68Å; M1120-D1122 PolarHBondContact O-N 2.91Å; M1120-L1123 PolarHBondContact O-N 2.77Å; M1120-I1124 WeakPolarHBondContact O-CG1 3.32Å; M1120-I1124 PolarHBondContact O-N 3.44Å; M1120-I1124 VanDerWaalsContact O-N 3.07Å
1121	E	87	Confident	90.4	Very high	88 Å²	88	46.3 Å²	46.3	41%	0.411	24%	0.241	S	C	.	.	H	α-helix	trans	-66.8	-30.7	-179.4	-43.7	-48.9	132.2	0	0	111.8	K984 M988 I1124 R1125	K984-E1121 IonicContact NZ-OE1 2.68Å; K984-E1121 PolarHBondContact NZ-OE1 3.03Å; K984-E1121 IonicContact NZ-OE2 2.73Å; K984-E1121 PolarHBondContact NZ-OE2 3.17Å; M988-E1121 HydrophobicContact CE-CB 3.96Å; E1121-I1124 PolarHBondContact O-N 3.36Å; E1121-R1125 PolarHBondContact O-N 2.9Å; E1121-R1125 VanDerWaalsContact O-N 3.11Å
1122	D	90	Very high	90.5	Very high	26 Å²	26	47.1 Å²	47.1	14%	0.139	24%	0.244	C	C	.	.	H	α-helix	trans	-69.2	-45.8	175.2	-174.2	28.3	0	0	0	111.5	T1118 G1119 M1120 I1124 R1125 V1126	T1118-D1122 WeakPolarHBondContact CB-OD2 3.42Å; T1118-D1122 PolarHBondContact N-OD2 3.48Å; T1118-D1122 PolarHBondContact OG1-OD2 3.02Å; G1119-D1122 WeakPolarHBondContact O-CB 3.23Å; G1119-D1122 PolarHBondContact O-N 3.02Å; M1120-D1122 PolarHBondContact O-N 2.91Å; D1122-I1124 VanDerWaalsContact C-N 3.28Å; D1122-I1124 PolarHBondContact O-N 3.34Å; D1122-R1125 WeakPolarHBondContact O-CB 3.48Å; D1122-R1125 PolarHBondContact O-N 2.89Å; D1122-R1125 VanDerWaalsContact O-N 3.11Å; D1122-R1125 IonicContact OD1-CZ 2.69Å; D1122-R1125 IonicContact OD1-NE 2.82Å; D1122-R1125 PolarHBondContact OD1-NE 3.18Å; D1122-R1125 IonicContact OD1-NH2 3.05Å; D1122-R1125 PolarHBondContact OD1-NH2 3.31Å; D1122-V1126 WeakPolarHBondContact O-CG2 3.48Å; D1122-V1126 PolarHBondContact O-N 3.4Å
1123	L	90.8	Very high	90.6	Very high	5 Å²	5	50.1 Å²	50.1	3%	0.026	26%	0.257	C	S	.	.	H	α-helix	trans	-55.7	-41.8	171.1	173.7	60.9	0	0	0	111.7	V1068 L1078 L1112 W1117 G1119 M1120 R1125 V1126 I1127	V1068-L1123 HydrophobicContact CG1-CD1 4.02Å; V1068-L1123 HydrophobicContact CG1-CD2 4.35Å; L1078-L1123 HydrophobicContact CD2-CD2 4.23Å; L1112-L1123 HydrophobicContact CD1-CD1 4.2Å; W1117-L1123 HydrophobicContact CB-CB 4.14Å; W1117-L1123 HydrophobicContact CD2-CB 3.95Å; W1117-L1123 HydrophobicContact CD2-CD1 3.99Å; W1117-L1123 HydrophobicContact CD2-CD2 4.28Å; W1117-L1123 HydrophobicContact CD2-CG 4.29Å; W1117-L1123 HydrophobicContact CE3-CB 3.84Å; W1117-L1123 HydrophobicContact CE3-CD2 4.18Å; W1117-L1123 HydrophobicContact CE3-CG 4.43Å; W1117-L1123 HydrophobicContact CG-CB 4.09Å; W1117-L1123 HydrophobicContact CG-CD1 3.91Å; W1117-L1123 HydrophobicContact CH2-CD2 4.28Å; W1117-L1123 HydrophobicContact CZ2-CD2 4.36Å; W1117-L1123 HydrophobicContact CZ3-CD2 4.17Å; G1119-L1123 WeakPolarHBondContact O-CB 3.44Å; G1119-L1123 PolarHBondContact O-N 2.77Å; M1120-L1123 PolarHBondContact O-N 2.77Å; L1123-R1125 PolarHBondContact O-N 3.46Å; L1123-V1126 PolarHBondContact O-N 3.29Å; L1123-I1127 HydrophobicContact CD1-CD1 3.83Å; L1123-I1127 HydrophobicContact CD1-CG1 4.1Å; L1123-I1127 HydrophobicContact CG-CD1 3.84Å; L1123-I1127 WeakPolarHBondContact O-CB 3.44Å; L1123-I1127 WeakPolarHBondContact O-CG1 3.41Å; L1123-I1127 PolarHBondContact O-N 3.49Å
1124	I	91.6	Very high	90.8	Very high	3 Å²	3	47.1 Å²	47.1	2%	0.015	24%	0.244	C	C	.	.	H	α-helix	trans	-68.7	-32.9	178.5	-61.2	-70.8	0	0	0	112	I981 K984 I985 M988 M1120 E1121 D1122 K1128	I981-I1124 HydrophobicContact CB-CD1 4.28Å; I981-I1124 HydrophobicContact CG1-CD1 4.29Å; I981-I1124 HydrophobicContact CG2-CD1 4.03Å; K984-I1124 HydrophobicContact CB-CD1 3.65Å; K984-I1124 HydrophobicContact CB-CG1 3.88Å; I985-I1124 HydrophobicContact CG1-CD1 4.33Å; I985-I1124 HydrophobicContact CG1-CG2 3.82Å; M988-I1124 HydrophobicContact SD-CB 3.8Å; M988-I1124 HydrophobicContact SD-CG1 4.35Å; M988-I1124 HydrophobicContact SD-CG2 3.43Å; M988-I1124 WeakPolarHBondContact SD-CG2 3.43Å; M1120-I1124 WeakPolarHBondContact O-CG1 3.32Å; M1120-I1124 PolarHBondContact O-N 3.44Å; M1120-I1124 VanDerWaalsContact O-N 3.07Å; E1121-I1124 PolarHBondContact O-N 3.36Å; D1122-I1124 VanDerWaalsContact C-N 3.28Å; D1122-I1124 PolarHBondContact O-N 3.34Å; I1124-K1128 HydrophobicContact CG2-CD 4.45Å; I1124-K1128 VanDerWaalsContact O-CG 3.29Å; I1124-K1128 WeakPolarHBondContact O-CG 3.48Å; I1124-K1128 PolarHBondContact O-N 2.67Å; I1124-K1128 VanDerWaalsContact O-N 3.14Å
1125	R	91.9	Very high	91.2	Very high	144 Å²	144	48.2 Å²	48.2	54%	0.543	25%	0.248	S	C	.	.	H	α-helix	trans	-63.1	-55.9	169.4	169.8	176.4	63	-178.8	3.6	110.8	E1121 D1122 L1123 I1127 K1128 D1129	E1121-R1125 PolarHBondContact O-N 2.9Å; E1121-R1125 VanDerWaalsContact O-N 3.11Å; D1122-R1125 WeakPolarHBondContact O-CB 3.48Å; D1122-R1125 PolarHBondContact O-N 2.89Å; D1122-R1125 VanDerWaalsContact O-N 3.11Å; D1122-R1125 IonicContact OD1-CZ 2.69Å; D1122-R1125 IonicContact OD1-NE 2.82Å; D1122-R1125 PolarHBondContact OD1-NE 3.18Å; D1122-R1125 IonicContact OD1-NH2 3.05Å; D1122-R1125 PolarHBondContact OD1-NH2 3.31Å; L1123-R1125 PolarHBondContact O-N 3.46Å; R1125-I1127 PolarHBondContact O-N 3.01Å; R1125-K1128 WeakPolarHBondContact O-CB 3.34Å; R1125-K1128 PolarHBondContact O-N 3.02Å; R1125-D1129 VanDerWaalsContact CG-OD2 3.29Å; R1125-D1129 WeakPolarHBondContact CG-OD2 3.42Å; R1125-D1129 VanDerWaalsContact O-CG 3.31Å; R1125-D1129 PolarHBondContact O-N 3.18Å
1126	V	94.3	Very high	91.6	Very high	31 Å²	31	48.9 Å²	48.9	19%	0.188	24%	0.244	C	C	.	.	H	α-helix	trans	-57.9	-35.8	-179.4	174.6	0	0	0	0	112	L1112 D1122 L1123 R1130	L1112-V1126 HydrophobicContact CD1-CG1 4.2Å; L1112-V1126 HydrophobicContact CD2-CG1 3.85Å; D1122-V1126 WeakPolarHBondContact O-CG2 3.48Å; D1122-V1126 PolarHBondContact O-N 3.4Å; L1123-V1126 PolarHBondContact O-N 3.29Å; V1126-R1130 WeakPolarHBondContact O-CB 3.44Å; V1126-R1130 PolarHBondContact O-N 3.09Å
1127	I	94.9	Very high	91.9	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-62.6	-49.2	171.9	-75.8	168.1	0	0	0	111.7	F972 I981 I985 V1066 V1068 L1112 L1123 R1125 D1129 R1130 I1131	F972-I1127 HydrophobicContact CE1-CG2 3.56Å; F972-I1127 HydrophobicContact CZ-CG2 4.08Å; I981-I1127 HydrophobicContact CD1-CD1 3.99Å; I981-I1127 HydrophobicContact CG1-CD1 4.28Å; I981-I1127 HydrophobicContact CG2-CD1 3.93Å; I985-I1127 HydrophobicContact CD1-CG2 4.07Å; V1066-I1127 HydrophobicContact CG1-CG1 4.41Å; V1068-I1127 HydrophobicContact CG2-CD1 4.37Å; L1112-I1127 HydrophobicContact CD1-CD1 4.48Å; L1112-I1127 HydrophobicContact CD1-CG1 3.47Å; L1112-I1127 VanDerWaalsContact CD1-CG1 3.47Å; L1123-I1127 HydrophobicContact CD1-CD1 3.83Å; L1123-I1127 HydrophobicContact CD1-CG1 4.1Å; L1123-I1127 HydrophobicContact CG-CD1 3.84Å; L1123-I1127 WeakPolarHBondContact O-CB 3.44Å; L1123-I1127 WeakPolarHBondContact O-CG1 3.41Å; L1123-I1127 PolarHBondContact O-N 3.49Å; R1125-I1127 PolarHBondContact O-N 3.01Å; I1127-D1129 PolarHBondContact O-N 3.48Å; I1127-R1130 PolarHBondContact O-N 2.83Å; I1127-I1131 HydrophobicContact CG2-CD1 3.7Å; I1127-I1131 WeakPolarHBondContact O-CD1 3.33Å; I1127-I1131 VanDerWaalsContact O-CG1 3.24Å; I1127-I1131 WeakPolarHBondContact O-CG1 3.48Å; I1127-I1131 PolarHBondContact O-N 2.85Å
1128	K	93.9	Very high	92.1	Very high	34 Å²	34	48.7 Å²	48.7	15%	0.148	24%	0.237	C	C	.	.	H	α-helix	trans	-59.8	-47.4	178.5	-72.2	166.4	179.4	178.9	0	110.9	M988 A990 F994 I1124 R1125 R1130 I1131 L1132	M988-K1128 PolarHBondContact O-NZ 2.95Å; A990-K1128 HydrophobicContact CB-CD 4.47Å; F994-K1128 HydrophobicContact CE2-CG 4.03Å; F994-K1128 HydrophobicContact CZ-CB 4.46Å; F994-K1128 HydrophobicContact CZ-CG 4.23Å; I1124-K1128 HydrophobicContact CG2-CD 4.45Å; I1124-K1128 VanDerWaalsContact O-CG 3.29Å; I1124-K1128 WeakPolarHBondContact O-CG 3.48Å; I1124-K1128 PolarHBondContact O-N 2.67Å; I1124-K1128 VanDerWaalsContact O-N 3.14Å; R1125-K1128 WeakPolarHBondContact O-CB 3.34Å; R1125-K1128 PolarHBondContact O-N 3.02Å; K1128-R1130 PolarHBondContact O-N 3.25Å; K1128-I1131 PolarHBondContact O-N 3.03Å; K1128-L1132 WeakPolarHBondContact O-CG 3.3Å; K1128-L1132 PolarHBondContact O-N 3.45Å; K1128-L1132 VanDerWaalsContact O-N 3.08Å
1129	D	93.9	Very high	92.5	Very high	92 Å²	92	43.9 Å²	43.9	49%	0.492	21%	0.207	S	C	.	.	H	α-helix	trans	-61.5	-45.3	-179.2	-61.3	-28.7	0	0	0	111	R1125 I1127 I1131 L1132 E1133	R1125-D1129 VanDerWaalsContact CG-OD2 3.29Å; R1125-D1129 WeakPolarHBondContact CG-OD2 3.42Å; R1125-D1129 VanDerWaalsContact O-CG 3.31Å; R1125-D1129 PolarHBondContact O-N 3.18Å; I1127-D1129 PolarHBondContact O-N 3.48Å; D1129-I1131 PolarHBondContact O-N 3.33Å; D1129-L1132 PolarHBondContact O-N 2.87Å; D1129-E1133 PolarHBondContact O-N 3.27Å
1130	R	95.8	Very high	93	Very high	60 Å²	60	43.4 Å²	43.4	23%	0.226	20%	0.199	C	C	.	.	H	α-helix	trans	-64.9	-37	175.5	179.8	58.5	71.2	77.5	15.4	112.7	A1110 T1111 L1112 V1126 I1127 K1128 L1132 E1133 E1134	A1110-R1130 HydrophobicContact CB-CG 3.82Å; T1111-R1130 PolarHBondContact O-NH1 2.92Å; T1111-R1130 PolarHBondContact O-NH2 3.32Å; L1112-R1130 HydrophobicContact CD2-CB 4.12Å; L1112-R1130 HydrophobicContact CD2-CG 4.13Å; V1126-R1130 WeakPolarHBondContact O-CB 3.44Å; V1126-R1130 PolarHBondContact O-N 3.09Å; I1127-R1130 PolarHBondContact O-N 2.83Å; K1128-R1130 PolarHBondContact O-N 3.25Å; R1130-L1132 VanDerWaalsContact C-N 3.31Å; R1130-L1132 PolarHBondContact O-N 3.46Å; R1130-E1133 VanDerWaalsContact CD-OE2 3.27Å; R1130-E1133 WeakPolarHBondContact CD-OE2 3.28Å; R1130-E1133 IonicContact CZ-OE2 3.19Å; R1130-E1133 IonicContact NE-OE2 2.69Å; R1130-E1133 PolarHBondContact NE-OE2 2.83Å; R1130-E1133 WeakPolarHBondContact O-CB 3.5Å; R1130-E1133 PolarHBondContact O-N 3.17Å; R1130-E1134 WeakPolarHBondContact CD-OE1 3.49Å; R1130-E1134 HydrophobicContact CG-CG 4.17Å; R1130-E1134 WeakPolarHBondContact O-CG 3.32Å; R1130-E1134 PolarHBondContact O-N 2.94Å
1131	I	95.6	Very high	93.5	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-64	-39.2	175.4	-65	157.8	0	0	0	110.9	V970 F972 F994 I1064 V1066 I1127 K1128 D1129 E1133 Q1135	V970-I1131 HydrophobicContact CG1-CD1 3.8Å; V970-I1131 HydrophobicContact CG1-CG1 4.03Å; V970-I1131 HydrophobicContact CG2-CD1 4.27Å; V970-I1131 HydrophobicContact CG2-CG1 4.38Å; V970-I1131 HydrophobicContact CG2-CG2 3.83Å; F972-I1131 HydrophobicContact CE1-CD1 4.18Å; F972-I1131 HydrophobicContact CZ-CD1 4.11Å; F994-I1131 HydrophobicContact CE1-CB 4.34Å; F994-I1131 HydrophobicContact CE1-CD1 3.83Å; F994-I1131 HydrophobicContact CE1-CG2 3.93Å; F994-I1131 HydrophobicContact CZ-CD1 4.32Å; F994-I1131 HydrophobicContact CZ-CG2 4.42Å; I1064-I1131 HydrophobicContact CD1-CG2 3.89Å; I1064-I1131 HydrophobicContact CG2-CG1 4.45Å; V1066-I1131 HydrophobicContact CG2-CG1 3.96Å; I1127-I1131 HydrophobicContact CG2-CD1 3.7Å; I1127-I1131 WeakPolarHBondContact O-CD1 3.33Å; I1127-I1131 VanDerWaalsContact O-CG1 3.24Å; I1127-I1131 WeakPolarHBondContact O-CG1 3.48Å; I1127-I1131 PolarHBondContact O-N 2.85Å; K1128-I1131 PolarHBondContact O-N 3.03Å; D1129-I1131 PolarHBondContact O-N 3.33Å; I1131-E1133 VanDerWaalsContact C-N 3.31Å; I1131-Q1135 WeakPolarHBondContact O-CB 3.41Å; I1131-Q1135 PolarHBondContact O-N 3.25Å
1132	L	93.7	Very high	93.8	Very high	58 Å²	58	38.2 Å²	38.2	30%	0.304	18%	0.175	S	C	.	.	H	α-helix	trans	-71.8	-24.1	175.7	-64.8	174.8	0	0	0	113.2	K1128 D1129 R1130 K1136	K1128-L1132 WeakPolarHBondContact O-CG 3.3Å; K1128-L1132 PolarHBondContact O-N 3.45Å; K1128-L1132 VanDerWaalsContact O-N 3.08Å; D1129-L1132 PolarHBondContact O-N 2.87Å; R1130-L1132 VanDerWaalsContact C-N 3.31Å; R1130-L1132 PolarHBondContact O-N 3.46Å; L1132-K1136 WeakPolarHBondContact O-CD 3.36Å; L1132-K1136 WeakPolarHBondContact O-CE 3.42Å; L1132-K1136 WeakPolarHBondContact O-CG 3.42Å
1133	E	94.6	Very high	93.6	Very high	63 Å²	63	41.4 Å²	41.4	29%	0.294	19%	0.189	S	C	.	.	H	α-helix	trans	-71.9	-53.9	169.4	-165.2	-158.8	142.6	0	0	110.8	D1129 R1130 I1131 Q1135 K1136 K1137	D1129-E1133 PolarHBondContact O-N 3.27Å; R1130-E1133 VanDerWaalsContact CD-OE2 3.27Å; R1130-E1133 WeakPolarHBondContact CD-OE2 3.28Å; R1130-E1133 IonicContact CZ-OE2 3.19Å; R1130-E1133 IonicContact NE-OE2 2.69Å; R1130-E1133 PolarHBondContact NE-OE2 2.83Å; R1130-E1133 WeakPolarHBondContact O-CB 3.5Å; R1130-E1133 PolarHBondContact O-N 3.17Å; I1131-E1133 VanDerWaalsContact C-N 3.31Å; E1133-Q1135 VanDerWaalsContact C-N 3.33Å; E1133-Q1135 PolarHBondContact O-N 3.47Å; E1133-K1136 WeakPolarHBondContact O-CB 3.2Å; E1133-K1136 PolarHBondContact O-N 3.05Å; E1133-K1136 VanDerWaalsContact O-N 3.08Å; E1133-K1137 VanDerWaalsContact OE1-CE 3.28Å; E1133-K1137 WeakPolarHBondContact OE1-CE 3.41Å; E1133-K1137 IonicContact OE1-NZ 2.81Å; E1133-K1137 PolarHBondContact OE1-NZ 3.16Å
1134	E	94.9	Very high	93.1	Very high	24 Å²	24	44 Å²	44	11%	0.112	20%	0.203	C	C	.	.	H	α-helix	trans	-64.4	-31.8	-178.6	-66.7	-55.4	139.6	0	0	113.3	R968 I1064 A1110 R1130 K1136 K1137	R968-E1134 PolarHBondContact NH1-O 3.12Å; I1064-E1134 HydrophobicContact CD1-CB 4.15Å; I1064-E1134 HydrophobicContact CG1-CB 4.11Å; I1064-E1134 HydrophobicContact CG2-CB 3.75Å; I1064-E1134 HydrophobicContact CG2-CG 4.1Å; A1110-E1134 HydrophobicContact CB-CG 3.75Å; R1130-E1134 WeakPolarHBondContact CD-OE1 3.49Å; R1130-E1134 HydrophobicContact CG-CG 4.17Å; R1130-E1134 WeakPolarHBondContact O-CG 3.32Å; R1130-E1134 PolarHBondContact O-N 2.94Å; E1134-K1136 PolarHBondContact O-N 2.92Å; E1134-K1137 PolarHBondContact O-N 3.07Å; E1134-K1137 IonicContact OE1-NZ 3.11Å; E1134-K1137 PolarHBondContact OE1-NZ 2.98Å; E1134-K1137 IonicContact OE2-NZ 2.84Å
1135	Q	94.5	Very high	92.6	Very high	34 Å²	34	45 Å²	45	16%	0.159	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-20.8	174.5	-179.3	59.5	53.6	0	0	113.2	R966 H1043 I1064 I1131 E1133	R966-Q1135 PolarHBondContact O-NE2 2.86Å; H1043-Q1135 PolarHBondContact CE1-OE1 3.04Å; I1064-Q1135 HydrophobicContact CD1-CB 4.03Å; I1131-Q1135 WeakPolarHBondContact O-CB 3.41Å; I1131-Q1135 PolarHBondContact O-N 3.25Å; E1133-Q1135 VanDerWaalsContact C-N 3.33Å; E1133-Q1135 PolarHBondContact O-N 3.47Å
1136	K	93.3	Very high	92	Very high	147 Å²	147	41.8 Å²	41.8	64%	0.639	20%	0.201	S	C	*	.	T	Hydrogen-bonded Turn	trans	-92	-10.8	179.4	-62.1	168.8	-175.4	173.4	0	113.6	Y822 L1132 E1133 E1134	Y822-K1136 HydrophobicContact CD1-CB 3.96Å; Y822-K1136 HydrophobicContact CE1-CB 4.19Å; L1132-K1136 WeakPolarHBondContact O-CD 3.36Å; L1132-K1136 WeakPolarHBondContact O-CE 3.42Å; L1132-K1136 WeakPolarHBondContact O-CG 3.42Å; E1133-K1136 WeakPolarHBondContact O-CB 3.2Å; E1133-K1136 PolarHBondContact O-N 3.05Å; E1133-K1136 VanDerWaalsContact O-N 3.08Å; E1134-K1136 PolarHBondContact O-N 2.92Å
1137	K	93.4	Very high	91.9	Very high	42 Å²	42	42.3 Å²	42.3	18%	0.183	20%	0.202	C	C	.	.	S	Bend	trans	-85	146.3	-175	-66.4	179.3	-168	171.8	0	111.6	P821 Y822 E1133 E1134	P821-K1137 HydrophobicContact CB-CD 4.29Å; P821-K1137 HydrophobicContact CB-CG 4.37Å; P821-K1137 CarbonylContact O-C 3.12Å; P821-K1137 WeakPolarHBondContact O-CA 3.49Å; P821-K1137 VanDerWaalsContact O-CB 3.31Å; P821-K1137 WeakPolarHBondContact O-CB 3.49Å; Y822-K1137 HydrophobicContact CD1-CG 3.91Å; Y822-K1137 HydrophobicContact CE1-CG 3.75Å; E1133-K1137 VanDerWaalsContact OE1-CE 3.28Å; E1133-K1137 WeakPolarHBondContact OE1-CE 3.41Å; E1133-K1137 IonicContact OE1-NZ 2.81Å; E1133-K1137 PolarHBondContact OE1-NZ 3.16Å; E1134-K1137 PolarHBondContact O-N 3.07Å; E1134-K1137 IonicContact OE1-NZ 3.11Å; E1134-K1137 PolarHBondContact OE1-NZ 2.98Å; E1134-K1137 IonicContact OE2-NZ 2.84Å
1138	T	94.2	Very high	91.7	Very high	11 Å²	11	44.5 Å²	44.5	7%	0.067	21%	0.212	C	C	.	.	P	Polyproline II helix	trans	-64	134.9	167.1	-71	0	0	0	0	108.8	P821 Y822 P961 W1140	P821-T1138 PolarHBondContact O-N 2.83Å; Y822-T1138 PolarHBondContact O-N 2.72Å; Y822-T1138 PolarHBondContact O-OG1 3.32Å; P961-T1138 HydrophobicContact CB-CG2 3.92Å; T1138-W1140 HydrophobicContact CG2-CZ2 3.84Å
1139	I	94.9	Very high	91.6	Very high	11 Å²	11	45.1 Å²	45.1	6%	0.056	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	125.4	-170.5	-50.6	176.7	0	0	0	108.2	P961 Q962 T964 Y1062 V1141	P961-I1139 CarbonylContact C-O 3.45Å; Q962-I1139 HydrophobicContact CB-CB 4.13Å; Q962-I1139 PolarHBondContact N-O 3.35Å; Q962-I1139 WeakPolarHBondContact O-CB 3.4Å; Q962-I1139 PolarHBondContact O-N 2.75Å; T964-I1139 HydrophobicContact CG2-CD1 3.97Å; Y1062-I1139 HydrophobicContact CD1-CG2 4.17Å; Y1062-I1139 HydrophobicContact CD2-CD1 4.38Å; Y1062-I1139 HydrophobicContact CG-CD1 4.04Å; Y1062-I1139 HydrophobicContact CG-CG2 4.32Å; I1139-V1141 HydrophobicContact CG2-CG2 4.08Å
1140	W	95.3	Very high	91.5	Very high	11 Å²	11	42.4 Å²	42.4	4%	0.042	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	126.7	179.7	-61	97.4	0	0	0	110.2	Y777 V800 V819 V959 P961 C1107 L1108 T1138	Y777-W1140 AromaticContact CD1-CH2 3.35Å; Y777-W1140 HydrophobicContact CD1-CH2 3.35Å; Y777-W1140 HydrophobicContact CD1-CZ2 4.38Å; Y777-W1140 AromaticContact CD1-CZ3 3.57Å; Y777-W1140 HydrophobicContact CD1-CZ3 3.57Å; Y777-W1140 HydrophobicContact CD2-CH2 4.33Å; Y777-W1140 HydrophobicContact CD2-CZ3 4.03Å; Y777-W1140 AromaticContact CE1-CH2 3.64Å; Y777-W1140 HydrophobicContact CE1-CH2 3.64Å; Y777-W1140 HydrophobicContact CE1-CZ3 4.24Å; Y777-W1140 AromaticContact CG-CH2 3.74Å; Y777-W1140 HydrophobicContact CG-CH2 3.74Å; Y777-W1140 AromaticContact CG-CZ3 3.44Å; Y777-W1140 HydrophobicContact CG-CZ3 3.44Å; Y777-W1140 VanDerWaalsContact CG-CZ3 3.44Å; V800-W1140 HydrophobicContact CB-CD2 4.47Å; V800-W1140 HydrophobicContact CB-CG 4.47Å; V800-W1140 HydrophobicContact CG1-CD2 3.83Å; V800-W1140 HydrophobicContact CG1-CE3 3.99Å; V800-W1140 HydrophobicContact CG1-CG 4.29Å; V800-W1140 HydrophobicContact CG1-CH2 4.39Å; V800-W1140 HydrophobicContact CG1-CZ2 4.28Å; V800-W1140 HydrophobicContact CG1-CZ3 4.25Å; V800-W1140 HydrophobicContact CG2-CB 4.1Å; V800-W1140 HydrophobicContact CG2-CD2 4.3Å; V800-W1140 HydrophobicContact CG2-CG 3.88Å; V819-W1140 HydrophobicContact CG1-CH2 4.38Å; V819-W1140 HydrophobicContact CG1-CZ2 3.85Å; V959-W1140 HydrophobicContact CB-CB 4.26Å; V959-W1140 HydrophobicContact CB-CE3 4.17Å; V959-W1140 HydrophobicContact CG1-CB 4.48Å; V959-W1140 HydrophobicContact CG2-CB 4.42Å; V959-W1140 HydrophobicContact CG2-CD2 4.37Å; V959-W1140 HydrophobicContact CG2-CE3 3.66Å; V959-W1140 HydrophobicContact CG2-CZ3 4.34Å; P961-W1140 HydrophobicContact CB-CE3 4.08Å; P961-W1140 HydrophobicContact CB-CH2 3.72Å; P961-W1140 HydrophobicContact CB-CZ2 4.33Å; P961-W1140 HydrophobicContact CB-CZ3 3.58Å; P961-W1140 HydrophobicContact CG-CH2 4.25Å; P961-W1140 HydrophobicContact CG-CZ3 3.95Å; C1107-W1140 WeakPolarHBondContact CA-O 3.45Å; C1107-W1140 WeakPolarHBondContact CB-O 3.45Å; L1108-W1140 HydrophobicContact CD1-CB 4.21Å; L1108-W1140 HydrophobicContact CD1-CG 4.39Å; L1108-W1140 HydrophobicContact CG-CB 4.42Å; T1138-W1140 HydrophobicContact CG2-CZ2 3.84Å
1141	V	95	Very high	91.2	Very high	4 Å²	4	41.3 Å²	41.3	2%	0.024	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	127.1	-174	-175.6	0	0	0	0	110.8	V959 T960 Q962 L1057 Y1062 P1106 I1139 Q1143 L1146	V959-V1141 WeakPolarHBondContact CA-O 3.44Å; T960-V1141 PolarHBondContact N-O 2.88Å; T960-V1141 PolarHBondContact O-N 3.48Å; T960-V1141 VanDerWaalsContact O-N 3.14Å; Q962-V1141 HydrophobicContact CB-CG2 4.49Å; Q962-V1141 HydrophobicContact CG-CB 4.31Å; Q962-V1141 HydrophobicContact CG-CG2 3.84Å; L1057-V1141 HydrophobicContact CD2-CG1 4.5Å; L1057-V1141 HydrophobicContact CD2-CG2 4.21Å; Y1062-V1141 HydrophobicContact CD1-CG2 3.89Å; Y1062-V1141 HydrophobicContact CE1-CG2 3.96Å; P1106-V1141 WeakPolarHBondContact O-CA 3.43Å; I1139-V1141 HydrophobicContact CG2-CG2 4.08Å; V1141-Q1143 PolarHBondContact O-N 3.07Å; V1141-L1146 HydrophobicContact CG1-CD1 3.95Å
1142	E	93	Very high	90.9	Very high	2 Å²	2	44 Å²	44	1%	0.009	21%	0.211	C	C	.	.			trans	-83.3	91.9	174.7	-64.2	165.1	-100.2	0	0	108.4	R779 R918 S957 V959 P1106 D1144 L1145	R779-E1142 WeakPolarHBondContact CD-OE1 3.07Å; R779-E1142 IonicContact CZ-OE1 3.57Å; R779-E1142 IonicContact NE-OE1 3.99Å; R779-E1142 IonicContact NH1-OE1 3.66Å; R779-E1142 PolarHBondContact NH1-OE1 3.24Å; R918-E1142 IonicContact CZ-OE1 2.92Å; R918-E1142 IonicContact CZ-OE2 3.23Å; R918-E1142 IonicContact NH1-OE1 3.31Å; R918-E1142 PolarHBondContact NH1-OE1 2.98Å; R918-E1142 IonicContact NH1-OE2 2.99Å; R918-E1142 PolarHBondContact NH1-OE2 3.4Å; R918-E1142 VanDerWaalsContact NH2-CD 3.34Å; R918-E1142 IonicContact NH2-OE1 2.76Å; R918-E1142 PolarHBondContact NH2-OE1 3.06Å; R918-E1142 IonicContact NH2-OE2 3.24Å; R918-E1142 PolarHBondContact NH2-OE2 2.9Å; S957-E1142 WeakPolarHBondContact CB-OE2 3.48Å; S957-E1142 PolarHBondContact OG-OE2 3.41Å; V959-E1142 HydrophobicContact CG1-CG 3.56Å; P1106-E1142 HydrophobicContact CB-CB 4.14Å; P1106-E1142 PolarHBondContact O-N 3.31Å; E1142-D1144 VanDerWaalsContact C-N 3.29Å; E1142-D1144 PolarHBondContact O-N 3.05Å; E1142-L1145 HydrophobicContact CB-CB 4.34Å; E1142-L1145 HydrophobicContact CB-CD1 4Å; E1142-L1145 HydrophobicContact CB-CG 4.25Å; E1142-L1145 PolarHBondContact O-N 3.39Å; E1142-L1145 WeakPolarHBondContact OE2-CD1 3.34Å
1143	Q	85.7	Confident	90.7	Very high	93 Å²	93	43 Å²	43	44%	0.435	21%	0.205	S	C	.	.	G	3₁₀ helix	trans	-61.5	-36.8	-174.8	-70.3	-175.4	-13.7	0	0	112.6	T960 V1141 L1145 L1146	T960-Q1143 HydrophobicContact CG2-CG 4.23Å; T960-Q1143 PolarHBondContact OG1-NE2 3.38Å; V1141-Q1143 PolarHBondContact O-N 3.07Å; Q1143-L1145 PolarHBondContact O-N 3.4Å; Q1143-L1146 PolarHBondContact O-N 3.42Å; Q1143-L1146 VanDerWaalsContact O-N 3.07Å
1144	D	81.1	Confident	90.4	Very high	60 Å²	60	41.5 Å²	41.5	32%	0.321	20%	0.198	S	C	.	.	G	3₁₀ helix	trans	-69.3	3.2	-178.9	-50.6	-17.6	0	0	0	113.6	R929 P958 E1142	R929-D1144 WeakPolarHBondContact CD-OD1 3.27Å; R929-D1144 IonicContact NH1-OD1 3.89Å; P958-D1144 WeakPolarHBondContact CG-OD2 3.46Å; E1142-D1144 VanDerWaalsContact C-N 3.29Å; E1142-D1144 PolarHBondContact O-N 3.05Å
1145	L	80.5	Confident	90	Very high	24 Å²	24	42.9 Å²	42.9	13%	0.126	21%	0.205	C	C	.	.	G	3₁₀ helix	trans	-117.8	5	175.9	-66	-176.8	0	0	0	113.3	I920 K1054 P1106 E1142 Q1143	I920-L1145 HydrophobicContact CD1-CD1 4.31Å; I920-L1145 HydrophobicContact CG2-CD1 4.19Å; I920-L1145 HydrophobicContact CG2-CD2 3.81Å; K1054-L1145 WeakPolarHBondContact CD-O 3.45Å; K1054-L1145 WeakPolarHBondContact CE-O 3.17Å; K1054-L1145 PolarHBondContact NZ-O 2.89Å; P1106-L1145 HydrophobicContact CB-CB 3.68Å; P1106-L1145 HydrophobicContact CB-CD1 4.39Å; E1142-L1145 HydrophobicContact CB-CB 4.34Å; E1142-L1145 HydrophobicContact CB-CD1 4Å; E1142-L1145 HydrophobicContact CB-CG 4.25Å; E1142-L1145 PolarHBondContact O-N 3.39Å; E1142-L1145 WeakPolarHBondContact OE2-CD1 3.34Å; Q1143-L1145 PolarHBondContact O-N 3.4Å
1146	L	79.4	Confident	89.6	Confident	76 Å²	76	43.7 Å²	43.7	40%	0.398	21%	0.209	S	C	.	.			trans	-89.7	0	176.8	-65.9	179.8	0	0	0	111.8	L1057 R1058 P1106 V1141 Q1143	L1057-L1146 HydrophobicContact CB-CD1 4.18Å; L1057-L1146 HydrophobicContact CB-CD2 3.5Å; L1057-L1146 VanDerWaalsContact CB-CD2 3.5Å; L1057-L1146 HydrophobicContact CD1-CD2 4.03Å; L1057-L1146 HydrophobicContact CG-CD2 4.42Å; R1058-L1146 HydrophobicContact CG-CB 4.25Å; R1058-L1146 PolarHBondContact NE-O 2.68Å; R1058-L1146 PolarHBondContact NH2-O 3.04Å; P1106-L1146 HydrophobicContact CB-CD2 4.18Å; P1106-L1146 HydrophobicContact CG-CD2 3.64Å; V1141-L1146 HydrophobicContact CG1-CD1 3.95Å; Q1143-L1146 PolarHBondContact O-N 3.42Å; Q1143-L1146 VanDerWaalsContact O-N 3.07Å

Retrieved 1,146 of 1,146 residues in 286.6 ms (Link to these results)

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