A0A5K4FCS4_SCHMA Loading...

Putative glutamate-gated chloride channel subunit 4

AlphaFold DB , UniProt , Accession A0A5K4FCS4, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 866 aa.

						>A0A5K4FCS4_SCHMA|A0A5K4FCS4
MAIRFWRTIYLIIKTIYYMNLFMSKYLLTIKTINGNQLNNQLNELDIYQNNPYPSLSQLESYRINNRLNTNVNQSYNFYTSNPYQSYMPIGRFTNISYPSSNVHENKWNAYINRVNNQYINRSSNSQISNSNNQSHYTSIPTNFPNLVSTSTSPFSSTSSLSGSTSSLGIVYTPEISHPFLAGESETEQILKYILTNYKSHERPNENSQDPTIVSVFIHIIDISSSNVVQMEYTINCYLRQQWYDPRLSWDTNTLLSNNIKELLLNQQKNQLWLPDLFFRNGKSGFLHDMSQPNYLLRVKSNGQVLYSQKITMTLSCQMYLRKFPMDKQECTVNIGSYGYTIDQLKFIWHHDKPVTISNNLQLLEFESPHGAYTLDCTKNGTTNTGTYSCLLLIIPLRRLIGSYIVTTYIPEVLIVMVSWLGFWIDIKAVPARVTLGLLTLLGLLTESSSVSSQLPKVTYLKAIDVWLTVCLLFVIAALAEFAYAYLMTPKSDSPEWEPEVRDLVKTLLVNYTGEIRCCCCFTKNRHHKPIFRDNNNNQRSRSHQPQSHIDNKHKKLNSHTRDIESDPEFTMKPMKKSSRTSRSRHIKSTNLRCKVCESYQPVCCTCPACARLKCPEAPRKKQTQVKISTKHSKLKSIKSINHNENKKSYQINSNLINSSPIIKSIKKTKSIQQKNKQSINIDSCHILIEPLYQELLLSKQPKKSALKINNSIINNNNLINSNKQLKITTFLNHKKQNIINNKSIKQSNDNKQQQQHHHYYHDQINQSNQKLWYYKNILNKCLSCFKCMLPCQQKQSLINMNKILSNSKKCKSIRFMNTTNTTHNNNNSSALYESKIDAYSRLIFPISFFVFLFIYWFFYLILAKD
					

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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	43.7	Very low	70	Confident	161 Å²	161	119.2 Å²	119.2	79%	0.793	55%	0.549	S	S	*	.				0	-41.3	0	-90	179.8	-82.2	0	0	113.9	I3 R4 F5 Y484	M1-I3 PolarHBondContact O-N 3.1Å; M1-I3 VanDerWaalsContact O-N 3.14Å; M1-R4 WeakPolarHBondContact O-CA 3.47Å; M1-R4 WeakPolarHBondContact O-CB 3.42Å; M1-R4 PolarHBondContact O-N 3.09Å; M1-F5 PolarHBondContact O-N 3.09Å; M1-F5 VanDerWaalsContact O-N 3.13Å; M1-Y484 PolarHBondContact SD-OH 3.27Å
2	A	52.8	Low	70.8	Confident	55 Å²	55	117 Å²	117	46%	0.455	54%	0.543	S	S	.	.	H	α-helix	trans	-47.5	-41.7	174.8	0	0	0	0	0	113.9	R4 F5 W6	A2-R4 VanDerWaalsContact C-N 3.31Å; A2-R4 PolarHBondContact O-N 3.23Å; A2-F5 PolarHBondContact O-N 3.07Å; A2-F5 VanDerWaalsContact O-N 3.14Å; A2-W6 WeakPolarHBondContact O-CB 3.49Å; A2-W6 PolarHBondContact O-N 3.37Å
3	I	72	Confident	71.6	Confident	142 Å²	142	116 Å²	116	73%	0.728	54%	0.542	S	S	*	.	H	α-helix	trans	-58	-37.6	173.8	-59.4	172.4	0	0	0	112.5	M1 R7	M1-I3 PolarHBondContact O-N 3.1Å; M1-I3 VanDerWaalsContact O-N 3.14Å; I3-R7 WeakPolarHBondContact O-CB 3.5Å; I3-R7 PolarHBondContact O-N 2.96Å
4	R	69.3	Low	72.2	Confident	200 Å²	200	112.8 Å²	112.8	76%	0.755	53%	0.525	S	S	*	.	H	α-helix	trans	-70.5	-40.4	175.2	-73.3	-172.7	177.6	175.9	-1.5	111.5	M1 A2 R7 T8	M1-R4 WeakPolarHBondContact O-CA 3.47Å; M1-R4 WeakPolarHBondContact O-CB 3.42Å; M1-R4 PolarHBondContact O-N 3.09Å; A2-R4 VanDerWaalsContact C-N 3.31Å; A2-R4 PolarHBondContact O-N 3.23Å; R4-R7 CarbonylContact O-C 3.59Å; R4-R7 PolarHBondContact O-N 3.35Å; R4-T8 PolarHBondContact O-N 3.11Å; R4-T8 PolarHBondContact O-OG1 3.44Å; R4-T8 VanDerWaalsContact O-OG1 3.06Å
5	F	67.1	Low	72.6	Confident	111 Å²	111	110.1 Å²	110.1	49%	0.487	52%	0.52	S	S	.	.	H	α-helix	trans	-63.8	-48	176.6	-177.2	-103.9	0	0	0	112	M1 A2 R7 T8 I9	M1-F5 PolarHBondContact O-N 3.09Å; M1-F5 VanDerWaalsContact O-N 3.13Å; A2-F5 PolarHBondContact O-N 3.07Å; A2-F5 VanDerWaalsContact O-N 3.14Å; F5-R7 VanDerWaalsContact C-N 3.31Å; F5-R7 PolarHBondContact O-N 2.97Å; F5-T8 VanDerWaalsContact CA-OG1 3.32Å; F5-T8 WeakPolarHBondContact CA-OG1 3.28Å; F5-T8 PolarHBondContact O-N 3.04Å; F5-T8 VanDerWaalsContact O-N 3.15Å; F5-T8 PolarHBondContact O-OG1 3.2Å; F5-I9 HydrophobicContact CD1-CD1 3.93Å; F5-I9 HydrophobicContact CE1-CD1 3.34Å; F5-I9 HydrophobicContact CE1-CG1 4.35Å; F5-I9 HydrophobicContact CE2-CD1 4.45Å; F5-I9 HydrophobicContact CZ-CD1 3.65Å; F5-I9 HydrophobicContact CZ-CG1 4.45Å; F5-I9 PolarHBondContact O-N 2.78Å
6	W	77.3	Confident	73.1	Confident	119 Å²	119	108.8 Å²	108.8	45%	0.451	52%	0.516	S	S	.	.	H	α-helix	trans	-62.7	-35.3	171.8	-84.2	107.1	0	0	0	112.5	A2 I9 Y10 I844	A2-W6 WeakPolarHBondContact O-CB 3.49Å; A2-W6 PolarHBondContact O-N 3.37Å; W6-I9 PolarHBondContact O-N 3.16Å; W6-Y10 WeakPolarHBondContact O-CB 3.42Å; W6-Y10 PolarHBondContact O-N 3.46Å; W6-I844 HydrophobicContact CZ2-CG2 3.8Å
7	R	76	Confident	73.6	Confident	174 Å²	174	111.1 Å²	111.1	66%	0.657	52%	0.52	S	S	*	.	H	α-helix	trans	-67.8	-34.9	172.7	-168.4	172.2	-177.4	173	-0.6	112.1	I3 R4 F5 L11	I3-R7 WeakPolarHBondContact O-CB 3.5Å; I3-R7 PolarHBondContact O-N 2.96Å; R4-R7 CarbonylContact O-C 3.59Å; R4-R7 PolarHBondContact O-N 3.35Å; F5-R7 VanDerWaalsContact C-N 3.31Å; F5-R7 PolarHBondContact O-N 2.97Å; R7-L11 HydrophobicContact CG-CD1 4.32Å; R7-L11 VanDerWaalsContact O-CB 3.25Å; R7-L11 WeakPolarHBondContact O-CB 3.21Å; R7-L11 WeakPolarHBondContact O-CD1 3.14Å; R7-L11 WeakPolarHBondContact O-CG 3.48Å; R7-L11 PolarHBondContact O-N 3.06Å
8	T	75.6	Confident	74	Confident	72 Å²	72	111.5 Å²	111.5	44%	0.442	52%	0.517	S	S	.	.	H	α-helix	trans	-70.5	-42.1	171.3	37	0	0	0	0	112.8	R4 F5 L11 I12	R4-T8 PolarHBondContact O-N 3.11Å; R4-T8 PolarHBondContact O-OG1 3.44Å; R4-T8 VanDerWaalsContact O-OG1 3.06Å; F5-T8 VanDerWaalsContact CA-OG1 3.32Å; F5-T8 WeakPolarHBondContact CA-OG1 3.28Å; F5-T8 PolarHBondContact O-N 3.04Å; F5-T8 VanDerWaalsContact O-N 3.15Å; F5-T8 PolarHBondContact O-OG1 3.2Å; T8-L11 PolarHBondContact O-N 3.39Å; T8-I12 VanDerWaalsContact O-CG1 3.27Å; T8-I12 WeakPolarHBondContact O-CG1 3.5Å; T8-I12 PolarHBondContact O-N 2.75Å
9	I	73.9	Confident	74.1	Confident	53 Å²	53	112.2 Å²	112.2	27%	0.272	52%	0.522	S	S	.	.	H	α-helix	trans	-63.2	-45.9	173.7	-72.3	179.2	0	0	0	110.4	F5 W6 L11 I12 I13	F5-I9 HydrophobicContact CD1-CD1 3.93Å; F5-I9 HydrophobicContact CE1-CD1 3.34Å; F5-I9 HydrophobicContact CE1-CG1 4.35Å; F5-I9 HydrophobicContact CE2-CD1 4.45Å; F5-I9 HydrophobicContact CZ-CD1 3.65Å; F5-I9 HydrophobicContact CZ-CG1 4.45Å; F5-I9 PolarHBondContact O-N 2.78Å; W6-I9 PolarHBondContact O-N 3.16Å; I9-L11 VanDerWaalsContact C-N 3.31Å; I9-L11 PolarHBondContact O-N 3.09Å; I9-I12 PolarHBondContact O-N 3.48Å; I9-I12 VanDerWaalsContact O-N 3.13Å; I9-I13 HydrophobicContact CG2-CD1 3.71Å; I9-I13 HydrophobicContact CG2-CG1 4.34Å; I9-I13 WeakPolarHBondContact O-CG1 3.42Å; I9-I13 PolarHBondContact O-N 3.06Å
10	Y	81.3	Confident	74.2	Confident	135 Å²	135	111.4 Å²	111.4	53%	0.529	52%	0.521	S	S	.	.	H	α-helix	trans	-58.5	-42.9	173.4	176.3	-98.5	0	0	0	111.2	W6 I12 I13 K14	W6-Y10 WeakPolarHBondContact O-CB 3.42Å; W6-Y10 PolarHBondContact O-N 3.46Å; Y10-I12 PolarHBondContact O-N 2.65Å; Y10-I13 PolarHBondContact O-N 3.48Å; Y10-K14 HydrophobicContact CE1-CD 3.91Å; Y10-K14 WeakPolarHBondContact O-CA 3.5Å; Y10-K14 WeakPolarHBondContact O-CB 3.41Å; Y10-K14 PolarHBondContact O-N 3.48Å
11	L	80.6	Confident	74.4	Confident	89 Å²	89	109 Å²	109	47%	0.466	51%	0.512	S	S	.	.	H	α-helix	trans	-64.5	-36.5	174.8	-77.3	167.2	0	0	0	112.6	R7 T8 I9 K14 T15	R7-L11 HydrophobicContact CG-CD1 4.32Å; R7-L11 VanDerWaalsContact O-CB 3.25Å; R7-L11 WeakPolarHBondContact O-CB 3.21Å; R7-L11 WeakPolarHBondContact O-CD1 3.14Å; R7-L11 WeakPolarHBondContact O-CG 3.48Å; R7-L11 PolarHBondContact O-N 3.06Å; T8-L11 PolarHBondContact O-N 3.39Å; I9-L11 VanDerWaalsContact C-N 3.31Å; I9-L11 PolarHBondContact O-N 3.09Å; L11-K14 CarbonylContact O-C 3.57Å; L11-K14 PolarHBondContact O-N 3.5Å; L11-T15 WeakPolarHBondContact O-CB 3.46Å; L11-T15 WeakPolarHBondContact O-CG2 3.45Å; L11-T15 PolarHBondContact O-N 2.89Å; L11-T15 PolarHBondContact O-OG1 2.98Å; L11-T15 VanDerWaalsContact O-OG1 3.07Å
12	I	80	Confident	75.9	Confident	93 Å²	93	107.2 Å²	107.2	48%	0.477	50%	0.5	S	S	.	.	H	α-helix	trans	-68.9	-45	175.2	-69.3	162.1	0	0	0	110.9	T8 I9 Y10 K14 T15 I16	T8-I12 VanDerWaalsContact O-CG1 3.27Å; T8-I12 WeakPolarHBondContact O-CG1 3.5Å; T8-I12 PolarHBondContact O-N 2.75Å; I9-I12 PolarHBondContact O-N 3.48Å; I9-I12 VanDerWaalsContact O-N 3.13Å; Y10-I12 PolarHBondContact O-N 2.65Å; I12-K14 VanDerWaalsContact C-N 3.29Å; I12-K14 PolarHBondContact O-N 2.97Å; I12-T15 WeakPolarHBondContact CA-OG1 3.25Å; I12-T15 PolarHBondContact O-N 3.08Å; I12-T15 PolarHBondContact O-OG1 2.91Å; I12-I16 HydrophobicContact CG2-CD1 3.88Å; I12-I16 WeakPolarHBondContact O-CB 3.49Å; I12-I16 VanDerWaalsContact O-CG1 3.25Å; I12-I16 WeakPolarHBondContact O-CG1 3.22Å; I12-I16 PolarHBondContact O-N 2.95Å
13	I	80.9	Confident	76.8	Confident	104 Å²	104	110 Å²	110	53%	0.533	51%	0.505	S	S	.	.	H	α-helix	trans	-63.2	-39.8	174.1	-66.2	169.9	0	0	0	109.8	I9 Y10 I16 Y17	I9-I13 HydrophobicContact CG2-CD1 3.71Å; I9-I13 HydrophobicContact CG2-CG1 4.34Å; I9-I13 WeakPolarHBondContact O-CG1 3.42Å; I9-I13 PolarHBondContact O-N 3.06Å; Y10-I13 PolarHBondContact O-N 3.48Å; I13-I16 PolarHBondContact O-N 3.4Å; I13-Y17 VanDerWaalsContact O-CB 3.26Å; I13-Y17 WeakPolarHBondContact O-CB 3.46Å; I13-Y17 PolarHBondContact O-N 3.13Å
14	K	80	Confident	77	Confident	71 Å²	71	106.3 Å²	106.3	31%	0.309	49%	0.492	S	S	.	.	H	α-helix	trans	-69.8	-35.3	177.4	-156.4	-169.4	-163.4	-157.9	0	112	Y10 L11 I12 Y18	Y10-K14 HydrophobicContact CE1-CD 3.91Å; Y10-K14 WeakPolarHBondContact O-CA 3.5Å; Y10-K14 WeakPolarHBondContact O-CB 3.41Å; Y10-K14 PolarHBondContact O-N 3.48Å; L11-K14 CarbonylContact O-C 3.57Å; L11-K14 PolarHBondContact O-N 3.5Å; I12-K14 VanDerWaalsContact C-N 3.29Å; I12-K14 PolarHBondContact O-N 2.97Å; K14-Y18 HydrophobicContact CD-CD2 4.31Å; K14-Y18 HydrophobicContact CD-CE2 3.6Å; K14-Y18 VanDerWaalsContact CE-CE2 3.47Å; K14-Y18 VanDerWaalsContact CE-OH 3.29Å; K14-Y18 WeakPolarHBondContact CE-OH 3.34Å; K14-Y18 HydrophobicContact CG-CD2 3.85Å; K14-Y18 HydrophobicContact CG-CE2 3.55Å; K14-Y18 PolarHBondContact NZ-OH 2.86Å; K14-Y18 VanDerWaalsContact O-CB 3.29Å; K14-Y18 WeakPolarHBondContact O-CB 3.44Å; K14-Y18 WeakPolarHBondContact O-CD2 3.43Å; K14-Y18 PolarHBondContact O-N 2.9Å
15	T	78.1	Confident	77.1	Confident	73 Å²	73	103.3 Å²	103.3	45%	0.448	48%	0.484	S	S	.	.	H	α-helix	trans	-73.6	-36.8	172.4	52.2	0	0	0	0	111.6	L11 I12 Y18 M19	L11-T15 WeakPolarHBondContact O-CB 3.46Å; L11-T15 WeakPolarHBondContact O-CG2 3.45Å; L11-T15 PolarHBondContact O-N 2.89Å; L11-T15 PolarHBondContact O-OG1 2.98Å; L11-T15 VanDerWaalsContact O-OG1 3.07Å; I12-T15 WeakPolarHBondContact CA-OG1 3.25Å; I12-T15 PolarHBondContact O-N 3.08Å; I12-T15 PolarHBondContact O-OG1 2.91Å; T15-Y18 CarbonylContact O-C 3.43Å; T15-Y18 PolarHBondContact O-N 3.16Å; T15-M19 WeakPolarHBondContact O-CB 3.22Å; T15-M19 WeakPolarHBondContact O-CG 3.49Å; T15-M19 PolarHBondContact O-N 3.45Å
16	I	80.4	Confident	77.3	Confident	89 Å²	89	104 Å²	104	46%	0.456	48%	0.484	S	S	.	.	H	α-helix	trans	-63.3	-43.4	171.2	-68.2	164.5	0	0	0	110.3	I12 I13 M19 N20	I12-I16 HydrophobicContact CG2-CD1 3.88Å; I12-I16 WeakPolarHBondContact O-CB 3.49Å; I12-I16 VanDerWaalsContact O-CG1 3.25Å; I12-I16 WeakPolarHBondContact O-CG1 3.22Å; I12-I16 PolarHBondContact O-N 2.95Å; I13-I16 PolarHBondContact O-N 3.4Å; I16-M19 PolarHBondContact O-N 2.87Å; I16-N20 WeakPolarHBondContact O-CB 3.27Å; I16-N20 PolarHBondContact O-N 3.4Å; I16-N20 PolarHBondContact O-ND2 3.41Å
17	Y	83	Confident	76.8	Confident	147 Å²	147	103.6 Å²	103.6	58%	0.576	49%	0.491	S	S	*	.	H	α-helix	trans	-63.8	-45.5	174.8	-176.8	-93.9	0	0	0	111.7	I13 N20 L21	I13-Y17 VanDerWaalsContact O-CB 3.26Å; I13-Y17 WeakPolarHBondContact O-CB 3.46Å; I13-Y17 PolarHBondContact O-N 3.13Å; Y17-N20 PolarHBondContact O-N 2.92Å; Y17-L21 HydrophobicContact CE1-CD2 4.34Å; Y17-L21 WeakPolarHBondContact O-CB 3.19Å; Y17-L21 PolarHBondContact O-N 3.27Å
18	Y	80.1	Confident	76.3	Confident	119 Å²	119	100.3 Å²	100.3	47%	0.467	49%	0.485	S	S	.	.	H	α-helix	trans	-68.7	-30.3	175.1	-77.8	-49.1	0	0	0	113.1	K14 T15 L21 F22	K14-Y18 HydrophobicContact CD-CD2 4.31Å; K14-Y18 HydrophobicContact CD-CE2 3.6Å; K14-Y18 VanDerWaalsContact CE-CE2 3.47Å; K14-Y18 VanDerWaalsContact CE-OH 3.29Å; K14-Y18 WeakPolarHBondContact CE-OH 3.34Å; K14-Y18 HydrophobicContact CG-CD2 3.85Å; K14-Y18 HydrophobicContact CG-CE2 3.55Å; K14-Y18 PolarHBondContact NZ-OH 2.86Å; K14-Y18 VanDerWaalsContact O-CB 3.29Å; K14-Y18 WeakPolarHBondContact O-CB 3.44Å; K14-Y18 WeakPolarHBondContact O-CD2 3.43Å; K14-Y18 PolarHBondContact O-N 2.9Å; T15-Y18 CarbonylContact O-C 3.43Å; T15-Y18 PolarHBondContact O-N 3.16Å; Y18-L21 HydrophobicContact CD1-CD2 4.29Å; Y18-F22 WeakPolarHBondContact O-CA 3.4Å; Y18-F22 WeakPolarHBondContact O-CB 3.47Å; Y18-F22 PolarHBondContact O-N 2.9Å
19	M	75.6	Confident	75.5	Confident	125 Å²	125	99.7 Å²	99.7	62%	0.616	48%	0.482	S	S	*	.	H	α-helix	trans	-71.6	-40.4	173.3	-74.3	-68.6	178.1	0	0	110.3	T15 I16 F22 M23	T15-M19 WeakPolarHBondContact O-CB 3.22Å; T15-M19 WeakPolarHBondContact O-CG 3.49Å; T15-M19 PolarHBondContact O-N 3.45Å; I16-M19 PolarHBondContact O-N 2.87Å; M19-F22 PolarHBondContact O-N 3.02Å; M19-M23 VanDerWaalsContact O-CB 3.26Å; M19-M23 WeakPolarHBondContact O-CB 3.23Å; M19-M23 WeakPolarHBondContact O-CG 3.05Å; M19-M23 PolarHBondContact O-N 3.02Å
20	N	76	Confident	74.8	Confident	96 Å²	96	100.5 Å²	100.5	51%	0.513	49%	0.486	S	S	.	.	H	α-helix	trans	-67	-39.1	171.9	-78	-27.1	0	0	0	112.2	I16 Y17 S24	I16-N20 WeakPolarHBondContact O-CB 3.27Å; I16-N20 PolarHBondContact O-N 3.4Å; I16-N20 PolarHBondContact O-ND2 3.41Å; Y17-N20 PolarHBondContact O-N 2.92Å; N20-S24 WeakPolarHBondContact O-CB 3.47Å; N20-S24 PolarHBondContact O-N 2.85Å
21	L	78.5	Confident	73.4	Confident	62 Å²	62	101.9 Å²	101.9	33%	0.325	50%	0.495	S	S	.	.	H	α-helix	trans	-70.9	-36	175.6	-167.6	76.6	0	0	0	111.4	Y17 Y18 K25	Y17-L21 HydrophobicContact CE1-CD2 4.34Å; Y17-L21 WeakPolarHBondContact O-CB 3.19Å; Y17-L21 PolarHBondContact O-N 3.27Å; Y18-L21 HydrophobicContact CD1-CD2 4.29Å; L21-K25 VanDerWaalsContact O-CB 3.24Å; L21-K25 WeakPolarHBondContact O-CB 3.48Å; L21-K25 WeakPolarHBondContact O-CG 3.37Å; L21-K25 PolarHBondContact O-N 2.62Å
22	F	75.5	Confident	72.2	Confident	123 Å²	123	100.7 Å²	100.7	54%	0.539	49%	0.491	S	S	.	.	H	α-helix	trans	-70	-46.8	174.4	-176.5	-92.2	0	0	0	109.9	Y18 M19 S24 K25 Y26	Y18-F22 WeakPolarHBondContact O-CA 3.4Å; Y18-F22 WeakPolarHBondContact O-CB 3.47Å; Y18-F22 PolarHBondContact O-N 2.9Å; M19-F22 PolarHBondContact O-N 3.02Å; F22-S24 VanDerWaalsContact C-N 3.32Å; F22-S24 PolarHBondContact O-N 3.23Å; F22-K25 CarbonylContact O-C 3.49Å; F22-K25 PolarHBondContact O-N 2.9Å; F22-Y26 AromaticContact CE1-CD2 3.93Å; F22-Y26 HydrophobicContact CE1-CD2 3.93Å; F22-Y26 HydrophobicContact CE1-CG 4.26Å; F22-Y26 AromaticContact CZ-CD2 3.88Å; F22-Y26 HydrophobicContact CZ-CD2 3.88Å; F22-Y26 HydrophobicContact CZ-CE2 4.4Å; F22-Y26 WeakPolarHBondContact O-CA 3.49Å; F22-Y26 WeakPolarHBondContact O-CB 3.46Å; F22-Y26 PolarHBondContact O-N 3.12Å
23	M	72.7	Confident	70.9	Confident	112 Å²	112	101.3 Å²	101.3	55%	0.552	49%	0.494	S	S	*	.	H	α-helix	trans	-62.7	-38.8	173.9	-69.3	-68.3	-80.6	0	0	111.5	M19 Y26 L27	M19-M23 VanDerWaalsContact O-CB 3.26Å; M19-M23 WeakPolarHBondContact O-CB 3.23Å; M19-M23 WeakPolarHBondContact O-CG 3.05Å; M19-M23 PolarHBondContact O-N 3.02Å; M23-Y26 PolarHBondContact O-N 3.14Å; M23-L27 VanDerWaalsContact O-CB 3.26Å; M23-L27 WeakPolarHBondContact O-CB 3.27Å; M23-L27 WeakPolarHBondContact O-CD1 3.46Å; M23-L27 WeakPolarHBondContact O-CG 3.39Å; M23-L27 PolarHBondContact O-N 2.71Å
24	S	74.9	Confident	69.3	Low	66 Å²	66	101 Å²	101	46%	0.462	49%	0.494	S	S	.	.	H	α-helix	trans	-63.7	-49	173	-178.2	0	0	0	0	111.5	N20 F22 Y26 L27 L28	N20-S24 WeakPolarHBondContact O-CB 3.47Å; N20-S24 PolarHBondContact O-N 2.85Å; F22-S24 VanDerWaalsContact C-N 3.32Å; F22-S24 PolarHBondContact O-N 3.23Å; S24-Y26 VanDerWaalsContact C-N 3.34Å; S24-Y26 PolarHBondContact O-N 3.26Å; S24-L27 PolarHBondContact O-N 3.12Å; S24-L28 WeakPolarHBondContact O-CB 3.39Å; S24-L28 PolarHBondContact O-N 3.06Å
25	K	71.3	Confident	67.6	Low	136 Å²	136	98.2 Å²	98.2	59%	0.591	49%	0.485	S	S	*	.	H	α-helix	trans	-66.3	-31.8	174.8	-80.9	-168.6	173.4	-168.7	0	112.9	L21 F22 L28 T29	L21-K25 VanDerWaalsContact O-CB 3.24Å; L21-K25 WeakPolarHBondContact O-CB 3.48Å; L21-K25 WeakPolarHBondContact O-CG 3.37Å; L21-K25 PolarHBondContact O-N 2.62Å; F22-K25 CarbonylContact O-C 3.49Å; F22-K25 PolarHBondContact O-N 2.9Å; K25-L28 CarbonylContact O-C 3.48Å; K25-L28 WeakPolarHBondContact O-CB 3.29Å; K25-L28 PolarHBondContact O-N 3.42Å; K25-T29 WeakPolarHBondContact O-CB 3.48Å; K25-T29 WeakPolarHBondContact O-CG2 3.02Å; K25-T29 PolarHBondContact O-N 3Å; K25-T29 PolarHBondContact O-OG1 3.13Å; K25-T29 VanDerWaalsContact O-OG1 3.08Å
26	Y	71.3	Confident	66	Low	125 Å²	125	100 Å²	100	49%	0.49	49%	0.492	S	S	.	.	H	α-helix	trans	-75.6	-37.8	179.5	-161.3	-99.5	0	0	0	110.1	F22 M23 S24 L28 T29 I30	F22-Y26 AromaticContact CE1-CD2 3.93Å; F22-Y26 HydrophobicContact CE1-CD2 3.93Å; F22-Y26 HydrophobicContact CE1-CG 4.26Å; F22-Y26 AromaticContact CZ-CD2 3.88Å; F22-Y26 HydrophobicContact CZ-CD2 3.88Å; F22-Y26 HydrophobicContact CZ-CE2 4.4Å; F22-Y26 WeakPolarHBondContact O-CA 3.49Å; F22-Y26 WeakPolarHBondContact O-CB 3.46Å; F22-Y26 PolarHBondContact O-N 3.12Å; M23-Y26 PolarHBondContact O-N 3.14Å; S24-Y26 VanDerWaalsContact C-N 3.34Å; S24-Y26 PolarHBondContact O-N 3.26Å; Y26-L28 VanDerWaalsContact C-N 3.33Å; Y26-T29 VanDerWaalsContact CA-OG1 3.31Å; Y26-T29 WeakPolarHBondContact CA-OG1 3.41Å; Y26-T29 PolarHBondContact O-N 3.17Å; Y26-T29 PolarHBondContact O-OG1 2.98Å; Y26-T29 VanDerWaalsContact O-OG1 3.13Å; Y26-I30 HydrophobicContact CD1-CD1 3.63Å; Y26-I30 HydrophobicContact CD1-CG1 4.38Å; Y26-I30 HydrophobicContact CE1-CD1 3.63Å; Y26-I30 HydrophobicContact CE1-CG1 4.39Å; Y26-I30 WeakPolarHBondContact O-CB 3.44Å; Y26-I30 WeakPolarHBondContact O-CG1 3.16Å; Y26-I30 PolarHBondContact O-N 2.91Å
27	L	67.9	Low	64.3	Low	111 Å²	111	102.5 Å²	102.5	58%	0.581	50%	0.502	S	S	*	.	H	α-helix	trans	-66.9	-33.7	166	-71.8	168.4	0	0	0	111.8	M23 S24 K31	M23-L27 VanDerWaalsContact O-CB 3.26Å; M23-L27 WeakPolarHBondContact O-CB 3.27Å; M23-L27 WeakPolarHBondContact O-CD1 3.46Å; M23-L27 WeakPolarHBondContact O-CG 3.39Å; M23-L27 PolarHBondContact O-N 2.71Å; S24-L27 PolarHBondContact O-N 3.12Å; L27-K31 VanDerWaalsContact O-CB 3.28Å; L27-K31 WeakPolarHBondContact O-CB 3.38Å; L27-K31 PolarHBondContact O-N 3.29Å
28	L	64.9	Low	62.3	Low	105 Å²	105	99.1 Å²	99.1	55%	0.55	49%	0.493	S	S	.	.	H	α-helix	trans	-70.3	-41.1	173.3	-133.2	94.8	0	0	0	111.7	S24 K25 Y26 K31 T32	S24-L28 WeakPolarHBondContact O-CB 3.39Å; S24-L28 PolarHBondContact O-N 3.06Å; K25-L28 CarbonylContact O-C 3.48Å; K25-L28 WeakPolarHBondContact O-CB 3.29Å; K25-L28 PolarHBondContact O-N 3.42Å; Y26-L28 VanDerWaalsContact C-N 3.33Å; L28-K31 CarbonylContact O-C 3.46Å; L28-K31 WeakPolarHBondContact O-CA 3.46Å; L28-K31 WeakPolarHBondContact O-CB 3.42Å; L28-K31 PolarHBondContact O-N 3.43Å; L28-K31 VanDerWaalsContact O-N 3.14Å; L28-T32 WeakPolarHBondContact O-CG2 3.43Å; L28-T32 PolarHBondContact O-N 2.86Å; L28-T32 PolarHBondContact O-OG1 2.96Å; L28-T32 VanDerWaalsContact O-OG1 3.09Å
29	T	59.2	Low	60.4	Low	59 Å²	59	97.5 Å²	97.5	36%	0.362	49%	0.493	S	S	.	.	H	α-helix	trans	-73.1	-32	175.6	52.8	0	0	0	0	111.4	K25 Y26 K31 T32 I33	K25-T29 WeakPolarHBondContact O-CB 3.48Å; K25-T29 WeakPolarHBondContact O-CG2 3.02Å; K25-T29 PolarHBondContact O-N 3Å; K25-T29 PolarHBondContact O-OG1 3.13Å; K25-T29 VanDerWaalsContact O-OG1 3.08Å; Y26-T29 VanDerWaalsContact CA-OG1 3.31Å; Y26-T29 WeakPolarHBondContact CA-OG1 3.41Å; Y26-T29 PolarHBondContact O-N 3.17Å; Y26-T29 PolarHBondContact O-OG1 2.98Å; Y26-T29 VanDerWaalsContact O-OG1 3.13Å; T29-K31 VanDerWaalsContact C-N 3.32Å; T29-T32 WeakPolarHBondContact CA-OG1 3.22Å; T29-T32 PolarHBondContact O-N 3.46Å; T29-I33 WeakPolarHBondContact O-CA 3.42Å; T29-I33 WeakPolarHBondContact O-CB 3.39Å; T29-I33 WeakPolarHBondContact O-CD1 3.24Å; T29-I33 WeakPolarHBondContact O-CG1 3.44Å; T29-I33 PolarHBondContact O-N 2.91Å
30	I	57.6	Low	58.7	Low	71 Å²	71	98.5 Å²	98.5	36%	0.364	50%	0.501	S	S	.	.	H	α-helix	trans	-65.1	-40.5	165.9	-71.6	166.4	0	0	0	109.4	Y26 T32 N34	Y26-I30 HydrophobicContact CD1-CD1 3.63Å; Y26-I30 HydrophobicContact CD1-CG1 4.38Å; Y26-I30 HydrophobicContact CE1-CD1 3.63Å; Y26-I30 HydrophobicContact CE1-CG1 4.39Å; Y26-I30 WeakPolarHBondContact O-CB 3.44Å; Y26-I30 WeakPolarHBondContact O-CG1 3.16Å; Y26-I30 PolarHBondContact O-N 2.91Å; I30-T32 PolarHBondContact O-N 3.36Å; I30-N34 WeakPolarHBondContact O-CB 3.2Å; I30-N34 VanDerWaalsContact O-CG 3.29Å; I30-N34 PolarHBondContact O-N 3.1Å
31	K	53.8	Low	56.9	Low	164 Å²	164	99.2 Å²	99.2	71%	0.713	50%	0.501	S	S	*	.	H	α-helix	trans	-68.5	-22.2	173.7	-93	-165.9	169.3	-165.8	0	115.1	L27 L28 T29 G35	L27-K31 VanDerWaalsContact O-CB 3.28Å; L27-K31 WeakPolarHBondContact O-CB 3.38Å; L27-K31 PolarHBondContact O-N 3.29Å; L28-K31 CarbonylContact O-C 3.46Å; L28-K31 WeakPolarHBondContact O-CA 3.46Å; L28-K31 WeakPolarHBondContact O-CB 3.42Å; L28-K31 PolarHBondContact O-N 3.43Å; L28-K31 VanDerWaalsContact O-N 3.14Å; T29-K31 VanDerWaalsContact C-N 3.32Å; K31-G35 WeakPolarHBondContact O-CA 3.4Å; K31-G35 PolarHBondContact O-N 3.43Å
32	T	54.2	Low	55.1	Low	64 Å²	64	98.5 Å²	98.5	39%	0.393	50%	0.497	S	S	.	.	H	α-helix	trans	-105.9	-22.4	178.4	56.8	0	0	0	0	113.9	L28 T29 I30 G35 N36	L28-T32 WeakPolarHBondContact O-CG2 3.43Å; L28-T32 PolarHBondContact O-N 2.86Å; L28-T32 PolarHBondContact O-OG1 2.96Å; L28-T32 VanDerWaalsContact O-OG1 3.09Å; T29-T32 WeakPolarHBondContact CA-OG1 3.22Å; T29-T32 PolarHBondContact O-N 3.46Å; I30-T32 PolarHBondContact O-N 3.36Å; T32-G35 CarbonylContact O-C 3.52Å; T32-G35 PolarHBondContact O-N 3.28Å; T32-N36 WeakPolarHBondContact O-CB 3.25Å; T32-N36 PolarHBondContact O-N 3.08Å; T32-N36 PolarHBondContact O-OD1 3.03Å
33	I	53.2	Low	53.2	Low	106 Å²	106	99.5 Å²	99.5	54%	0.544	51%	0.508	S	S	.	.	H	α-helix	trans	-74.2	-48.5	166.1	-66.3	165.2	0	0	0	108.4	T29 G35 Q37	T29-I33 WeakPolarHBondContact O-CA 3.42Å; T29-I33 WeakPolarHBondContact O-CB 3.39Å; T29-I33 WeakPolarHBondContact O-CD1 3.24Å; T29-I33 WeakPolarHBondContact O-CG1 3.44Å; T29-I33 PolarHBondContact O-N 2.91Å; I33-G35 VanDerWaalsContact C-N 3.33Å; I33-Q37 PolarHBondContact O-N 3.27Å
34	N	47.9	Very low	51.6	Low	97 Å²	97	101.8 Å²	101.8	52%	0.519	52%	0.518	S	S	.	.	H	α-helix	trans	-62.1	-46.7	164	-66.2	-1.7	0	0	0	108.7	I30 N36 Q37 L38	I30-N34 WeakPolarHBondContact O-CB 3.2Å; I30-N34 VanDerWaalsContact O-CG 3.29Å; I30-N34 PolarHBondContact O-N 3.1Å; N34-N36 VanDerWaalsContact C-N 3.28Å; N34-N36 PolarHBondContact O-N 2.98Å; N34-N36 VanDerWaalsContact O-N 3.15Å; N34-Q37 CarbonylContact O-C 3.55Å; N34-Q37 PolarHBondContact O-N 3.1Å; N34-L38 WeakPolarHBondContact O-CA 3.35Å; N34-L38 WeakPolarHBondContact O-CB 3.24Å; N34-L38 PolarHBondContact O-N 2.88Å
35	G	43.9	Very low	49.8	Very low	13 Å²	13	101.5 Å²	101.5	13%	0.134	51%	0.51	C	S	.	.	H	α-helix	trans	-56.9	-29.8	-178	0	0	0	0	0	116.2	K31 T32 I33 N39	K31-G35 WeakPolarHBondContact O-CA 3.4Å; K31-G35 PolarHBondContact O-N 3.43Å; T32-G35 CarbonylContact O-C 3.52Å; T32-G35 PolarHBondContact O-N 3.28Å; I33-G35 VanDerWaalsContact C-N 3.33Å; G35-N39 WeakPolarHBondContact O-CB 3.42Å; G35-N39 PolarHBondContact O-N 3.21Å; G35-N39 PolarHBondContact O-OD1 3.36Å
36	N	44	Very low	48	Very low	110 Å²	110	100.2 Å²	100.2	59%	0.588	51%	0.51	S	S	*	.	H	α-helix	trans	-89.9	-25.6	178.7	-72.3	-3.6	0	0	0	113	T32 N34	T32-N36 WeakPolarHBondContact O-CB 3.25Å; T32-N36 PolarHBondContact O-N 3.08Å; T32-N36 PolarHBondContact O-OD1 3.03Å; N34-N36 VanDerWaalsContact C-N 3.28Å; N34-N36 PolarHBondContact O-N 2.98Å; N34-N36 VanDerWaalsContact O-N 3.15Å
37	Q	44.6	Very low	46.3	Very low	141 Å²	141	101.3 Å²	101.3	66%	0.659	52%	0.523	S	S	*	.	H	α-helix	trans	-75.5	-32.7	162.3	-75	-172.9	-79.6	0	0	111.5	I33 N34 Q41	I33-Q37 PolarHBondContact O-N 3.27Å; N34-Q37 CarbonylContact O-C 3.55Å; N34-Q37 PolarHBondContact O-N 3.1Å; Q37-Q41 PolarHBondContact O-N 3.05Å
38	L	42.2	Very low	44.7	Very low	76 Å²	76	103.6 Å²	103.6	40%	0.398	53%	0.525	S	S	.	.	H	α-helix	trans	-75.2	-32	178.2	-158.5	75.9	0	0	0	110.4	N34 N40 Q41 L42 L45	N34-L38 WeakPolarHBondContact O-CA 3.35Å; N34-L38 WeakPolarHBondContact O-CB 3.24Å; N34-L38 PolarHBondContact O-N 2.88Å; L38-N40 VanDerWaalsContact C-N 3.32Å; L38-N40 PolarHBondContact O-N 3.19Å; L38-Q41 CarbonylContact O-C 3.58Å; L38-Q41 VanDerWaalsContact O-C 3.28Å; L38-Q41 WeakPolarHBondContact O-CA 3.47Å; L38-Q41 PolarHBondContact O-N 3.34Å; L38-L42 HydrophobicContact CB-CD1 4.17Å; L38-L42 HydrophobicContact CD2-CD1 3.85Å; L38-L42 HydrophobicContact CD2-CG 4.39Å; L38-L42 HydrophobicContact CG-CD1 3.76Å; L38-L42 HydrophobicContact CG-CG 4Å; L38-L42 WeakPolarHBondContact O-CA 3.22Å; L38-L42 WeakPolarHBondContact O-CB 3.46Å; L38-L42 WeakPolarHBondContact O-CD1 3Å; L38-L42 VanDerWaalsContact O-CG 3.27Å; L38-L42 WeakPolarHBondContact O-CG 3.03Å; L38-L42 PolarHBondContact O-N 2.93Å; L38-L45 HydrophobicContact CD1-CD1 4.33Å
39	N	40.3	Very low	43	Very low	86 Å²	86	106.3 Å²	106.3	46%	0.46	54%	0.535	S	S	.	.	H	α-helix	trans	-64.5	-34.3	176.6	-86.3	-2.3	0	0	0	112.7	G35 Q41 L42	G35-N39 WeakPolarHBondContact O-CB 3.42Å; G35-N39 PolarHBondContact O-N 3.21Å; G35-N39 PolarHBondContact O-OD1 3.36Å; N39-Q41 VanDerWaalsContact C-N 3.27Å; N39-Q41 PolarHBondContact O-N 3.17Å; N39-L42 PolarHBondContact O-N 3.41Å; N39-L42 WeakPolarHBondContact OD1-CD1 3.43Å
40	N	38.8	Very low	41.6	Very low	146 Å²	146	108.7 Å²	108.7	78%	0.781	55%	0.545	S	S	*	.	H	α-helix	trans	-81.6	-2.9	171.9	-73.7	0.9	0	0	0	113.5	L38	L38-N40 VanDerWaalsContact C-N 3.32Å; L38-N40 PolarHBondContact O-N 3.19Å
41	Q	39.4	Very low	40.4	Very low	111 Å²	111	111.3 Å²	111.3	52%	0.519	56%	0.56	S	S	.	*	H	α-helix	trans	-108.9	-11.9	165.1	-62.3	-164.5	-66.8	0	0	112.6	Q37 L38 N39 E44 L45	Q37-Q41 PolarHBondContact O-N 3.05Å; L38-Q41 CarbonylContact O-C 3.58Å; L38-Q41 VanDerWaalsContact O-C 3.28Å; L38-Q41 WeakPolarHBondContact O-CA 3.47Å; L38-Q41 PolarHBondContact O-N 3.34Å; N39-Q41 VanDerWaalsContact C-N 3.27Å; N39-Q41 PolarHBondContact O-N 3.17Å; Q41-E44 CarbonylContact O-C 3.49Å; Q41-E44 WeakPolarHBondContact O-CA 3.49Å; Q41-E44 PolarHBondContact O-N 2.67Å; Q41-E44 VanDerWaalsContact O-N 3.08Å; Q41-L45 HydrophobicContact CB-CD1 4.05Å; Q41-L45 WeakPolarHBondContact O-CB 3.4Å; Q41-L45 WeakPolarHBondContact O-CD1 3.47Å; Q41-L45 WeakPolarHBondContact O-CG 3.37Å; Q41-L45 PolarHBondContact O-N 3.15Å
42	L	40.4	Very low	39.5	Very low	47 Å²	47	108 Å²	108	25%	0.246	56%	0.555	C	S	.	*	H	α-helix	trans	-78.6	-28.8	-175.7	-94.6	156.4	0	0	0	111.8	L38 N39 E44 L45 D46	L38-L42 HydrophobicContact CB-CD1 4.17Å; L38-L42 HydrophobicContact CD2-CD1 3.85Å; L38-L42 HydrophobicContact CD2-CG 4.39Å; L38-L42 HydrophobicContact CG-CD1 3.76Å; L38-L42 HydrophobicContact CG-CG 4Å; L38-L42 WeakPolarHBondContact O-CA 3.22Å; L38-L42 WeakPolarHBondContact O-CB 3.46Å; L38-L42 WeakPolarHBondContact O-CD1 3Å; L38-L42 VanDerWaalsContact O-CG 3.27Å; L38-L42 WeakPolarHBondContact O-CG 3.03Å; L38-L42 PolarHBondContact O-N 2.93Å; N39-L42 PolarHBondContact O-N 3.41Å; N39-L42 WeakPolarHBondContact OD1-CD1 3.43Å; L42-E44 PolarHBondContact O-N 3.22Å; L42-E44 VanDerWaalsContact O-N 3.16Å; L42-L45 HydrophobicContact CD2-CB 4.35Å; L42-L45 CarbonylContact O-C 3.53Å; L42-L45 PolarHBondContact O-N 3.48Å; L42-D46 PolarHBondContact O-N 3.31Å
43	N	35.4	Very low	38.8	Very low	143 Å²	143	112.6 Å²	112.6	77%	0.765	57%	0.567	S	S	*	*	H	α-helix	trans	-66	-9.6	166.5	-65.8	-1.8	0	0	0	112.9
44	E	38.5	Very low	37.9	Very low	161 Å²	161	111.4 Å²	111.4	75%	0.752	57%	0.566	S	S	*	*	H	α-helix	trans	-107	-10.6	163.5	-69.5	-168.3	143.9	0	0	113.4	Q41 L42	Q41-E44 CarbonylContact O-C 3.49Å; Q41-E44 WeakPolarHBondContact O-CA 3.49Å; Q41-E44 PolarHBondContact O-N 2.67Å; Q41-E44 VanDerWaalsContact O-N 3.08Å; L42-E44 PolarHBondContact O-N 3.22Å; L42-E44 VanDerWaalsContact O-N 3.16Å
45	L	37.5	Very low	37.4	Very low	59 Å²	59	108.8 Å²	108.8	31%	0.309	56%	0.555	S	S	.	*	H	α-helix	trans	-111.4	7.7	-176.3	-63.8	164.9	0	0	0	114.6	L38 Q41 L42 I47 Y48	L38-L45 HydrophobicContact CD1-CD1 4.33Å; Q41-L45 HydrophobicContact CB-CD1 4.05Å; Q41-L45 WeakPolarHBondContact O-CB 3.4Å; Q41-L45 WeakPolarHBondContact O-CD1 3.47Å; Q41-L45 WeakPolarHBondContact O-CG 3.37Å; Q41-L45 PolarHBondContact O-N 3.15Å; L42-L45 HydrophobicContact CD2-CB 4.35Å; L42-L45 CarbonylContact O-C 3.53Å; L42-L45 PolarHBondContact O-N 3.48Å; L45-I47 PolarHBondContact O-N 2.6Å; L45-Y48 HydrophobicContact CB-CD2 4.42Å; L45-Y48 HydrophobicContact CD2-CD2 3.46Å; L45-Y48 VanDerWaalsContact CD2-CD2 3.46Å; L45-Y48 HydrophobicContact CD2-CE2 3.83Å; L45-Y48 HydrophobicContact CD2-CG 4.25Å; L45-Y48 WeakPolarHBondContact O-CB 3.44Å; L45-Y48 PolarHBondContact O-N 3.02Å
46	D	33.3	Very low	37	Very low	109 Å²	109	114.8 Å²	114.8	58%	0.583	58%	0.584	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.6	-5.3	167.5	-87.5	-20.2	0	0	0	113.2	L42 Y48	L42-D46 PolarHBondContact O-N 3.31Å; D46-Y48 VanDerWaalsContact C-N 3.34Å
47	I	36.2	Very low	36.8	Very low	149 Å²	149	114 Å²	114	76%	0.764	59%	0.586	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.4	-15.9	166.7	-66.6	172.7	0	0	0	112.6	L45	L45-I47 PolarHBondContact O-N 2.6Å
48	Y	33.9	Very low	36.8	Very low	158 Å²	158	113 Å²	113	62%	0.62	58%	0.581	S	S	*	*			trans	-106.7	10.7	-167.6	-78.3	-84	0	0	0	116.5	L45 D46 N50	L45-Y48 HydrophobicContact CB-CD2 4.42Å; L45-Y48 HydrophobicContact CD2-CD2 3.46Å; L45-Y48 VanDerWaalsContact CD2-CD2 3.46Å; L45-Y48 HydrophobicContact CD2-CE2 3.83Å; L45-Y48 HydrophobicContact CD2-CG 4.25Å; L45-Y48 WeakPolarHBondContact O-CB 3.44Å; L45-Y48 PolarHBondContact O-N 3.02Å; D46-Y48 VanDerWaalsContact C-N 3.34Å; Y48-N50 PolarHBondContact O-N 3.09Å
49	Q	29.4	Very low	36.7	Very low	163 Å²	163	112.4 Å²	112.4	76%	0.762	58%	0.579	S	S	*	*			trans	-72.2	5.6	-172.4	-122.1	-178.9	33.7	0	0	116.5
50	N	29.2	Very low	36.6	Very low	108 Å²	108	114.9 Å²	114.9	58%	0.578	59%	0.587	S	S	*	*			trans	-118.2	62.9	-176.8	-85.5	-34.2	0	0	0	113.1	Y48 N380	Y48-N50 PolarHBondContact O-N 3.09Å; N50-N380 PolarHBondContact O-ND2 3.16Å
51	N	33.1	Very low	36.7	Very low	126 Å²	126	111.1 Å²	111.1	67%	0.674	57%	0.573	S	S	*	*			trans	-153.6	104.2	174.8	-104.6	-41.9	0	0	0	115.5
52	P	35.2	Very low	36.7	Very low	95 Å²	95	112.2 Å²	112.2	62%	0.617	57%	0.573	S	S	*	*			trans	-104.3	134.1	150.7	34.7	-26.3	0	0	0	111.2
53	Y	38.5	Very low	36.7	Very low	160 Å²	160	119.1 Å²	119.1	63%	0.627	60%	0.596	S	S	*	*			trans	75	90.1	170.6	-44.7	-72	0	0	0	119.6	Q318	Y53-Q318 VanDerWaalsContact CD1-OE1 3.28Å
54	P	35	Very low	37.1	Very low	82 Å²	82	117.8 Å²	117.8	53%	0.532	59%	0.588	S	S	.	*			trans	-74.8	136.8	141	-3.5	22.6	0	0	0	109.4	L59	P54-L59 HydrophobicContact CB-CD1 3.85Å; P54-L59 HydrophobicContact CB-CG 4.01Å; P54-L59 HydrophobicContact CG-CD1 4.1Å; P54-L59 HydrophobicContact CG-CG 4.48Å
55	S	36.3	Very low	37.3	Very low	42 Å²	42	115.7 Å²	115.7	29%	0.294	58%	0.582	S	S	.	*			trans	-66.7	144.3	171.7	64.2	0	0	0	0	110.9	S57 Q58 L59	S55-S57 PolarHBondContact O-N 2.83Å; S55-S57 VanDerWaalsContact O-N 3.11Å; S55-S57 PolarHBondContact OG-OG 3.2Å; S55-Q58 PolarHBondContact O-N 2.69Å; S55-Q58 WeakPolarHBondContact OG-CG 3.32Å; S55-Q58 PolarHBondContact OG-OE1 3.09Å; S55-L59 PolarHBondContact O-N 3.48Å
56	L	36.6	Very low	37.6	Very low	139 Å²	139	119.4 Å²	119.4	73%	0.728	60%	0.602	S	S	*	*	H	α-helix	trans	-61.3	-25.5	-174.8	-162.8	68.6	0	0	0	112.6
57	S	38.4	Very low	37.9	Very low	92 Å²	92	125 Å²	125	64%	0.643	62%	0.615	S	S	*	*	H	α-helix	trans	-74	-19.1	174.1	46.2	0	0	0	0	114.9	S55	S55-S57 PolarHBondContact O-N 2.83Å; S55-S57 VanDerWaalsContact O-N 3.11Å; S55-S57 PolarHBondContact OG-OG 3.2Å
58	Q	44.2	Very low	38.1	Very low	120 Å²	120	124.5 Å²	124.5	56%	0.561	61%	0.613	S	S	*	*	H	α-helix	trans	-93.5	-18.6	176.1	-72.6	173.7	-41.8	0	0	113	S55 S61	S55-Q58 PolarHBondContact O-N 2.69Å; S55-Q58 WeakPolarHBondContact OG-CG 3.32Å; S55-Q58 PolarHBondContact OG-OE1 3.09Å; Q58-S61 PolarHBondContact O-OG 2.91Å
59	L	40.2	Very low	38.2	Very low	65 Å²	65	123.7 Å²	123.7	34%	0.34	62%	0.619	S	S	.	*	H	α-helix	trans	-80.1	-22	176.5	-89.1	161.1	0	0	0	113.8	P54 S55 R63	P54-L59 HydrophobicContact CB-CD1 3.85Å; P54-L59 HydrophobicContact CB-CG 4.01Å; P54-L59 HydrophobicContact CG-CD1 4.1Å; P54-L59 HydrophobicContact CG-CG 4.48Å; S55-L59 PolarHBondContact O-N 3.48Å; L59-R63 PolarHBondContact O-N 2.88Å
60	E	39.1	Very low	38.5	Very low	137 Å²	137	122.6 Å²	122.6	64%	0.64	62%	0.624	S	S	*	*	H	α-helix	trans	-81.9	-31.6	179	-69.3	-171.3	146.9	0	0	113.1	I64	E60-I64 WeakPolarHBondContact O-CD1 3.38Å; E60-I64 WeakPolarHBondContact O-CG1 3.21Å
61	S	41.4	Very low	38.6	Very low	68 Å²	68	125 Å²	125	48%	0.476	64%	0.637	S	S	.	*	H	α-helix	trans	-70.2	-40.5	173.7	53.3	0	0	0	0	112.6	Q58 I64	Q58-S61 PolarHBondContact O-OG 2.91Å; S61-I64 PolarHBondContact O-N 3.42Å
62	Y	37.8	Very low	38.7	Very low	133 Å²	133	124.8 Å²	124.8	52%	0.522	64%	0.64	S	S	.	*	H	α-helix	trans	-71.4	-29.1	178.7	-98.9	-83	0	0	0	114.3	I64 N384	Y62-I64 VanDerWaalsContact C-N 3.3Å; Y62-I64 PolarHBondContact O-N 2.87Å; Y62-N384 PolarHBondContact OH-ND2 3.49Å
63	R	41.2	Very low	38.5	Very low	192 Å²	192	126.3 Å²	126.3	73%	0.725	64%	0.642	S	S	*	*	H	α-helix	trans	-74.6	-15.7	177.3	-89	-176.5	174.2	155.9	1.7	114.8	L59	L59-R63 PolarHBondContact O-N 2.88Å
64	I	44.8	Very low	38.1	Very low	116 Å²	116	127 Å²	127	60%	0.595	65%	0.651	S	S	*	*	H	α-helix	trans	-89.8	-36.7	-178.6	-66.9	172.6	0	0	0	111.2	E60 S61 Y62	E60-I64 WeakPolarHBondContact O-CD1 3.38Å; E60-I64 WeakPolarHBondContact O-CG1 3.21Å; S61-I64 PolarHBondContact O-N 3.42Å; Y62-I64 VanDerWaalsContact C-N 3.3Å; Y62-I64 PolarHBondContact O-N 2.87Å
65	N	41.6	Very low	37.7	Very low	117 Å²	117	126.9 Å²	126.9	63%	0.626	65%	0.653	S	S	*	*	H	α-helix	trans	-75	-37.4	-179.3	-78.3	-5.6	0	0	0	114.3	R67 L68	N65-R67 PolarHBondContact O-N 2.89Å; N65-R67 VanDerWaalsContact O-N 3.08Å; N65-L68 PolarHBondContact O-N 2.98Å
66	N	44	Very low	37.4	Very low	137 Å²	137	134.2 Å²	134.2	73%	0.733	68%	0.675	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.8	14.8	-177.4	-80.7	14.1	0	0	0	115.1
67	R	39.2	Very low	37	Very low	227 Å²	227	133.2 Å²	133.2	86%	0.857	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.7	4.2	172	-88.9	-174.5	172.1	-179	-1.7	114.4	N65	N65-R67 PolarHBondContact O-N 2.89Å; N65-R67 VanDerWaalsContact O-N 3.08Å
68	L	40.1	Very low	36.6	Very low	137 Å²	137	135.8 Å²	135.8	72%	0.717	67%	0.671	S	S	*	*	S	Bend	trans	-116.8	-3.5	-171.8	-81.9	163.8	0	0	0	115.7	N65	N65-L68 PolarHBondContact O-N 2.98Å
69	N	37.3	Very low	36	Very low	142 Å²	142	138.9 Å²	138.9	76%	0.759	68%	0.679	S	S	*	*	S	Bend	trans	-130.8	158.9	177.6	-80.2	-36.6	0	0	0	111.9
70	T	35.5	Very low	35.5	Very low	140 Å²	140	141.6 Å²	141.6	86%	0.859	70%	0.698	S	S	*	*			trans	70.6	59.4	178.3	72.9	0	0	0	0	117.8
71	N	32	Very low	35.2	Very low	159 Å²	159	140.6 Å²	140.6	85%	0.85	71%	0.706	S	S	*	*				-78.4	168.9	129.2	-86.7	-32.4	0	0	0	108.9
72	V	34.5	Very low	34.6	Very low	121 Å²	121	144.5 Å²	144.5	73%	0.733	72%	0.722	S	S	*	*			trans	100	108.3	169.1	-173.8	0	0	0	0	116.3
73	N	30.5	Very low	34.4	Very low	126 Å²	126	142.3 Å²	142.3	67%	0.674	72%	0.724	S	S	*	*			trans	69	121.8	153.5	-58.1	-1.6	0	0	0	118.6
74	Q	29.4	Very low	34	Very low	175 Å²	175	142 Å²	142	82%	0.818	72%	0.724	S	S	*	*				62.4	134.3	67.8	-67.7	179.6	-28.4	0	0	112.3
75	S	26.9	Very low	33.4	Very low	80 Å²	80	144.4 Å²	144.4	56%	0.559	73%	0.732	S	S	*	*			cis	-166.2	156.4	-0.5	37.4	0	0	0	0	107.7
76	Y	30	Very low	32.8	Very low	195 Å²	195	142.6 Å²	142.6	77%	0.765	73%	0.729	S	S	*	*				168	148	89.6	-95.8	-71.8	0	0	0	111
77	N	29.4	Very low	32.3	Very low	119 Å²	119	146.8 Å²	146.8	64%	0.636	74%	0.736	S	S	*	*			trans	56.3	150.1	145.5	-59.1	-12.4	0	0	0	119
78	F	30.1	Very low	31.7	Very low	146 Å²	146	143.3 Å²	143.3	64%	0.64	73%	0.732	S	S	*	*			cis	-157	169.4	-7.7	-103.8	-41.8	0	0	0	105.2
79	Y	30.9	Very low	31.4	Very low	185 Å²	185	142.1 Å²	142.1	73%	0.725	73%	0.732	S	S	*	*			cis	-152.4	-156.3	11.2	-120.4	-46.4	0	0	0	109.8
80	T	30.6	Very low	30.9	Very low	121 Å²	121	141.9 Å²	141.9	74%	0.742	73%	0.729	S	S	*	*			trans	-37	156.3	165.2	49.1	0	0	0	0	119
81	S	32.4	Very low	30.6	Very low	116 Å²	116	138.9 Å²	138.9	81%	0.811	73%	0.727	S	S	*	*			cis	-160.6	155.8	11.9	37.2	0	0	0	0	114.9
82	N	27.9	Very low	30.4	Very low	151 Å²	151	141.6 Å²	141.6	81%	0.807	73%	0.725	S	S	*	*			trans	-56.7	-177.3	167	-107.5	-20.6	0	0	0	115.2
83	P	35.1	Very low	30.2	Very low	87 Å²	87	145.5 Å²	145.5	57%	0.565	73%	0.732	S	S	*	*			cis	-127.1	177.9	-0.8	15.6	12.8	0	0	0	112.9
84	Y	32.6	Very low	30.2	Very low	186 Å²	186	144.2 Å²	144.2	73%	0.729	73%	0.729	S	S	*	*			cis	-157.6	138.8	49	-88.7	-90.9	0	0	0	113.3
85	Q	31.3	Very low	30.1	Very low	165 Å²	165	143.3 Å²	143.3	77%	0.771	73%	0.73	S	S	*	*			trans	20.3	146.3	131.2	-78.3	164.2	-32.4	0	0	120.2
86	S	30.2	Very low	30.3	Very low	80 Å²	80	147.4 Å²	147.4	56%	0.559	74%	0.744	S	S	*	*			cis	-176.1	142.8	-4.2	37.8	0	0	0	0	105.7
87	Y	32.3	Very low	30.4	Very low	224 Å²	224	143.3 Å²	143.3	88%	0.878	74%	0.744	S	S	*	*				-173.1	138.1	77.8	-91.6	-86.7	0	0	0	110.8
88	M	27.6	Very low	30	Very low	155 Å²	155	148.5 Å²	148.5	76%	0.764	76%	0.756	S	S	*	*			trans	-94.6	-171.9	161.2	-111	-179.9	176.3	0	0	109.2	I90	M88-I90 HydrophobicContact CE-CD1 3.88Å; M88-I90 HydrophobicContact CE-CG1 4.19Å; M88-I90 HydrophobicContact CG-CD1 4.46Å; M88-I90 HydrophobicContact CG-CG1 4.44Å; M88-I90 HydrophobicContact SD-CD1 3.57Å; M88-I90 VanDerWaalsContact SD-CD1 3.57Å; M88-I90 HydrophobicContact SD-CG1 4.12Å
89	P	32	Very low	30.3	Very low	111 Å²	111	147.5 Å²	147.5	72%	0.721	76%	0.764	S	S	*	*			cis	-126.1	160.3	11	12.2	16.1	0	0	0	114.9
90	I	27.6	Very low	30.5	Very low	137 Å²	137	143.8 Å²	143.8	70%	0.703	77%	0.765	S	S	*	*				62.5	121.6	76.6	-51.1	169.8	0	0	0	115	M88	M88-I90 HydrophobicContact CE-CD1 3.88Å; M88-I90 HydrophobicContact CE-CG1 4.19Å; M88-I90 HydrophobicContact CG-CD1 4.46Å; M88-I90 HydrophobicContact CG-CG1 4.44Å; M88-I90 HydrophobicContact SD-CD1 3.57Å; M88-I90 VanDerWaalsContact SD-CD1 3.57Å; M88-I90 HydrophobicContact SD-CG1 4.12Å
91	G	30.2	Very low	30.4	Very low	78 Å²	78	142.2 Å²	142.2	80%	0.804	76%	0.759	S	S	*	*			trans	-172.9	78	177.1	0	0	0	0	0	115.2
92	R	26.4	Very low	30.4	Very low	216 Å²	216	143.5 Å²	143.5	82%	0.815	76%	0.757	S	S	*	*			trans	-41.3	142.9	171.3	-73.1	168.4	165.3	173.6	-4.2	117.8
93	F	31.3	Very low	30.8	Very low	203 Å²	203	142 Å²	142	89%	0.89	75%	0.753	S	S	*	*			trans	-160.6	93.2	136.8	-87.6	-73.9	0	0	0	107.7
94	T	30.8	Very low	30.9	Very low	99 Å²	99	145.4 Å²	145.4	61%	0.607	76%	0.761	S	S	*	*				57.7	110.8	84.6	65.3	0	0	0	0	117.3
95	N	27.1	Very low	31.3	Very low	155 Å²	155	143.7 Å²	143.7	83%	0.829	76%	0.76	S	S	*	*			trans	60.8	100.5	139.4	-57.2	-1.5	0	0	0	120.5
96	I	31.4	Very low	31.9	Very low	167 Å²	167	142.4 Å²	142.4	86%	0.856	76%	0.758	S	S	*	*			trans	-129.6	140	135.8	-63.2	-175.7	0	0	0	108.5
97	S	30.5	Very low	32.5	Very low	109 Å²	109	146.2 Å²	146.2	76%	0.762	76%	0.764	S	S	*	*	P	Polyproline II helix	trans	-75.1	150.3	-169.6	42.9	0	0	0	0	115.5
98	Y	22.6	Very low	32.8	Very low	227 Å²	227	143.3 Å²	143.3	89%	0.89	75%	0.752	S	S	*	*	P	Polyproline II helix	trans	-93.7	136.8	163.3	-78.3	-89.7	0	0	0	111
99	P	36.5	Very low	33.6	Very low	126 Å²	126	140.4 Å²	140.4	82%	0.818	74%	0.739	S	S	*	*	P	Polyproline II helix	trans	-90.1	151.2	152.7	10.9	7.5	0	0	0	111.1
100	S	34	Very low	34.3	Very low	106 Å²	106	137.1 Å²	137.1	74%	0.741	72%	0.722	S	S	*	*	P	Polyproline II helix	trans	-87.7	155.4	-171.4	53.7	0	0	0	0	115.2
101	S	29.8	Very low	35.4	Very low	88 Å²	88	136.6 Å²	136.6	62%	0.615	71%	0.712	S	S	*	*			trans	65.5	149.2	137.8	63.9	0	0	0	0	122.1
102	N	31.3	Very low	36.5	Very low	144 Å²	144	136.4 Å²	136.4	77%	0.77	69%	0.692	S	S	*	*			trans	76.2	60.8	152.4	-58.7	-7	0	0	0	120.4
103	V	37.2	Very low	37.7	Very low	119 Å²	119	131 Å²	131	72%	0.721	68%	0.679	S	S	*	*	S	Bend	trans	-135.9	-25.6	159.3	-175.7	0	0	0	0	114.8
104	H	36.5	Very low	38.4	Very low	159 Å²	159	129 Å²	129	74%	0.736	67%	0.666	S	S	*	*	S	Bend	trans	-90	-21.5	-166.2	-105.4	-90.8	0	0	0	117
105	E	39.8	Very low	39.2	Very low	150 Å²	150	126.8 Å²	126.8	70%	0.701	65%	0.652	S	S	*	*	H	α-helix	trans	-75.5	-36.4	-170.2	-153.3	158.1	-170	0	0	113.2	K107 W108	E105-K107 VanDerWaalsContact C-N 3.29Å; E105-K107 PolarHBondContact O-N 3.49Å; E105-W108 PolarHBondContact O-N 2.79Å
106	N	45	Very low	40.1	Very low	138 Å²	138	123.4 Å²	123.4	74%	0.738	63%	0.633	S	S	*	*	H	α-helix	trans	-71.4	-16.8	-178.8	-72.8	-20.9	0	0	0	114.6	A110	N106-A110 WeakPolarHBondContact O-CB 3.46Å
107	K	42.7	Very low	40.6	Very low	159 Å²	159	119.8 Å²	119.8	69%	0.691	62%	0.616	S	S	*	*	H	α-helix	trans	-79.5	-25.4	173.7	-87.7	-178.2	177.4	173.1	0	113	E105 Y111	E105-K107 VanDerWaalsContact C-N 3.29Å; E105-K107 PolarHBondContact O-N 3.49Å; K107-Y111 PolarHBondContact O-N 2.99Å
108	W	37.8	Very low	41.2	Very low	164 Å²	164	121.3 Å²	121.3	62%	0.621	61%	0.611	S	S	*	*	H	α-helix	trans	-79.6	-45	-175.9	-153.5	-131.4	0	0	0	111.7	E105 A110 Y111 I112	E105-W108 PolarHBondContact O-N 2.79Å; W108-A110 VanDerWaalsContact C-N 3.26Å; W108-A110 PolarHBondContact O-N 3.19Å; W108-Y111 HydrophobicContact CE3-CD1 4.32Å; W108-Y111 HydrophobicContact CH2-CD1 4.21Å; W108-Y111 HydrophobicContact CH2-CE1 4.41Å; W108-Y111 AromaticContact CZ3-CD1 3.9Å; W108-Y111 HydrophobicContact CZ3-CD1 3.9Å; W108-Y111 HydrophobicContact CZ3-CE1 4.39Å; W108-Y111 HydrophobicContact CZ3-CG 4.41Å; W108-Y111 WeakPolarHBondContact O-CA 3.45Å; W108-Y111 WeakPolarHBondContact O-CB 3.4Å; W108-Y111 PolarHBondContact O-N 2.98Å; W108-I112 PolarHBondContact O-N 3.4Å
109	N	45.3	Very low	42	Very low	93 Å²	93	119.5 Å²	119.5	50%	0.497	60%	0.604	S	S	.	*	H	α-helix	trans	-62.2	-33.9	172.9	-66.6	-21.4	0	0	0	112.2	Y111 N113	N109-Y111 VanDerWaalsContact C-N 3.26Å; N109-Y111 PolarHBondContact O-N 3.28Å; N109-N113 WeakPolarHBondContact O-CB 3.11Å; N109-N113 PolarHBondContact O-N 2.75Å
110	A	47	Very low	42.2	Very low	43 Å²	43	118.9 Å²	118.9	36%	0.355	59%	0.593	S	S	.	*	H	α-helix	trans	-75.2	-7.2	173.5	0	0	0	0	0	114.9	N106 W108 R114	N106-A110 WeakPolarHBondContact O-CB 3.46Å; W108-A110 VanDerWaalsContact C-N 3.26Å; W108-A110 PolarHBondContact O-N 3.19Å; A110-R114 PolarHBondContact O-NE 3.49Å; A110-R114 PolarHBondContact O-NH2 2.96Å; A110-R114 VanDerWaalsContact O-NH2 3.12Å
111	Y	49.6	Very low	42.4	Very low	126 Å²	126	118.5 Å²	118.5	49%	0.494	58%	0.582	S	S	.	*	H	α-helix	trans	-94.7	-48.3	170.7	-179.1	-105.7	0	0	0	110.5	K107 W108 N109 N113 R114 V115	K107-Y111 PolarHBondContact O-N 2.99Å; W108-Y111 HydrophobicContact CE3-CD1 4.32Å; W108-Y111 HydrophobicContact CH2-CD1 4.21Å; W108-Y111 HydrophobicContact CH2-CE1 4.41Å; W108-Y111 AromaticContact CZ3-CD1 3.9Å; W108-Y111 HydrophobicContact CZ3-CD1 3.9Å; W108-Y111 HydrophobicContact CZ3-CE1 4.39Å; W108-Y111 HydrophobicContact CZ3-CG 4.41Å; W108-Y111 WeakPolarHBondContact O-CA 3.45Å; W108-Y111 WeakPolarHBondContact O-CB 3.4Å; W108-Y111 PolarHBondContact O-N 2.98Å; N109-Y111 VanDerWaalsContact C-N 3.26Å; N109-Y111 PolarHBondContact O-N 3.28Å; Y111-N113 PolarHBondContact O-N 2.97Å; Y111-R114 WeakPolarHBondContact O-CA 3.5Å; Y111-R114 WeakPolarHBondContact O-CB 3.41Å; Y111-R114 PolarHBondContact O-N 3.17Å; Y111-V115 HydrophobicContact CD1-CG2 4.42Å; Y111-V115 HydrophobicContact CE1-CG2 4.05Å; Y111-V115 HydrophobicContact CE2-CG2 4.37Å; Y111-V115 PolarHBondContact O-N 3.27Å
112	I	53.5	Low	42.6	Very low	74 Å²	74	125.2 Å²	125.2	38%	0.379	59%	0.594	S	S	.	*	H	α-helix	trans	-60.1	-43.6	176.7	-65.7	-175.6	0	0	0	111.3	W108 R114 V115 N116	W108-I112 PolarHBondContact O-N 3.4Å; I112-R114 PolarHBondContact O-N 3.31Å; I112-V115 PolarHBondContact O-N 2.58Å; I112-N116 PolarHBondContact O-N 3.17Å
113	N	51.2	Low	42.7	Very low	101 Å²	101	123.1 Å²	123.1	54%	0.54	59%	0.591	S	S	.	*	H	α-helix	trans	-65.9	-16.5	173.8	-75.4	-16.2	0	0	0	113.9	N109 Y111 N117	N109-N113 WeakPolarHBondContact O-CB 3.11Å; N109-N113 PolarHBondContact O-N 2.75Å; Y111-N113 PolarHBondContact O-N 2.97Å; N113-N117 WeakPolarHBondContact O-CB 3.1Å; N113-N117 PolarHBondContact O-ND2 2.98Å
114	R	47.2	Very low	42.5	Very low	163 Å²	163	120.9 Å²	120.9	62%	0.615	58%	0.581	S	S	*	*	H	α-helix	trans	-84.8	-39.6	172.5	-112.8	179.5	-70.7	-171.5	-5.3	112.1	A110 Y111 I112 Q118	A110-R114 PolarHBondContact O-NE 3.49Å; A110-R114 PolarHBondContact O-NH2 2.96Å; A110-R114 VanDerWaalsContact O-NH2 3.12Å; Y111-R114 WeakPolarHBondContact O-CA 3.5Å; Y111-R114 WeakPolarHBondContact O-CB 3.41Å; Y111-R114 PolarHBondContact O-N 3.17Å; I112-R114 PolarHBondContact O-N 3.31Å; R114-Q118 WeakPolarHBondContact O-CG 3.45Å; R114-Q118 PolarHBondContact O-N 2.88Å
115	V	48	Very low	42.2	Very low	51 Å²	51	120.7 Å²	120.7	31%	0.309	59%	0.585	S	S	.	*	H	α-helix	trans	-68	-46.4	177.3	177.1	0	0	0	0	110.8	Y111 I112 N117 Q118 Y119	Y111-V115 HydrophobicContact CD1-CG2 4.42Å; Y111-V115 HydrophobicContact CE1-CG2 4.05Å; Y111-V115 HydrophobicContact CE2-CG2 4.37Å; Y111-V115 PolarHBondContact O-N 3.27Å; I112-V115 PolarHBondContact O-N 2.58Å; V115-N117 PolarHBondContact O-N 2.99Å; V115-Q118 PolarHBondContact O-N 2.96Å; V115-Y119 HydrophobicContact CG1-CD2 4.5Å; V115-Y119 PolarHBondContact O-N 3.28Å; V115-Y119 VanDerWaalsContact O-N 3.16Å
116	N	44.9	Very low	41.6	Very low	84 Å²	84	118.4 Å²	118.4	45%	0.449	59%	0.585	S	S	.	*	H	α-helix	trans	-63.2	-40.8	178.7	-70.9	-6	0	0	0	112	I112 Q118 Y119 I120	I112-N116 PolarHBondContact O-N 3.17Å; N116-Q118 VanDerWaalsContact C-N 3.26Å; N116-Q118 PolarHBondContact O-N 2.96Å; N116-Y119 PolarHBondContact O-N 2.93Å; N116-I120 WeakPolarHBondContact O-CG1 3.1Å; N116-I120 PolarHBondContact O-N 3.22Å
117	N	43.1	Very low	40.9	Very low	92 Å²	92	120.8 Å²	120.8	49%	0.492	59%	0.592	S	S	.	*	H	α-helix	trans	-69.3	-17.9	174.4	-83.1	-54.9	0	0	0	114.1	N113 V115 N121	N113-N117 WeakPolarHBondContact O-CB 3.1Å; N113-N117 PolarHBondContact O-ND2 2.98Å; V115-N117 PolarHBondContact O-N 2.99Å; N117-N121 PolarHBondContact O-ND2 2.97Å
118	Q	43.5	Very low	40.2	Very low	140 Å²	140	121.4 Å²	121.4	65%	0.654	60%	0.601	S	S	*	*	H	α-helix	trans	-85.7	-25.4	173.7	-79.3	-176.3	-29.4	0	0	113.3	R114 V115 N116	R114-Q118 WeakPolarHBondContact O-CG 3.45Å; R114-Q118 PolarHBondContact O-N 2.88Å; V115-Q118 PolarHBondContact O-N 2.96Å; N116-Q118 VanDerWaalsContact C-N 3.26Å; N116-Q118 PolarHBondContact O-N 2.96Å
119	Y	37.6	Very low	39.9	Very low	190 Å²	190	118.3 Å²	118.3	75%	0.745	60%	0.604	S	S	*	*	H	α-helix	trans	-82.4	-40.1	172.9	-92.8	-93.1	0	0	0	112.8	V115 N116 N121 R122	V115-Y119 HydrophobicContact CG1-CD2 4.5Å; V115-Y119 PolarHBondContact O-N 3.28Å; V115-Y119 VanDerWaalsContact O-N 3.16Å; N116-Y119 PolarHBondContact O-N 2.93Å; Y119-N121 VanDerWaalsContact C-N 3.32Å; Y119-N121 PolarHBondContact O-N 2.93Å; Y119-R122 PolarHBondContact O-N 2.91Å
120	I	41.9	Very low	39.2	Very low	113 Å²	113	121.5 Å²	121.5	58%	0.579	62%	0.622	S	S	*	*	H	α-helix	trans	-68.8	-28.1	-178.9	-66.6	168.1	0	0	0	112.6	N116	N116-I120 WeakPolarHBondContact O-CG1 3.1Å; N116-I120 PolarHBondContact O-N 3.22Å
121	N	37.1	Very low	38.6	Very low	97 Å²	97	124.7 Å²	124.7	52%	0.519	64%	0.641	S	S	.	*	T	Hydrogen-bonded Turn	trans	-91.1	9.7	-179	-74.2	-66	0	0	0	115	N117 Y119	N117-N121 PolarHBondContact O-ND2 2.97Å; Y119-N121 VanDerWaalsContact C-N 3.32Å; Y119-N121 PolarHBondContact O-N 2.93Å
122	R	34.5	Very low	37.6	Very low	229 Å²	229	126 Å²	126	86%	0.864	66%	0.657	S	S	*	*	S	Bend	trans	-110.9	-7.4	177.1	-87.6	-175.6	169.5	-177.2	-2.6	114.9	Y119	Y119-R122 PolarHBondContact O-N 2.91Å
123	S	33.8	Very low	36.6	Very low	101 Å²	101	130.4 Å²	130.4	71%	0.706	68%	0.681	S	S	*	*	S	Bend	trans	-99	6.5	173.3	47.1	0	0	0	0	113.9
124	S	32.4	Very low	35.4	Very low	72 Å²	72	133.9 Å²	133.9	50%	0.503	69%	0.694	S	S	.	*	S	Bend	trans	-121	19.6	-169.7	65	0	0	0	0	115.1
125	N	29.9	Very low	34.7	Very low	154 Å²	154	131.1 Å²	131.1	82%	0.824	70%	0.7	S	S	*	*			trans	-131.3	55.9	-179.6	-87.4	-45	0	0	0	112.5
126	S	27.9	Very low	33.7	Very low	102 Å²	102	135.2 Å²	135.2	71%	0.713	72%	0.716	S	S	*	*	S	Bend	trans	-147.5	135.6	160.6	55.8	0	0	0	0	108.4
127	Q	29.3	Very low	33.1	Very low	188 Å²	188	140.3 Å²	140.3	88%	0.879	73%	0.73	S	S	*	*			trans	77.3	107.7	-166.3	-51.6	-176	-8.4	0	0	114.8
128	I	29.5	Very low	32.5	Very low	173 Å²	173	141.5 Å²	141.5	89%	0.887	74%	0.741	S	S	*	*				-169.6	109.1	129.8	-89.5	149.2	0	0	0	106.3
129	S	30.7	Very low	31.8	Very low	98 Å²	98	139.4 Å²	139.4	69%	0.685	74%	0.741	S	S	*	*			trans	-167.2	107.1	151	59.1	0	0	0	0	109.9
130	N	31.7	Very low	31.4	Very low	161 Å²	161	138 Å²	138	86%	0.861	75%	0.745	S	S	*	*			trans	70.3	139.3	164.9	-49.2	-17	0	0	0	115.7
131	S	32.9	Very low	30.9	Very low	110 Å²	110	138.2 Å²	138.2	77%	0.769	75%	0.754	S	S	*	*			cis	-156.7	144.6	-2	41	0	0	0	0	111.6
132	N	29.3	Very low	30.5	Very low	154 Å²	154	139.5 Å²	139.5	82%	0.824	77%	0.765	S	S	*	*			trans	-13.8	126.1	168.6	-51.9	-11.5	0	0	0	118.1
133	N	31.4	Very low	30.4	Very low	166 Å²	166	136.4 Å²	136.4	89%	0.888	77%	0.766	S	S	*	*				-153.3	138.7	119.2	-96.2	-19	0	0	0	109.8
134	Q	27.5	Very low	30.3	Very low	173 Å²	173	140.5 Å²	140.5	81%	0.808	77%	0.771	S	S	*	*			trans	-80.5	149.5	-178.7	-64.5	152.1	-58.3	0	0	109.3
135	S	31.5	Very low	30.6	Very low	106 Å²	106	143 Å²	143	74%	0.741	79%	0.786	S	S	*	*				-166.5	137.9	70	27.6	0	0	0	0	110.2
136	H	28.4	Very low	30.6	Very low	137 Å²	137	142.6 Å²	142.6	63%	0.634	78%	0.783	S	S	*	*				58.3	131.5	88.8	-77.8	-72.9	0	0	0	114.6
137	Y	32.1	Very low	30.8	Very low	191 Å²	191	145.6 Å²	145.6	75%	0.749	79%	0.791	S	S	*	*			cis	-148.7	142.8	14.3	-74	-78.4	0	0	0	109.1
138	T	29.6	Very low	30.9	Very low	117 Å²	117	143 Å²	143	72%	0.718	79%	0.787	S	S	*	*				50	93.1	78.2	64.7	0	0	0	0	119.7
139	S	28.6	Very low	31.1	Very low	96 Å²	96	140.2 Å²	140.2	67%	0.671	78%	0.783	S	S	*	*				46	128.5	128.2	63	0	0	0	0	124.5
140	I	29	Very low	31.1	Very low	160 Å²	160	141.5 Å²	141.5	82%	0.821	79%	0.787	S	S	*	*			trans	74	150.9	145.3	-63.3	164.5	0	0	0	115.6
141	P	32.4	Very low	31.3	Very low	117 Å²	117	138.9 Å²	138.9	76%	0.76	78%	0.781	S	S	*	*			cis	-126.6	-174.8	4.3	23.6	1.7	0	0	0	116.7
142	T	28.9	Very low	31.4	Very low	124 Å²	124	139.5 Å²	139.5	76%	0.761	78%	0.781	S	S	*	*			trans	-57.5	143.1	168.6	49.1	0	0	0	0	116.6
143	N	32.8	Very low	31.8	Very low	165 Å²	165	137.1 Å²	137.1	88%	0.882	78%	0.776	S	S	*	*			trans	-166.3	144.7	135.8	-102.4	-18.3	0	0	0	112.3
144	F	31.5	Very low	32.2	Very low	187 Å²	187	134 Å²	134	82%	0.82	77%	0.765	S	S	*	*			trans	-76.3	166.7	174.6	-87.4	-96.8	0	0	0	112.1
145	P	37.1	Very low	32.4	Very low	125 Å²	125	135.2 Å²	135.2	81%	0.812	77%	0.768	S	S	*	*				-135	160.6	106.7	36.9	-27.1	0	0	0	115.3
146	N	30.9	Very low	32.6	Very low	144 Å²	144	136 Å²	136	77%	0.77	77%	0.774	S	S	*	*			trans	-66.2	148.6	-175.6	-53.4	-42.4	0	0	0	114.1
147	L	32.9	Very low	32.9	Very low	166 Å²	166	134.1 Å²	134.1	87%	0.869	78%	0.776	S	S	*	*			trans	-157.1	108.1	132.6	-119.6	132.2	0	0	0	110.6
148	V	29.6	Very low	32.8	Very low	133 Å²	133	131.1 Å²	131.1	81%	0.806	78%	0.778	S	S	*	*			trans	-127.8	125.6	168.3	172.7	0	0	0	0	106.6	T150	V148-T150 HydrophobicContact CG1-CG2 4.45Å
149	S	35.4	Very low	33.2	Very low	115 Å²	115	130.5 Å²	130.5	80%	0.804	78%	0.778	S	S	*	*			trans	-128.7	135.2	166.8	46.2	0	0	0	0	109.5
150	T	29	Very low	33.6	Very low	125 Å²	125	130.8 Å²	130.8	77%	0.767	78%	0.78	S	S	*	*			trans	-106.6	134.9	-167.1	46.2	0	0	0	0	112.3	V148	V148-T150 HydrophobicContact CG1-CG2 4.45Å
151	S	35.9	Very low	34	Very low	105 Å²	105	130.7 Å²	130.7	73%	0.734	78%	0.78	S	S	*	*			trans	-167.2	97.6	152.4	52.4	0	0	0	0	109.7
152	T	36.8	Very low	34.3	Very low	123 Å²	123	130.8 Å²	130.8	76%	0.755	78%	0.784	S	S	*	*				65.9	99.9	97.2	58.3	0	0	0	0	116.2
153	S	36.8	Very low	34.7	Very low	105 Å²	105	128.5 Å²	128.5	73%	0.734	79%	0.785	S	S	*	*				48.4	157.6	120.6	63.9	0	0	0	0	122.4
154	P	40.4	Very low	34.9	Very low	101 Å²	101	125.8 Å²	125.8	66%	0.656	78%	0.779	S	S	*	*			cis	-145.1	-167.9	-27.5	38.9	-18.7	0	0	0	114.4
155	F	30.8	Very low	35.2	Very low	197 Å²	197	122.8 Å²	122.8	86%	0.864	78%	0.776	S	S	*	*			trans	44.8	126.9	150.2	-76.2	-69.1	0	0	0	121.3
156	S	36	Very low	35.2	Very low	123 Å²	123	122.2 Å²	122.2	86%	0.86	78%	0.775	S	S	*	*				-176.1	142	111.6	45.4	0	0	0	0	112.8
157	S	34.6	Very low	35.7	Very low	98 Å²	98	121 Å²	121	69%	0.685	78%	0.778	S	S	*	*			trans	-108.4	135.8	171.6	50.6	0	0	0	0	110.1
158	T	30.8	Very low	35.7	Very low	127 Å²	127	122 Å²	122	78%	0.779	78%	0.783	S	S	*	*			trans	41.6	116.5	148.2	56.9	0	0	0	0	117.2
159	S	36.9	Very low	36.1	Very low	105 Å²	105	118.6 Å²	118.6	73%	0.734	78%	0.775	S	S	*	*				167.6	166.3	66.8	46.8	0	0	0	0	112.7
160	S	38	Very low	36.2	Very low	101 Å²	101	119.8 Å²	119.8	71%	0.706	77%	0.771	S	S	*	*			trans	82.3	111.2	151.4	72.6	0	0	0	0	121.8
161	L	37	Very low	36.5	Very low	158 Å²	158	120.1 Å²	120.1	83%	0.827	77%	0.772	S	S	*	*				82.7	117.7	127.4	-97.9	72.9	0	0	0	123.9
162	S	38.1	Very low	36.6	Very low	119 Å²	119	124.7 Å²	124.7	83%	0.832	78%	0.775	S	S	*	*			trans	82.4	132.5	130.7	72.1	0	0	0	0	120.1
163	G	36.7	Very low	36.6	Very low	77 Å²	77	124.5 Å²	124.5	79%	0.794	77%	0.774	S	S	*	*			trans	144.4	68.6	172.6	0	0	0	0	0	115.6
164	S	38.5	Very low	36.7	Very low	107 Å²	107	125.1 Å²	125.1	75%	0.748	78%	0.775	S	S	*	*			trans	-29.7	139.4	163.9	56.9	0	0	0	0	115.6
165	T	38.2	Very low	36.3	Very low	125 Å²	125	128.4 Å²	128.4	77%	0.767	78%	0.782	S	S	*	*				-172.5	147.1	63.4	34	0	0	0	0	113.6
166	S	36.5	Very low	36.6	Very low	112 Å²	112	126.2 Å²	126.2	78%	0.783	78%	0.778	S	S	*	*			trans	33	106.1	149.3	62.4	0	0	0	0	122
167	S	41.9	Very low	36.6	Very low	120 Å²	120	124.8 Å²	124.8	84%	0.839	77%	0.768	S	S	*	*				-159.6	147.1	121.5	48.9	0	0	0	0	110.3	G169	S167-G169 PolarHBondContact O-N 2.79Å
168	L	32.7	Very low	37.2	Very low	186 Å²	186	128.1 Å²	128.1	97%	0.974	77%	0.772	S	S	*	*			trans	-75.7	111	-178.4	-77	86.9	0	0	0	110.6
169	G	38.1	Very low	37.8	Very low	61 Å²	61	127 Å²	127	63%	0.629	77%	0.767	S	S	*	*			trans	-125.1	107.5	167.2	0	0	0	0	0	110.1	S167 V171	S167-G169 PolarHBondContact O-N 2.79Å; G169-V171 PolarHBondContact O-N 3.49Å; G169-V171 VanDerWaalsContact O-N 3.1Å
170	I	36.7	Very low	38	Very low	140 Å²	140	130.7 Å²	130.7	72%	0.718	77%	0.77	S	S	*	*			trans	-74	101.1	176.1	-56.5	176	0	0	0	108.2	Y172	I170-Y172 HydrophobicContact CG2-CD2 3.79Å; I170-Y172 HydrophobicContact CG2-CE2 3.46Å; I170-Y172 VanDerWaalsContact CG2-CE2 3.46Å
171	V	34.9	Very low	38.4	Very low	132 Å²	132	131.6 Å²	131.6	80%	0.8	77%	0.766	S	S	*	*			trans	-96.5	101.2	173.2	-179.4	0	0	0	0	108.8	G169 T173	G169-V171 PolarHBondContact O-N 3.49Å; G169-V171 VanDerWaalsContact O-N 3.1Å; V171-T173 PolarHBondContact O-N 3.09Å
172	Y	38	Very low	39	Very low	202 Å²	202	129.3 Å²	129.3	79%	0.792	77%	0.77	S	S	*	*			trans	-70.3	117.5	168.4	-74.7	-89.2	0	0	0	109.8	I170	I170-Y172 HydrophobicContact CG2-CD2 3.79Å; I170-Y172 HydrophobicContact CG2-CE2 3.46Å; I170-Y172 VanDerWaalsContact CG2-CE2 3.46Å
173	T	37.6	Very low	40.4	Very low	119 Å²	119	127.2 Å²	127.2	73%	0.73	77%	0.768	S	S	*	*			trans	-69.9	128.6	160.9	47.8	0	0	0	0	108.9	V171 E175	V171-T173 PolarHBondContact O-N 3.09Å; T173-E175 PolarHBondContact O-N 2.89Å; T173-E175 VanDerWaalsContact O-N 3.09Å
174	P	37.8	Very low	42	Very low	118 Å²	118	126.2 Å²	126.2	77%	0.766	74%	0.742	S	S	*	*			trans	-74	104.8	176.1	29.6	-32.3	0	0	0	109.6	I176	P174-I176 PolarHBondContact O-N 3.39Å
175	E	33.1	Very low	44.2	Very low	169 Å²	169	123.2 Å²	123.2	79%	0.79	72%	0.721	S	S	*	*			trans	-57.5	121.5	157	-75.9	-175	130.3	0	0	108	T173 S177	T173-E175 PolarHBondContact O-N 2.89Å; T173-E175 VanDerWaalsContact O-N 3.09Å; E175-S177 PolarHBondContact O-N 2.89Å
176	I	37.6	Very low	46.4	Very low	151 Å²	151	121.4 Å²	121.4	77%	0.774	70%	0.704	S	S	*	*			trans	-75.2	70	170.7	-54.2	178.1	0	0	0	108	P174 H178	P174-I176 PolarHBondContact O-N 3.39Å; I176-H178 PolarHBondContact O-N 2.94Å
177	S	35.6	Very low	48.8	Very low	93 Å²	93	119.1 Å²	119.1	65%	0.65	69%	0.685	S	S	*	*			trans	-72.3	98.5	158.7	47.2	0	0	0	0	106.8	E175 P179	E175-S177 PolarHBondContact O-N 2.89Å; S177-P179 WeakPolarHBondContact O-CD 3.43Å; S177-P179 VanDerWaalsContact O-N 3.12Å
178	H	47.6	Very low	50.9	Low	168 Å²	168	118 Å²	118	78%	0.778	67%	0.667	S	S	*	*			trans	-58.4	119	166.4	-96.1	-70.8	0	0	0	107.4	I176 F180	I176-H178 PolarHBondContact O-N 2.94Å; H178-F180 PolarHBondContact O-N 2.88Å
179	P	41.8	Very low	53.5	Low	103 Å²	103	112 Å²	112	67%	0.669	63%	0.634	S	S	*	*			trans	-66.6	137.6	-172.7	26.1	-33.8	0	0	0	109.5	S177 L181	S177-P179 WeakPolarHBondContact O-CD 3.43Å; S177-P179 VanDerWaalsContact O-N 3.12Å; P179-L181 PolarHBondContact O-N 3.4Å
180	F	42.7	Very low	56	Low	184 Å²	184	109.2 Å²	109.2	81%	0.807	60%	0.604	S	S	*	*			trans	-48.8	111.5	163.3	-94.2	-105.1	0	0	0	108.7	H178 A182	H178-F180 PolarHBondContact O-N 2.88Å; F180-A182 PolarHBondContact O-N 3.03Å
181	L	45.8	Very low	58.5	Low	119 Å²	119	104.3 Å²	104.3	62%	0.623	58%	0.579	S	S	*	*			trans	-69	99.7	165.8	-76.9	169.2	0	0	0	106.9	P179 G183 E184	P179-L181 PolarHBondContact O-N 3.4Å; L181-G183 PolarHBondContact O-N 2.91Å; L181-E184 PolarHBondContact O-N 2.9Å; L181-E184 VanDerWaalsContact O-N 3.11Å
182	A	48.8	Very low	61.1	Low	110 Å²	110	102.7 Å²	102.7	91%	0.909	56%	0.562	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.1	96.8	-179.5	0	0	0	0	0	110.3	F180	F180-A182 PolarHBondContact O-N 3.03Å
183	G	68.1	Low	63.5	Low	76 Å²	76	98.6 Å²	98.6	78%	0.784	55%	0.546	S	S	*	.	T	Hydrogen-bonded Turn	trans	138.2	-17.1	-177.4	0	0	0	0	0	115.8	L181 S185	L181-G183 PolarHBondContact O-N 2.91Å; G183-S185 PolarHBondContact O-N 3.45Å
184	E	71	Confident	66.1	Low	56 Å²	56	93.3 Å²	93.3	26%	0.262	51%	0.513	S	S	.	.			trans	-73.2	118.5	179.5	-165.3	167.8	-152.8	0	0	110.6	L181 E188 Q189 K192	L181-E184 PolarHBondContact O-N 2.9Å; L181-E184 VanDerWaalsContact O-N 3.11Å; E184-E188 HydrophobicContact CG-CB 3.7Å; E184-Q189 HydrophobicContact CB-CG 4.45Å; E184-Q189 HydrophobicContact CG-CG 4.02Å; E184-Q189 PolarHBondContact O-NE2 3.49Å; E184-K192 VanDerWaalsContact CD-NZ 3.31Å; E184-K192 VanDerWaalsContact OE1-CD 3.24Å; E184-K192 WeakPolarHBondContact OE1-CD 3.35Å; E184-K192 IonicContact OE1-NZ 3.69Å; E184-K192 PolarHBondContact OE1-NZ 2.85Å; E184-K192 IonicContact OE2-NZ 3.56Å; E184-K192 PolarHBondContact OE2-NZ 3.39Å
185	S	84.1	Confident	68.5	Low	43 Å²	43	89.1 Å²	89.1	30%	0.301	48%	0.484	S	S	.	.			trans	-65.6	152.3	-178.4	64.1	0	0	0	0	112.1	G183 T187 E188 Q189	G183-S185 PolarHBondContact O-N 3.45Å; S185-T187 PolarHBondContact O-N 3.47Å; S185-T187 VanDerWaalsContact O-N 3.11Å; S185-T187 PolarHBondContact OG-OG1 3.42Å; S185-E188 VanDerWaalsContact CB-OE2 3.31Å; S185-E188 WeakPolarHBondContact CB-OE2 3.46Å; S185-E188 PolarHBondContact N-OE2 3.34Å; S185-E188 PolarHBondContact O-N 2.77Å; S185-E188 WeakPolarHBondContact OG-CB 3.27Å; S185-E188 VanDerWaalsContact OG-CG 3.25Å; S185-E188 WeakPolarHBondContact OG-CG 3.16Å; S185-E188 PolarHBondContact OG-N 2.85Å; S185-E188 PolarHBondContact OG-OE2 2.93Å; S185-Q189 WeakPolarHBondContact O-CG 3.5Å; S185-Q189 PolarHBondContact O-N 3.45Å
186	E	83.9	Confident	71.1	Confident	88 Å²	88	86 Å²	86	41%	0.411	48%	0.476	S	S	.	.	H	α-helix	trans	-53.3	-35.8	175.1	-63.8	-173.6	165	0	0	111.9	Q189 I190 N259 I260	E186-Q189 PolarHBondContact O-N 3.32Å; E186-I190 VanDerWaalsContact O-CG1 3.32Å; E186-I190 WeakPolarHBondContact O-CG1 3.42Å; E186-I190 PolarHBondContact O-N 2.84Å; E186-N259 PolarHBondContact OE1-ND2 3.46Å; E186-N259 WeakPolarHBondContact OE2-CB 3.19Å; E186-N259 PolarHBondContact OE2-ND2 2.82Å; E186-I260 HydrophobicContact CB-CD1 3.78Å
187	T	86.3	Confident	73.5	Confident	63 Å²	63	86 Å²	86	39%	0.387	48%	0.478	S	S	.	.	H	α-helix	trans	-63.7	-38.5	174.2	40.1	0	0	0	0	113.6	S185 L191 I260 L263	S185-T187 PolarHBondContact O-N 3.47Å; S185-T187 VanDerWaalsContact O-N 3.11Å; S185-T187 PolarHBondContact OG-OG1 3.42Å; T187-L191 VanDerWaalsContact O-CB 3.25Å; T187-L191 WeakPolarHBondContact O-CB 3.39Å; T187-L191 PolarHBondContact O-N 3.4Å; T187-I260 HydrophobicContact CG2-CD1 3.74Å; T187-L263 HydrophobicContact CG2-CD1 3.82Å
188	E	87.2	Confident	76.2	Confident	97 Å²	97	82.9 Å²	82.9	45%	0.453	45%	0.452	S	S	.	.	H	α-helix	trans	-73.4	-37.6	176.2	-74.2	160	140.2	0	0	111.3	E184 S185 L191 K192	E184-E188 HydrophobicContact CG-CB 3.7Å; S185-E188 VanDerWaalsContact CB-OE2 3.31Å; S185-E188 WeakPolarHBondContact CB-OE2 3.46Å; S185-E188 PolarHBondContact N-OE2 3.34Å; S185-E188 PolarHBondContact O-N 2.77Å; S185-E188 WeakPolarHBondContact OG-CB 3.27Å; S185-E188 VanDerWaalsContact OG-CG 3.25Å; S185-E188 WeakPolarHBondContact OG-CG 3.16Å; S185-E188 PolarHBondContact OG-N 2.85Å; S185-E188 PolarHBondContact OG-OE2 2.93Å; E188-L191 PolarHBondContact O-N 3.01Å; E188-K192 VanDerWaalsContact O-CB 3.25Å; E188-K192 WeakPolarHBondContact O-CB 3.12Å; E188-K192 PolarHBondContact O-N 3.05Å
189	Q	87.4	Confident	78.2	Confident	61 Å²	61	79.7 Å²	79.7	29%	0.285	44%	0.436	S	S	.	.	H	α-helix	trans	-60.3	-46.1	173.7	-62.9	173.9	33.4	0	0	111.4	E184 S185 E186 Y193 L256	E184-Q189 HydrophobicContact CB-CG 4.45Å; E184-Q189 HydrophobicContact CG-CG 4.02Å; E184-Q189 PolarHBondContact O-NE2 3.49Å; S185-Q189 WeakPolarHBondContact O-CG 3.5Å; S185-Q189 PolarHBondContact O-N 3.45Å; E186-Q189 PolarHBondContact O-N 3.32Å; Q189-Y193 WeakPolarHBondContact O-CB 3.09Å; Q189-Y193 PolarHBondContact O-N 2.72Å; Q189-L256 HydrophobicContact CB-CD2 4.31Å
190	I	89.4	Confident	80.6	Confident	1 Å²	1	77.3 Å²	77.3	1%	0.005	42%	0.422	C	S	.	.	H	α-helix	trans	-62.5	-45.3	172.8	-67.3	166.1	0	0	0	110.7	E186 K192 Y193 I194 W250 L256 I260 L263	E186-I190 VanDerWaalsContact O-CG1 3.32Å; E186-I190 WeakPolarHBondContact O-CG1 3.42Å; E186-I190 PolarHBondContact O-N 2.84Å; I190-K192 VanDerWaalsContact C-N 3.32Å; I190-K192 PolarHBondContact O-N 3.09Å; I190-Y193 WeakPolarHBondContact O-CB 3.25Å; I190-Y193 PolarHBondContact O-N 3.09Å; I190-I194 HydrophobicContact CG2-CD1 4.47Å; I190-I194 HydrophobicContact CG2-CG2 4.39Å; I190-I194 WeakPolarHBondContact O-CG1 3.43Å; I190-I194 PolarHBondContact O-N 3.37Å; I190-W250 HydrophobicContact CG2-CD2 3.76Å; I190-W250 HydrophobicContact CG2-CE3 3.98Å; I190-W250 HydrophobicContact CG2-CG 4.08Å; I190-W250 HydrophobicContact CG2-CZ3 4.44Å; I190-L256 HydrophobicContact CD1-CB 4.42Å; I190-L256 HydrophobicContact CG1-CB 3.96Å; I190-L256 HydrophobicContact CG1-CD1 4.04Å; I190-L256 HydrophobicContact CG1-CD2 4.11Å; I190-L256 HydrophobicContact CG1-CG 4.26Å; I190-I260 HydrophobicContact CD1-CB 3.76Å; I190-I260 HydrophobicContact CD1-CD1 3.95Å; I190-I260 HydrophobicContact CD1-CG1 4.3Å; I190-I260 HydrophobicContact CD1-CG2 4.08Å; I190-L263 HydrophobicContact CG2-CD2 3.89Å
191	L	90	Very high	82.8	Confident	37 Å²	37	74.8 Å²	74.8	19%	0.194	41%	0.412	C	S	.	.	H	α-helix	trans	-60.1	-43.1	-178.6	-170.6	68.3	0	0	0	112	T187 E188 L195 L265 Q268	T187-L191 VanDerWaalsContact O-CB 3.25Å; T187-L191 WeakPolarHBondContact O-CB 3.39Å; T187-L191 PolarHBondContact O-N 3.4Å; E188-L191 PolarHBondContact O-N 3.01Å; L191-L195 HydrophobicContact CD1-CD1 3.5Å; L191-L195 VanDerWaalsContact CD1-CD1 3.5Å; L191-L195 HydrophobicContact CD1-CG 3.95Å; L191-L195 HydrophobicContact CG-CD1 3.85Å; L191-L195 HydrophobicContact CG-CG 4.33Å; L191-L195 WeakPolarHBondContact O-CB 3.5Å; L191-L195 WeakPolarHBondContact O-CG 3.14Å; L191-L195 PolarHBondContact O-N 2.76Å; L191-L265 HydrophobicContact CD1-CD2 3.47Å; L191-L265 VanDerWaalsContact CD1-CD2 3.47Å; L191-Q268 HydrophobicContact CD1-CG 4.12Å; L191-Q268 HydrophobicContact CD2-CG 4.3Å
192	K	89.5	Confident	85	Confident	98 Å²	98	71.5 Å²	71.5	43%	0.426	39%	0.394	S	S	.	.	H	α-helix	trans	-64.2	-47.2	175.5	-172.2	171.7	-179.7	177.5	0	110.9	E184 E188 I190 I194 L195 T196	E184-K192 VanDerWaalsContact CD-NZ 3.31Å; E184-K192 VanDerWaalsContact OE1-CD 3.24Å; E184-K192 WeakPolarHBondContact OE1-CD 3.35Å; E184-K192 IonicContact OE1-NZ 3.69Å; E184-K192 PolarHBondContact OE1-NZ 2.85Å; E184-K192 IonicContact OE2-NZ 3.56Å; E184-K192 PolarHBondContact OE2-NZ 3.39Å; E188-K192 VanDerWaalsContact O-CB 3.25Å; E188-K192 WeakPolarHBondContact O-CB 3.12Å; E188-K192 PolarHBondContact O-N 3.05Å; I190-K192 VanDerWaalsContact C-N 3.32Å; I190-K192 PolarHBondContact O-N 3.09Å; K192-I194 PolarHBondContact O-N 3.32Å; K192-L195 PolarHBondContact O-N 2.84Å; K192-T196 WeakPolarHBondContact O-CB 3.44Å; K192-T196 PolarHBondContact O-N 2.05Å; K192-T196 VanDerWaalsContact O-N 3.09Å; K192-T196 PolarHBondContact O-OG1 3.21Å
193	Y	88.6	Confident	87.1	Confident	116 Å²	116	67.1 Å²	67.1	46%	0.455	35%	0.354	S	S	.	.	H	α-helix	trans	-55.3	-48.9	175.6	179.7	-97.8	0	0	0	112.6	Q189 I190 W250 T252 L256	Q189-Y193 WeakPolarHBondContact O-CB 3.09Å; Q189-Y193 PolarHBondContact O-N 2.72Å; I190-Y193 WeakPolarHBondContact O-CB 3.25Å; I190-Y193 PolarHBondContact O-N 3.09Å; Y193-W250 HydrophobicContact CD1-CB 4.06Å; Y193-W250 HydrophobicContact CE1-CB 4.06Å; Y193-T252 PolarHBondContact OH-OG1 3.5Å; Y193-L256 HydrophobicContact CG-CD1 4.32Å
194	I	90.9	Very high	88.2	Confident	8 Å²	8	64.2 Å²	64.2	4%	0.041	32%	0.321	C	S	.	.	H	α-helix	trans	-79.5	-30.3	-177.2	70.3	-173.7	0	0	0	113.9	I190 K192 L248 W250 L263 L265	I190-I194 HydrophobicContact CG2-CD1 4.47Å; I190-I194 HydrophobicContact CG2-CG2 4.39Å; I190-I194 WeakPolarHBondContact O-CG1 3.43Å; I190-I194 PolarHBondContact O-N 3.37Å; K192-I194 PolarHBondContact O-N 3.32Å; I194-L248 HydrophobicContact CB-CD2 4.39Å; I194-L248 HydrophobicContact CD1-CD2 4.46Å; I194-W250 HydrophobicContact CG2-CB 4.48Å; I194-W250 HydrophobicContact CG2-CE3 4.12Å; I194-L263 HydrophobicContact CD1-CD2 4.3Å; I194-L265 HydrophobicContact CD1-CD1 4.01Å
195	L	90.1	Very high	89	Confident	30 Å²	30	63.4 Å²	63.4	16%	0.157	32%	0.318	C	S	.	.	H	α-helix	trans	-96.7	-21.9	-172.7	-64.8	-170	0	0	0	115.6	L191 K192 N197 Y198 Q268 L272	L191-L195 HydrophobicContact CD1-CD1 3.5Å; L191-L195 VanDerWaalsContact CD1-CD1 3.5Å; L191-L195 HydrophobicContact CD1-CG 3.95Å; L191-L195 HydrophobicContact CG-CD1 3.85Å; L191-L195 HydrophobicContact CG-CG 4.33Å; L191-L195 WeakPolarHBondContact O-CB 3.5Å; L191-L195 WeakPolarHBondContact O-CG 3.14Å; L191-L195 PolarHBondContact O-N 2.76Å; K192-L195 PolarHBondContact O-N 2.84Å; L195-N197 PolarHBondContact O-N 2.84Å; L195-Y198 HydrophobicContact CD2-CG 4.46Å; L195-Y198 PolarHBondContact O-N 3.21Å; L195-Q268 HydrophobicContact CD1-CB 4.35Å; L195-Q268 HydrophobicContact CD1-CG 4.2Å; L195-L272 HydrophobicContact CD2-CD2 3.87Å
196	T	87.8	Confident	89	Confident	103 Å²	103	64.6 Å²	64.6	63%	0.632	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.7	-36.2	-171.3	-73.6	0	0	0	0	113.9	K192	K192-T196 WeakPolarHBondContact O-CB 3.44Å; K192-T196 PolarHBondContact O-N 2.05Å; K192-T196 VanDerWaalsContact O-N 3.09Å; K192-T196 PolarHBondContact O-OG1 3.21Å
197	N	86.3	Confident	89	Confident	151 Å²	151	68.4 Å²	68.4	81%	0.807	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115.7	14.1	178.8	-66.6	-37.5	0	0	0	113.4	L195	L195-N197 PolarHBondContact O-N 2.84Å
198	Y	92.4	Very high	88.9	Confident	29 Å²	29	67.4 Å²	67.4	11%	0.114	34%	0.338	C	S	.	.			trans	-79.6	125.3	-173.6	-169.8	-86.3	0	0	0	112.1	L195 D245 R247 L248 Q271 L272 W273	L195-Y198 HydrophobicContact CD2-CG 4.46Å; L195-Y198 PolarHBondContact O-N 3.21Å; Y198-D245 WeakPolarHBondContact CE2-OD2 3.26Å; Y198-D245 PolarHBondContact OH-OD2 2.95Å; Y198-R247 HydrophobicContact CD2-CB 3.96Å; Y198-R247 HydrophobicContact CE2-CB 3.93Å; Y198-R247 PolarHBondContact OH-NH2 3.03Å; Y198-R247 VanDerWaalsContact OH-NH2 3.16Å; Y198-L248 HydrophobicContact CD2-CD2 3.61Å; Y198-L248 HydrophobicContact CD2-CG 4.26Å; Y198-L248 HydrophobicContact CE2-CD1 4.21Å; Y198-L248 HydrophobicContact CE2-CD2 3.46Å; Y198-L248 VanDerWaalsContact CE2-CD2 3.46Å; Y198-L248 HydrophobicContact CE2-CG 3.67Å; Y198-L248 HydrophobicContact CG-CD2 4.41Å; Y198-Q271 VanDerWaalsContact CD1-O 3.24Å; Y198-Q271 WeakPolarHBondContact CD1-O 3.46Å; Y198-Q271 WeakPolarHBondContact CE1-O 3.45Å; Y198-L272 HydrophobicContact CD1-CD2 4.45Å; Y198-L272 HydrophobicContact CE1-CD2 4.11Å; Y198-W273 WeakPolarHBondContact OH-CB 3.24Å; Y198-W273 PolarHBondContact OH-N 3.21Å
199	K	91.1	Very high	88.9	Confident	101 Å²	101	72 Å²	72	44%	0.439	36%	0.359	S	S	.	.			trans	-103.7	107.4	177.6	-66.7	173.3	178.4	174.2	0	110.8	H201 E202	K199-H201 PolarHBondContact O-N 2.9Å; K199-E202 HydrophobicContact CB-CB 4.45Å; K199-E202 HydrophobicContact CB-CG 4.28Å; K199-E202 HydrophobicContact CD-CG 4.17Å; K199-E202 WeakPolarHBondContact CD-OE1 3.42Å; K199-E202 WeakPolarHBondContact CD-OE2 3.32Å; K199-E202 WeakPolarHBondContact CE-OE1 3.18Å; K199-E202 IonicContact NZ-OE1 3.46Å; K199-E202 PolarHBondContact NZ-OE1 3.41Å; K199-E202 IonicContact NZ-OE2 2.7Å; K199-E202 PolarHBondContact NZ-OE2 3.11Å; K199-E202 PolarHBondContact O-N 2.96Å
200	S	90.9	Very high	89.1	Confident	52 Å²	52	74 Å²	74	36%	0.364	37%	0.372	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-16.8	-178.3	57.9	0	0	0	0	115.9	Q271 W273	S200-Q271 WeakPolarHBondContact CB-O 3.46Å; S200-W273 WeakPolarHBondContact O-CA 3.38Å; S200-W273 WeakPolarHBondContact O-CB 3.37Å
201	H	89.7	Confident	89.3	Confident	132 Å²	132	75.5 Å²	75.5	61%	0.611	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.3	-16.5	-178.4	58.7	-89.7	0	0	0	114	K199	K199-H201 PolarHBondContact O-N 2.9Å
202	E	91.6	Very high	89.6	Confident	50 Å²	50	73.9 Å²	73.9	23%	0.234	37%	0.373	C	S	.	.	S	Bend	trans	-92.7	133.1	178	-66.4	177.7	179.2	0	0	109.8	K199 E206 R247	K199-E202 HydrophobicContact CB-CB 4.45Å; K199-E202 HydrophobicContact CB-CG 4.28Å; K199-E202 HydrophobicContact CD-CG 4.17Å; K199-E202 WeakPolarHBondContact CD-OE1 3.42Å; K199-E202 WeakPolarHBondContact CD-OE2 3.32Å; K199-E202 WeakPolarHBondContact CE-OE1 3.18Å; K199-E202 IonicContact NZ-OE1 3.46Å; K199-E202 PolarHBondContact NZ-OE1 3.41Å; K199-E202 IonicContact NZ-OE2 2.7Å; K199-E202 PolarHBondContact NZ-OE2 3.11Å; K199-E202 PolarHBondContact O-N 2.96Å; E202-E206 HydrophobicContact CB-CB 4.3Å; E202-E206 HydrophobicContact CB-CG 4.41Å; E202-R247 PolarHBondContact O-NH1 2.69Å; E202-R247 PolarHBondContact O-NH2 3.02Å; E202-R247 VanDerWaalsContact O-NH2 3.09Å
203	R	92.6	Very high	89.9	Confident	18 Å²	18	73.7 Å²	73.7	7%	0.068	38%	0.376	C	S	.	.			trans	-65.1	153.7	175.1	78.2	-158.5	165.9	86.6	16.7	110.3	N205 E206 S208 D210 W273 Q344	R203-N205 VanDerWaalsContact CZ-O 3.24Å; R203-N205 PolarHBondContact NH1-O 3.01Å; R203-N205 PolarHBondContact NH2-O 2.83Å; R203-N205 PolarHBondContact O-N 2.92Å; R203-E206 WeakPolarHBondContact CD-OE1 3.33Å; R203-E206 HydrophobicContact CG-CB 4.09Å; R203-E206 VanDerWaalsContact CG-OE2 3.28Å; R203-E206 WeakPolarHBondContact CG-OE2 3.36Å; R203-E206 IonicContact CZ-OE1 3.49Å; R203-E206 PolarHBondContact N-OE2 2.85Å; R203-E206 IonicContact NE-OE1 3.24Å; R203-E206 PolarHBondContact NE-OE1 2.88Å; R203-E206 IonicContact NE-OE2 2.79Å; R203-E206 PolarHBondContact NH2-O 2.85Å; R203-E206 VanDerWaalsContact NH2-O 3.07Å; R203-E206 IonicContact NH2-OE1 3Å; R203-E206 PolarHBondContact O-N 2.8Å; R203-S208 PolarHBondContact NH2-O 2.88Å; R203-S208 VanDerWaalsContact NH2-O 3.09Å; R203-D210 PolarHBondContact NH1-O 3.11Å; R203-D210 VanDerWaalsContact NH1-O 3.16Å; R203-W273 HydrophobicContact CB-CZ2 3.92Å; R203-Q344 PolarHBondContact NH1-O 3.36Å
204	P	91.9	Very high	90.3	Very high	14 Å²	14	68.2 Å²	68.2	9%	0.091	36%	0.355	C	S	.	.	T	Hydrogen-bonded Turn	trans	-50.4	-35	-178.7	-30.4	36.1	0	0	0	114.7	T212 D245 W273	P204-T212 HydrophobicContact CG-CG2 4.04Å; P204-D245 HydrophobicContact CB-CB 4.1Å; P204-D245 HydrophobicContact CG-CB 3.98Å; P204-W273 HydrophobicContact CG-CD2 4.45Å; P204-W273 HydrophobicContact CG-CE3 3.93Å; P204-W273 HydrophobicContact CG-CZ3 4.06Å
205	N	86.8	Confident	90.6	Very high	39 Å²	39	68.3 Å²	68.3	21%	0.209	36%	0.356	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107.1	27.6	-176.9	-70.5	15.9	0	0	0	112.9	R203 N207 S208 D210	R203-N205 VanDerWaalsContact CZ-O 3.24Å; R203-N205 PolarHBondContact NH1-O 3.01Å; R203-N205 PolarHBondContact NH2-O 2.83Å; R203-N205 PolarHBondContact O-N 2.92Å; N205-N207 PolarHBondContact O-N 2.81Å; N205-N207 VanDerWaalsContact O-N 3.11Å; N205-S208 WeakPolarHBondContact CB-OG 3.49Å; N205-S208 PolarHBondContact O-N 2.93Å; N205-D210 WeakPolarHBondContact CB-O 3.42Å
206	E	84.6	Confident	90.9	Very high	69 Å²	69	66.9 Å²	66.9	32%	0.322	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.3	-39.5	-172.1	-157	64.5	-99.7	0	0	113.5	E202 R203	E202-E206 HydrophobicContact CB-CB 4.3Å; E202-E206 HydrophobicContact CB-CG 4.41Å; R203-E206 WeakPolarHBondContact CD-OE1 3.33Å; R203-E206 HydrophobicContact CG-CB 4.09Å; R203-E206 VanDerWaalsContact CG-OE2 3.28Å; R203-E206 WeakPolarHBondContact CG-OE2 3.36Å; R203-E206 IonicContact CZ-OE1 3.49Å; R203-E206 PolarHBondContact N-OE2 2.85Å; R203-E206 IonicContact NE-OE1 3.24Å; R203-E206 PolarHBondContact NE-OE1 2.88Å; R203-E206 IonicContact NE-OE2 2.79Å; R203-E206 PolarHBondContact NH2-O 2.85Å; R203-E206 VanDerWaalsContact NH2-O 3.07Å; R203-E206 IonicContact NH2-OE1 3Å; R203-E206 PolarHBondContact O-N 2.8Å
207	N	83	Confident	91.3	Very high	167 Å²	167	63.2 Å²	63.2	89%	0.893	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.8	-2.4	-179	-63.3	-25	0	0	0	114.6	N205	N205-N207 PolarHBondContact O-N 2.81Å; N205-N207 VanDerWaalsContact O-N 3.11Å
208	S	85.3	Confident	91.7	Very high	42 Å²	42	56.2 Å²	56.2	29%	0.294	29%	0.286	S	S	.	.	S	Bend	trans	-108.4	155.9	174.7	81	0	0	0	0	111.9	R203 N205 D210	R203-S208 PolarHBondContact NH2-O 2.88Å; R203-S208 VanDerWaalsContact NH2-O 3.09Å; N205-S208 WeakPolarHBondContact CB-OG 3.49Å; N205-S208 PolarHBondContact O-N 2.93Å; S208-D210 PolarHBondContact O-N 2.81Å; S208-D210 PolarHBondContact OG-N 2.91Å
209	Q	86.4	Confident	91.8	Very high	193 Å²	193	57.1 Å²	57.1	90%	0.902	29%	0.292	S	S	*	.	S	Bend	trans	-71.9	-10.7	175	-65.1	-177	-7.4	0	0	112.3
210	D	92.4	Very high	92	Very high	104 Å²	104	52.4 Å²	52.4	56%	0.556	27%	0.271	S	S	*	.	S	Bend	trans	-80.2	134.3	-178.5	-57	-62.5	0	0	0	111.5	R203 N205 S208	R203-D210 PolarHBondContact NH1-O 3.11Å; R203-D210 VanDerWaalsContact NH1-O 3.16Å; N205-D210 WeakPolarHBondContact CB-O 3.42Å; S208-D210 PolarHBondContact O-N 2.81Å; S208-D210 PolarHBondContact OG-N 2.91Å
211	P	93.9	Very high	92	Very high	33 Å²	33	52 Å²	52	21%	0.214	26%	0.264	C	S	.	.	P	Polyproline II helix	trans	-65.6	146.8	171.5	26.9	-33.6	0	0	0	110.8	I213 I342 D343 Q344 K346	P211-I213 PolarHBondContact O-N 2.96Å; P211-I342 VanDerWaalsContact CB-O 3.23Å; P211-I342 WeakPolarHBondContact CB-O 3.37Å; P211-D343 WeakPolarHBondContact CA-O 3.25Å; P211-D343 WeakPolarHBondContact CB-O 3.38Å; P211-Q344 WeakPolarHBondContact CA-O 3.27Å; P211-K346 HydrophobicContact CB-CB 4.34Å
212	T	95.3	Very high	92.1	Very high	2 Å²	2	48 Å²	48	1%	0.012	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.8	118.6	166.8	-58.7	0	0	0	0	108.2	P204 V214 W273 Q344 L345 K346	P204-T212 HydrophobicContact CG-CG2 4.04Å; T212-V214 HydrophobicContact CG2-CG2 4.37Å; T212-W273 HydrophobicContact CG2-CH2 3.91Å; T212-W273 HydrophobicContact CG2-CZ3 4.14Å; T212-Q344 PolarHBondContact N-O 2.72Å; T212-L345 HydrophobicContact CG2-CD1 4.26Å; T212-K346 PolarHBondContact O-N 3.08Å
213	I	95.9	Very high	92	Very high	95 Å²	95	46.1 Å²	46.1	49%	0.487	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	123.1	-179.7	-58.5	178.2	0	0	0	109.2	P211 K346 I348	P211-I213 PolarHBondContact O-N 2.96Å; I213-K346 WeakPolarHBondContact CA-O 3.43Å; I213-I348 HydrophobicContact CG2-CD1 3.52Å; I213-I348 HydrophobicContact CG2-CG1 3.87Å; I213-I348 HydrophobicContact CG2-CG2 4.38Å
214	V	97	Very high	91.7	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	113.4	179.8	-175.9	0	0	0	0	110.1	T212 V216 Q241 W243 P275 L345 K346 F347 I348	T212-V214 HydrophobicContact CG2-CG2 4.37Å; V214-V216 HydrophobicContact CG1-CG2 4.39Å; V214-V216 PolarHBondContact O-N 2.9Å; V214-Q241 HydrophobicContact CG1-CB 4.06Å; V214-W243 HydrophobicContact CG2-CB 4.06Å; V214-P275 HydrophobicContact CG1-CG 4.22Å; V214-P275 HydrophobicContact CG2-CB 4.05Å; V214-P275 HydrophobicContact CG2-CG 4.31Å; V214-L345 HydrophobicContact CG2-CD1 3.65Å; V214-K346 PolarHBondContact N-O 3.31Å; V214-F347 HydrophobicContact CB-CD1 3.68Å; V214-F347 HydrophobicContact CB-CE1 3.88Å; V214-F347 HydrophobicContact CG1-CD1 3.88Å; V214-F347 HydrophobicContact CG1-CE1 3.86Å; V214-F347 HydrophobicContact CG2-CD1 4.47Å; V214-F347 HydrophobicContact CG2-CE1 4.29Å; V214-F347 WeakPolarHBondContact O-CA 3.44Å; V214-I348 PolarHBondContact O-N 3.04Å
215	S	97.1	Very high	91.5	Very high	11 Å²	11	50.3 Å²	50.3	8%	0.077	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	113.7	174.6	168.6	0	0	0	0	110.6	Q241 Q242 I348 H350	S215-Q241 CarbonylContact O-C 3.57Å; S215-Q241 WeakPolarHBondContact O-CA 3.37Å; S215-Q242 PolarHBondContact N-O 3.41Å; S215-Q242 PolarHBondContact O-N 2.78Å; S215-I348 CarbonylContact C-O 3.45Å; S215-I348 WeakPolarHBondContact CA-O 3.43Å; S215-H350 WeakPolarHBondContact OG-CA 3.13Å; S215-H350 WeakPolarHBondContact OG-CB 3.29Å; S215-H350 PolarHBondContact OG-ND1 2.83Å
216	V	97.1	Very high	91.6	Very high	0 Å²	0	50 Å²	50	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	137	-178.2	-176.5	0	0	0	0	110.8	V214 L239 R240 L277 I335 F347 I348 W349 H350 L391	V214-V216 HydrophobicContact CG1-CG2 4.39Å; V214-V216 PolarHBondContact O-N 2.9Å; V216-L239 HydrophobicContact CG1-CD1 4.05Å; V216-R240 WeakPolarHBondContact CA-O 3.21Å; V216-L277 HydrophobicContact CG1-CD1 3.99Å; V216-L277 HydrophobicContact CG2-CD1 3.87Å; V216-I335 HydrophobicContact CG1-CD1 4.4Å; V216-F347 HydrophobicContact CG2-CB 4.15Å; V216-F347 HydrophobicContact CG2-CD1 3.53Å; V216-F347 HydrophobicContact CG2-CE1 4.31Å; V216-F347 HydrophobicContact CG2-CG 4.16Å; V216-I348 PolarHBondContact N-O 2.99Å; V216-W349 HydrophobicContact CG1-CZ3 4.41Å; V216-H350 PolarHBondContact O-N 2.95Å; V216-L391 HydrophobicContact CB-CD1 4Å; V216-L391 HydrophobicContact CG2-CD1 4.13Å
217	F	95.8	Very high	91.9	Very high	26 Å²	26	49 Å²	49	11%	0.114	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.2	148.5	175.7	53.4	-63.6	0	0	0	111.9	R240 Q242 L306 H350 P354	F217-R240 HydrophobicContact CD1-CB 3.69Å; F217-R240 HydrophobicContact CD2-CB 3.74Å; F217-R240 HydrophobicContact CD2-CG 4.27Å; F217-R240 HydrophobicContact CE1-CB 3.51Å; F217-R240 HydrophobicContact CE2-CB 3.61Å; F217-R240 HydrophobicContact CE2-CG 4.04Å; F217-R240 HydrophobicContact CG-CB 3.79Å; F217-R240 HydrophobicContact CZ-CB 3.48Å; F217-R240 VanDerWaalsContact CZ-CB 3.48Å; F217-R240 HydrophobicContact CZ-CG 4.26Å; F217-R240 PolarHBondContact N-O 2.87Å; F217-R240 PolarHBondContact O-N 2.62Å; F217-Q242 HydrophobicContact CE1-CB 4.19Å; F217-L306 HydrophobicContact CE1-CD1 4.2Å; F217-L306 HydrophobicContact CZ-CD1 3.76Å; F217-H350 HydrophobicContact CB-CB 3.75Å; F217-H350 HydrophobicContact CD1-CB 4.07Å; F217-H350 HydrophobicContact CG-CB 4.09Å; F217-P354 CarbonylContact C-O 3.59Å; F217-P354 VanDerWaalsContact CA-O 3.22Å; F217-P354 WeakPolarHBondContact CA-O 3.15Å; F217-P354 WeakPolarHBondContact CB-O 3.37Å
218	I	96.1	Very high	92.3	Very high	3 Å²	3	41.6 Å²	41.6	2%	0.015	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	133.1	-171.6	-64.2	179.4	0	0	0	110.5	I220 C237 Y238 L239 I335 W349 P354 V355 T356 L393	I218-I220 HydrophobicContact CG2-CG1 3.99Å; I218-C237 HydrophobicContact CG2-CB 3.96Å; I218-Y238 WeakPolarHBondContact CA-O 3.36Å; I218-L239 HydrophobicContact CD1-CD1 4.23Å; I218-L239 HydrophobicContact CG1-CD1 3.95Å; I218-I335 HydrophobicContact CD1-CD1 3.71Å; I218-W349 HydrophobicContact CD1-CH2 4.41Å; I218-W349 HydrophobicContact CD1-CZ3 4.44Å; I218-P354 PolarHBondContact N-O 3.27Å; I218-V355 WeakPolarHBondContact O-CA 3.36Å; I218-T356 PolarHBondContact O-N 3.41Å; I218-L393 HydrophobicContact CD1-CD2 4.13Å
219	H	94.5	Very high	92.6	Very high	49 Å²	49	43 Å²	43	23%	0.227	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	110.9	166.3	-176.5	78.2	0	0	0	110	I221 C237 Y238 T356	H219-I221 PolarHBondContact O-N 3.41Å; H219-C237 CarbonylContact O-C 3.56Å; H219-C237 WeakPolarHBondContact O-CA 3.25Å; H219-C237 VanDerWaalsContact O-CB 3.23Å; H219-C237 WeakPolarHBondContact O-CB 3.4Å; H219-Y238 HydrophobicContact CB-CD2 4.18Å; H219-Y238 AromaticContact CD2-CD2 3.74Å; H219-Y238 PolarHBondContact N-O 3.34Å; H219-Y238 PolarHBondContact O-N 2.97Å; H219-T356 CarbonylContact C-O 3.33Å; H219-T356 WeakPolarHBondContact CA-O 3.38Å; H219-T356 PolarHBondContact ND1-OG1 3.38Å
220	I	93.7	Very high	92.9	Very high	1 Å²	1	39.2 Å²	39.2	1%	0.005	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	115.9	178	-57.1	177.8	0	0	0	108.5	I218 I223 V355 T356 I357 S358 L361 L393 I395	I218-I220 HydrophobicContact CG2-CG1 3.99Å; I220-I223 HydrophobicContact CG2-CG1 4.2Å; I220-V355 HydrophobicContact CD1-CG1 4.26Å; I220-T356 PolarHBondContact N-O 2.7Å; I220-I357 HydrophobicContact CB-CG1 4.42Å; I220-I357 HydrophobicContact CD1-CG1 4.26Å; I220-S358 PolarHBondContact O-N 3.26Å; I220-L361 HydrophobicContact CG2-CD1 3.86Å; I220-L393 HydrophobicContact CD1-CD2 4.5Å; I220-I395 HydrophobicContact CD1-CD1 3.65Å; I220-I395 HydrophobicContact CD1-CG1 4.22Å
221	I	91.9	Very high	92.9	Very high	43 Å²	43	36.5 Å²	36.5	22%	0.221	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85	-50.6	-178.6	-54.1	165.9	0	0	0	109.6	H219 N236 Y238 K310 S358	H219-I221 PolarHBondContact O-N 3.41Å; I221-N236 WeakPolarHBondContact CA-O 3.45Å; I221-N236 HydrophobicContact CB-CB 4.44Å; I221-N236 WeakPolarHBondContact CB-O 3.31Å; I221-N236 PolarHBondContact N-O 2.79Å; I221-Y238 HydrophobicContact CD1-CD1 4.34Å; I221-Y238 HydrophobicContact CD1-CD2 3.84Å; I221-Y238 HydrophobicContact CD1-CE1 4.03Å; I221-Y238 HydrophobicContact CD1-CE2 3.48Å; I221-Y238 VanDerWaalsContact CD1-CE2 3.48Å; I221-Y238 HydrophobicContact CD1-CG 4.24Å; I221-Y238 HydrophobicContact CG1-CD2 3.95Å; I221-Y238 HydrophobicContact CG1-CE2 3.74Å; I221-K310 HydrophobicContact CD1-CD 4.38Å; I221-K310 HydrophobicContact CD1-CG 4.14Å; I221-S358 PolarHBondContact O-OG 3.23Å
222	D	90.4	Very high	93	Very high	50 Å²	50	36.5 Å²	36.5	27%	0.267	20%	0.201	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.4	166.1	175.9	70.4	55.2	0	0	0	111.5	S224 N236 L361	D222-S224 WeakPolarHBondContact OD1-CB 3.33Å; D222-S224 PolarHBondContact OD1-N 3.4Å; D222-N236 PolarHBondContact N-O 2.85Å; D222-N236 PolarHBondContact O-N 3.26Å; D222-N236 WeakPolarHBondContact OD1-CB 3.31Å; D222-N236 VanDerWaalsContact OD1-CG 3.28Å; D222-N236 PolarHBondContact OD1-ND2 2.9Å; D222-N236 PolarHBondContact OD2-ND2 2.86Å; D222-L361 VanDerWaalsContact CA-CD1 3.48Å
223	I	91.1	Very high	92.9	Very high	10 Å²	10	36.4 Å²	36.4	5%	0.051	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	81.4	164.8	-58.4	-176.6	0	0	0	106.5	I220 S225 Y233 T234 I235 L361 L363 I395 L397	I220-I223 HydrophobicContact CG2-CG1 4.2Å; I223-S225 VanDerWaalsContact C-N 3.34Å; I223-S225 PolarHBondContact O-N 2.94Å; I223-Y233 HydrophobicContact CG2-CD2 4.36Å; I223-T234 CarbonylContact C-O 3.59Å; I223-I235 HydrophobicContact CG1-CG2 3.99Å; I223-I235 HydrophobicContact CG2-CG2 4.33Å; I223-L361 HydrophobicContact CD1-CD2 4.18Å; I223-L361 HydrophobicContact CG1-CD1 4.41Å; I223-L361 HydrophobicContact CG1-CD2 4.15Å; I223-L363 HydrophobicContact CB-CD2 3.7Å; I223-L363 HydrophobicContact CB-CG 4.38Å; I223-L363 HydrophobicContact CD1-CD2 4.12Å; I223-L363 HydrophobicContact CG1-CD2 4.37Å; I223-L363 HydrophobicContact CG2-CD2 3.87Å; I223-I395 HydrophobicContact CD1-CG2 4.21Å; I223-L397 HydrophobicContact CD1-CD2 4.01Å
224	S	86.6	Confident	92.8	Very high	63 Å²	63	32.5 Å²	32.5	44%	0.441	18%	0.181	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-57.2	-34.3	-170.9	59	0	0	0	0	116	D222 T234	D222-S224 WeakPolarHBondContact OD1-CB 3.33Å; D222-S224 PolarHBondContact OD1-N 3.4Å; S224-T234 PolarHBondContact N-O 3.48Å; S224-T234 VanDerWaalsContact N-O 3.08Å; S224-T234 WeakPolarHBondContact OG-CB 3.43Å; S224-T234 WeakPolarHBondContact OG-CG2 3.28Å; S224-T234 PolarHBondContact OG-O 2.7Å
225	S	87.1	Confident	92.6	Very high	57 Å²	57	32.5 Å²	32.5	40%	0.399	18%	0.181	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.9	151	177	65.4	0	0	0	0	112.9	I223 Y233 T234	I223-S225 VanDerWaalsContact C-N 3.34Å; I223-S225 PolarHBondContact O-N 2.94Å; S225-Y233 CarbonylContact O-C 3.51Å; S225-Y233 WeakPolarHBondContact O-CA 3.42Å; S225-T234 PolarHBondContact O-N 3.08Å; S225-T234 WeakPolarHBondContact OG-CB 3.47Å; S225-T234 PolarHBondContact OG-OG1 3.14Å
226	S	88.7	Confident	92.5	Very high	32 Å²	32	33 Å²	33	22%	0.224	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	119.5	170.8	48.3	0	0	0	0	108.2	F366	S226-F366 WeakPolarHBondContact OG-CE2 3.42Å
227	N	91.2	Very high	92.3	Very high	49 Å²	49	33 Å²	33	26%	0.262	18%	0.183	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	95.7	179.7	-170.9	-22.7	0	0	0	109.9	V229 Q230 M231 E232	N227-V229 PolarHBondContact O-N 3.11Å; N227-V229 WeakPolarHBondContact OD1-CB 3.37Å; N227-V229 PolarHBondContact OD1-N 2.81Å; N227-Q230 HydrophobicContact CB-CB 4.31Å; N227-Q230 PolarHBondContact ND2-OE1 3.38Å; N227-Q230 PolarHBondContact O-N 3.01Å; N227-Q230 PolarHBondContact OD1-N 3.04Å; N227-M231 PolarHBondContact O-N 3.36Å; N227-E232 HydrophobicContact CB-CG 3.91Å; N227-E232 PolarHBondContact N-O 3.13Å; N227-E232 PolarHBondContact O-N 2.78Å
228	V	91.1	Very high	92.3	Very high	11 Å²	11	35.7 Å²	35.7	7%	0.067	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62	-32.9	178.8	-169.4	0	0	0	0	111.3	M319 L321 L455 P456	V228-M319 HydrophobicContact CB-SD 4.3Å; V228-M319 HydrophobicContact CG1-SD 4.18Å; V228-M319 HydrophobicContact CG2-SD 4.03Å; V228-L321 HydrophobicContact CG1-CD1 3.64Å; V228-L321 HydrophobicContact CG1-CD2 3.66Å; V228-L321 HydrophobicContact CG1-CG 4.29Å; V228-L455 HydrophobicContact CG1-CD2 4.16Å; V228-P456 HydrophobicContact CG1-CG 4.4Å; V228-P456 WeakPolarHBondContact O-CD 3.44Å; V228-P456 VanDerWaalsContact O-CG 3.26Å; V228-P456 WeakPolarHBondContact O-CG 3.26Å
229	V	91.8	Very high	92.3	Very high	71 Å²	71	35.6 Å²	35.6	43%	0.43	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.6	-38.6	179.6	-175.6	0	0	0	0	111.9	N227 Q454	N227-V229 PolarHBondContact O-N 3.11Å; N227-V229 WeakPolarHBondContact OD1-CB 3.37Å; N227-V229 PolarHBondContact OD1-N 2.81Å; V229-Q454 VanDerWaalsContact CG2-O 3.28Å; V229-Q454 WeakPolarHBondContact CG2-O 3.38Å
230	Q	92.6	Very high	92.5	Very high	114 Å²	114	37.3 Å²	37.3	53%	0.533	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.7	-0.8	179.6	-66.7	-174.4	-92.7	0	0	114	N227 E232 K283	N227-Q230 HydrophobicContact CB-CB 4.31Å; N227-Q230 PolarHBondContact ND2-OE1 3.38Å; N227-Q230 PolarHBondContact O-N 3.01Å; N227-Q230 PolarHBondContact OD1-N 3.04Å; Q230-E232 HydrophobicContact CB-CG 3.8Å; Q230-K283 PolarHBondContact O-NZ 3.05Å
231	M	93.3	Very high	92.6	Very high	46 Å²	46	37.6 Å²	37.6	23%	0.227	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	54.1	52.5	-176.9	-61.9	-64.8	-163.8	0	0	111.9	N227 C317 M319 L321 P456 V458	N227-M231 PolarHBondContact O-N 3.36Å; M231-C317 CarbonylContact C-O 3.56Å; M231-C317 VanDerWaalsContact C-O 3.31Å; M231-C317 WeakPolarHBondContact CB-O 3.31Å; M231-C317 PolarHBondContact O-N 3.36Å; M231-M319 HydrophobicContact SD-CB 3.88Å; M231-M319 HydrophobicContact SD-CG 4.37Å; M231-L321 HydrophobicContact CE-CD1 4.28Å; M231-P456 HydrophobicContact CE-CB 4.09Å; M231-P456 HydrophobicContact CE-CG 3.58Å; M231-P456 HydrophobicContact SD-CG 4.41Å; M231-V458 HydrophobicContact CE-CG1 4.32Å
232	E	94.4	Very high	92.9	Very high	33 Å²	33	37.8 Å²	37.8	15%	0.154	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148	161.3	-178.4	61	-166.1	-140.1	0	0	112.9	N227 Q230 K283 T314 L315	N227-E232 HydrophobicContact CB-CG 3.91Å; N227-E232 PolarHBondContact N-O 3.13Å; N227-E232 PolarHBondContact O-N 2.78Å; Q230-E232 HydrophobicContact CB-CG 3.8Å; E232-K283 HydrophobicContact CB-CD 4.02Å; E232-K283 WeakPolarHBondContact OE2-CD 3.36Å; E232-K283 WeakPolarHBondContact OE2-CE 3.45Å; E232-K283 IonicContact OE2-NZ 3.64Å; E232-K283 PolarHBondContact OE2-NZ 2.89Å; E232-T314 HydrophobicContact CB-CG2 4.01Å; E232-T314 HydrophobicContact CG-CG2 4.13Å; E232-L315 VanDerWaalsContact CA-O 3.24Å; E232-L315 WeakPolarHBondContact CA-O 3.15Å; E232-L315 WeakPolarHBondContact CB-O 3.5Å
233	Y	93.5	Very high	93.1	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	149.4	175.3	74.2	-64.2	0	0	0	109.7	I223 S225 I235 T314 L315 C317 C331 T332 V333 I395	I223-Y233 HydrophobicContact CG2-CD2 4.36Å; S225-Y233 CarbonylContact O-C 3.51Å; S225-Y233 WeakPolarHBondContact O-CA 3.42Å; Y233-I235 HydrophobicContact CD2-CG2 3.53Å; Y233-I235 HydrophobicContact CE2-CG2 3.38Å; Y233-T314 CarbonylContact O-C 3.59Å; Y233-T314 WeakPolarHBondContact O-CA 3.29Å; Y233-L315 HydrophobicContact CD1-CB 3.95Å; Y233-L315 WeakPolarHBondContact CD1-O 3.45Å; Y233-L315 HydrophobicContact CE1-CB 3.43Å; Y233-L315 VanDerWaalsContact CE1-CB 3.43Å; Y233-L315 HydrophobicContact CE1-CD1 4.06Å; Y233-L315 HydrophobicContact CE1-CG 4.4Å; Y233-L315 HydrophobicContact CE2-CD1 4.37Å; Y233-L315 PolarHBondContact N-O 3.31Å; Y233-L315 PolarHBondContact O-N 2.95Å; Y233-L315 WeakPolarHBondContact OH-CD1 3.44Å; Y233-C317 HydrophobicContact CD1-CB 3.59Å; Y233-C317 HydrophobicContact CE1-CB 3.91Å; Y233-C331 HydrophobicContact CD1-CB 3.92Å; Y233-C331 HydrophobicContact CD2-CB 4.29Å; Y233-C331 HydrophobicContact CE1-CB 3.61Å; Y233-C331 HydrophobicContact CE2-CB 4.01Å; Y233-C331 HydrophobicContact CG-CB 4.25Å; Y233-T332 PolarHBondContact OH-O 3.16Å; Y233-V333 WeakPolarHBondContact OH-CG2 3.11Å; Y233-I395 HydrophobicContact CE2-CD1 4.19Å
234	T	94.2	Very high	93.4	Very high	14 Å²	14	41 Å²	41	9%	0.086	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	125	-178.1	-53.1	0	0	0	0	109.8	I223 S224 S225 T312 M313 T314	I223-T234 CarbonylContact C-O 3.59Å; S224-T234 PolarHBondContact N-O 3.48Å; S224-T234 VanDerWaalsContact N-O 3.08Å; S224-T234 WeakPolarHBondContact OG-CB 3.43Å; S224-T234 WeakPolarHBondContact OG-CG2 3.28Å; S224-T234 PolarHBondContact OG-O 2.7Å; S225-T234 PolarHBondContact O-N 3.08Å; S225-T234 WeakPolarHBondContact OG-CB 3.47Å; S225-T234 PolarHBondContact OG-OG1 3.14Å; T234-T312 HydrophobicContact CG2-CG2 3.6Å; T234-M313 CarbonylContact C-O 3.58Å; T234-M313 VanDerWaalsContact CA-O 3.31Å; T234-M313 WeakPolarHBondContact CA-O 3.13Å; T234-T314 PolarHBondContact OG1-OG1 3.02Å
235	I	93.4	Very high	93.8	Very high	0 Å²	0	38 Å²	38	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	142.8	178.1	68	177.9	0	0	0	110.7	I223 Y233 T312 M313 L315 V333	I223-I235 HydrophobicContact CG1-CG2 3.99Å; I223-I235 HydrophobicContact CG2-CG2 4.33Å; Y233-I235 HydrophobicContact CD2-CG2 3.53Å; Y233-I235 HydrophobicContact CE2-CG2 3.38Å; I235-T312 WeakPolarHBondContact O-CA 3.46Å; I235-M313 HydrophobicContact CD1-CG 4Å; I235-M313 HydrophobicContact CD1-SD 3.94Å; I235-M313 HydrophobicContact CG1-CG 3.47Å; I235-M313 VanDerWaalsContact CG1-CG 3.47Å; I235-M313 HydrophobicContact CG1-SD 4.09Å; I235-M313 PolarHBondContact N-O 3.31Å; I235-M313 PolarHBondContact O-N 3.17Å; I235-L315 HydrophobicContact CD1-CD1 3.79Å; I235-L315 HydrophobicContact CG1-CD1 4.24Å; I235-V333 HydrophobicContact CD1-CG2 3.95Å
236	N	93.3	Very high	94	Very high	21 Å²	21	37.8 Å²	37.8	11%	0.112	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	121.5	166.5	-66.2	-26.1	0	0	0	107.9	I221 D222 T312	I221-N236 WeakPolarHBondContact CA-O 3.45Å; I221-N236 HydrophobicContact CB-CB 4.44Å; I221-N236 WeakPolarHBondContact CB-O 3.31Å; I221-N236 PolarHBondContact N-O 2.79Å; D222-N236 PolarHBondContact N-O 2.85Å; D222-N236 PolarHBondContact O-N 3.26Å; D222-N236 WeakPolarHBondContact OD1-CB 3.31Å; D222-N236 VanDerWaalsContact OD1-CG 3.28Å; D222-N236 PolarHBondContact OD1-ND2 2.9Å; D222-N236 PolarHBondContact OD2-ND2 2.86Å; N236-T312 VanDerWaalsContact OD1-CB 3.27Å; N236-T312 WeakPolarHBondContact OD1-CB 3.49Å; N236-T312 VanDerWaalsContact OD1-CG2 3.25Å; N236-T312 WeakPolarHBondContact OD1-CG2 3.23Å; N236-T312 PolarHBondContact OD1-OG1 3.19Å
237	C	94.6	Very high	94.1	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	156.2	-177.6	65.3	0	0	0	0	113.2	I218 H219 I311 M313	I218-C237 HydrophobicContact CG2-CB 3.96Å; H219-C237 CarbonylContact O-C 3.56Å; H219-C237 WeakPolarHBondContact O-CA 3.25Å; H219-C237 VanDerWaalsContact O-CB 3.23Å; H219-C237 WeakPolarHBondContact O-CB 3.4Å; C237-I311 PolarHBondContact N-O 2.64Å; C237-I311 PolarHBondContact O-N 2.68Å; C237-M313 VanDerWaalsContact SG-CE 3.53Å
238	Y	95.7	Very high	94.2	Very high	82 Å²	82	37.4 Å²	37.4	32%	0.322	17%	0.173	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	114.3	157.4	-56	-67.2	0	0	0	108.5	I218 H219 I221 Q309 K310	I218-Y238 WeakPolarHBondContact CA-O 3.36Å; H219-Y238 HydrophobicContact CB-CD2 4.18Å; H219-Y238 AromaticContact CD2-CD2 3.74Å; H219-Y238 PolarHBondContact N-O 3.34Å; H219-Y238 PolarHBondContact O-N 2.97Å; I221-Y238 HydrophobicContact CD1-CD1 4.34Å; I221-Y238 HydrophobicContact CD1-CD2 3.84Å; I221-Y238 HydrophobicContact CD1-CE1 4.03Å; I221-Y238 HydrophobicContact CD1-CE2 3.48Å; I221-Y238 VanDerWaalsContact CD1-CE2 3.48Å; I221-Y238 HydrophobicContact CD1-CG 4.24Å; I221-Y238 HydrophobicContact CG1-CD2 3.95Å; I221-Y238 HydrophobicContact CG1-CE2 3.74Å; Y238-Q309 WeakPolarHBondContact CA-O 3.43Å; Y238-K310 HydrophobicContact CD1-CB 3.76Å; Y238-K310 HydrophobicContact CD1-CG 3.86Å; Y238-K310 HydrophobicContact CE1-CB 3.72Å; Y238-K310 HydrophobicContact CE1-CD 3.9Å; Y238-K310 HydrophobicContact CE1-CG 3.58Å
239	L	96.4	Very high	94.3	Very high	2 Å²	2	38.1 Å²	38.1	1%	0.01	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	129.4	165.9	176.8	70.8	0	0	0	107.9	V216 I218 Q241 L277 F279 S308 Q309 I311	V216-L239 HydrophobicContact CG1-CD1 4.05Å; I218-L239 HydrophobicContact CD1-CD1 4.23Å; I218-L239 HydrophobicContact CG1-CD1 3.95Å; L239-Q241 HydrophobicContact CG-CG 4.46Å; L239-L277 HydrophobicContact CD1-CD1 4.15Å; L239-L277 HydrophobicContact CD1-CD2 4.5Å; L239-L277 HydrophobicContact CD2-CD1 4.17Å; L239-L277 HydrophobicContact CD2-CD2 3.82Å; L239-F279 HydrophobicContact CD1-CZ 4.44Å; L239-F279 HydrophobicContact CD2-CE2 4.49Å; L239-F279 HydrophobicContact CD2-CZ 4.06Å; L239-S308 WeakPolarHBondContact O-CA 3.34Å; L239-Q309 HydrophobicContact CB-CG 4.19Å; L239-Q309 HydrophobicContact CD2-CG 4.45Å; L239-Q309 PolarHBondContact N-O 2.9Å; L239-Q309 PolarHBondContact O-N 3.49Å; L239-I311 HydrophobicContact CB-CD1 3.61Å; L239-I311 HydrophobicContact CB-CG1 4.27Å; L239-I311 HydrophobicContact CD2-CD1 3.73Å; L239-I311 HydrophobicContact CG-CD1 4.32Å
240	R	96.8	Very high	94.2	Very high	85 Å²	85	34.7 Å²	34.7	32%	0.321	16%	0.158	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	138.4	178.4	-59.1	-176.7	175.7	157.3	0	110.5	V216 F217 Y307	V216-R240 WeakPolarHBondContact CA-O 3.21Å; F217-R240 HydrophobicContact CD1-CB 3.69Å; F217-R240 HydrophobicContact CD2-CB 3.74Å; F217-R240 HydrophobicContact CD2-CG 4.27Å; F217-R240 HydrophobicContact CE1-CB 3.51Å; F217-R240 HydrophobicContact CE2-CB 3.61Å; F217-R240 HydrophobicContact CE2-CG 4.04Å; F217-R240 HydrophobicContact CG-CB 3.79Å; F217-R240 HydrophobicContact CZ-CB 3.48Å; F217-R240 VanDerWaalsContact CZ-CB 3.48Å; F217-R240 HydrophobicContact CZ-CG 4.26Å; F217-R240 PolarHBondContact N-O 2.87Å; F217-R240 PolarHBondContact O-N 2.62Å; R240-Y307 CarbonylContact C-O 3.59Å; R240-Y307 WeakPolarHBondContact CA-O 3.33Å
241	Q	97.1	Very high	94	Very high	6 Å²	6	33.4 Å²	33.4	3%	0.028	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	133.2	-176.9	-58.7	-175.3	74.7	0	0	107.6	V214 S215 L239 W243 P275 L277 Y307	V214-Q241 HydrophobicContact CG1-CB 4.06Å; S215-Q241 CarbonylContact O-C 3.57Å; S215-Q241 WeakPolarHBondContact O-CA 3.37Å; L239-Q241 HydrophobicContact CG-CG 4.46Å; Q241-W243 HydrophobicContact CB-CE3 4.49Å; Q241-W243 HydrophobicContact CB-CZ3 4.26Å; Q241-P275 VanDerWaalsContact OE1-CG 3.3Å; Q241-L277 HydrophobicContact CG-CD1 3.9Å; Q241-L277 VanDerWaalsContact OE1-CD1 3.32Å; Q241-Y307 PolarHBondContact N-O 2.8Å; Q241-Y307 PolarHBondContact O-N 2.87Å
242	Q	97	Very high	93.5	Very high	47 Å²	47	36.3 Å²	36.3	22%	0.22	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135	127.2	-178.4	-175	-170.5	-79.5	0	0	109.9	S215 F217 Q304 V305 L306	S215-Q242 PolarHBondContact N-O 3.41Å; S215-Q242 PolarHBondContact O-N 2.78Å; F217-Q242 HydrophobicContact CE1-CB 4.19Å; Q242-Q304 HydrophobicContact CG-CG 4.22Å; Q242-V305 VanDerWaalsContact CA-O 3.26Å; Q242-V305 WeakPolarHBondContact CA-O 3.4Å; Q242-V305 WeakPolarHBondContact CG-O 3.27Å; Q242-L306 HydrophobicContact CB-CD1 4.48Å
243	W	96.4	Very high	92.9	Very high	9 Å²	9	36.9 Å²	36.9	3%	0.034	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	178.3	178.5	69.1	97.3	0	0	0	110.8	V214 Q241 W273 L274 P275 V305	V214-W243 HydrophobicContact CG2-CB 4.06Å; Q241-W243 HydrophobicContact CB-CE3 4.49Å; Q241-W243 HydrophobicContact CB-CZ3 4.26Å; W243-W273 HydrophobicContact CD2-CZ3 4.44Å; W243-W273 HydrophobicContact CG-CZ3 4.43Å; W243-W273 HydrophobicContact CZ2-CE3 4.44Å; W243-W273 WeakPolarHBondContact CZ2-O 3.11Å; W243-W273 AromaticContact NE1-CE3 3.88Å; W243-W273 AromaticContact NE1-CZ3 3.87Å; W243-L274 HydrophobicContact CH2-CD2 3.81Å; W243-L274 HydrophobicContact CZ2-CD2 4.25Å; W243-P275 HydrophobicContact CE3-CG 4.26Å; W243-P275 HydrophobicContact CZ3-CG 4.16Å; W243-V305 HydrophobicContact CD2-CB 4Å; W243-V305 HydrophobicContact CD2-CG1 4.38Å; W243-V305 HydrophobicContact CE3-CB 4.42Å; W243-V305 HydrophobicContact CG-CB 4.49Å; W243-V305 HydrophobicContact CH2-CB 4.31Å; W243-V305 HydrophobicContact CH2-CG1 3.63Å; W243-V305 HydrophobicContact CZ2-CB 3.87Å; W243-V305 HydrophobicContact CZ2-CG1 3.47Å; W243-V305 VanDerWaalsContact CZ2-CG1 3.47Å; W243-V305 HydrophobicContact CZ2-CG2 4.33Å; W243-V305 HydrophobicContact CZ3-CG1 4.16Å; W243-V305 PolarHBondContact N-O 3.37Å; W243-V305 VanDerWaalsContact N-O 3.09Å; W243-V305 PolarHBondContact O-N 3.32Å
244	Y	95.6	Very high	92.1	Very high	119 Å²	119	41.3 Å²	41.3	47%	0.467	21%	0.206	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	128.5	176.3	-170.7	-113.5	0	0	0	109.2	P246 N302	Y244-P246 HydrophobicContact CD1-CG 4.06Å; Y244-P246 HydrophobicContact CE1-CB 4.32Å; Y244-P246 HydrophobicContact CE1-CG 3.73Å; Y244-N302 WeakPolarHBondContact CE2-O 3.37Å; Y244-N302 PolarHBondContact OH-O 2.93Å
245	D	94.9	Very high	91.3	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	24%	0.237	C	C	.	.			trans	-126.9	102.4	170.6	-167.5	-19	0	0	0	109.6	Y198 P204 R247 L248 G303 V305	Y198-D245 WeakPolarHBondContact CE2-OD2 3.26Å; Y198-D245 PolarHBondContact OH-OD2 2.95Å; P204-D245 HydrophobicContact CB-CB 4.1Å; P204-D245 HydrophobicContact CG-CB 3.98Å; D245-R247 PolarHBondContact O-N 2.89Å; D245-R247 VanDerWaalsContact O-N 3.14Å; D245-R247 VanDerWaalsContact OD1-CB 3.27Å; D245-R247 WeakPolarHBondContact OD1-CB 3.34Å; D245-R247 WeakPolarHBondContact OD1-CG 3.22Å; D245-R247 IonicContact OD1-CZ 3.67Å; D245-R247 PolarHBondContact OD1-N 2.94Å; D245-R247 VanDerWaalsContact OD1-N 3.12Å; D245-R247 IonicContact OD1-NE 3.74Å; D245-R247 PolarHBondContact OD1-NE 2.82Å; D245-R247 IonicContact OD1-NH2 2.65Å; D245-R247 IonicContact OD2-CZ 3.81Å; D245-R247 IonicContact OD2-NE 2.75Å; D245-R247 PolarHBondContact OD2-NE 2.91Å; D245-R247 IonicContact OD2-NH2 3.48Å; D245-R247 PolarHBondContact OD2-NH2 2.86Å; D245-L248 HydrophobicContact CB-CB 4.42Å; D245-L248 HydrophobicContact CB-CD1 4.03Å; D245-L248 HydrophobicContact CB-CG 4.17Å; D245-L248 PolarHBondContact O-N 2.83Å; D245-G303 PolarHBondContact N-O 3.35Å; D245-G303 WeakPolarHBondContact O-CA 3.39Å; D245-V305 HydrophobicContact CB-CG2 4.25Å
246	P	92	Very high	90.5	Very high	53 Å²	53	48.3 Å²	48.3	34%	0.344	24%	0.242	S	C	.	.	G	3₁₀ helix	trans	-56.6	-30.2	-179.6	-20	27.8	0	0	0	112.9	Y244 L248 S249	Y244-P246 HydrophobicContact CD1-CG 4.06Å; Y244-P246 HydrophobicContact CE1-CB 4.32Å; Y244-P246 HydrophobicContact CE1-CG 3.73Å; P246-L248 PolarHBondContact O-N 2.86Å; P246-S249 WeakPolarHBondContact O-CB 3.41Å; P246-S249 PolarHBondContact O-N 2.84Å; P246-S249 VanDerWaalsContact O-N 3.12Å; P246-S249 PolarHBondContact O-OG 2.83Å
247	R	92	Very high	89.7	Confident	71 Å²	71	48 Å²	48	27%	0.268	24%	0.241	S	C	.	.	G	3₁₀ helix	trans	-69.6	-17	-177.8	-51.9	170.4	-64.4	-178.5	4.4	112.6	Y198 E202 D245	Y198-R247 HydrophobicContact CD2-CB 3.96Å; Y198-R247 HydrophobicContact CE2-CB 3.93Å; Y198-R247 PolarHBondContact OH-NH2 3.03Å; Y198-R247 VanDerWaalsContact OH-NH2 3.16Å; E202-R247 PolarHBondContact O-NH1 2.69Å; E202-R247 PolarHBondContact O-NH2 3.02Å; E202-R247 VanDerWaalsContact O-NH2 3.09Å; D245-R247 PolarHBondContact O-N 2.89Å; D245-R247 VanDerWaalsContact O-N 3.14Å; D245-R247 VanDerWaalsContact OD1-CB 3.27Å; D245-R247 WeakPolarHBondContact OD1-CB 3.34Å; D245-R247 WeakPolarHBondContact OD1-CG 3.22Å; D245-R247 IonicContact OD1-CZ 3.67Å; D245-R247 PolarHBondContact OD1-N 2.94Å; D245-R247 VanDerWaalsContact OD1-N 3.12Å; D245-R247 IonicContact OD1-NE 3.74Å; D245-R247 PolarHBondContact OD1-NE 2.82Å; D245-R247 IonicContact OD1-NH2 2.65Å; D245-R247 IonicContact OD2-CZ 3.81Å; D245-R247 IonicContact OD2-NE 2.75Å; D245-R247 PolarHBondContact OD2-NE 2.91Å; D245-R247 IonicContact OD2-NH2 3.48Å; D245-R247 PolarHBondContact OD2-NH2 2.86Å
248	L	92.7	Very high	88.8	Confident	2 Å²	2	53.6 Å²	53.6	1%	0.01	27%	0.272	C	S	.	.	G	3₁₀ helix	trans	-101.8	11	176.4	-59.4	177.4	0	0	0	112.5	I194 Y198 D245 P246 W250 L272 V299 V305	I194-L248 HydrophobicContact CB-CD2 4.39Å; I194-L248 HydrophobicContact CD1-CD2 4.46Å; Y198-L248 HydrophobicContact CD2-CD2 3.61Å; Y198-L248 HydrophobicContact CD2-CG 4.26Å; Y198-L248 HydrophobicContact CE2-CD1 4.21Å; Y198-L248 HydrophobicContact CE2-CD2 3.46Å; Y198-L248 VanDerWaalsContact CE2-CD2 3.46Å; Y198-L248 HydrophobicContact CE2-CG 3.67Å; Y198-L248 HydrophobicContact CG-CD2 4.41Å; D245-L248 HydrophobicContact CB-CB 4.42Å; D245-L248 HydrophobicContact CB-CD1 4.03Å; D245-L248 HydrophobicContact CB-CG 4.17Å; D245-L248 PolarHBondContact O-N 2.83Å; P246-L248 PolarHBondContact O-N 2.86Å; L248-W250 VanDerWaalsContact O-CE3 3.28Å; L248-W250 WeakPolarHBondContact O-CZ3 3.34Å; L248-L272 HydrophobicContact CD1-CD2 3.98Å; L248-L272 HydrophobicContact CD2-CD2 3.74Å; L248-V299 HydrophobicContact CB-CG1 3.95Å; L248-V299 HydrophobicContact CD1-CG2 4.42Å; L248-V305 HydrophobicContact CD1-CG2 3.83Å
249	S	92.2	Very high	88	Confident	25 Å²	25	54.7 Å²	54.7	18%	0.175	28%	0.283	C	S	.	.			trans	-84.4	141.5	173.3	70.7	0	0	0	0	111.5	P246 S301 N302	P246-S249 WeakPolarHBondContact O-CB 3.41Å; P246-S249 PolarHBondContact O-N 2.84Å; P246-S249 VanDerWaalsContact O-N 3.12Å; P246-S249 PolarHBondContact O-OG 2.83Å; S249-S301 CarbonylContact C-O 3.59Å; S249-S301 VanDerWaalsContact CA-O 3.29Å; S249-S301 WeakPolarHBondContact CA-O 3.29Å; S249-S301 WeakPolarHBondContact CB-O 3.49Å; S249-N302 WeakPolarHBondContact CB-O 3.46Å
250	W	90.9	Very high	87.5	Confident	0 Å²	0	56 Å²	56	0%	0	29%	0.289	C	S	.	.			trans	-128.5	8	171.8	64.9	92	0	0	0	112.6	I190 Y193 I194 L248 T252 N253 I260 L263 V299 S301	I190-W250 HydrophobicContact CG2-CD2 3.76Å; I190-W250 HydrophobicContact CG2-CE3 3.98Å; I190-W250 HydrophobicContact CG2-CG 4.08Å; I190-W250 HydrophobicContact CG2-CZ3 4.44Å; Y193-W250 HydrophobicContact CD1-CB 4.06Å; Y193-W250 HydrophobicContact CE1-CB 4.06Å; I194-W250 HydrophobicContact CG2-CB 4.48Å; I194-W250 HydrophobicContact CG2-CE3 4.12Å; L248-W250 VanDerWaalsContact O-CE3 3.28Å; L248-W250 WeakPolarHBondContact O-CZ3 3.34Å; W250-T252 PolarHBondContact O-N 2.65Å; W250-N253 PolarHBondContact O-N 2.91Å; W250-I260 HydrophobicContact CZ2-CG2 4.49Å; W250-I260 WeakPolarHBondContact CZ2-O 3.27Å; W250-I260 PolarHBondContact NE1-O 2.95Å; W250-L263 HydrophobicContact CH2-CB 3.78Å; W250-L263 HydrophobicContact CZ2-CB 4.3Å; W250-V299 HydrophobicContact CH2-CG1 4.34Å; W250-V299 HydrophobicContact CZ3-CB 4.33Å; W250-V299 HydrophobicContact CZ3-CG1 3.8Å; W250-S301 VanDerWaalsContact CE2-CA 3.48Å; W250-S301 PolarHBondContact N-O 3.19Å
251	D	87.8	Confident	87	Confident	86 Å²	86	58.8 Å²	58.8	46%	0.46	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57	-29.6	178.3	-130.9	32.1	0	0	0	112.9	N253 S257 S301	D251-N253 PolarHBondContact O-N 3.47Å; D251-S257 PolarHBondContact O-OG 3.44Å; D251-S301 PolarHBondContact N-O 2.84Å; D251-S301 VanDerWaalsContact N-O 3.13Å; D251-S301 WeakPolarHBondContact OD1-CB 3.07Å; D251-S301 PolarHBondContact OD1-OG 3.43Å
252	T	82.6	Confident	86.7	Confident	107 Å²	107	62.6 Å²	62.6	66%	0.656	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.1	-23.7	175.6	53.4	0	0	0	0	113.6	Y193 W250	Y193-T252 PolarHBondContact OH-OG1 3.5Å; W250-T252 PolarHBondContact O-N 2.65Å
253	N	82.2	Confident	86.5	Confident	46 Å²	46	61.2 Å²	61.2	25%	0.246	32%	0.316	C	S	.	.			trans	-98.7	93	176.5	-170.7	-18.1	0	0	0	109.5	W250 D251 L255 L256 S257	W250-N253 PolarHBondContact O-N 2.91Å; D251-N253 PolarHBondContact O-N 3.47Å; N253-L255 PolarHBondContact O-N 3.43Å; N253-L255 VanDerWaalsContact O-N 3.1Å; N253-L255 WeakPolarHBondContact OD1-CB 3.49Å; N253-L255 PolarHBondContact OD1-N 2.74Å; N253-L256 HydrophobicContact CB-CB 4.36Å; N253-L256 HydrophobicContact CB-CD1 4.25Å; N253-L256 HydrophobicContact CB-CG 4.34Å; N253-L256 WeakPolarHBondContact ND2-CD1 3.42Å; N253-L256 PolarHBondContact O-N 2.81Å; N253-S257 PolarHBondContact O-N 3.28Å; N253-S257 PolarHBondContact O-OG 2.99Å
254	T	77.2	Confident	86.3	Confident	93 Å²	93	65.1 Å²	65.1	57%	0.571	34%	0.337	S	S	*	.	H	α-helix	trans	-57.4	-24.7	-177.4	54.1	0	0	0	0	114	N258	T254-N258 VanDerWaalsContact O-CG 3.25Å; T254-N258 PolarHBondContact O-ND2 2.98Å
255	L	76	Confident	86.1	Confident	142 Å²	142	59.6 Å²	59.6	74%	0.743	32%	0.315	S	S	*	.	H	α-helix	trans	-70.7	-32.4	175	-59.3	177.4	0	0	0	112.1	N253	N253-L255 PolarHBondContact O-N 3.43Å; N253-L255 VanDerWaalsContact O-N 3.1Å; N253-L255 WeakPolarHBondContact OD1-CB 3.49Å; N253-L255 PolarHBondContact OD1-N 2.74Å
256	L	77.7	Confident	85.8	Confident	19 Å²	19	61.7 Å²	61.7	10%	0.099	33%	0.327	C	S	.	.	H	α-helix	trans	-94.5	-35.6	-177.5	-60.9	-179.3	0	0	0	112.9	Q189 I190 Y193 N253	Q189-L256 HydrophobicContact CB-CD2 4.31Å; I190-L256 HydrophobicContact CD1-CB 4.42Å; I190-L256 HydrophobicContact CG1-CB 3.96Å; I190-L256 HydrophobicContact CG1-CD1 4.04Å; I190-L256 HydrophobicContact CG1-CD2 4.11Å; I190-L256 HydrophobicContact CG1-CG 4.26Å; Y193-L256 HydrophobicContact CG-CD1 4.32Å; N253-L256 HydrophobicContact CB-CB 4.36Å; N253-L256 HydrophobicContact CB-CD1 4.25Å; N253-L256 HydrophobicContact CB-CG 4.34Å; N253-L256 WeakPolarHBondContact ND2-CD1 3.42Å; N253-L256 PolarHBondContact O-N 2.81Å
257	S	75.9	Confident	85.5	Confident	13 Å²	13	67.5 Å²	67.5	9%	0.091	35%	0.349	C	S	.	.	H	α-helix	trans	-75.5	-24.6	-173.9	62.4	0	0	0	0	114.3	D251 N253 N259	D251-S257 PolarHBondContact O-OG 3.44Å; N253-S257 PolarHBondContact O-N 3.28Å; N253-S257 PolarHBondContact O-OG 2.99Å; S257-N259 PolarHBondContact O-N 2.63Å
258	N	75.3	Confident	85.4	Confident	119 Å²	119	65.7 Å²	65.7	64%	0.636	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.5	-40.4	-180	-81.2	-22.7	0	0	0	113.2	T254	T254-N258 VanDerWaalsContact O-CG 3.25Å; T254-N258 PolarHBondContact O-ND2 2.98Å
259	N	79.4	Confident	85.3	Confident	104 Å²	104	67.2 Å²	67.2	56%	0.556	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.4	-41.3	-173.3	-67.9	-4.1	0	0	0	112.7	E186 S257	E186-N259 PolarHBondContact OE1-ND2 3.46Å; E186-N259 WeakPolarHBondContact OE2-CB 3.19Å; E186-N259 PolarHBondContact OE2-ND2 2.82Å; S257-N259 PolarHBondContact O-N 2.63Å
260	I	85.2	Confident	85.1	Confident	29 Å²	29	73 Å²	73	15%	0.149	38%	0.379	C	S	.	.			trans	-121.3	104.5	-172	-57.9	-179.2	0	0	0	110.7	E186 T187 I190 W250	E186-I260 HydrophobicContact CB-CD1 3.78Å; T187-I260 HydrophobicContact CG2-CD1 3.74Å; I190-I260 HydrophobicContact CD1-CB 3.76Å; I190-I260 HydrophobicContact CD1-CD1 3.95Å; I190-I260 HydrophobicContact CD1-CG1 4.3Å; I190-I260 HydrophobicContact CD1-CG2 4.08Å; W250-I260 HydrophobicContact CZ2-CG2 4.49Å; W250-I260 WeakPolarHBondContact CZ2-O 3.27Å; W250-I260 PolarHBondContact NE1-O 2.95Å
261	K	87.8	Confident	85.1	Confident	145 Å²	145	78 Å²	78	63%	0.63	40%	0.402	S	S	*	.	S	Bend	trans	-90.1	-24.2	179.1	-62.8	-174.4	179.9	-177	0	114.3	K300 S301	K261-K300 CarbonylContact O-C 3.47Å; K261-K300 VanDerWaalsContact O-CA 3.32Å; K261-K300 WeakPolarHBondContact O-CA 3.37Å; K261-S301 PolarHBondContact O-N 3.37Å
262	E	90.9	Very high	85.4	Confident	85 Å²	85	74.3 Å²	74.3	40%	0.397	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138	133.6	178.4	-53.4	-161.4	141.1	0	0	110.3	R298 V299 K300	E262-R298 HydrophobicContact CB-CG 4.36Å; E262-R298 VanDerWaalsContact OE2-CD 3.29Å; E262-R298 WeakPolarHBondContact OE2-CD 3.41Å; E262-R298 IonicContact OE2-CZ 3.45Å; E262-R298 IonicContact OE2-NE 2.83Å; E262-R298 IonicContact OE2-NH1 2.87Å; E262-R298 PolarHBondContact OE2-NH1 2.86Å; E262-V299 CarbonylContact C-O 3.58Å; E262-V299 WeakPolarHBondContact CA-O 3.24Å; E262-K300 HydrophobicContact CG-CG 4.12Å; E262-K300 WeakPolarHBondContact OE1-CE 3.31Å
263	L	91.9	Very high	86	Confident	18 Å²	18	69.5 Å²	69.5	9%	0.094	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	143.6	179.6	-172.2	61.5	0	0	0	110.4	T187 I190 I194 W250 L265 R298 V299	T187-L263 HydrophobicContact CG2-CD1 3.82Å; I190-L263 HydrophobicContact CG2-CD2 3.89Å; I194-L263 HydrophobicContact CD1-CD2 4.3Å; W250-L263 HydrophobicContact CH2-CB 3.78Å; W250-L263 HydrophobicContact CZ2-CB 4.3Å; L263-L265 HydrophobicContact CD2-CD2 3.64Å; L263-L265 HydrophobicContact CD2-CG 4.19Å; L263-L265 HydrophobicContact CG-CD2 3.83Å; L263-L265 HydrophobicContact CG-CG 4.16Å; L263-R298 WeakPolarHBondContact O-CA 3.08Å; L263-V299 PolarHBondContact N-O 3.32Å; L263-V299 PolarHBondContact O-N 2.87Å
264	L	92.8	Very high	86.6	Confident	92 Å²	92	69.7 Å²	69.7	48%	0.482	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	108.5	179.3	-174.1	72.2	0	0	0	110.6	L296	L264-L296 HydrophobicContact CD1-CD1 3.47Å; L264-L296 VanDerWaalsContact CD1-CD1 3.47Å; L264-L296 HydrophobicContact CD1-CG 4.02Å
265	L	90.7	Very high	87.5	Confident	3 Å²	3	65.8 Å²	65.8	2%	0.016	33%	0.33	C	S	.	.			trans	-106.8	40.8	-172	-64	-178.4	0	0	0	112.6	L191 I194 L263 Q267 Q268 K269 L272 L297 V299	L191-L265 HydrophobicContact CD1-CD2 3.47Å; L191-L265 VanDerWaalsContact CD1-CD2 3.47Å; I194-L265 HydrophobicContact CD1-CD1 4.01Å; L263-L265 HydrophobicContact CD2-CD2 3.64Å; L263-L265 HydrophobicContact CD2-CG 4.19Å; L263-L265 HydrophobicContact CG-CD2 3.83Å; L263-L265 HydrophobicContact CG-CG 4.16Å; L265-Q267 VanDerWaalsContact C-N 3.29Å; L265-Q267 PolarHBondContact O-N 2.82Å; L265-Q268 PolarHBondContact O-N 2.93Å; L265-K269 PolarHBondContact O-N 2.95Å; L265-L272 HydrophobicContact CB-CD1 4Å; L265-L272 HydrophobicContact CD1-CD1 3.94Å; L265-L297 HydrophobicContact CB-CD2 3.91Å; L265-L297 PolarHBondContact N-O 2.78Å; L265-V299 HydrophobicContact CD1-CB 4.46Å; L265-V299 HydrophobicContact CD1-CG2 3.72Å; L265-V299 HydrophobicContact CG-CG2 4.4Å
266	N	88.2	Confident	88.3	Confident	44 Å²	44	61 Å²	61	24%	0.235	31%	0.305	C	S	.	.	S	Bend	trans	-62.9	-32.8	-177.3	-77.8	-0.5	0	0	0	113.5	Y295 L296 L297	N266-Y295 HydrophobicContact CB-CE2 4.25Å; N266-Y295 PolarHBondContact ND2-O 2.93Å; N266-Y295 VanDerWaalsContact O-CE2 3.27Å; N266-Y295 WeakPolarHBondContact O-CE2 3.26Å; N266-Y295 PolarHBondContact O-OH 2.87Å; N266-L296 WeakPolarHBondContact OD1-CA 3.41Å; N266-L297 PolarHBondContact OD1-N 2.85Å
267	Q	87.1	Confident	89.1	Confident	175 Å²	175	61.3 Å²	61.3	82%	0.818	31%	0.306	S	S	*	.	S	Bend	trans	-79.4	-34.9	-179.5	-67.1	175.9	-16.7	0	0	111.4	L265 K269	L265-Q267 VanDerWaalsContact C-N 3.29Å; L265-Q267 PolarHBondContact O-N 2.82Å; Q267-K269 VanDerWaalsContact C-N 3.27Å; Q267-K269 PolarHBondContact O-N 2.89Å
268	Q	89.3	Confident	89.9	Confident	33 Å²	33	63.7 Å²	63.7	15%	0.154	32%	0.315	C	S	.	.	G	3₁₀ helix	trans	-86.9	9.5	-176.7	-60.4	81.1	2.2	0	0	113.1	L191 L195 L265 N270 Q271	L191-Q268 HydrophobicContact CD1-CG 4.12Å; L191-Q268 HydrophobicContact CD2-CG 4.3Å; L195-Q268 HydrophobicContact CD1-CB 4.35Å; L195-Q268 HydrophobicContact CD1-CG 4.2Å; L265-Q268 PolarHBondContact O-N 2.93Å; Q268-N270 PolarHBondContact O-N 2.92Å; Q268-Q271 WeakPolarHBondContact O-CA 3.36Å; Q268-Q271 WeakPolarHBondContact O-CB 3.4Å; Q268-Q271 PolarHBondContact O-N 2.84Å
269	K	89.6	Confident	90.8	Very high	33 Å²	33	60.1 Å²	60.1	14%	0.143	29%	0.294	C	S	.	.	G	3₁₀ helix	trans	-45.9	-41.3	178.6	179.7	-174.1	166.2	-179	0	113.3	L265 Q267 Q271 L272 L274 Y295 Y307	L265-K269 PolarHBondContact O-N 2.95Å; Q267-K269 VanDerWaalsContact C-N 3.27Å; Q267-K269 PolarHBondContact O-N 2.89Å; K269-Q271 PolarHBondContact O-N 2.93Å; K269-L272 PolarHBondContact O-N 2.85Å; K269-L274 HydrophobicContact CD-CD1 4.4Å; K269-L274 HydrophobicContact CG-CD1 3.93Å; K269-Y295 HydrophobicContact CB-CE2 4.13Å; K269-Y295 HydrophobicContact CD-CD1 4.32Å; K269-Y295 HydrophobicContact CD-CD2 4.08Å; K269-Y295 HydrophobicContact CD-CE1 3.9Å; K269-Y295 HydrophobicContact CD-CE2 3.67Å; K269-Y295 HydrophobicContact CD-CG 4.41Å; K269-Y295 HydrophobicContact CG-CE2 4.39Å; K269-Y307 HydrophobicContact CD-CE2 4.42Å; K269-Y307 WeakPolarHBondContact CE-OH 3.26Å; K269-Y307 PolarHBondContact NZ-OH 2.78Å
270	N	89.1	Confident	91.5	Very high	146 Å²	146	60.8 Å²	60.8	78%	0.781	29%	0.289	S	S	*	.	G	3₁₀ helix	trans	-74.4	-10.7	-177.4	-62.5	-13.1	0	0	0	113.9	Q268	Q268-N270 PolarHBondContact O-N 2.92Å
271	Q	91.5	Very high	92	Very high	105 Å²	105	60.7 Å²	60.7	49%	0.491	29%	0.289	S	S	.	.	G	3₁₀ helix	trans	-97.7	-5.4	176.9	-63.2	171.5	-40.8	0	0	112.2	Y198 S200 Q268 K269	Y198-Q271 VanDerWaalsContact CD1-O 3.24Å; Y198-Q271 WeakPolarHBondContact CD1-O 3.46Å; Y198-Q271 WeakPolarHBondContact CE1-O 3.45Å; S200-Q271 WeakPolarHBondContact CB-O 3.46Å; Q268-Q271 WeakPolarHBondContact O-CA 3.36Å; Q268-Q271 WeakPolarHBondContact O-CB 3.4Å; Q268-Q271 PolarHBondContact O-N 2.84Å; K269-Q271 PolarHBondContact O-N 2.93Å
272	L	93.6	Very high	92.3	Very high	10 Å²	10	55.7 Å²	55.7	5%	0.052	28%	0.278	C	S	.	.	S	Bend	trans	-106.6	149	-176.5	-63.3	174.7	0	0	0	111.2	L195 Y198 L248 L265 K269 L297	L195-L272 HydrophobicContact CD2-CD2 3.87Å; Y198-L272 HydrophobicContact CD1-CD2 4.45Å; Y198-L272 HydrophobicContact CE1-CD2 4.11Å; L248-L272 HydrophobicContact CD1-CD2 3.98Å; L248-L272 HydrophobicContact CD2-CD2 3.74Å; L265-L272 HydrophobicContact CB-CD1 4Å; L265-L272 HydrophobicContact CD1-CD1 3.94Å; K269-L272 PolarHBondContact O-N 2.85Å; L272-L297 HydrophobicContact CD1-CD1 3.99Å; L272-L297 HydrophobicContact CD1-CD2 3.47Å; L272-L297 VanDerWaalsContact CD1-CD2 3.47Å; L272-L297 HydrophobicContact CD1-CG 4.4Å
273	W	94.9	Very high	92.4	Very high	5 Å²	5	56.3 Å²	56.3	2%	0.019	28%	0.28	C	S	.	.			trans	-70.9	138.4	170	178.9	93.6	0	0	0	109.6	Y198 S200 R203 P204 T212 W243 P275 Y340 L345	Y198-W273 WeakPolarHBondContact OH-CB 3.24Å; Y198-W273 PolarHBondContact OH-N 3.21Å; S200-W273 WeakPolarHBondContact O-CA 3.38Å; S200-W273 WeakPolarHBondContact O-CB 3.37Å; R203-W273 HydrophobicContact CB-CZ2 3.92Å; P204-W273 HydrophobicContact CG-CD2 4.45Å; P204-W273 HydrophobicContact CG-CE3 3.93Å; P204-W273 HydrophobicContact CG-CZ3 4.06Å; T212-W273 HydrophobicContact CG2-CH2 3.91Å; T212-W273 HydrophobicContact CG2-CZ3 4.14Å; W243-W273 HydrophobicContact CD2-CZ3 4.44Å; W243-W273 HydrophobicContact CG-CZ3 4.43Å; W243-W273 HydrophobicContact CZ2-CE3 4.44Å; W243-W273 WeakPolarHBondContact CZ2-O 3.11Å; W243-W273 AromaticContact NE1-CE3 3.88Å; W243-W273 AromaticContact NE1-CZ3 3.87Å; W273-P275 HydrophobicContact CH2-CB 3.86Å; W273-P275 HydrophobicContact CZ3-CB 4.17Å; W273-P275 HydrophobicContact CZ3-CG 4.4Å; W273-Y340 PolarHBondContact NE1-OH 2.85Å; W273-L345 HydrophobicContact CH2-CD1 3.76Å; W273-L345 HydrophobicContact CZ2-CD1 4.24Å
274	L	94.7	Very high	92.5	Very high	51 Å²	51	58.9 Å²	58.9	27%	0.267	30%	0.299	S	S	.	.			trans	-131.5	137.1	177.1	-63.5	175.9	0	0	0	109.8	W243 K269 L297 Y307	W243-L274 HydrophobicContact CH2-CD2 3.81Å; W243-L274 HydrophobicContact CZ2-CD2 4.25Å; K269-L274 HydrophobicContact CD-CD1 4.4Å; K269-L274 HydrophobicContact CG-CD1 3.93Å; L274-L297 HydrophobicContact CD2-CD1 3.74Å; L274-Y307 HydrophobicContact CD2-CD1 4.48Å; L274-Y307 HydrophobicContact CD2-CG 4.45Å
275	P	95.4	Very high	92.5	Very high	11 Å²	11	57 Å²	57	7%	0.071	30%	0.302	C	S	.	.			trans	-67	146.6	175.7	28.2	-35.7	0	0	0	112.3	V214 Q241 W243 W273 L277 L345 F347	V214-P275 HydrophobicContact CG1-CG 4.22Å; V214-P275 HydrophobicContact CG2-CB 4.05Å; V214-P275 HydrophobicContact CG2-CG 4.31Å; Q241-P275 VanDerWaalsContact OE1-CG 3.3Å; W243-P275 HydrophobicContact CE3-CG 4.26Å; W243-P275 HydrophobicContact CZ3-CG 4.16Å; W273-P275 HydrophobicContact CH2-CB 3.86Å; W273-P275 HydrophobicContact CZ3-CB 4.17Å; W273-P275 HydrophobicContact CZ3-CG 4.4Å; P275-L277 PolarHBondContact O-N 3.26Å; P275-L345 HydrophobicContact CB-CD1 4.37Å; P275-L345 HydrophobicContact CB-CD2 4.29Å; P275-F347 HydrophobicContact CB-CE1 4.13Å; P275-F347 HydrophobicContact CB-CZ 4.28Å
276	D	92.8	Very high	92.5	Very high	42 Å²	42	62.4 Å²	62.4	23%	0.225	33%	0.326	C	S	.	.			trans	-86.2	39.4	-170.8	75.3	-28.9	0	0	0	114.1	F278 S337 Y338 G339 Y340 L345	D276-F278 PolarHBondContact O-N 3.21Å; D276-F278 VanDerWaalsContact O-N 3.09Å; D276-S337 WeakPolarHBondContact OD1-CB 3.36Å; D276-S337 PolarHBondContact OD1-OG 2.72Å; D276-S337 PolarHBondContact OD2-OG 3.36Å; D276-Y338 WeakPolarHBondContact OD2-CA 3.47Å; D276-Y338 PolarHBondContact OD2-N 3.4Å; D276-G339 PolarHBondContact OD2-N 2.78Å; D276-Y340 HydrophobicContact CB-CD2 4.36Å; D276-Y340 HydrophobicContact CB-CE2 4.3Å; D276-L345 WeakPolarHBondContact OD1-CD2 3.38Å
277	L	94.7	Very high	92.6	Very high	24 Å²	24	64 Å²	64	13%	0.126	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-58	116	-177.1	-171.8	161.6	0	0	0	111.1	V216 L239 Q241 P275 F279 I335 F347	V216-L277 HydrophobicContact CG1-CD1 3.99Å; V216-L277 HydrophobicContact CG2-CD1 3.87Å; L239-L277 HydrophobicContact CD1-CD1 4.15Å; L239-L277 HydrophobicContact CD1-CD2 4.5Å; L239-L277 HydrophobicContact CD2-CD1 4.17Å; L239-L277 HydrophobicContact CD2-CD2 3.82Å; Q241-L277 HydrophobicContact CG-CD1 3.9Å; Q241-L277 VanDerWaalsContact OE1-CD1 3.32Å; P275-L277 PolarHBondContact O-N 3.26Å; L277-F279 HydrophobicContact CD2-CE1 4.35Å; L277-F279 HydrophobicContact CD2-CE2 4.16Å; L277-F279 HydrophobicContact CD2-CZ 3.96Å; L277-I335 HydrophobicContact CD1-CG2 3.82Å; L277-I335 HydrophobicContact CD2-CG2 3.62Å; L277-I335 HydrophobicContact CG-CG2 3.52Å; L277-F347 HydrophobicContact CB-CE1 4.02Å; L277-F347 HydrophobicContact CB-CE2 4.45Å; L277-F347 HydrophobicContact CB-CZ 3.7Å; L277-F347 HydrophobicContact CD1-CD1 4.5Å; L277-F347 HydrophobicContact CD1-CE1 4.16Å; L277-F347 HydrophobicContact CG-CE1 4.33Å; L277-F347 HydrophobicContact CG-CZ 4.2Å
278	F	92.9	Very high	92.7	Very high	63 Å²	63	56.8 Å²	56.8	28%	0.276	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	156.8	177.9	89.4	-73.9	0	0	0	112.6	D276 R280 I335 G336 S337 Y338	D276-F278 PolarHBondContact O-N 3.21Å; D276-F278 VanDerWaalsContact O-N 3.09Å; F278-R280 HydrophobicContact CD2-CG 4.39Å; F278-R280 HydrophobicContact CE1-CG 4.02Å; F278-R280 HydrophobicContact CE2-CB 4.29Å; F278-R280 HydrophobicContact CE2-CG 3.53Å; F278-R280 HydrophobicContact CZ-CB 4.5Å; F278-R280 HydrophobicContact CZ-CG 3.32Å; F278-I335 WeakPolarHBondContact O-CA 3.15Å; F278-G336 WeakPolarHBondContact CD1-O 3.5Å; F278-G336 PolarHBondContact N-O 2.61Å; F278-G336 PolarHBondContact O-N 2.68Å; F278-S337 VanDerWaalsContact CE1-C 3.41Å; F278-S337 VanDerWaalsContact CE1-O 3.27Å; F278-S337 WeakPolarHBondContact CE1-O 3.49Å; F278-Y338 HydrophobicContact CD1-CD2 4.33Å; F278-Y338 HydrophobicContact CD2-CD2 4.16Å; F278-Y338 HydrophobicContact CE1-CD2 4.32Å; F278-Y338 HydrophobicContact CE2-CD2 4.09Å; F278-Y338 HydrophobicContact CG-CD2 4.26Å; F278-Y338 HydrophobicContact CZ-CD2 4.16Å
279	F	95.2	Very high	92.7	Very high	45 Å²	45	61.2 Å²	61.2	20%	0.197	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	105.7	179.8	-62.9	-79	0	0	0	110.7	L239 L277 N281 G282 I311 M313 L315 V333 N334 I335	L239-F279 HydrophobicContact CD1-CZ 4.44Å; L239-F279 HydrophobicContact CD2-CE2 4.49Å; L239-F279 HydrophobicContact CD2-CZ 4.06Å; L277-F279 HydrophobicContact CD2-CE1 4.35Å; L277-F279 HydrophobicContact CD2-CE2 4.16Å; L277-F279 HydrophobicContact CD2-CZ 3.96Å; F279-N281 PolarHBondContact O-N 3.34Å; F279-G282 PolarHBondContact O-N 2.81Å; F279-I311 HydrophobicContact CE2-CD1 4.12Å; F279-I311 HydrophobicContact CZ-CD1 4.25Å; F279-M313 HydrophobicContact CD1-SD 3.95Å; F279-M313 HydrophobicContact CD2-CE 4.39Å; F279-M313 HydrophobicContact CD2-SD 4.42Å; F279-M313 HydrophobicContact CE1-CE 3.79Å; F279-M313 HydrophobicContact CE1-SD 3.69Å; F279-M313 HydrophobicContact CE2-CE 3.66Å; F279-M313 HydrophobicContact CE2-SD 4.2Å; F279-M313 HydrophobicContact CG-SD 4.31Å; F279-M313 HydrophobicContact CZ-CE 3.31Å; F279-M313 HydrophobicContact CZ-SD 3.83Å; F279-L315 HydrophobicContact CB-CD2 4.29Å; F279-V333 HydrophobicContact CD1-CG1 3.69Å; F279-V333 HydrophobicContact CE1-CG1 3.73Å; F279-N334 CarbonylContact C-O 3.58Å; F279-N334 VanDerWaalsContact CA-O 3.31Å; F279-N334 WeakPolarHBondContact CA-O 3.49Å; F279-I335 HydrophobicContact CD1-CG1 3.97Å; F279-I335 HydrophobicContact CE1-CD1 4.25Å; F279-I335 HydrophobicContact CE1-CG1 3.84Å
280	R	93	Very high	92.5	Very high	118 Å²	118	67.5 Å²	67.5	45%	0.445	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61	-26.7	-176.4	-71.1	179.9	75.2	-168.9	7.1	113.8	F278 N334 C390	F278-R280 HydrophobicContact CD2-CG 4.39Å; F278-R280 HydrophobicContact CE1-CG 4.02Å; F278-R280 HydrophobicContact CE2-CB 4.29Å; F278-R280 HydrophobicContact CE2-CG 3.53Å; F278-R280 HydrophobicContact CZ-CB 4.5Å; F278-R280 HydrophobicContact CZ-CG 3.32Å; R280-N334 HydrophobicContact CB-CB 4.1Å; R280-N334 WeakPolarHBondContact CD-OD1 3.4Å; R280-N334 PolarHBondContact N-O 2.77Å; R280-C390 PolarHBondContact NH1-SG 2.98Å
281	N	95.3	Very high	92.5	Very high	27 Å²	27	65.3 Å²	65.3	14%	0.144	35%	0.353	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110.9	17.1	175.4	71.6	-43.6	0	0	0	113.7	F279 L315 S316 T332 N334	F279-N281 PolarHBondContact O-N 3.34Å; N281-L315 WeakPolarHBondContact O-CA 3.41Å; N281-S316 PolarHBondContact ND2-O 3.21Å; N281-S316 PolarHBondContact O-N 2.88Å; N281-T332 PolarHBondContact ND2-O 2.8Å; N281-N334 WeakPolarHBondContact OD1-CB 3.22Å; N281-N334 PolarHBondContact OD1-N 3.15Å
282	G	94.4	Very high	92.2	Very high	40 Å²	40	67.1 Å²	67.1	41%	0.412	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	127.2	172.3	0	0	0	0	0	112.3	F279	F279-G282 PolarHBondContact O-N 2.81Å
283	K	93.7	Very high	91.9	Very high	97 Å²	97	69.6 Å²	69.6	42%	0.422	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	-41	169.9	-76	178	163.7	177.8	0	111.5	Q230 E232 T314	Q230-K283 PolarHBondContact O-NZ 3.05Å; E232-K283 HydrophobicContact CB-CD 4.02Å; E232-K283 WeakPolarHBondContact OE2-CD 3.36Å; E232-K283 WeakPolarHBondContact OE2-CE 3.45Å; E232-K283 IonicContact OE2-NZ 3.64Å; E232-K283 PolarHBondContact OE2-NZ 2.89Å; K283-T314 PolarHBondContact N-O 3.04Å
284	S	93.5	Very high	91.7	Very high	72 Å²	72	72.6 Å²	72.6	50%	0.503	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.4	161.5	175.6	57.1	0	0	0	0	109.9	T314	S284-T314 PolarHBondContact N-O 3.37Å; S284-T314 PolarHBondContact O-N 2.76Å; S284-T314 WeakPolarHBondContact OG-CB 3.47Å
285	G	91.9	Very high	91.6	Very high	53 Å²	53	72.5 Å²	72.5	55%	0.546	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-172.5	160.7	172.2	0	0	0	0	0	111.4	T312	G285-T312 CarbonylContact C-O 3.46Å; G285-T312 WeakPolarHBondContact CA-O 3.48Å
286	F	92.5	Very high	91.5	Very high	116 Å²	116	74.7 Å²	74.7	51%	0.509	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	150.8	176.4	63.3	-90	0	0	0	111.2	H288 I311 T312	F286-H288 AromaticContact CE2-CE1 3.85Å; F286-H288 AromaticContact CE2-ND1 3.76Å; F286-I311 WeakPolarHBondContact O-CG2 3.34Å; F286-T312 HydrophobicContact CD1-CG2 4.19Å; F286-T312 VanDerWaalsContact CE1-CB 3.44Å; F286-T312 HydrophobicContact CE1-CG2 3.44Å; F286-T312 VanDerWaalsContact CE1-CG2 3.44Å; F286-T312 HydrophobicContact CZ-CG2 3.7Å; F286-T312 WeakPolarHBondContact CZ-OG1 3.48Å; F286-T312 PolarHBondContact N-O 3.45Å; F286-T312 PolarHBondContact O-N 3.06Å
287	L	90.4	Very high	91.6	Very high	79 Å²	79	72.7 Å²	72.7	41%	0.414	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	140.2	167.5	-66.3	171	0	0	0	108.4	Q309 I311	L287-Q309 HydrophobicContact CD2-CB 4.11Å; L287-Q309 HydrophobicContact CD2-CG 4.2Å; L287-I311 HydrophobicContact CD2-CG1 4Å
288	H	88.3	Confident	91.6	Very high	22 Å²	22	76 Å²	76	10%	0.102	40%	0.402	C	S	.	.			trans	-79.2	133.8	178.3	-60.5	-95	0	0	0	111.5	F286 N294 K310 T312	F286-H288 AromaticContact CE2-CE1 3.85Å; F286-H288 AromaticContact CE2-ND1 3.76Å; H288-N294 HydrophobicContact CB-CB 4.2Å; H288-N294 WeakPolarHBondContact CB-ND2 3.17Å; H288-N294 WeakPolarHBondContact O-CB 3.11Å; H288-N294 PolarHBondContact O-N 3.03Å; H288-N294 PolarHBondContact O-ND2 2.84Å; H288-K310 VanDerWaalsContact CD2-CD 3.43Å; H288-K310 WeakPolarHBondContact CD2-CD 3.01Å; H288-K310 VanDerWaalsContact CD2-CG 3.44Å; H288-K310 WeakPolarHBondContact CD2-CG 3.46Å; H288-K310 WeakPolarHBondContact NE2-CE 3.39Å; H288-T312 PolarHBondContact CE1-OG1 3.22Å; H288-T312 PolarHBondContact NE2-OG1 3.1Å; H288-T312 VanDerWaalsContact NE2-OG1 3.15Å
289	D	88.2	Confident	91.7	Very high	127 Å²	127	73 Å²	73	68%	0.679	39%	0.389	S	S	*	.			trans	-132.6	27.3	-171.7	59.9	-16.2	0	0	0	113.3	S291	D289-S291 PolarHBondContact O-N 2.91Å
290	M	85.9	Confident	91.7	Very high	165 Å²	165	74.3 Å²	74.3	81%	0.813	39%	0.394	S	S	*	.	S	Bend	trans	-60	-31.3	-167.9	-66.8	-178.7	73.1	0	0	116.7
291	S	88.7	Confident	91.7	Very high	99 Å²	99	69.4 Å²	69.4	69%	0.692	38%	0.378	S	S	*	.	S	Bend	trans	-144.6	-42.1	-177.7	57.8	0	0	0	0	111.3	D289	D289-S291 PolarHBondContact O-N 2.91Å
292	Q	86.7	Confident	91.6	Very high	143 Å²	143	71.1 Å²	71.1	67%	0.668	39%	0.387	S	S	*	.	S	Bend	trans	-136	158	162.1	-70.9	-62.2	-66	0	0	107.3	N294	Q292-N294 PolarHBondContact O-N 2.97Å; Q292-N294 PolarHBondContact O-ND2 2.97Å
293	P	87.5	Confident	91.5	Very high	62 Å²	62	69.2 Å²	69.2	40%	0.403	37%	0.367	S	S	.	.			trans	-63.1	127	174.1	28.2	-35.5	0	0	0	110.1	Y295	P293-Y295 HydrophobicContact CB-CD1 3.86Å; P293-Y295 HydrophobicContact CB-CE1 3.56Å; P293-Y295 HydrophobicContact CG-CD1 4.32Å; P293-Y295 HydrophobicContact CG-CE1 3.65Å; P293-Y295 PolarHBondContact O-N 2.92Å
294	N	89.5	Confident	91.6	Very high	68 Å²	68	66.7 Å²	66.7	36%	0.364	36%	0.357	S	S	.	.	S	Bend	trans	-82	64.5	-171.5	-71.3	-80	0	0	0	112.3	H288 Q292 K310	H288-N294 HydrophobicContact CB-CB 4.2Å; H288-N294 WeakPolarHBondContact CB-ND2 3.17Å; H288-N294 WeakPolarHBondContact O-CB 3.11Å; H288-N294 PolarHBondContact O-N 3.03Å; H288-N294 PolarHBondContact O-ND2 2.84Å; Q292-N294 PolarHBondContact O-N 2.97Å; Q292-N294 PolarHBondContact O-ND2 2.97Å; N294-K310 HydrophobicContact CB-CB 3.93Å; N294-K310 PolarHBondContact O-N 3.18Å
295	Y	92.1	Very high	91.7	Very high	50 Å²	50	63.3 Å²	63.3	20%	0.196	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	157	166.3	65.1	-104.2	0	0	0	111.6	N266 K269 P293 Y307 S308	N266-Y295 HydrophobicContact CB-CE2 4.25Å; N266-Y295 PolarHBondContact ND2-O 2.93Å; N266-Y295 VanDerWaalsContact O-CE2 3.27Å; N266-Y295 WeakPolarHBondContact O-CE2 3.26Å; N266-Y295 PolarHBondContact O-OH 2.87Å; K269-Y295 HydrophobicContact CB-CE2 4.13Å; K269-Y295 HydrophobicContact CD-CD1 4.32Å; K269-Y295 HydrophobicContact CD-CD2 4.08Å; K269-Y295 HydrophobicContact CD-CE1 3.9Å; K269-Y295 HydrophobicContact CD-CE2 3.67Å; K269-Y295 HydrophobicContact CD-CG 4.41Å; K269-Y295 HydrophobicContact CG-CE2 4.39Å; P293-Y295 HydrophobicContact CB-CD1 3.86Å; P293-Y295 HydrophobicContact CB-CE1 3.56Å; P293-Y295 HydrophobicContact CG-CD1 4.32Å; P293-Y295 HydrophobicContact CG-CE1 3.65Å; P293-Y295 PolarHBondContact O-N 2.92Å; Y295-Y307 HydrophobicContact CD2-CE2 4.25Å; Y295-Y307 HydrophobicContact CG-CE2 4.31Å; Y295-S308 CarbonylContact C-O 3.55Å; Y295-S308 VanDerWaalsContact CA-O 3.26Å; Y295-S308 WeakPolarHBondContact CA-O 3.14Å
296	L	93.2	Very high	91.9	Very high	56 Å²	56	62.8 Å²	62.8	29%	0.293	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	120.8	179.6	-176.5	90.1	0	0	0	107	L264 N266 Y307 S308	L264-L296 HydrophobicContact CD1-CD1 3.47Å; L264-L296 VanDerWaalsContact CD1-CD1 3.47Å; L264-L296 HydrophobicContact CD1-CG 4.02Å; N266-L296 WeakPolarHBondContact OD1-CA 3.41Å; L296-Y307 CarbonylContact O-C 3.6Å; L296-Y307 WeakPolarHBondContact O-CA 3.08Å; L296-S308 PolarHBondContact N-O 2.99Å; L296-S308 PolarHBondContact O-N 2.82Å
297	L	95	Very high	92.1	Very high	1 Å²	1	57.7 Å²	57.7	1%	0.005	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	107.8	171.8	-164.4	152.4	0	0	0	108.5	L265 N266 L272 L274 V299 V305 L306 Y307	L265-L297 HydrophobicContact CB-CD2 3.91Å; L265-L297 PolarHBondContact N-O 2.78Å; N266-L297 PolarHBondContact OD1-N 2.85Å; L272-L297 HydrophobicContact CD1-CD1 3.99Å; L272-L297 HydrophobicContact CD1-CD2 3.47Å; L272-L297 VanDerWaalsContact CD1-CD2 3.47Å; L272-L297 HydrophobicContact CD1-CG 4.4Å; L274-L297 HydrophobicContact CD2-CD1 3.74Å; L297-V299 HydrophobicContact CD2-CG2 3.88Å; L297-V305 HydrophobicContact CD2-CG1 4.12Å; L297-V305 HydrophobicContact CG-CG1 4.32Å; L297-L306 WeakPolarHBondContact CA-O 3.26Å; L297-Y307 HydrophobicContact CB-CD2 4.05Å; L297-Y307 HydrophobicContact CD1-CD2 3.92Å; L297-Y307 HydrophobicContact CD1-CE2 4.47Å; L297-Y307 HydrophobicContact CG-CD2 4.18Å
298	R	95.3	Very high	92.4	Very high	93 Å²	93	54.7 Å²	54.7	35%	0.351	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	132.8	-179.4	-174.4	-173.6	-63	-166.3	3.3	109.4	E262 L263 L306	E262-R298 HydrophobicContact CB-CG 4.36Å; E262-R298 VanDerWaalsContact OE2-CD 3.29Å; E262-R298 WeakPolarHBondContact OE2-CD 3.41Å; E262-R298 IonicContact OE2-CZ 3.45Å; E262-R298 IonicContact OE2-NE 2.83Å; E262-R298 IonicContact OE2-NH1 2.87Å; E262-R298 PolarHBondContact OE2-NH1 2.86Å; L263-R298 WeakPolarHBondContact O-CA 3.08Å; R298-L306 PolarHBondContact N-O 3.23Å; R298-L306 PolarHBondContact O-N 2.87Å
299	V	95.3	Very high	92.7	Very high	0 Å²	0	55 Å²	55	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	137.6	174	-173.6	0	0	0	0	108.2	L248 W250 E262 L263 L265 L297 V305	L248-V299 HydrophobicContact CB-CG1 3.95Å; L248-V299 HydrophobicContact CD1-CG2 4.42Å; W250-V299 HydrophobicContact CH2-CG1 4.34Å; W250-V299 HydrophobicContact CZ3-CB 4.33Å; W250-V299 HydrophobicContact CZ3-CG1 3.8Å; E262-V299 CarbonylContact C-O 3.58Å; E262-V299 WeakPolarHBondContact CA-O 3.24Å; L263-V299 PolarHBondContact N-O 3.32Å; L263-V299 PolarHBondContact O-N 2.87Å; L265-V299 HydrophobicContact CD1-CB 4.46Å; L265-V299 HydrophobicContact CD1-CG2 3.72Å; L265-V299 HydrophobicContact CG-CG2 4.4Å; L297-V299 HydrophobicContact CD2-CG2 3.88Å; V299-V305 HydrophobicContact CG1-CG2 4.41Å; V299-V305 HydrophobicContact CG2-CG1 4.31Å; V299-V305 HydrophobicContact CG2-CG2 4.24Å
300	K	94.8	Very high	93.1	Very high	73 Å²	73	51.4 Å²	51.4	32%	0.317	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	157.5	171.5	-57.9	-168.2	-172.5	166.1	0	111.1	K261 E262 N302 G303 Q304	K261-K300 CarbonylContact O-C 3.47Å; K261-K300 VanDerWaalsContact O-CA 3.32Å; K261-K300 WeakPolarHBondContact O-CA 3.37Å; E262-K300 HydrophobicContact CG-CG 4.12Å; E262-K300 WeakPolarHBondContact OE1-CE 3.31Å; K300-N302 WeakPolarHBondContact CB-OD1 3.34Å; K300-N302 PolarHBondContact O-N 2.7Å; K300-G303 PolarHBondContact O-N 2.76Å; K300-Q304 HydrophobicContact CB-CB 4.32Å; K300-Q304 HydrophobicContact CD-CB 4.38Å; K300-Q304 VanDerWaalsContact CE-OE1 3.31Å; K300-Q304 HydrophobicContact CG-CB 4.44Å; K300-Q304 PolarHBondContact N-O 3.08Å
301	S	92.8	Very high	93.5	Very high	14 Å²	14	44 Å²	44	10%	0.098	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.3	-30.9	-177.4	66.1	0	0	0	0	114.5	S249 W250 D251 K261 G303	S249-S301 CarbonylContact C-O 3.59Å; S249-S301 VanDerWaalsContact CA-O 3.29Å; S249-S301 WeakPolarHBondContact CA-O 3.29Å; S249-S301 WeakPolarHBondContact CB-O 3.49Å; W250-S301 VanDerWaalsContact CE2-CA 3.48Å; W250-S301 PolarHBondContact N-O 3.19Å; D251-S301 PolarHBondContact N-O 2.84Å; D251-S301 VanDerWaalsContact N-O 3.13Å; D251-S301 WeakPolarHBondContact OD1-CB 3.07Å; D251-S301 PolarHBondContact OD1-OG 3.43Å; K261-S301 PolarHBondContact O-N 3.37Å; S301-G303 VanDerWaalsContact C-N 3.29Å; S301-G303 PolarHBondContact O-N 2.95Å
302	N	93.1	Very high	93.8	Very high	63 Å²	63	39.9 Å²	39.9	34%	0.337	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.2	-10.2	177.7	69.5	-6.9	0	0	0	114.9	Y244 S249 K300 Q304	Y244-N302 WeakPolarHBondContact CE2-O 3.37Å; Y244-N302 PolarHBondContact OH-O 2.93Å; S249-N302 WeakPolarHBondContact CB-O 3.46Å; K300-N302 WeakPolarHBondContact CB-OD1 3.34Å; K300-N302 PolarHBondContact O-N 2.7Å; N302-Q304 WeakPolarHBondContact OD1-CB 3.22Å; N302-Q304 PolarHBondContact OD1-N 2.05Å
303	G	92.9	Very high	94.2	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	16%	0.164	C	C	.	.	S	Bend	trans	97.7	5	-174.5	0	0	0	0	0	115.1	D245 K300 S301 V305	D245-G303 PolarHBondContact N-O 3.35Å; D245-G303 WeakPolarHBondContact O-CA 3.39Å; K300-G303 PolarHBondContact O-N 2.76Å; S301-G303 VanDerWaalsContact C-N 3.29Å; S301-G303 PolarHBondContact O-N 2.95Å; G303-V305 PolarHBondContact O-N 2.83Å
304	Q	95.6	Very high	94.6	Very high	44 Å²	44	31.2 Å²	31.2	21%	0.206	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	119.7	174.3	-172.6	-179.6	29.1	0	0	110.5	Q242 K300 N302	Q242-Q304 HydrophobicContact CG-CG 4.22Å; K300-Q304 HydrophobicContact CB-CB 4.32Å; K300-Q304 HydrophobicContact CD-CB 4.38Å; K300-Q304 VanDerWaalsContact CE-OE1 3.31Å; K300-Q304 HydrophobicContact CG-CB 4.44Å; K300-Q304 PolarHBondContact N-O 3.08Å; N302-Q304 WeakPolarHBondContact OD1-CB 3.22Å; N302-Q304 PolarHBondContact OD1-N 2.05Å
305	V	96.5	Very high	95	Very high	1 Å²	1	28 Å²	28	1%	0.006	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	132.2	178.2	-171.3	0	0	0	0	110.3	Q242 W243 D245 L248 L297 V299 G303	Q242-V305 VanDerWaalsContact CA-O 3.26Å; Q242-V305 WeakPolarHBondContact CA-O 3.4Å; Q242-V305 WeakPolarHBondContact CG-O 3.27Å; W243-V305 HydrophobicContact CD2-CB 4Å; W243-V305 HydrophobicContact CD2-CG1 4.38Å; W243-V305 HydrophobicContact CE3-CB 4.42Å; W243-V305 HydrophobicContact CG-CB 4.49Å; W243-V305 HydrophobicContact CH2-CB 4.31Å; W243-V305 HydrophobicContact CH2-CG1 3.63Å; W243-V305 HydrophobicContact CZ2-CB 3.87Å; W243-V305 HydrophobicContact CZ2-CG1 3.47Å; W243-V305 VanDerWaalsContact CZ2-CG1 3.47Å; W243-V305 HydrophobicContact CZ2-CG2 4.33Å; W243-V305 HydrophobicContact CZ3-CG1 4.16Å; W243-V305 PolarHBondContact N-O 3.37Å; W243-V305 VanDerWaalsContact N-O 3.09Å; W243-V305 PolarHBondContact O-N 3.32Å; D245-V305 HydrophobicContact CB-CG2 4.25Å; L248-V305 HydrophobicContact CD1-CG2 3.83Å; L297-V305 HydrophobicContact CD2-CG1 4.12Å; L297-V305 HydrophobicContact CG-CG1 4.32Å; V299-V305 HydrophobicContact CG1-CG2 4.41Å; V299-V305 HydrophobicContact CG2-CG1 4.31Å; V299-V305 HydrophobicContact CG2-CG2 4.24Å; G303-V305 PolarHBondContact O-N 2.83Å
306	L	96.5	Very high	95.2	Very high	43 Å²	43	27.6 Å²	27.6	23%	0.225	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	116	170.4	172.6	64	0	0	0	109.4	F217 Q242 L297 R298	F217-L306 HydrophobicContact CE1-CD1 4.2Å; F217-L306 HydrophobicContact CZ-CD1 3.76Å; Q242-L306 HydrophobicContact CB-CD1 4.48Å; L297-L306 WeakPolarHBondContact CA-O 3.26Å; R298-L306 PolarHBondContact N-O 3.23Å; R298-L306 PolarHBondContact O-N 2.87Å
307	Y	96.5	Very high	95.3	Very high	9 Å²	9	25 Å²	25	4%	0.035	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	120.4	173.3	-176.4	-125.4	0	0	0	110.2	R240 Q241 K269 L274 Y295 L296 L297 Q309	R240-Y307 CarbonylContact C-O 3.59Å; R240-Y307 WeakPolarHBondContact CA-O 3.33Å; Q241-Y307 PolarHBondContact N-O 2.8Å; Q241-Y307 PolarHBondContact O-N 2.87Å; K269-Y307 HydrophobicContact CD-CE2 4.42Å; K269-Y307 WeakPolarHBondContact CE-OH 3.26Å; K269-Y307 PolarHBondContact NZ-OH 2.78Å; L274-Y307 HydrophobicContact CD2-CD1 4.48Å; L274-Y307 HydrophobicContact CD2-CG 4.45Å; Y295-Y307 HydrophobicContact CD2-CE2 4.25Å; Y295-Y307 HydrophobicContact CG-CE2 4.31Å; L296-Y307 CarbonylContact O-C 3.6Å; L296-Y307 WeakPolarHBondContact O-CA 3.08Å; L297-Y307 HydrophobicContact CB-CD2 4.05Å; L297-Y307 HydrophobicContact CD1-CD2 3.92Å; L297-Y307 HydrophobicContact CD1-CE2 4.47Å; L297-Y307 HydrophobicContact CG-CD2 4.18Å; Y307-Q309 HydrophobicContact CE1-CG 4.45Å; Y307-Q309 PolarHBondContact OH-OE1 2.97Å
308	S	96	Very high	95.2	Very high	15 Å²	15	30.5 Å²	30.5	11%	0.105	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	124.6	-178	171.3	0	0	0	0	109.6	L239 Y295 L296	L239-S308 WeakPolarHBondContact O-CA 3.34Å; Y295-S308 CarbonylContact C-O 3.55Å; Y295-S308 VanDerWaalsContact CA-O 3.26Å; Y295-S308 WeakPolarHBondContact CA-O 3.14Å; L296-S308 PolarHBondContact N-O 2.99Å; L296-S308 PolarHBondContact O-N 2.82Å
309	Q	94.9	Very high	95	Very high	28 Å²	28	26.3 Å²	26.3	13%	0.131	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	140.3	-179.5	62.3	-179	37.1	0	0	111.9	Y238 L239 L287 Y307 I311	Y238-Q309 WeakPolarHBondContact CA-O 3.43Å; L239-Q309 HydrophobicContact CB-CG 4.19Å; L239-Q309 HydrophobicContact CD2-CG 4.45Å; L239-Q309 PolarHBondContact N-O 2.9Å; L239-Q309 PolarHBondContact O-N 3.49Å; L287-Q309 HydrophobicContact CD2-CB 4.11Å; L287-Q309 HydrophobicContact CD2-CG 4.2Å; Y307-Q309 HydrophobicContact CE1-CG 4.45Å; Y307-Q309 PolarHBondContact OH-OE1 2.97Å; Q309-I311 HydrophobicContact CG-CD1 3.99Å; Q309-I311 HydrophobicContact CG-CG1 3.88Å
310	K	95.3	Very high	94.8	Very high	53 Å²	53	32.5 Å²	32.5	23%	0.23	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	121.6	172.8	-163.6	-171.1	171.7	-175	0	109.5	I221 Y238 H288 N294	I221-K310 HydrophobicContact CD1-CD 4.38Å; I221-K310 HydrophobicContact CD1-CG 4.14Å; Y238-K310 HydrophobicContact CD1-CB 3.76Å; Y238-K310 HydrophobicContact CD1-CG 3.86Å; Y238-K310 HydrophobicContact CE1-CB 3.72Å; Y238-K310 HydrophobicContact CE1-CD 3.9Å; Y238-K310 HydrophobicContact CE1-CG 3.58Å; H288-K310 VanDerWaalsContact CD2-CD 3.43Å; H288-K310 WeakPolarHBondContact CD2-CD 3.01Å; H288-K310 VanDerWaalsContact CD2-CG 3.44Å; H288-K310 WeakPolarHBondContact CD2-CG 3.46Å; H288-K310 WeakPolarHBondContact NE2-CE 3.39Å; N294-K310 HydrophobicContact CB-CB 3.93Å; N294-K310 PolarHBondContact O-N 3.18Å
311	I	94.9	Very high	94.7	Very high	10 Å²	10	29 Å²	29	5%	0.051	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	135.4	-177.5	-34.5	177.2	0	0	0	109.6	C237 L239 F279 F286 L287 Q309 M313	C237-I311 PolarHBondContact N-O 2.64Å; C237-I311 PolarHBondContact O-N 2.68Å; L239-I311 HydrophobicContact CB-CD1 3.61Å; L239-I311 HydrophobicContact CB-CG1 4.27Å; L239-I311 HydrophobicContact CD2-CD1 3.73Å; L239-I311 HydrophobicContact CG-CD1 4.32Å; F279-I311 HydrophobicContact CE2-CD1 4.12Å; F279-I311 HydrophobicContact CZ-CD1 4.25Å; F286-I311 WeakPolarHBondContact O-CG2 3.34Å; L287-I311 HydrophobicContact CD2-CG1 4Å; Q309-I311 HydrophobicContact CG-CD1 3.99Å; Q309-I311 HydrophobicContact CG-CG1 3.88Å; I311-M313 HydrophobicContact CB-CE 3.93Å; I311-M313 HydrophobicContact CD1-CE 3.8Å; I311-M313 HydrophobicContact CG1-CE 4.42Å; I311-M313 HydrophobicContact CG2-CB 4.45Å; I311-M313 HydrophobicContact CG2-CE 4Å
312	T	95.5	Very high	94.7	Very high	11 Å²	11	35.6 Å²	35.6	7%	0.067	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	123.7	154.7	-64.4	0	0	0	0	107.7	T234 I235 N236 G285 F286 H288	T234-T312 HydrophobicContact CG2-CG2 3.6Å; I235-T312 WeakPolarHBondContact O-CA 3.46Å; N236-T312 VanDerWaalsContact OD1-CB 3.27Å; N236-T312 WeakPolarHBondContact OD1-CB 3.49Å; N236-T312 VanDerWaalsContact OD1-CG2 3.25Å; N236-T312 WeakPolarHBondContact OD1-CG2 3.23Å; N236-T312 PolarHBondContact OD1-OG1 3.19Å; G285-T312 CarbonylContact C-O 3.46Å; G285-T312 WeakPolarHBondContact CA-O 3.48Å; F286-T312 HydrophobicContact CD1-CG2 4.19Å; F286-T312 VanDerWaalsContact CE1-CB 3.44Å; F286-T312 HydrophobicContact CE1-CG2 3.44Å; F286-T312 VanDerWaalsContact CE1-CG2 3.44Å; F286-T312 HydrophobicContact CZ-CG2 3.7Å; F286-T312 WeakPolarHBondContact CZ-OG1 3.48Å; F286-T312 PolarHBondContact N-O 3.45Å; F286-T312 PolarHBondContact O-N 3.06Å; H288-T312 PolarHBondContact CE1-OG1 3.22Å; H288-T312 PolarHBondContact NE2-OG1 3.1Å; H288-T312 VanDerWaalsContact NE2-OG1 3.15Å
313	M	95	Very high	94.6	Very high	5 Å²	5	35.7 Å²	35.7	3%	0.025	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	136.6	176.7	66.2	-174.4	71.9	0	0	111.6	T234 I235 C237 F279 I311 L315 V333	T234-M313 CarbonylContact C-O 3.58Å; T234-M313 VanDerWaalsContact CA-O 3.31Å; T234-M313 WeakPolarHBondContact CA-O 3.13Å; I235-M313 HydrophobicContact CD1-CG 4Å; I235-M313 HydrophobicContact CD1-SD 3.94Å; I235-M313 HydrophobicContact CG1-CG 3.47Å; I235-M313 VanDerWaalsContact CG1-CG 3.47Å; I235-M313 HydrophobicContact CG1-SD 4.09Å; I235-M313 PolarHBondContact N-O 3.31Å; I235-M313 PolarHBondContact O-N 3.17Å; C237-M313 VanDerWaalsContact SG-CE 3.53Å; F279-M313 HydrophobicContact CD1-SD 3.95Å; F279-M313 HydrophobicContact CD2-CE 4.39Å; F279-M313 HydrophobicContact CD2-SD 4.42Å; F279-M313 HydrophobicContact CE1-CE 3.79Å; F279-M313 HydrophobicContact CE1-SD 3.69Å; F279-M313 HydrophobicContact CE2-CE 3.66Å; F279-M313 HydrophobicContact CE2-SD 4.2Å; F279-M313 HydrophobicContact CG-SD 4.31Å; F279-M313 HydrophobicContact CZ-CE 3.31Å; F279-M313 HydrophobicContact CZ-SD 3.83Å; I311-M313 HydrophobicContact CB-CE 3.93Å; I311-M313 HydrophobicContact CD1-CE 3.8Å; I311-M313 HydrophobicContact CG1-CE 4.42Å; I311-M313 HydrophobicContact CG2-CB 4.45Å; I311-M313 HydrophobicContact CG2-CE 4Å; M313-L315 HydrophobicContact CG-CD1 4.06Å; M313-L315 HydrophobicContact CG-CD2 4.28Å; M313-L315 HydrophobicContact CG-CG 3.97Å; M313-L315 HydrophobicContact SD-CD1 3.9Å; M313-L315 HydrophobicContact SD-CD2 4Å; M313-L315 HydrophobicContact SD-CG 4.13Å; M313-V333 HydrophobicContact SD-CG1 4.34Å
314	T	96.5	Very high	94.5	Very high	18 Å²	18	35.8 Å²	35.8	11%	0.11	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	117.1	170.9	-56.3	0	0	0	0	108.3	E232 Y233 T234 K283 S284	E232-T314 HydrophobicContact CB-CG2 4.01Å; E232-T314 HydrophobicContact CG-CG2 4.13Å; Y233-T314 CarbonylContact O-C 3.59Å; Y233-T314 WeakPolarHBondContact O-CA 3.29Å; T234-T314 PolarHBondContact OG1-OG1 3.02Å; K283-T314 PolarHBondContact N-O 3.04Å; S284-T314 PolarHBondContact N-O 3.37Å; S284-T314 PolarHBondContact O-N 2.76Å; S284-T314 WeakPolarHBondContact OG-CB 3.47Å
315	L	96.9	Very high	94.3	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	144.5	-173.1	-64	167.1	0	0	0	109.9	E232 Y233 I235 F279 N281 M313 V333	E232-L315 VanDerWaalsContact CA-O 3.24Å; E232-L315 WeakPolarHBondContact CA-O 3.15Å; E232-L315 WeakPolarHBondContact CB-O 3.5Å; Y233-L315 HydrophobicContact CD1-CB 3.95Å; Y233-L315 WeakPolarHBondContact CD1-O 3.45Å; Y233-L315 HydrophobicContact CE1-CB 3.43Å; Y233-L315 VanDerWaalsContact CE1-CB 3.43Å; Y233-L315 HydrophobicContact CE1-CD1 4.06Å; Y233-L315 HydrophobicContact CE1-CG 4.4Å; Y233-L315 HydrophobicContact CE2-CD1 4.37Å; Y233-L315 PolarHBondContact N-O 3.31Å; Y233-L315 PolarHBondContact O-N 2.95Å; Y233-L315 WeakPolarHBondContact OH-CD1 3.44Å; I235-L315 HydrophobicContact CD1-CD1 3.79Å; I235-L315 HydrophobicContact CG1-CD1 4.24Å; F279-L315 HydrophobicContact CB-CD2 4.29Å; N281-L315 WeakPolarHBondContact O-CA 3.41Å; M313-L315 HydrophobicContact CG-CD1 4.06Å; M313-L315 HydrophobicContact CG-CD2 4.28Å; M313-L315 HydrophobicContact CG-CG 3.97Å; M313-L315 HydrophobicContact SD-CD1 3.9Å; M313-L315 HydrophobicContact SD-CD2 4Å; M313-L315 HydrophobicContact SD-CG 4.13Å; L315-V333 HydrophobicContact CD1-CB 4.11Å; L315-V333 HydrophobicContact CD1-CG1 3.88Å; L315-V333 HydrophobicContact CD1-CG2 3.68Å; L315-V333 HydrophobicContact CD2-CG1 4.49Å
316	S	96.1	Very high	93.9	Very high	42 Å²	42	34.8 Å²	34.8	29%	0.294	16%	0.16	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	127.1	174.1	-161	0	0	0	0	110.4	N281	N281-S316 PolarHBondContact ND2-O 3.21Å; N281-S316 PolarHBondContact O-N 2.88Å
317	C	95.2	Very high	93.6	Very high	2 Å²	2	32.9 Å²	32.9	1%	0.014	15%	0.149	C	C	.	.			trans	-129.7	116.1	177	174.9	0	0	0	0	109.9	M231 Y233 M319 C331	M231-C317 CarbonylContact C-O 3.56Å; M231-C317 VanDerWaalsContact C-O 3.31Å; M231-C317 WeakPolarHBondContact CB-O 3.31Å; M231-C317 PolarHBondContact O-N 3.36Å; Y233-C317 HydrophobicContact CD1-CB 3.59Å; Y233-C317 HydrophobicContact CE1-CB 3.91Å; C317-M319 HydrophobicContact CB-CE 4.43Å; C317-M319 PolarHBondContact O-N 3.17Å; C317-C331 HydrophobicContact CB-CB 3.77Å; C317-C331 WeakPolarHBondContact CB-SG 3.43Å; C317-C331 WeakPolarHBondContact SG-CA 3.35Å; C317-C331 WeakPolarHBondContact SG-CB 3.41Å; C317-C331 CovalentContact SG-SG 2.05Å; C317-C331 PolarHBondContact SG-SG 3Å
318	Q	92.8	Very high	93.3	Very high	116 Å²	116	37.9 Å²	37.9	54%	0.542	17%	0.172	S	C	.	.			trans	-81.6	83.6	-179	-63	-169.4	40.1	0	0	110.3	Y53	Y53-Q318 VanDerWaalsContact CD1-OE1 3.28Å
319	M	92.2	Very high	93.2	Very high	6 Å²	6	37.5 Å²	37.5	3%	0.03	17%	0.168	C	C	.	.			trans	-70.3	133.1	-175.1	-60.1	-179	-170.7	0	0	112.4	V228 M231 C317 L321 Q329	V228-M319 HydrophobicContact CB-SD 4.3Å; V228-M319 HydrophobicContact CG1-SD 4.18Å; V228-M319 HydrophobicContact CG2-SD 4.03Å; M231-M319 HydrophobicContact SD-CB 3.88Å; M231-M319 HydrophobicContact SD-CG 4.37Å; C317-M319 HydrophobicContact CB-CE 4.43Å; C317-M319 PolarHBondContact O-N 3.17Å; M319-L321 HydrophobicContact CB-CD2 4.09Å; M319-L321 HydrophobicContact CB-CG 4.41Å; M319-Q329 HydrophobicContact CB-CG 4.34Å; M319-Q329 HydrophobicContact CG-CG 4.3Å
320	Y	91.8	Very high	93.1	Very high	129 Å²	129	42.6 Å²	42.6	51%	0.506	19%	0.192	S	C	.	.			trans	-98.2	96.9	178.5	-167.8	-111.7	0	0	0	111.4	R322 Q329 Y460	Y320-R322 VanDerWaalsContact C-N 3.33Å; Y320-R322 HydrophobicContact CD1-CB 4.07Å; Y320-R322 HydrophobicContact CE1-CB 3.5Å; Y320-R322 VanDerWaalsContact CE1-CB 3.5Å; Y320-R322 HydrophobicContact CE1-CG 4.39Å; Y320-R322 PolarHBondContact O-N 2.91Å; Y320-R322 VanDerWaalsContact OH-CD 3.27Å; Y320-R322 WeakPolarHBondContact OH-CD 3.38Å; Y320-Q329 PolarHBondContact O-NE2 3.41Å; Y320-Y460 HydrophobicContact CD2-CE1 4.46Å; Y320-Y460 HydrophobicContact CE2-CE1 4.35Å
321	L	92.3	Very high	93	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	18%	0.181	C	C	.	.	G	3₁₀ helix	trans	-90.2	14	-166.6	-57.1	173.5	0	0	0	114.2	V228 M231 M319 K323 F324 P456 Y460 K462	V228-L321 HydrophobicContact CG1-CD1 3.64Å; V228-L321 HydrophobicContact CG1-CD2 3.66Å; V228-L321 HydrophobicContact CG1-CG 4.29Å; M231-L321 HydrophobicContact CE-CD1 4.28Å; M319-L321 HydrophobicContact CB-CD2 4.09Å; M319-L321 HydrophobicContact CB-CG 4.41Å; L321-K323 VanDerWaalsContact C-N 3.33Å; L321-K323 PolarHBondContact O-N 2.95Å; L321-F324 HydrophobicContact CB-CB 4.15Å; L321-F324 HydrophobicContact CD2-CD2 4.12Å; L321-F324 WeakPolarHBondContact O-CB 3.49Å; L321-F324 PolarHBondContact O-N 3.42Å; L321-P456 HydrophobicContact CD1-CG 3.38Å; L321-Y460 HydrophobicContact CB-CE2 4.36Å; L321-Y460 PolarHBondContact N-OH 3.47Å; L321-K462 HydrophobicContact CB-CD 4.22Å
322	R	91.8	Very high	93	Very high	152 Å²	152	41.5 Å²	41.5	57%	0.574	19%	0.19	S	C	*	.	G	3₁₀ helix	trans	-61.6	-39.6	-176.3	-175.4	174.7	174.3	-174	-2.3	112.6	Y320 Y460 A463	Y320-R322 VanDerWaalsContact C-N 3.33Å; Y320-R322 HydrophobicContact CD1-CB 4.07Å; Y320-R322 HydrophobicContact CE1-CB 3.5Å; Y320-R322 VanDerWaalsContact CE1-CB 3.5Å; Y320-R322 HydrophobicContact CE1-CG 4.39Å; Y320-R322 PolarHBondContact O-N 2.91Å; Y320-R322 VanDerWaalsContact OH-CD 3.27Å; Y320-R322 WeakPolarHBondContact OH-CD 3.38Å; R322-Y460 HydrophobicContact CB-CD2 4.33Å; R322-Y460 HydrophobicContact CB-CE2 4.25Å; R322-A463 PolarHBondContact O-N 3.31Å
323	K	90.7	Very high	93	Very high	66 Å²	66	41 Å²	41	29%	0.287	19%	0.187	S	C	.	.	G	3₁₀ helix	trans	-84.4	1	175.2	-67.2	-167.6	175.2	-169.9	0	113.4	L321 M326 D327 L863 D866	L321-K323 VanDerWaalsContact C-N 3.33Å; L321-K323 PolarHBondContact O-N 2.95Å; K323-M326 CarbonylContact O-C 3.56Å; K323-M326 VanDerWaalsContact O-CA 3.29Å; K323-M326 WeakPolarHBondContact O-CA 3.33Å; K323-M326 VanDerWaalsContact O-CB 3.26Å; K323-M326 WeakPolarHBondContact O-CB 3.41Å; K323-M326 PolarHBondContact O-N 3.33Å; K323-D327 HydrophobicContact CB-CB 4.26Å; K323-L863 HydrophobicContact CD-CB 4.46Å; K323-L863 HydrophobicContact CD-CD1 4.11Å; K323-L863 HydrophobicContact CG-CD1 4.1Å; K323-L863 PolarHBondContact NZ-O 3.03Å; K323-D866 IonicContact NZ-OD2 3.84Å; K323-D866 PolarHBondContact NZ-OD2 3.24Å
324	F	91.4	Very high	93	Very high	2 Å²	2	42.4 Å²	42.4	1%	0.009	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.9	135.7	-172.3	-179.4	-82.9	0	0	0	113.2	L321 D327 Y404 L455 I464	L321-F324 HydrophobicContact CB-CB 4.15Å; L321-F324 HydrophobicContact CD2-CD2 4.12Å; L321-F324 WeakPolarHBondContact O-CB 3.49Å; L321-F324 PolarHBondContact O-N 3.42Å; F324-D327 WeakPolarHBondContact CD2-OD1 3.35Å; F324-Y404 HydrophobicContact CE1-CE1 4.1Å; F324-Y404 HydrophobicContact CZ-CD1 4.4Å; F324-Y404 AromaticContact CZ-CE1 3.62Å; F324-Y404 HydrophobicContact CZ-CE1 3.62Å; F324-Y404 HydrophobicContact CZ-CE2 4.32Å; F324-Y404 AromaticContact CZ-CZ 3.57Å; F324-L455 HydrophobicContact CD1-CD1 3.82Å; F324-L455 HydrophobicContact CD1-CD2 4.2Å; F324-L455 HydrophobicContact CD2-CD2 4.09Å; F324-L455 HydrophobicContact CE1-CD1 3.66Å; F324-L455 HydrophobicContact CE1-CD2 3.89Å; F324-L455 HydrophobicContact CE1-CG 4.28Å; F324-L455 HydrophobicContact CE2-CD2 3.73Å; F324-L455 HydrophobicContact CG-CD2 4.31Å; F324-L455 HydrophobicContact CZ-CD1 4.25Å; F324-L455 HydrophobicContact CZ-CD2 3.64Å; F324-L455 HydrophobicContact CZ-CG 4.39Å; F324-I464 HydrophobicContact CD1-CB 4.33Å; F324-I464 HydrophobicContact CD1-CD1 4.29Å; F324-I464 HydrophobicContact CD1-CG2 3.88Å; F324-I464 HydrophobicContact CE1-CD1 3.99Å; F324-I464 HydrophobicContact CE1-CG2 4.46Å; F324-I464 PolarHBondContact O-N 3.43Å
325	P	91.1	Very high	92.9	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	cis	-90.9	15	5.5	37.2	-36.3	0	0	0	114.3	D327 I401 Y404 Y409	P325-D327 WeakPolarHBondContact CA-OD1 3.38Å; P325-D327 PolarHBondContact O-N 3.16Å; P325-I401 HydrophobicContact CG-CD1 4.14Å; P325-I401 HydrophobicContact CG-CG1 4.19Å; P325-Y404 HydrophobicContact CB-CD1 4.24Å; P325-Y404 HydrophobicContact CB-CD2 3.73Å; P325-Y404 HydrophobicContact CB-CE2 4.12Å; P325-Y404 HydrophobicContact CB-CG 3.79Å; P325-Y404 HydrophobicContact CG-CD2 4.41Å; P325-Y404 HydrophobicContact CG-CG 4.07Å; P325-Y409 WeakPolarHBondContact CD-OH 3.42Å; P325-Y409 HydrophobicContact CG-CE2 4.05Å
326	M	88.2	Confident	92.8	Very high	24 Å²	24	41.6 Å²	41.6	12%	0.118	19%	0.19	C	C	.	.	S	Bend	trans	-95.9	32	-176.1	-52	152.9	167.1	0	0	110.5	K323 I401 Y856 W857 Y860	K323-M326 CarbonylContact O-C 3.56Å; K323-M326 VanDerWaalsContact O-CA 3.29Å; K323-M326 WeakPolarHBondContact O-CA 3.33Å; K323-M326 VanDerWaalsContact O-CB 3.26Å; K323-M326 WeakPolarHBondContact O-CB 3.41Å; K323-M326 PolarHBondContact O-N 3.33Å; M326-I401 HydrophobicContact CB-CD1 4.47Å; M326-I401 HydrophobicContact CE-CD1 3.85Å; M326-I401 HydrophobicContact CG-CD1 3.4Å; M326-Y856 HydrophobicContact CE-CE1 3.92Å; M326-W857 HydrophobicContact CE-CH2 4.46Å; M326-W857 HydrophobicContact CE-CZ3 4.02Å; M326-Y860 HydrophobicContact CB-CD2 3.88Å; M326-Y860 HydrophobicContact CB-CE2 3.84Å; M326-Y860 HydrophobicContact CE-CD1 4.48Å; M326-Y860 HydrophobicContact CE-CD2 3.49Å; M326-Y860 VanDerWaalsContact CE-CD2 3.49Å; M326-Y860 HydrophobicContact CE-CE2 4.13Å; M326-Y860 HydrophobicContact CE-CG 3.64Å; M326-Y860 HydrophobicContact CG-CD2 3.38Å; M326-Y860 HydrophobicContact CG-CE2 3.46Å; M326-Y860 VanDerWaalsContact CG-CE2 3.46Å; M326-Y860 HydrophobicContact CG-CG 4.45Å; M326-Y860 HydrophobicContact SD-CD2 3.3Å; M326-Y860 WeakPolarHBondContact SD-CD2 3.41Å; M326-Y860 HydrophobicContact SD-CE2 4.04Å; M326-Y860 HydrophobicContact SD-CG 3.94Å
327	D	90.5	Very high	92.6	Very high	2 Å²	2	39.7 Å²	39.7	1%	0.011	18%	0.177	C	C	.	.			trans	-98.6	144.7	-166.8	56.6	-55.3	0	0	0	113.5	K323 F324 P325 Q329 R399	K323-D327 HydrophobicContact CB-CB 4.26Å; F324-D327 WeakPolarHBondContact CD2-OD1 3.35Å; P325-D327 WeakPolarHBondContact CA-OD1 3.38Å; P325-D327 PolarHBondContact O-N 3.16Å; D327-Q329 PolarHBondContact OD2-NE2 2.82Å; D327-R399 PolarHBondContact O-N 3.04Å; D327-R399 IonicContact OD1-CZ 3.72Å; D327-R399 IonicContact OD1-NE 2.73Å; D327-R399 PolarHBondContact OD1-NE 3Å; D327-R399 IonicContact OD1-NH2 2.87Å; D327-R399 IonicContact OD2-CZ 2.92Å; D327-R399 IonicContact OD2-NE 3.36Å; D327-R399 PolarHBondContact OD2-NE 2.99Å; D327-R399 IonicContact OD2-NH2 3.23Å; D327-R399 PolarHBondContact OD2-NH2 3.01Å
328	K	90.9	Very high	92.3	Very high	115 Å²	115	48.1 Å²	48.1	50%	0.5	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	135.2	163.1	-62.8	-178.9	-176.4	178.8	0	107.3	L397 R398 D866	K328-L397 WeakPolarHBondContact CA-O 3.42Å; K328-R398 HydrophobicContact CG-CG 4.38Å; K328-D866 WeakPolarHBondContact CE-OXT 3.35Å; K328-D866 PolarHBondContact NZ-O 3.32Å; K328-D866 PolarHBondContact NZ-OXT 2.91Å
329	Q	92.3	Very high	92.1	Very high	6 Å²	6	44.9 Å²	44.9	3%	0.028	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	138.8	179.2	-62	-55.8	-24.5	0	0	110.1	M319 Y320 D327 F366 L397	M319-Q329 HydrophobicContact CB-CG 4.34Å; M319-Q329 HydrophobicContact CG-CG 4.3Å; Y320-Q329 PolarHBondContact O-NE2 3.41Å; D327-Q329 PolarHBondContact OD2-NE2 2.82Å; Q329-F366 HydrophobicContact CG-CE1 4.39Å; Q329-L397 PolarHBondContact N-O 3.2Å; Q329-L397 PolarHBondContact O-N 2.95Å
330	E	92.9	Very high	92.1	Very high	136 Å²	136	47.1 Å²	47.1	64%	0.636	22%	0.215	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-112.4	98.5	177.1	-68.4	179.9	170.4	0	0	108.1	I394	E330-I394 HydrophobicContact CB-CG2 4.04Å; E330-I394 HydrophobicContact CG-CG2 4.4Å
331	C	94.4	Very high	92.1	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	132.4	179.6	-69.9	0	0	0	0	110.4	Y233 C317 I395 L397	Y233-C331 HydrophobicContact CD1-CB 3.92Å; Y233-C331 HydrophobicContact CD2-CB 4.29Å; Y233-C331 HydrophobicContact CE1-CB 3.61Å; Y233-C331 HydrophobicContact CE2-CB 4.01Å; Y233-C331 HydrophobicContact CG-CB 4.25Å; C317-C331 HydrophobicContact CB-CB 3.77Å; C317-C331 WeakPolarHBondContact CB-SG 3.43Å; C317-C331 WeakPolarHBondContact SG-CA 3.35Å; C317-C331 WeakPolarHBondContact SG-CB 3.41Å; C317-C331 CovalentContact SG-SG 2.05Å; C317-C331 PolarHBondContact SG-SG 3Å; C331-I395 PolarHBondContact N-O 3.19Å; C331-I395 VanDerWaalsContact N-O 3.08Å; C331-I395 PolarHBondContact O-N 3.35Å; C331-L397 HydrophobicContact CB-CD1 4.39Å
332	T	95.1	Very high	92.2	Very high	40 Å²	40	43.9 Å²	43.9	25%	0.245	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	144.4	-170.2	61.5	0	0	0	0	113.3	Y233 N281 L392 L393 I394	Y233-T332 PolarHBondContact OH-O 3.16Å; N281-T332 PolarHBondContact ND2-O 2.8Å; T332-L392 HydrophobicContact CG2-CD1 4.23Å; T332-L393 CarbonylContact C-O 3.55Å; T332-L393 WeakPolarHBondContact CA-O 3.12Å; T332-I394 HydrophobicContact CG2-CB 4.47Å; T332-I394 HydrophobicContact CG2-CG1 4.05Å; T332-I394 HydrophobicContact CG2-CG2 4.36Å
333	V	95.5	Very high	92.1	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	114.7	163.3	-165.4	0	0	0	0	106.7	Y233 I235 F279 M313 L315 I335 L393 I395	Y233-V333 WeakPolarHBondContact OH-CG2 3.11Å; I235-V333 HydrophobicContact CD1-CG2 3.95Å; F279-V333 HydrophobicContact CD1-CG1 3.69Å; F279-V333 HydrophobicContact CE1-CG1 3.73Å; M313-V333 HydrophobicContact SD-CG1 4.34Å; L315-V333 HydrophobicContact CD1-CB 4.11Å; L315-V333 HydrophobicContact CD1-CG1 3.88Å; L315-V333 HydrophobicContact CD1-CG2 3.68Å; L315-V333 HydrophobicContact CD2-CG1 4.49Å; V333-I335 HydrophobicContact CG1-CD1 4.38Å; V333-I335 HydrophobicContact CG1-CG1 4.12Å; V333-L393 HydrophobicContact CB-CB 4.11Å; V333-L393 HydrophobicContact CB-CD2 4.38Å; V333-L393 HydrophobicContact CB-CG 4.43Å; V333-L393 HydrophobicContact CG2-CB 4.36Å; V333-L393 HydrophobicContact CG2-CD2 3.93Å; V333-L393 HydrophobicContact CG2-CG 4.13Å; V333-L393 PolarHBondContact N-O 3.31Å; V333-L393 PolarHBondContact O-N 3.44Å; V333-I395 HydrophobicContact CG2-CD1 4.24Å
334	N	94.6	Very high	92.2	Very high	34 Å²	34	42 Å²	42	18%	0.182	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	115.4	-179.1	-171.9	-15.1	0	0	0	109.5	F279 R280 N281 L392	F279-N334 CarbonylContact C-O 3.58Å; F279-N334 VanDerWaalsContact CA-O 3.31Å; F279-N334 WeakPolarHBondContact CA-O 3.49Å; R280-N334 HydrophobicContact CB-CB 4.1Å; R280-N334 WeakPolarHBondContact CD-OD1 3.4Å; R280-N334 PolarHBondContact N-O 2.77Å; N281-N334 WeakPolarHBondContact OD1-CB 3.22Å; N281-N334 PolarHBondContact OD1-N 3.15Å; N334-L392 HydrophobicContact CB-CD1 3.94Å
335	I	95.2	Very high	92.4	Very high	0 Å²	0	42 Å²	42	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	140.1	-171.4	-58.2	171.1	0	0	0	108.4	V216 I218 L277 F278 F279 V333 W349 C390 L391	V216-I335 HydrophobicContact CG1-CD1 4.4Å; I218-I335 HydrophobicContact CD1-CD1 3.71Å; L277-I335 HydrophobicContact CD1-CG2 3.82Å; L277-I335 HydrophobicContact CD2-CG2 3.62Å; L277-I335 HydrophobicContact CG-CG2 3.52Å; F278-I335 WeakPolarHBondContact O-CA 3.15Å; F279-I335 HydrophobicContact CD1-CG1 3.97Å; F279-I335 HydrophobicContact CE1-CD1 4.25Å; F279-I335 HydrophobicContact CE1-CG1 3.84Å; V333-I335 HydrophobicContact CG1-CD1 4.38Å; V333-I335 HydrophobicContact CG1-CG1 4.12Å; I335-W349 HydrophobicContact CD1-CH2 3.96Å; I335-C390 CarbonylContact O-C 3.54Å; I335-C390 WeakPolarHBondContact O-CA 3.47Å; I335-L391 HydrophobicContact CB-CB 4.27Å; I335-L391 PolarHBondContact N-O 3.13Å; I335-L391 PolarHBondContact O-N 3.45Å
336	G	93.6	Very high	92.5	Very high	1 Å²	1	45.6 Å²	45.6	1%	0.01	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159	-174.1	170.7	0	0	0	0	0	113.7	F278 F347 S389	F278-G336 WeakPolarHBondContact CD1-O 3.5Å; F278-G336 PolarHBondContact N-O 2.61Å; F278-G336 PolarHBondContact O-N 2.68Å; G336-F347 WeakPolarHBondContact O-CE2 3.26Å; G336-S389 WeakPolarHBondContact CA-O 3.49Å
337	S	92.8	Very high	92.9	Very high	3 Å²	3	44.5 Å²	44.5	2%	0.021	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	138.8	169.4	-179.8	0	0	0	0	110.2	D276 F278 Y340 Y388 S389	D276-S337 WeakPolarHBondContact OD1-CB 3.36Å; D276-S337 PolarHBondContact OD1-OG 2.72Å; D276-S337 PolarHBondContact OD2-OG 3.36Å; F278-S337 VanDerWaalsContact CE1-C 3.41Å; F278-S337 VanDerWaalsContact CE1-O 3.27Å; F278-S337 WeakPolarHBondContact CE1-O 3.49Å; S337-Y340 WeakPolarHBondContact OG-CB 3.39Å; S337-Y340 PolarHBondContact OG-N 2.8Å; S337-Y340 PolarHBondContact OG-O 3.48Å; S337-Y388 WeakPolarHBondContact O-CD1 3.43Å; S337-S389 PolarHBondContact N-O 3.44Å
338	Y	88.5	Confident	93.1	Very high	179 Å²	179	46.5 Å²	46.5	70%	0.702	23%	0.23	S	C	*	.	S	Bend	trans	-90.1	-44.2	-174.5	-173	-94.1	0	0	0	112.2	D276 F278	D276-Y338 WeakPolarHBondContact OD2-CA 3.47Å; D276-Y338 PolarHBondContact OD2-N 3.4Å; F278-Y338 HydrophobicContact CD1-CD2 4.33Å; F278-Y338 HydrophobicContact CD2-CD2 4.16Å; F278-Y338 HydrophobicContact CE1-CD2 4.32Å; F278-Y338 HydrophobicContact CE2-CD2 4.09Å; F278-Y338 HydrophobicContact CG-CD2 4.26Å; F278-Y338 HydrophobicContact CZ-CD2 4.16Å
339	G	89.1	Confident	93.4	Very high	47 Å²	47	42.4 Å²	42.4	49%	0.485	21%	0.212	S	C	.	.	S	Bend	trans	-105.7	-33.9	-176.5	0	0	0	0	0	114.4	D276	D276-G339 PolarHBondContact OD2-N 2.78Å
340	Y	91.5	Very high	93.6	Very high	53 Å²	53	44 Å²	44	21%	0.208	22%	0.219	C	C	.	.			trans	-91.8	135.9	-172.7	-59.9	-79.4	0	0	0	112.8	W273 D276 S337 Q344 L345 Y388	W273-Y340 PolarHBondContact NE1-OH 2.85Å; D276-Y340 HydrophobicContact CB-CD2 4.36Å; D276-Y340 HydrophobicContact CB-CE2 4.3Å; S337-Y340 WeakPolarHBondContact OG-CB 3.39Å; S337-Y340 PolarHBondContact OG-N 2.8Å; S337-Y340 PolarHBondContact OG-O 3.48Å; Y340-Q344 HydrophobicContact CD1-CB 4.04Å; Y340-L345 VanDerWaalsContact CB-CB 3.5Å; Y340-L345 HydrophobicContact CD2-CB 4.37Å; Y340-L345 HydrophobicContact CD2-CD2 3.74Å; Y340-L345 HydrophobicContact CG-CB 4.03Å; Y340-L345 HydrophobicContact CG-CD2 4.24Å; Y340-Y388 WeakPolarHBondContact O-CD1 3.35Å
341	T	92.6	Very high	93.4	Very high	27 Å²	27	45.1 Å²	45.1	17%	0.166	22%	0.224	C	C	.	.			trans	-75.6	165.6	171.1	60	0	0	0	0	111.3	D343 Q344 L345 T387	T341-D343 PolarHBondContact O-N 3.05Å; T341-D343 VanDerWaalsContact O-N 3.13Å; T341-Q344 VanDerWaalsContact N-OE1 3.17Å; T341-Q344 PolarHBondContact O-N 3.37Å; T341-Q344 PolarHBondContact OG1-OE1 3.25Å; T341-L345 PolarHBondContact O-N 2.95Å; T341-T387 CarbonylContact C-O 3.28Å; T341-T387 VanDerWaalsContact CA-O 3.25Å; T341-T387 WeakPolarHBondContact CA-O 3.4Å; T341-T387 WeakPolarHBondContact CB-O 3.23Å
342	I	92.6	Very high	93.1	Very high	34 Å²	34	51.2 Å²	51.2	17%	0.174	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.7	-34.2	178.1	-63.6	164	0	0	0	112.1	P211 Q344 K346 T378 T387	P211-I342 VanDerWaalsContact CB-O 3.23Å; P211-I342 WeakPolarHBondContact CB-O 3.37Å; I342-Q344 PolarHBondContact O-N 2.72Å; I342-K346 HydrophobicContact CG2-CD 4.43Å; I342-T378 HydrophobicContact CD1-CG2 3.15Å; I342-T378 HydrophobicContact CG1-CG2 3.74Å; I342-T387 WeakPolarHBondContact CD1-OG1 3.28Å; I342-T387 WeakPolarHBondContact CG1-O 3.41Å; I342-T387 PolarHBondContact N-O 3.44Å
343	D	91	Very high	92.8	Very high	109 Å²	109	57.2 Å²	57.2	58%	0.583	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.1	-19.9	-178.7	-46.6	-44	0	0	0	112.3	P211 T341	P211-D343 WeakPolarHBondContact CA-O 3.25Å; P211-D343 WeakPolarHBondContact CB-O 3.38Å; T341-D343 PolarHBondContact O-N 3.05Å; T341-D343 VanDerWaalsContact O-N 3.13Å
344	Q	93	Very high	92.6	Very high	70 Å²	70	58.5 Å²	58.5	33%	0.327	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.7	-42	178	-64.2	173.2	-43.4	0	0	112.2	R203 P211 T212 Y340 T341 I342	R203-Q344 PolarHBondContact NH1-O 3.36Å; P211-Q344 WeakPolarHBondContact CA-O 3.27Å; T212-Q344 PolarHBondContact N-O 2.72Å; Y340-Q344 HydrophobicContact CD1-CB 4.04Å; T341-Q344 VanDerWaalsContact N-OE1 3.17Å; T341-Q344 PolarHBondContact O-N 3.37Å; T341-Q344 PolarHBondContact OG1-OE1 3.25Å; I342-Q344 PolarHBondContact O-N 2.72Å
345	L	94.1	Very high	92.5	Very high	1 Å²	1	58 Å²	58	1%	0.005	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	125	-174.6	-173.1	70.6	0	0	0	111	T212 V214 W273 P275 D276 Y340 T341 F347	T212-L345 HydrophobicContact CG2-CD1 4.26Å; V214-L345 HydrophobicContact CG2-CD1 3.65Å; W273-L345 HydrophobicContact CH2-CD1 3.76Å; W273-L345 HydrophobicContact CZ2-CD1 4.24Å; P275-L345 HydrophobicContact CB-CD1 4.37Å; P275-L345 HydrophobicContact CB-CD2 4.29Å; D276-L345 WeakPolarHBondContact OD1-CD2 3.38Å; Y340-L345 VanDerWaalsContact CB-CB 3.5Å; Y340-L345 HydrophobicContact CD2-CB 4.37Å; Y340-L345 HydrophobicContact CD2-CD2 3.74Å; Y340-L345 HydrophobicContact CG-CB 4.03Å; Y340-L345 HydrophobicContact CG-CD2 4.24Å; T341-L345 PolarHBondContact O-N 2.95Å; L345-F347 HydrophobicContact CD2-CE2 4.15Å; L345-F347 HydrophobicContact CD2-CZ 3.85Å
346	K	94.4	Very high	92.4	Very high	77 Å²	77	60.3 Å²	60.3	34%	0.335	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	115.4	178.5	-171.5	175.6	-179.4	177.8	0	111.2	P211 T212 I213 V214 I342 I348	P211-K346 HydrophobicContact CB-CB 4.34Å; T212-K346 PolarHBondContact O-N 3.08Å; I213-K346 WeakPolarHBondContact CA-O 3.43Å; V214-K346 PolarHBondContact N-O 3.31Å; I342-K346 HydrophobicContact CG2-CD 4.43Å; K346-I348 HydrophobicContact CG-CG2 4.3Å
347	F	95.9	Very high	92.2	Very high	0 Å²	0	62 Å²	62	0%	0	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	136.1	167.5	-63.1	-64.9	0	0	0	110.2	V214 V216 P275 L277 G336 L345 S389 L391	V214-F347 HydrophobicContact CB-CD1 3.68Å; V214-F347 HydrophobicContact CB-CE1 3.88Å; V214-F347 HydrophobicContact CG1-CD1 3.88Å; V214-F347 HydrophobicContact CG1-CE1 3.86Å; V214-F347 HydrophobicContact CG2-CD1 4.47Å; V214-F347 HydrophobicContact CG2-CE1 4.29Å; V214-F347 WeakPolarHBondContact O-CA 3.44Å; V216-F347 HydrophobicContact CG2-CB 4.15Å; V216-F347 HydrophobicContact CG2-CD1 3.53Å; V216-F347 HydrophobicContact CG2-CE1 4.31Å; V216-F347 HydrophobicContact CG2-CG 4.16Å; P275-F347 HydrophobicContact CB-CE1 4.13Å; P275-F347 HydrophobicContact CB-CZ 4.28Å; L277-F347 HydrophobicContact CB-CE1 4.02Å; L277-F347 HydrophobicContact CB-CE2 4.45Å; L277-F347 HydrophobicContact CB-CZ 3.7Å; L277-F347 HydrophobicContact CD1-CD1 4.5Å; L277-F347 HydrophobicContact CD1-CE1 4.16Å; L277-F347 HydrophobicContact CG-CE1 4.33Å; L277-F347 HydrophobicContact CG-CZ 4.2Å; G336-F347 WeakPolarHBondContact O-CE2 3.26Å; L345-F347 HydrophobicContact CD2-CE2 4.15Å; L345-F347 HydrophobicContact CD2-CZ 3.85Å; F347-S389 WeakPolarHBondContact CB-OG 3.29Å; F347-S389 PolarHBondContact N-OG 2.84Å; F347-S389 PolarHBondContact O-OG 3.41Å; F347-L391 HydrophobicContact CB-CD1 3.69Å; F347-L391 HydrophobicContact CB-CG 3.96Å
348	I	96	Very high	91.9	Very high	44 Å²	44	63.2 Å²	63.2	23%	0.226	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	149	171.1	61.8	172.2	0	0	0	109.5	I213 V214 S215 V216 K346	I213-I348 HydrophobicContact CG2-CD1 3.52Å; I213-I348 HydrophobicContact CG2-CG1 3.87Å; I213-I348 HydrophobicContact CG2-CG2 4.38Å; V214-I348 PolarHBondContact O-N 3.04Å; S215-I348 CarbonylContact C-O 3.45Å; S215-I348 WeakPolarHBondContact CA-O 3.43Å; V216-I348 PolarHBondContact N-O 2.99Å; K346-I348 HydrophobicContact CG-CG2 4.3Å
349	W	96.6	Very high	91.4	Very high	30 Å²	30	62.2 Å²	62.2	11%	0.114	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	138.1	169	-73.8	116.2	0	0	0	110.1	V216 I218 I335 P354 V355 T374 L375 L391 L393	V216-W349 HydrophobicContact CG1-CZ3 4.41Å; I218-W349 HydrophobicContact CD1-CH2 4.41Å; I218-W349 HydrophobicContact CD1-CZ3 4.44Å; I335-W349 HydrophobicContact CD1-CH2 3.96Å; W349-P354 HydrophobicContact CB-CB 3.92Å; W349-P354 HydrophobicContact CD2-CB 4.29Å; W349-P354 HydrophobicContact CE3-CB 3.86Å; W349-P354 HydrophobicContact CG-CB 4.36Å; W349-V355 HydrophobicContact CZ3-CG2 4.29Å; W349-T374 HydrophobicContact CD2-CG2 3.8Å; W349-T374 HydrophobicContact CE3-CG2 4.08Å; W349-T374 HydrophobicContact CG-CG2 4.27Å; W349-T374 HydrophobicContact CH2-CG2 4.34Å; W349-T374 HydrophobicContact CZ2-CG2 4.05Å; W349-T374 HydrophobicContact CZ3-CG2 4.34Å; W349-L375 PolarHBondContact NE1-O 2.82Å; W349-L391 HydrophobicContact CD2-CB 4.5Å; W349-L391 HydrophobicContact CD2-CD1 4.07Å; W349-L391 HydrophobicContact CE3-CD1 4.44Å; W349-L391 HydrophobicContact CG-CD1 4.31Å; W349-L391 HydrophobicContact CG-CD2 4.37Å; W349-L391 HydrophobicContact CH2-CB 4.44Å; W349-L391 HydrophobicContact CZ2-CB 3.7Å; W349-L393 HydrophobicContact CH2-CB 3.84Å; W349-L393 HydrophobicContact CZ2-CB 4.01Å
350	H	95.2	Very high	90.5	Very high	40 Å²	40	66.9 Å²	66.9	19%	0.185	34%	0.337	C	S	.	.			trans	-61.3	136	175.5	-168.4	55.9	0	0	0	111.4	S215 V216 F217 D352 P354	S215-H350 WeakPolarHBondContact OG-CA 3.13Å; S215-H350 WeakPolarHBondContact OG-CB 3.29Å; S215-H350 PolarHBondContact OG-ND1 2.83Å; V216-H350 PolarHBondContact O-N 2.95Å; F217-H350 HydrophobicContact CB-CB 3.75Å; F217-H350 HydrophobicContact CD1-CB 4.07Å; F217-H350 HydrophobicContact CG-CB 4.09Å; H350-D352 PolarHBondContact CD2-O 2.81Å; H350-D352 VanDerWaalsContact CD2-O 3.26Å; H350-D352 PolarHBondContact O-N 2.77Å; H350-P354 WeakPolarHBondContact O-CB 3.4Å; H350-P354 WeakPolarHBondContact O-CD 3.5Å
351	H	90.3	Very high	89.7	Confident	159 Å²	159	64.6 Å²	64.6	74%	0.736	33%	0.329	S	S	*	.	S	Bend	trans	-61.6	-42.2	-174.3	-60.5	-67.4	0	0	0	112.8
352	D	87.3	Confident	88.4	Confident	128 Å²	128	71.9 Å²	71.9	68%	0.684	36%	0.361	S	S	*	.	S	Bend	trans	-93.9	105.2	-179.1	-68.5	-42.7	0	0	0	111.6	H350	H350-D352 PolarHBondContact CD2-O 2.81Å; H350-D352 VanDerWaalsContact CD2-O 3.26Å; H350-D352 PolarHBondContact O-N 2.77Å
353	K	88.6	Confident	87.8	Confident	166 Å²	166	71.3 Å²	71.3	72%	0.722	36%	0.358	S	S	*	.			trans	51.2	66.3	175.7	-58.8	175.6	-178.6	173.2	0	112.3	V355 T356	K353-V355 PolarHBondContact O-N 3.42Å; K353-T356 HydrophobicContact CB-CG2 3.91Å; K353-T356 HydrophobicContact CD-CG2 4.42Å
354	P	91.9	Very high	87	Confident	26 Å²	26	74.8 Å²	74.8	17%	0.169	38%	0.376	C	S	.	.	S	Bend	trans	-57.3	-26.9	-176.7	22.2	-33.1	0	0	0	113.4	F217 I218 W349 H350 T374	F217-P354 CarbonylContact C-O 3.59Å; F217-P354 VanDerWaalsContact CA-O 3.22Å; F217-P354 WeakPolarHBondContact CA-O 3.15Å; F217-P354 WeakPolarHBondContact CB-O 3.37Å; I218-P354 PolarHBondContact N-O 3.27Å; W349-P354 HydrophobicContact CB-CB 3.92Å; W349-P354 HydrophobicContact CD2-CB 4.29Å; W349-P354 HydrophobicContact CE3-CB 3.86Å; W349-P354 HydrophobicContact CG-CB 4.36Å; H350-P354 WeakPolarHBondContact O-CB 3.4Å; H350-P354 WeakPolarHBondContact O-CD 3.5Å; P354-T374 HydrophobicContact CB-CG2 4.19Å; P354-T374 HydrophobicContact CG-CG2 3.97Å
355	V	92.8	Very high	86.5	Confident	25 Å²	25	73.4 Å²	73.4	15%	0.152	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	132.7	172.1	-177.2	0	0	0	0	109.6	I218 I220 W349 K353 A372 T374 L393	I218-V355 WeakPolarHBondContact O-CA 3.36Å; I220-V355 HydrophobicContact CD1-CG1 4.26Å; W349-V355 HydrophobicContact CZ3-CG2 4.29Å; K353-V355 PolarHBondContact O-N 3.42Å; V355-A372 HydrophobicContact CG1-CB 4.25Å; V355-T374 HydrophobicContact CG2-CG2 3.61Å; V355-L393 HydrophobicContact CB-CD1 4.38Å; V355-L393 HydrophobicContact CG1-CD1 4.19Å; V355-L393 HydrophobicContact CG1-CD2 4.14Å; V355-L393 HydrophobicContact CG2-CD1 3.72Å; V355-L393 HydrophobicContact CG2-CD2 3.78Å; V355-L393 HydrophobicContact CG2-CG 4.28Å
356	T	92.1	Very high	86.2	Confident	47 Å²	47	73.6 Å²	73.6	29%	0.288	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	140.7	171.4	49.5	0	0	0	0	109.2	I218 H219 I220 K353	I218-T356 PolarHBondContact O-N 3.41Å; H219-T356 CarbonylContact C-O 3.33Å; H219-T356 WeakPolarHBondContact CA-O 3.38Å; H219-T356 PolarHBondContact ND1-OG1 3.38Å; I220-T356 PolarHBondContact N-O 2.7Å; K353-T356 HydrophobicContact CB-CG2 3.91Å; K353-T356 HydrophobicContact CD-CG2 4.42Å
357	I	89.7	Confident	85.8	Confident	36 Å²	36	73.2 Å²	73.2	19%	0.185	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	141.5	-178.6	-63	163.6	0	0	0	107.1	I220 L361 P369 A372	I220-I357 HydrophobicContact CB-CG1 4.42Å; I220-I357 HydrophobicContact CD1-CG1 4.26Å; I357-L361 HydrophobicContact CG2-CB 4.33Å; I357-L361 HydrophobicContact CG2-CD1 4.12Å; I357-L361 HydrophobicContact CG2-CD2 4.48Å; I357-P369 HydrophobicContact CD1-CB 4.44Å; I357-P369 HydrophobicContact CD1-CG 4.21Å; I357-P369 HydrophobicContact CG2-CG 4.42Å; I357-A372 HydrophobicContact CD1-CB 4.09Å
358	S	87.3	Confident	85.1	Confident	29 Å²	29	75.8 Å²	75.8	20%	0.203	39%	0.388	C	S	.	.			trans	-65.9	133	175.1	71.5	0	0	0	0	110.9	I220 I221 N360 L361	I220-S358 PolarHBondContact O-N 3.26Å; I221-S358 PolarHBondContact O-OG 3.23Å; S358-N360 PolarHBondContact O-N 2.93Å; S358-N360 VanDerWaalsContact O-N 3.1Å; S358-L361 WeakPolarHBondContact O-CB 3.09Å; S358-L361 PolarHBondContact O-N 2.81Å
359	N	77.2	Confident	84.5	Confident	159 Å²	159	74.4 Å²	74.4	85%	0.85	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.4	-23.4	-177.7	-65.1	3.3	0	0	0	113.2
360	N	69.9	Low	83.5	Confident	145 Å²	145	81.3 Å²	81.3	78%	0.775	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.7	33.5	-176.7	-64.8	-10.4	0	0	0	112.1	S358 Q362	S358-N360 PolarHBondContact O-N 2.93Å; S358-N360 VanDerWaalsContact O-N 3.1Å; N360-Q362 VanDerWaalsContact C-N 3.35Å; N360-Q362 PolarHBondContact O-N 3.09Å
361	L	74.7	Confident	82.9	Confident	4 Å²	4	80.9 Å²	80.9	2%	0.021	42%	0.421	C	S	.	.			trans	-70.6	85.4	179.4	-164.3	113.8	0	0	0	111.2	I220 D222 I223 I357 S358 L363 S368 P369	I220-L361 HydrophobicContact CG2-CD1 3.86Å; D222-L361 VanDerWaalsContact CA-CD1 3.48Å; I223-L361 HydrophobicContact CD1-CD2 4.18Å; I223-L361 HydrophobicContact CG1-CD1 4.41Å; I223-L361 HydrophobicContact CG1-CD2 4.15Å; I357-L361 HydrophobicContact CG2-CB 4.33Å; I357-L361 HydrophobicContact CG2-CD1 4.12Å; I357-L361 HydrophobicContact CG2-CD2 4.48Å; S358-L361 WeakPolarHBondContact O-CB 3.09Å; S358-L361 PolarHBondContact O-N 2.81Å; L361-L363 HydrophobicContact CD2-CD1 3.58Å; L361-L363 HydrophobicContact CD2-CD2 4.43Å; L361-L363 HydrophobicContact CD2-CG 4.05Å; L361-L363 PolarHBondContact O-N 2.73Å; L361-S368 PolarHBondContact O-OG 3.29Å; L361-P369 VanDerWaalsContact CD2-CD 3.48Å; L361-P369 HydrophobicContact CD2-CG 3.93Å
362	Q	65.4	Low	82.8	Confident	181 Å²	181	74.7 Å²	74.7	85%	0.846	40%	0.397	S	S	*	.			trans	-79.3	109.1	175.1	-67.2	-176.7	-8	0	0	110.3	N360	N360-Q362 VanDerWaalsContact C-N 3.35Å; N360-Q362 PolarHBondContact O-N 3.09Å
363	L	79.6	Confident	83	Confident	21 Å²	21	75.9 Å²	75.9	11%	0.11	39%	0.393	C	S	.	.			trans	-96.6	146.7	164	-42.9	91.2	0	0	0	109.4	I223 L361 F366 L397	I223-L363 HydrophobicContact CB-CD2 3.7Å; I223-L363 HydrophobicContact CB-CG 4.38Å; I223-L363 HydrophobicContact CD1-CD2 4.12Å; I223-L363 HydrophobicContact CG1-CD2 4.37Å; I223-L363 HydrophobicContact CG2-CD2 3.87Å; L361-L363 HydrophobicContact CD2-CD1 3.58Å; L361-L363 HydrophobicContact CD2-CD2 4.43Å; L361-L363 HydrophobicContact CD2-CG 4.05Å; L361-L363 PolarHBondContact O-N 2.73Å; L363-F366 HydrophobicContact CB-CB 4.12Å; L363-F366 HydrophobicContact CD1-CB 4.47Å; L363-F366 HydrophobicContact CD2-CB 3.97Å; L363-F366 HydrophobicContact CG-CB 4.43Å; L363-L397 HydrophobicContact CD2-CD2 4.13Å
364	L	74.9	Confident	83.3	Confident	183 Å²	183	70.7 Å²	70.7	96%	0.958	38%	0.375	S	S	*	.	S	Bend	trans	-76.4	-27.3	-178.8	-68.8	168.9	0	0	0	113.5
365	E	83.9	Confident	83.3	Confident	41 Å²	41	73.9 Å²	73.9	19%	0.192	39%	0.391	C	S	.	.	S	Bend	trans	-121.4	-11.7	-170.7	-153.8	-166.2	164	0	0	113.5	R399 L400 Y404	E365-R399 HydrophobicContact CG-CG 4.37Å; E365-R399 WeakPolarHBondContact O-CG 3.5Å; E365-R399 IonicContact OE1-CZ 2.69Å; E365-R399 IonicContact OE1-NH1 2.68Å; E365-R399 PolarHBondContact OE1-NH1 3.25Å; E365-R399 IonicContact OE2-NH1 2.97Å; E365-R399 PolarHBondContact OE2-NH1 3.33Å; E365-L400 PolarHBondContact O-N 3.26Å; E365-Y404 PolarHBondContact OE1-OH 3.1Å
366	F	87.7	Confident	83.3	Confident	4 Å²	4	76.5 Å²	76.5	2%	0.018	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	151.9	-172.1	-69.7	-91.8	0	0	0	110.9	S226 Q329 L363 L397 R398 R399	S226-F366 WeakPolarHBondContact OG-CE2 3.42Å; Q329-F366 HydrophobicContact CG-CE1 4.39Å; L363-F366 HydrophobicContact CB-CB 4.12Å; L363-F366 HydrophobicContact CD1-CB 4.47Å; L363-F366 HydrophobicContact CD2-CB 3.97Å; L363-F366 HydrophobicContact CG-CB 4.43Å; F366-L397 HydrophobicContact CD1-CB 3.65Å; F366-L397 HydrophobicContact CE1-CB 3.99Å; F366-L397 HydrophobicContact CG-CB 4.29Å; F366-R398 CarbonylContact C-O 3.44Å; F366-R398 VanDerWaalsContact CA-O 3.25Å; F366-R398 WeakPolarHBondContact CA-O 3.26Å; F366-R398 WeakPolarHBondContact CD1-O 3.29Å; F366-R399 HydrophobicContact CD1-CB 4.26Å; F366-R399 HydrophobicContact CE1-CB 4.14Å; F366-R399 HydrophobicContact CE1-CG 4.47Å; F366-R399 VanDerWaalsContact CZ-NH1 3.33Å
367	E	84.9	Confident	83.3	Confident	69 Å²	69	75 Å²	75	32%	0.322	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70	145.4	168.6	-170.9	173.1	-168.1	0	0	109.8	H370 R398 L400	E367-H370 IonicContact OE1-CE1 3.51Å; E367-R398 HydrophobicContact CB-CB 4.33Å; E367-R398 PolarHBondContact N-O 2.98Å; E367-R398 WeakPolarHBondContact OE2-CD 3.38Å; E367-R398 IonicContact OE2-NH1 2.89Å; E367-L400 HydrophobicContact CB-CD2 4.1Å
368	S	82.2	Confident	83.3	Confident	55 Å²	55	74.1 Å²	74.1	39%	0.385	39%	0.391	S	S	.	.	P	Polyproline II helix	trans	-60.1	127.6	177.3	-52.4	0	0	0	0	110.3	L361 H370	L361-S368 PolarHBondContact O-OG 3.29Å; S368-H370 PolarHBondContact O-N 3.25Å; S368-H370 PolarHBondContact O-ND1 3.13Å; S368-H370 VanDerWaalsContact O-ND1 3.09Å
369	P	82.3	Confident	83	Confident	14 Å²	14	81.6 Å²	81.6	9%	0.091	42%	0.42	C	S	.	.	P	Polyproline II helix	trans	-63.5	120.6	180	25.4	-32.9	0	0	0	109.6	I357 L361 G371 I395 P396 L397	I357-P369 HydrophobicContact CD1-CB 4.44Å; I357-P369 HydrophobicContact CD1-CG 4.21Å; I357-P369 HydrophobicContact CG2-CG 4.42Å; L361-P369 VanDerWaalsContact CD2-CD 3.48Å; L361-P369 HydrophobicContact CD2-CG 3.93Å; P369-G371 PolarHBondContact O-N 3.48Å; P369-I395 HydrophobicContact CB-CG2 4.21Å; P369-I395 HydrophobicContact CG-CG2 4.27Å; P369-P396 WeakPolarHBondContact CB-O 3.25Å; P369-L397 HydrophobicContact CG-CD2 4.42Å
370	H	75.3	Confident	82.9	Confident	175 Å²	175	77.3 Å²	77.3	81%	0.81	40%	0.397	S	S	*	.	S	Bend	trans	-70.5	-11	-179.7	-72.2	51.3	0	0	0	113.1	E367 S368	E367-H370 IonicContact OE1-CE1 3.51Å; S368-H370 PolarHBondContact O-N 3.25Å; S368-H370 PolarHBondContact O-ND1 3.13Å; S368-H370 VanDerWaalsContact O-ND1 3.09Å
371	G	82.4	Confident	83	Confident	31 Å²	31	70.6 Å²	70.6	32%	0.32	36%	0.362	S	S	.	.			trans	-175.8	178.1	176.1	0	0	0	0	0	110.4	P369 P396	P369-G371 PolarHBondContact O-N 3.48Å; G371-P396 WeakPolarHBondContact O-CD 3.45Å
372	A	89.4	Confident	83.3	Confident	29 Å²	29	74.8 Å²	74.8	24%	0.24	39%	0.388	C	S	.	.			trans	-143.3	150.5	171.3	0	0	0	0	0	109.5	V355 I357 L393 I394 I395	V355-A372 HydrophobicContact CG1-CB 4.25Å; I357-A372 HydrophobicContact CD1-CB 4.09Å; A372-L393 HydrophobicContact CB-CD1 3.6Å; A372-I394 WeakPolarHBondContact CA-O 3.25Å; A372-I394 WeakPolarHBondContact CB-O 3.26Å; A372-I395 HydrophobicContact CB-CG1 4.32Å
373	Y	91.8	Very high	84.2	Confident	153 Å²	153	69.3 Å²	69.3	60%	0.6	37%	0.367	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103.8	140.5	-174.7	-50.4	-75.6	0	0	0	110.5	L393 I394 P396	Y373-L393 CarbonylContact O-C 3.31Å; Y373-L393 WeakPolarHBondContact O-CA 3.44Å; Y373-L393 WeakPolarHBondContact O-CD1 3.47Å; Y373-I394 PolarHBondContact N-O 3.35Å; Y373-I394 PolarHBondContact O-N 3.5Å; Y373-P396 HydrophobicContact CE2-CG 3.94Å
374	T	94.1	Very high	84.4	Confident	57 Å²	57	75.1 Å²	75.1	35%	0.35	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	135.3	175.4	50	0	0	0	0	110.4	W349 P354 V355 L393	W349-T374 HydrophobicContact CD2-CG2 3.8Å; W349-T374 HydrophobicContact CE3-CG2 4.08Å; W349-T374 HydrophobicContact CG-CG2 4.27Å; W349-T374 HydrophobicContact CH2-CG2 4.34Å; W349-T374 HydrophobicContact CZ2-CG2 4.05Å; W349-T374 HydrophobicContact CZ3-CG2 4.34Å; P354-T374 HydrophobicContact CB-CG2 4.19Å; P354-T374 HydrophobicContact CG-CG2 3.97Å; V355-T374 HydrophobicContact CG2-CG2 3.61Å; T374-L393 HydrophobicContact CG2-CD1 4.49Å
375	L	92.9	Very high	85	Confident	93 Å²	93	71.5 Å²	71.5	49%	0.487	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	146.6	178.7	-175	72.7	0	0	0	109.3	W349 L392	W349-L375 PolarHBondContact NE1-O 2.82Å; L375-L392 HydrophobicContact CB-CB 4.31Å; L375-L392 HydrophobicContact CD2-CD2 4.2Å; L375-L392 PolarHBondContact N-O 2.82Å; L375-L392 PolarHBondContact O-N 2.75Å
376	D	92.7	Very high	85.2	Confident	81 Å²	81	70.7 Å²	70.7	43%	0.433	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	113.4	165.6	-176.5	-11.6	0	0	0	108.3	T378 C390	D376-T378 WeakPolarHBondContact OD1-CB 3.49Å; D376-T378 PolarHBondContact OD1-N 2.79Å; D376-T378 PolarHBondContact OD1-OG1 2.95Å; D376-C390 VanDerWaalsContact OD1-O 3.13Å
377	C	92	Very high	85.4	Confident	15 Å²	15	72.9 Å²	72.9	10%	0.101	40%	0.4	C	S	.	.			trans	-97	7.6	-180	48.9	0	0	0	0	113.2	K379 N380 G381 C390 L392	C377-K379 PolarHBondContact O-N 2.8Å; C377-N380 PolarHBondContact O-N 3.43Å; C377-G381 PolarHBondContact O-N 2.77Å; C377-C390 HydrophobicContact CB-CB 3.98Å; C377-C390 WeakPolarHBondContact CB-SG 3.3Å; C377-C390 PolarHBondContact N-O 3.08Å; C377-C390 WeakPolarHBondContact SG-CB 3.36Å; C377-C390 PolarHBondContact SG-O 3.43Å; C377-C390 CovalentContact SG-SG 2.05Å; C377-C390 PolarHBondContact SG-SG 3.33Å; C377-L392 HydrophobicContact CB-CB 4.37Å
378	T	88.6	Confident	85.8	Confident	17 Å²	17	71.5 Å²	71.5	10%	0.104	39%	0.392	C	S	.	.	G	3₁₀ helix	trans	-57.4	-33.6	-173.9	-59.6	0	0	0	0	112.8	I342 D376 N380 G381 C390	I342-T378 HydrophobicContact CD1-CG2 3.15Å; I342-T378 HydrophobicContact CG1-CG2 3.74Å; D376-T378 WeakPolarHBondContact OD1-CB 3.49Å; D376-T378 PolarHBondContact OD1-N 2.79Å; D376-T378 PolarHBondContact OD1-OG1 2.95Å; T378-N380 PolarHBondContact O-N 3.38Å; T378-G381 PolarHBondContact O-N 3.03Å; T378-C390 PolarHBondContact N-O 3.12Å; T378-C390 PolarHBondContact OG1-N 3.42Å; T378-C390 PolarHBondContact OG1-O 3.18Å
379	K	81.2	Confident	86.3	Confident	186 Å²	186	69 Å²	69	81%	0.809	38%	0.375	S	S	*	.	G	3₁₀ helix	trans	-56.9	-30.3	175	-67.9	-173.8	177.4	-176.6	0	113.9	C377	C377-K379 PolarHBondContact O-N 2.8Å
380	N	75.7	Confident	86.8	Confident	70 Å²	70	68.5 Å²	68.5	37%	0.374	37%	0.371	S	S	.	.	G	3₁₀ helix	trans	-102.6	6	-179.7	-53	-1.7	0	0	0	111.5	N50 C377 T378 T382	N50-N380 PolarHBondContact O-ND2 3.16Å; C377-N380 PolarHBondContact O-N 3.43Å; T378-N380 PolarHBondContact O-N 3.38Å; N380-T382 VanDerWaalsContact C-N 3.31Å; N380-T382 PolarHBondContact O-N 3.07Å
381	G	71.2	Confident	87.8	Confident	3 Å²	3	60.2 Å²	60.2	3%	0.031	33%	0.333	C	S	.	.			trans	-89	16	-177	0	0	0	0	0	114.5	C377 T378 Y388	C377-G381 PolarHBondContact O-N 2.77Å; T378-G381 PolarHBondContact O-N 3.03Å; G381-Y388 PolarHBondContact O-N 3.02Å
382	T	82.2	Confident	88.4	Confident	92 Å²	92	60.1 Å²	60.1	56%	0.564	33%	0.325	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.8	135.3	-178.2	66.1	0	0	0	0	110.9	N380 T387	N380-T382 VanDerWaalsContact C-N 3.31Å; N380-T382 PolarHBondContact O-N 3.07Å; T382-T387 HydrophobicContact CG2-CG2 3.67Å
383	T	84.1	Confident	88.7	Confident	66 Å²	66	58.8 Å²	58.8	41%	0.405	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	170.7	176.7	74.1	0	0	0	0	109.5	T385 G386 Y388	T383-T385 PolarHBondContact O-N 3.13Å; T383-T385 PolarHBondContact OG1-N 2.76Å; T383-T385 PolarHBondContact OG1-OG1 2.66Å; T383-T385 VanDerWaalsContact OG1-OG1 3.1Å; T383-G386 PolarHBondContact N-O 2.88Å; T383-G386 PolarHBondContact O-N 2.7Å; T383-G386 VanDerWaalsContact O-N 3.09Å; T383-G386 VanDerWaalsContact O-O 3.13Å; T383-G386 PolarHBondContact OG1-O 2.84Å; T383-Y388 HydrophobicContact CG2-CD2 4.41Å; T383-Y388 WeakPolarHBondContact OG1-CE2 3.46Å
384	N	83.7	Confident	88.8	Confident	144 Å²	144	53.2 Å²	53.2	77%	0.77	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.8	-17.9	179.1	-55.9	5	0	0	0	113.6	Y62	Y62-N384 PolarHBondContact OH-ND2 3.49Å
385	T	86.9	Confident	88.8	Confident	106 Å²	106	50.5 Å²	50.5	65%	0.65	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.5	-6.4	179.7	57.1	0	0	0	0	113.5	T383 Y388	T383-T385 PolarHBondContact O-N 3.13Å; T383-T385 PolarHBondContact OG1-N 2.76Å; T383-T385 PolarHBondContact OG1-OG1 2.66Å; T383-T385 VanDerWaalsContact OG1-OG1 3.1Å; T385-Y388 WeakPolarHBondContact OG1-CE2 3.41Å; T385-Y388 PolarHBondContact OG1-OH 3.24Å
386	G	88.3	Confident	88.7	Confident	24 Å²	24	48 Å²	48	25%	0.247	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	143.1	-173.1	-179.9	0	0	0	0	0	113.3	T383 Y388	T383-G386 PolarHBondContact N-O 2.88Å; T383-G386 PolarHBondContact O-N 2.7Å; T383-G386 VanDerWaalsContact O-N 3.09Å; T383-G386 VanDerWaalsContact O-O 3.13Å; T383-G386 PolarHBondContact OG1-O 2.84Å; G386-Y388 WeakPolarHBondContact O-CD2 3.16Å
387	T	92.1	Very high	88.6	Confident	51 Å²	51	44.3 Å²	44.3	31%	0.313	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	128.6	177.3	60.1	0	0	0	0	108.7	T341 I342 T382	T341-T387 CarbonylContact C-O 3.28Å; T341-T387 VanDerWaalsContact CA-O 3.25Å; T341-T387 WeakPolarHBondContact CA-O 3.4Å; T341-T387 WeakPolarHBondContact CB-O 3.23Å; I342-T387 WeakPolarHBondContact CD1-OG1 3.28Å; I342-T387 WeakPolarHBondContact CG1-O 3.41Å; I342-T387 PolarHBondContact N-O 3.44Å; T382-T387 HydrophobicContact CG2-CG2 3.67Å
388	Y	92.4	Very high	88.5	Confident	40 Å²	40	48.6 Å²	48.6	16%	0.157	26%	0.261	C	S	.	.			trans	-118.5	139.8	-175.2	-65.8	-96.1	0	0	0	110.7	S337 Y340 G381 T383 T385 G386 C390	S337-Y388 WeakPolarHBondContact O-CD1 3.43Å; Y340-Y388 WeakPolarHBondContact O-CD1 3.35Å; G381-Y388 PolarHBondContact O-N 3.02Å; T383-Y388 HydrophobicContact CG2-CD2 4.41Å; T383-Y388 WeakPolarHBondContact OG1-CE2 3.46Å; T385-Y388 WeakPolarHBondContact OG1-CE2 3.41Å; T385-Y388 PolarHBondContact OG1-OH 3.24Å; G386-Y388 WeakPolarHBondContact O-CD2 3.16Å; Y388-C390 PolarHBondContact O-N 2.84Å
389	S	92.9	Very high	88.6	Confident	2 Å²	2	48.4 Å²	48.4	1%	0.014	26%	0.258	C	S	.	.			trans	-62.8	135.6	176.3	-176.2	0	0	0	0	110.9	G336 S337 F347	G336-S389 WeakPolarHBondContact CA-O 3.49Å; S337-S389 PolarHBondContact N-O 3.44Å; F347-S389 WeakPolarHBondContact CB-OG 3.29Å; F347-S389 PolarHBondContact N-OG 2.84Å; F347-S389 PolarHBondContact O-OG 3.41Å
390	C	93.9	Very high	89	Confident	3 Å²	3	43.3 Å²	43.3	2%	0.02	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140	119.2	-174.4	-178	0	0	0	0	110	R280 I335 D376 C377 T378 Y388	R280-C390 PolarHBondContact NH1-SG 2.98Å; I335-C390 CarbonylContact O-C 3.54Å; I335-C390 WeakPolarHBondContact O-CA 3.47Å; D376-C390 VanDerWaalsContact OD1-O 3.13Å; C377-C390 HydrophobicContact CB-CB 3.98Å; C377-C390 WeakPolarHBondContact CB-SG 3.3Å; C377-C390 PolarHBondContact N-O 3.08Å; C377-C390 WeakPolarHBondContact SG-CB 3.36Å; C377-C390 PolarHBondContact SG-O 3.43Å; C377-C390 CovalentContact SG-SG 2.05Å; C377-C390 PolarHBondContact SG-SG 3.33Å; T378-C390 PolarHBondContact N-O 3.12Å; T378-C390 PolarHBondContact OG1-N 3.42Å; T378-C390 PolarHBondContact OG1-O 3.18Å; Y388-C390 PolarHBondContact O-N 2.84Å
391	L	95.3	Very high	89.7	Confident	1 Å²	1	41.1 Å²	41.1	1%	0.005	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	130.3	174.1	-61.7	-174.8	0	0	0	109.9	V216 I335 F347 W349	V216-L391 HydrophobicContact CB-CD1 4Å; V216-L391 HydrophobicContact CG2-CD1 4.13Å; I335-L391 HydrophobicContact CB-CB 4.27Å; I335-L391 PolarHBondContact N-O 3.13Å; I335-L391 PolarHBondContact O-N 3.45Å; F347-L391 HydrophobicContact CB-CD1 3.69Å; F347-L391 HydrophobicContact CB-CG 3.96Å; W349-L391 HydrophobicContact CD2-CB 4.5Å; W349-L391 HydrophobicContact CD2-CD1 4.07Å; W349-L391 HydrophobicContact CE3-CD1 4.44Å; W349-L391 HydrophobicContact CG-CD1 4.31Å; W349-L391 HydrophobicContact CG-CD2 4.37Å; W349-L391 HydrophobicContact CH2-CB 4.44Å; W349-L391 HydrophobicContact CZ2-CB 3.7Å
392	L	95	Very high	90.5	Very high	30 Å²	30	43.1 Å²	43.1	16%	0.157	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	125.6	-179.1	-170.5	73.9	0	0	0	110.5	T332 N334 L375 C377 I394	T332-L392 HydrophobicContact CG2-CD1 4.23Å; N334-L392 HydrophobicContact CB-CD1 3.94Å; L375-L392 HydrophobicContact CB-CB 4.31Å; L375-L392 HydrophobicContact CD2-CD2 4.2Å; L375-L392 PolarHBondContact N-O 2.82Å; L375-L392 PolarHBondContact O-N 2.75Å; C377-L392 HydrophobicContact CB-CB 4.37Å; L392-I394 HydrophobicContact CD2-CD1 4.17Å; L392-I394 HydrophobicContact CD2-CG1 4.09Å; L392-I394 HydrophobicContact CG-CG1 4.23Å
393	L	95.3	Very high	90.9	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	126.9	170.2	162	55.5	0	0	0	108.6	I218 I220 T332 V333 W349 V355 A372 Y373 T374 I395	I218-L393 HydrophobicContact CD1-CD2 4.13Å; I220-L393 HydrophobicContact CD1-CD2 4.5Å; T332-L393 CarbonylContact C-O 3.55Å; T332-L393 WeakPolarHBondContact CA-O 3.12Å; V333-L393 HydrophobicContact CB-CB 4.11Å; V333-L393 HydrophobicContact CB-CD2 4.38Å; V333-L393 HydrophobicContact CB-CG 4.43Å; V333-L393 HydrophobicContact CG2-CB 4.36Å; V333-L393 HydrophobicContact CG2-CD2 3.93Å; V333-L393 HydrophobicContact CG2-CG 4.13Å; V333-L393 PolarHBondContact N-O 3.31Å; V333-L393 PolarHBondContact O-N 3.44Å; W349-L393 HydrophobicContact CH2-CB 3.84Å; W349-L393 HydrophobicContact CZ2-CB 4.01Å; V355-L393 HydrophobicContact CB-CD1 4.38Å; V355-L393 HydrophobicContact CG1-CD1 4.19Å; V355-L393 HydrophobicContact CG1-CD2 4.14Å; V355-L393 HydrophobicContact CG2-CD1 3.72Å; V355-L393 HydrophobicContact CG2-CD2 3.78Å; V355-L393 HydrophobicContact CG2-CG 4.28Å; A372-L393 HydrophobicContact CB-CD1 3.6Å; Y373-L393 CarbonylContact O-C 3.31Å; Y373-L393 WeakPolarHBondContact O-CA 3.44Å; Y373-L393 WeakPolarHBondContact O-CD1 3.47Å; T374-L393 HydrophobicContact CG2-CD1 4.49Å; L393-I395 HydrophobicContact CD1-CG1 4.3Å; L393-I395 HydrophobicContact CG-CG1 4.2Å
394	I	95	Very high	91.2	Very high	37 Å²	37	39.6 Å²	39.6	19%	0.19	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	120.4	179	-49.4	179.3	0	0	0	109.2	E330 T332 A372 Y373 L392	E330-I394 HydrophobicContact CB-CG2 4.04Å; E330-I394 HydrophobicContact CG-CG2 4.4Å; T332-I394 HydrophobicContact CG2-CB 4.47Å; T332-I394 HydrophobicContact CG2-CG1 4.05Å; T332-I394 HydrophobicContact CG2-CG2 4.36Å; A372-I394 WeakPolarHBondContact CA-O 3.25Å; A372-I394 WeakPolarHBondContact CB-O 3.26Å; Y373-I394 PolarHBondContact N-O 3.35Å; Y373-I394 PolarHBondContact O-N 3.5Å; L392-I394 HydrophobicContact CD2-CD1 4.17Å; L392-I394 HydrophobicContact CD2-CG1 4.09Å; L392-I394 HydrophobicContact CG-CG1 4.23Å
395	I	92.8	Very high	91.7	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	109.2	179.1	-56	166.3	0	0	0	108.3	I220 I223 Y233 C331 V333 P369 A372 L393 L397	I220-I395 HydrophobicContact CD1-CD1 3.65Å; I220-I395 HydrophobicContact CD1-CG1 4.22Å; I223-I395 HydrophobicContact CD1-CG2 4.21Å; Y233-I395 HydrophobicContact CE2-CD1 4.19Å; C331-I395 PolarHBondContact N-O 3.19Å; C331-I395 VanDerWaalsContact N-O 3.08Å; C331-I395 PolarHBondContact O-N 3.35Å; V333-I395 HydrophobicContact CG2-CD1 4.24Å; P369-I395 HydrophobicContact CB-CG2 4.21Å; P369-I395 HydrophobicContact CG-CG2 4.27Å; A372-I395 HydrophobicContact CB-CG1 4.32Å; L393-I395 HydrophobicContact CD1-CG1 4.3Å; L393-I395 HydrophobicContact CG-CG1 4.2Å; I395-L397 HydrophobicContact CG2-CD2 3.87Å; I395-L397 HydrophobicContact CG2-CG 4.2Å
396	P	92.3	Very high	92	Very high	39 Å²	39	34.8 Å²	34.8	25%	0.253	20%	0.2	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	121.7	175.1	31.3	-33.8	0	0	0	110.7	P369 G371 Y373	P369-P396 WeakPolarHBondContact CB-O 3.25Å; G371-P396 WeakPolarHBondContact O-CD 3.45Å; Y373-P396 HydrophobicContact CE2-CG 3.94Å
397	L	90.2	Very high	92.2	Very high	4 Å²	4	37.6 Å²	37.6	2%	0.021	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	126.3	-180	-61	175.8	0	0	0	110	I223 K328 Q329 C331 L363 F366 P369 I395	I223-L397 HydrophobicContact CD1-CD2 4.01Å; K328-L397 WeakPolarHBondContact CA-O 3.42Å; Q329-L397 PolarHBondContact N-O 3.2Å; Q329-L397 PolarHBondContact O-N 2.95Å; C331-L397 HydrophobicContact CB-CD1 4.39Å; L363-L397 HydrophobicContact CD2-CD2 4.13Å; F366-L397 HydrophobicContact CD1-CB 3.65Å; F366-L397 HydrophobicContact CE1-CB 3.99Å; F366-L397 HydrophobicContact CG-CB 4.29Å; P369-L397 HydrophobicContact CG-CD2 4.42Å; I395-L397 HydrophobicContact CG2-CD2 3.87Å; I395-L397 HydrophobicContact CG2-CG 4.2Å
398	R	89.7	Confident	92.2	Very high	106 Å²	106	35.6 Å²	35.6	40%	0.4	20%	0.2	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	127.9	176.6	-170	-166.1	-163.2	174.6	6.1	110.2	K328 F366 E367 A864	K328-R398 HydrophobicContact CG-CG 4.38Å; F366-R398 CarbonylContact C-O 3.44Å; F366-R398 VanDerWaalsContact CA-O 3.25Å; F366-R398 WeakPolarHBondContact CA-O 3.26Å; F366-R398 WeakPolarHBondContact CD1-O 3.29Å; E367-R398 HydrophobicContact CB-CB 4.33Å; E367-R398 PolarHBondContact N-O 2.98Å; E367-R398 WeakPolarHBondContact OE2-CD 3.38Å; E367-R398 IonicContact OE2-NH1 2.89Å; R398-A864 PolarHBondContact NH2-O 3.23Å
399	R	90.9	Very high	92.3	Very high	12 Å²	12	33.9 Å²	33.9	5%	0.045	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	140.9	-178.1	-160.4	178.9	-53.6	-79.5	-9.6	112.1	D327 E365 F366 Y404	D327-R399 PolarHBondContact O-N 3.04Å; D327-R399 IonicContact OD1-CZ 3.72Å; D327-R399 IonicContact OD1-NE 2.73Å; D327-R399 PolarHBondContact OD1-NE 3Å; D327-R399 IonicContact OD1-NH2 2.87Å; D327-R399 IonicContact OD2-CZ 2.92Å; D327-R399 IonicContact OD2-NE 3.36Å; D327-R399 PolarHBondContact OD2-NE 2.99Å; D327-R399 IonicContact OD2-NH2 3.23Å; D327-R399 PolarHBondContact OD2-NH2 3.01Å; E365-R399 HydrophobicContact CG-CG 4.37Å; E365-R399 WeakPolarHBondContact O-CG 3.5Å; E365-R399 IonicContact OE1-CZ 2.69Å; E365-R399 IonicContact OE1-NH1 2.68Å; E365-R399 PolarHBondContact OE1-NH1 3.25Å; E365-R399 IonicContact OE2-NH1 2.97Å; E365-R399 PolarHBondContact OE2-NH1 3.33Å; F366-R399 HydrophobicContact CD1-CB 4.26Å; F366-R399 HydrophobicContact CE1-CB 4.14Å; F366-R399 HydrophobicContact CE1-CG 4.47Å; F366-R399 VanDerWaalsContact CZ-NH1 3.33Å; R399-Y404 HydrophobicContact CG-CE2 4.41Å
400	L	89.7	Confident	92.4	Very high	79 Å²	79	37.7 Å²	37.7	41%	0.414	21%	0.213	S	C	.	.			trans	-84	111.3	173.2	-66.2	173.9	0	0	0	110.2	E365 E367 G402	E365-L400 PolarHBondContact O-N 3.26Å; E367-L400 HydrophobicContact CB-CD2 4.1Å; L400-G402 PolarHBondContact O-N 2.63Å
401	I	89.8	Confident	92.4	Very high	24 Å²	24	39.4 Å²	39.4	12%	0.123	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.6	-15.1	-173.8	-164.6	158.9	0	0	0	114.9	P325 M326 S403 Y404 I405 Y860	P325-I401 HydrophobicContact CG-CD1 4.14Å; P325-I401 HydrophobicContact CG-CG1 4.19Å; M326-I401 HydrophobicContact CB-CD1 4.47Å; M326-I401 HydrophobicContact CE-CD1 3.85Å; M326-I401 HydrophobicContact CG-CD1 3.4Å; I401-S403 VanDerWaalsContact C-N 3.31Å; I401-S403 PolarHBondContact O-N 3.47Å; I401-Y404 PolarHBondContact O-N 3.42Å; I401-Y404 VanDerWaalsContact O-N 3.12Å; I401-I405 HydrophobicContact CG1-CD1 4.22Å; I401-I405 HydrophobicContact CG1-CG1 4.12Å; I401-I405 HydrophobicContact CG2-CD1 3.98Å; I401-I405 PolarHBondContact O-N 2.86Å; I401-Y860 HydrophobicContact CD1-CE2 4Å
402	G	88.5	Confident	92.4	Very high	45 Å²	45	39.3 Å²	39.3	46%	0.464	22%	0.223	S	C	.	.	H	α-helix	trans	-58.7	-36.9	-170.5	0	0	0	0	0	114.4	L400 V406	L400-G402 PolarHBondContact O-N 2.63Å; G402-V406 PolarHBondContact O-N 2.88Å
403	S	89.1	Confident	92.4	Very high	62 Å²	62	39.5 Å²	39.5	43%	0.434	23%	0.225	S	C	.	.	H	α-helix	trans	-61.9	-52.8	174.1	50.9	0	0	0	0	111.4	I401 I405 V406 T407	I401-S403 VanDerWaalsContact C-N 3.31Å; I401-S403 PolarHBondContact O-N 3.47Å; S403-I405 VanDerWaalsContact C-N 3.29Å; S403-I405 PolarHBondContact O-N 3.01Å; S403-V406 PolarHBondContact O-N 2.87Å; S403-V406 VanDerWaalsContact O-N 3.08Å; S403-T407 PolarHBondContact O-N 3.48Å; S403-T407 PolarHBondContact O-OG1 3.38Å
404	Y	91.8	Very high	92.4	Very high	23 Å²	23	44.4 Å²	44.4	9%	0.09	25%	0.251	C	S	.	.	H	α-helix	trans	-60.1	-33.5	179.7	-67.6	-77.2	0	0	0	113.6	F324 P325 E365 R399 I401 T408 Y409	F324-Y404 HydrophobicContact CE1-CE1 4.1Å; F324-Y404 HydrophobicContact CZ-CD1 4.4Å; F324-Y404 AromaticContact CZ-CE1 3.62Å; F324-Y404 HydrophobicContact CZ-CE1 3.62Å; F324-Y404 HydrophobicContact CZ-CE2 4.32Å; F324-Y404 AromaticContact CZ-CZ 3.57Å; P325-Y404 HydrophobicContact CB-CD1 4.24Å; P325-Y404 HydrophobicContact CB-CD2 3.73Å; P325-Y404 HydrophobicContact CB-CE2 4.12Å; P325-Y404 HydrophobicContact CB-CG 3.79Å; P325-Y404 HydrophobicContact CG-CD2 4.41Å; P325-Y404 HydrophobicContact CG-CG 4.07Å; E365-Y404 PolarHBondContact OE1-OH 3.1Å; R399-Y404 HydrophobicContact CG-CE2 4.41Å; I401-Y404 PolarHBondContact O-N 3.42Å; I401-Y404 VanDerWaalsContact O-N 3.12Å; Y404-T408 WeakPolarHBondContact O-CA 3.41Å; Y404-T408 WeakPolarHBondContact O-CB 3.43Å; Y404-T408 PolarHBondContact O-N 3.01Å; Y404-Y409 WeakPolarHBondContact O-CD2 3.45Å; Y404-Y409 PolarHBondContact O-N 3.47Å; Y404-Y409 VanDerWaalsContact O-N 3.13Å
405	I	92.9	Very high	92.4	Very high	52 Å²	52	44.1 Å²	44.1	27%	0.267	25%	0.25	S	C	.	.	I	π-helix	trans	-60.7	-46.9	174.1	-69.4	169.4	0	0	0	110.5	I401 S403 Y409 I410 W857	I401-I405 HydrophobicContact CG1-CD1 4.22Å; I401-I405 HydrophobicContact CG1-CG1 4.12Å; I401-I405 HydrophobicContact CG2-CD1 3.98Å; I401-I405 PolarHBondContact O-N 2.86Å; S403-I405 VanDerWaalsContact C-N 3.29Å; S403-I405 PolarHBondContact O-N 3.01Å; I405-Y409 HydrophobicContact CG1-CD2 4.4Å; I405-Y409 PolarHBondContact O-N 2.96Å; I405-I410 HydrophobicContact CG2-CD1 4Å; I405-I410 HydrophobicContact CG2-CG1 4.29Å; I405-I410 WeakPolarHBondContact O-CB 3.13Å; I405-I410 WeakPolarHBondContact O-CG1 3.36Å; I405-I410 PolarHBondContact O-N 2.89Å; I405-W857 HydrophobicContact CD1-CH2 4.42Å; I405-W857 HydrophobicContact CG1-CH2 4.18Å
406	V	93.9	Very high	92.5	Very high	97 Å²	97	44.1 Å²	44.1	59%	0.588	25%	0.25	S	C	*	.	I	π-helix	trans	-76.6	-38.1	-176.6	178.6	0	0	0	0	112.4	G402 S403 P411	G402-V406 PolarHBondContact O-N 2.88Å; S403-V406 PolarHBondContact O-N 2.87Å; S403-V406 VanDerWaalsContact O-N 3.08Å; V406-P411 VanDerWaalsContact O-CD 3.31Å; V406-P411 WeakPolarHBondContact O-CD 3.38Å
407	T	92.1	Very high	92.5	Very high	82 Å²	82	45 Å²	45	50%	0.503	25%	0.252	S	S	.	.	I	π-helix	trans	-90	-24.5	-175.1	59.4	0	0	0	0	114.4	S403	S403-T407 PolarHBondContact O-N 3.48Å; S403-T407 PolarHBondContact O-OG1 3.38Å
408	T	92.5	Very high	92.7	Very high	9 Å²	9	47.7 Å²	47.7	6%	0.055	27%	0.268	C	S	.	.	I	π-helix	trans	-121.1	-58.7	-176.6	-50.8	0	0	0	0	112.4	Y404 I410 P411 E412 V451 I464	Y404-T408 WeakPolarHBondContact O-CA 3.41Å; Y404-T408 WeakPolarHBondContact O-CB 3.43Å; Y404-T408 PolarHBondContact O-N 3.01Å; T408-I410 PolarHBondContact O-N 2.98Å; T408-P411 WeakPolarHBondContact O-CD 3.25Å; T408-E412 WeakPolarHBondContact O-CB 3.24Å; T408-E412 WeakPolarHBondContact O-CG 3.27Å; T408-E412 PolarHBondContact O-N 3.33Å; T408-V451 HydrophobicContact CG2-CG2 3.75Å; T408-I464 HydrophobicContact CG2-CD1 4.38Å
409	Y	94.1	Very high	92.8	Very high	4 Å²	4	43 Å²	43	2%	0.016	25%	0.251	C	S	.	.	I	π-helix	trans	-66.2	-45.4	-171.3	-70.7	-86.4	0	0	0	113.1	P325 Y404 I405 V413 W467 Y856 W857	P325-Y409 WeakPolarHBondContact CD-OH 3.42Å; P325-Y409 HydrophobicContact CG-CE2 4.05Å; Y404-Y409 WeakPolarHBondContact O-CD2 3.45Å; Y404-Y409 PolarHBondContact O-N 3.47Å; Y404-Y409 VanDerWaalsContact O-N 3.13Å; I405-Y409 HydrophobicContact CG1-CD2 4.4Å; I405-Y409 PolarHBondContact O-N 2.96Å; Y409-V413 WeakPolarHBondContact O-CG2 3.3Å; Y409-V413 PolarHBondContact O-N 3.33Å; Y409-W467 AromaticContact CD1-CD2 3.72Å; Y409-W467 HydrophobicContact CD1-CD2 3.72Å; Y409-W467 AromaticContact CD1-CE2 3.46Å; Y409-W467 VanDerWaalsContact CD1-CE2 3.46Å; Y409-W467 HydrophobicContact CD1-CE3 4.08Å; Y409-W467 HydrophobicContact CD1-CG 4.27Å; Y409-W467 AromaticContact CD1-CH2 3.94Å; Y409-W467 HydrophobicContact CD1-CH2 3.94Å; Y409-W467 AromaticContact CD1-CZ2 3.6Å; Y409-W467 HydrophobicContact CD1-CZ2 3.6Å; Y409-W467 HydrophobicContact CD1-CZ3 4.17Å; Y409-W467 AromaticContact CD1-NE1 3.85Å; Y409-W467 AromaticContact CE1-CD2 3.66Å; Y409-W467 HydrophobicContact CE1-CD2 3.66Å; Y409-W467 AromaticContact CE1-CE2 3.9Å; Y409-W467 AromaticContact CE1-CE3 3.96Å; Y409-W467 HydrophobicContact CE1-CE3 3.96Å; Y409-W467 AromaticContact CE1-CG 3.89Å; Y409-W467 HydrophobicContact CE1-CG 3.89Å; Y409-W467 HydrophobicContact CE1-CZ2 4.4Å; Y409-W467 HydrophobicContact CE1-CZ3 4.43Å; Y409-W467 HydrophobicContact CG-CZ2 4.48Å; Y409-Y856 HydrophobicContact CD1-CE1 4.49Å; Y409-Y856 AromaticContact CE1-CE1 3.6Å; Y409-Y856 HydrophobicContact CE1-CE1 3.6Å; Y409-Y856 AromaticContact CE1-CZ 3.97Å; Y409-Y856 PolarHBondContact OH-OH 3.24Å; Y409-W857 HydrophobicContact CD1-CH2 4.34Å; Y409-W857 AromaticContact CD1-CZ2 3.91Å; Y409-W857 HydrophobicContact CD1-CZ2 3.91Å; Y409-W857 HydrophobicContact CE1-CZ2 4.41Å; Y409-W857 HydrophobicContact CG-CH2 4.34Å; Y409-W857 HydrophobicContact CG-CZ2 4.09Å
410	I	94.6	Very high	92.7	Very high	83 Å²	83	45.9 Å²	45.9	43%	0.426	26%	0.262	S	S	.	.	H	α-helix	trans	-65.1	-49.8	-179.3	-72.5	171.1	0	0	0	112.1	I405 T408 E412 V413 L414	I405-I410 HydrophobicContact CG2-CD1 4Å; I405-I410 HydrophobicContact CG2-CG1 4.29Å; I405-I410 WeakPolarHBondContact O-CB 3.13Å; I405-I410 WeakPolarHBondContact O-CG1 3.36Å; I405-I410 PolarHBondContact O-N 2.89Å; T408-I410 PolarHBondContact O-N 2.98Å; I410-E412 VanDerWaalsContact C-N 3.34Å; I410-E412 PolarHBondContact O-N 2.96Å; I410-V413 PolarHBondContact O-N 2.72Å; I410-L414 HydrophobicContact CG2-CD1 4.04Å; I410-L414 WeakPolarHBondContact O-CG 3.29Å; I410-L414 PolarHBondContact O-N 3Å
411	P	95.1	Very high	92.8	Very high	38 Å²	38	45.9 Å²	45.9	25%	0.247	26%	0.262	C	S	.	.	H	α-helix	trans	-56.7	-42.9	175.4	-29.6	37.9	0	0	0	113.5	V406 T408 L414 I415	V406-P411 VanDerWaalsContact O-CD 3.31Å; V406-P411 WeakPolarHBondContact O-CD 3.38Å; T408-P411 WeakPolarHBondContact O-CD 3.25Å; P411-L414 WeakPolarHBondContact O-CB 3.12Å; P411-L414 PolarHBondContact O-N 2.87Å; P411-I415 WeakPolarHBondContact O-CG1 3.33Å; P411-I415 PolarHBondContact O-N 3.41Å
412	E	94.6	Very high	92.7	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-69.2	-38.4	-179	-64.3	-70.5	-158.7	0	0	112.7	T408 I410 L414 I415 V416 L444 E447 L468	T408-E412 WeakPolarHBondContact O-CB 3.24Å; T408-E412 WeakPolarHBondContact O-CG 3.27Å; T408-E412 PolarHBondContact O-N 3.33Å; I410-E412 VanDerWaalsContact C-N 3.34Å; I410-E412 PolarHBondContact O-N 2.96Å; E412-L414 VanDerWaalsContact C-N 3.33Å; E412-L414 PolarHBondContact O-N 2.67Å; E412-I415 PolarHBondContact O-N 3.16Å; E412-V416 WeakPolarHBondContact O-CG2 3.11Å; E412-V416 PolarHBondContact O-N 3.12Å; E412-L444 VanDerWaalsContact CD-CD1 3.43Å; E412-L444 WeakPolarHBondContact OE1-CD1 3.36Å; E412-L444 WeakPolarHBondContact OE2-CD1 3.5Å; E412-E447 WeakPolarHBondContact OE1-CB 3.37Å; E412-L468 HydrophobicContact CG-CD2 4.18Å; E412-L468 WeakPolarHBondContact OE1-CD2 3.26Å
413	V	94.9	Very high	92.8	Very high	33 Å²	33	43.4 Å²	43.4	20%	0.2	24%	0.241	C	C	.	.	H	α-helix	trans	-55.7	-50.8	168.4	166.1	0	0	0	0	109.8	Y409 I410 I415 V416 M417 W467 F849 L853	Y409-V413 WeakPolarHBondContact O-CG2 3.3Å; Y409-V413 PolarHBondContact O-N 3.33Å; I410-V413 PolarHBondContact O-N 2.72Å; V413-I415 VanDerWaalsContact C-N 3.33Å; V413-I415 PolarHBondContact O-N 3.23Å; V413-V416 PolarHBondContact O-N 2.88Å; V413-M417 HydrophobicContact CG1-CG 4.32Å; V413-M417 VanDerWaalsContact O-CG 3.28Å; V413-M417 WeakPolarHBondContact O-CG 3.22Å; V413-M417 PolarHBondContact O-N 3.46Å; V413-W467 HydrophobicContact CG2-CH2 3.99Å; V413-W467 HydrophobicContact CG2-CZ2 3.94Å; V413-F849 HydrophobicContact CG1-CE1 4.3Å; V413-F849 HydrophobicContact CG2-CE1 4.4Å; V413-F849 HydrophobicContact CG2-CZ 4.18Å; V413-L853 HydrophobicContact CG2-CD2 3.96Å
414	L	94.9	Very high	92.7	Very high	103 Å²	103	48.5 Å²	48.5	54%	0.539	25%	0.251	S	S	.	.	H	α-helix	trans	-61.7	-36.6	-179.5	-67.7	172.4	0	0	0	113	I410 P411 E412 M417 V418	I410-L414 HydrophobicContact CG2-CD1 4.04Å; I410-L414 WeakPolarHBondContact O-CG 3.29Å; I410-L414 PolarHBondContact O-N 3Å; P411-L414 WeakPolarHBondContact O-CB 3.12Å; P411-L414 PolarHBondContact O-N 2.87Å; E412-L414 VanDerWaalsContact C-N 3.33Å; E412-L414 PolarHBondContact O-N 2.67Å; L414-M417 PolarHBondContact O-N 3.15Å; L414-V418 WeakPolarHBondContact O-CG2 3.35Å; L414-V418 PolarHBondContact O-N 2.99Å
415	I	95.7	Very high	92.6	Very high	31 Å²	31	49.7 Å²	49.7	16%	0.159	26%	0.258	C	S	.	.	H	α-helix	trans	-66.1	-43.3	175.6	-69.3	164.1	0	0	0	110.9	P411 E412 V413 M417 V418 S419 T440 L444	P411-I415 WeakPolarHBondContact O-CG1 3.33Å; P411-I415 PolarHBondContact O-N 3.41Å; E412-I415 PolarHBondContact O-N 3.16Å; V413-I415 VanDerWaalsContact C-N 3.33Å; V413-I415 PolarHBondContact O-N 3.23Å; I415-M417 VanDerWaalsContact C-N 3.34Å; I415-M417 PolarHBondContact O-N 2.85Å; I415-V418 PolarHBondContact O-N 3.15Å; I415-S419 PolarHBondContact O-N 3.31Å; I415-T440 HydrophobicContact CG2-CG2 4.28Å; I415-T440 WeakPolarHBondContact CG2-O 3.33Å; I415-L444 HydrophobicContact CG2-CB 4.16Å
416	V	95	Very high	92.2	Very high	1 Å²	1	49.8 Å²	49.8	1%	0.006	26%	0.259	C	S	.	.	H	α-helix	trans	-63.1	-40.6	174.2	176.8	0	0	0	0	110.7	E412 V413 S419 W420 C471 F474 V475 F845 F849	E412-V416 WeakPolarHBondContact O-CG2 3.11Å; E412-V416 PolarHBondContact O-N 3.12Å; V413-V416 PolarHBondContact O-N 2.88Å; V416-S419 WeakPolarHBondContact O-CB 3.46Å; V416-S419 PolarHBondContact O-N 3.46Å; V416-S419 PolarHBondContact O-OG 3Å; V416-W420 PolarHBondContact O-N 3.5Å; V416-C471 HydrophobicContact CG2-CB 3.96Å; V416-F474 HydrophobicContact CG1-CB 4.15Å; V416-V475 HydrophobicContact CG2-CG2 4.28Å; V416-F845 HydrophobicContact CG1-CE1 4.08Å; V416-F845 HydrophobicContact CG1-CZ 4.42Å; V416-F849 HydrophobicContact CB-CE1 4.11Å; V416-F849 HydrophobicContact CB-CE2 4.18Å; V416-F849 HydrophobicContact CB-CZ 3.87Å; V416-F849 HydrophobicContact CG1-CD1 3.94Å; V416-F849 HydrophobicContact CG1-CD2 3.82Å; V416-F849 HydrophobicContact CG1-CE1 3.91Å; V416-F849 HydrophobicContact CG1-CE2 3.81Å; V416-F849 HydrophobicContact CG1-CG 3.89Å; V416-F849 HydrophobicContact CG1-CZ 3.85Å; V416-F849 HydrophobicContact CG2-CE2 4.15Å; V416-F849 HydrophobicContact CG2-CZ 4.14Å
417	M	92.7	Very high	91.7	Very high	58 Å²	58	45.4 Å²	45.4	29%	0.286	23%	0.232	S	C	.	.	H	α-helix	trans	-59.9	-47.6	171.8	-57.2	-49.4	-127.8	0	0	111.3	V413 L414 I415 S419 W420 F849	V413-M417 HydrophobicContact CG1-CG 4.32Å; V413-M417 VanDerWaalsContact O-CG 3.28Å; V413-M417 WeakPolarHBondContact O-CG 3.22Å; V413-M417 PolarHBondContact O-N 3.46Å; L414-M417 PolarHBondContact O-N 3.15Å; I415-M417 VanDerWaalsContact C-N 3.34Å; I415-M417 PolarHBondContact O-N 2.85Å; M417-S419 PolarHBondContact O-N 3.34Å; M417-W420 HydrophobicContact CB-CD2 4.38Å; M417-W420 HydrophobicContact CB-CZ2 4.19Å; M417-W420 HydrophobicContact CE-CH2 3.21Å; M417-W420 HydrophobicContact CE-CZ2 3.97Å; M417-W420 HydrophobicContact CE-CZ3 3.59Å; M417-W420 HydrophobicContact CG-CH2 4.36Å; M417-W420 HydrophobicContact CG-CZ2 4.39Å; M417-W420 PolarHBondContact O-N 3Å; M417-W420 PolarHBondContact O-NE1 3.17Å; M417-W420 VanDerWaalsContact O-NE1 3.15Å; M417-W420 HydrophobicContact SD-CD2 4.33Å; M417-W420 HydrophobicContact SD-CE3 3.72Å; M417-W420 HydrophobicContact SD-CH2 3.36Å; M417-W420 WeakPolarHBondContact SD-CH2 3.41Å; M417-W420 HydrophobicContact SD-CZ2 3.93Å; M417-W420 HydrophobicContact SD-CZ3 3.21Å; M417-W420 WeakPolarHBondContact SD-CZ3 3.33Å; M417-F849 HydrophobicContact SD-CD1 4.41Å; M417-F849 HydrophobicContact SD-CE1 4.43Å
418	V	93.1	Very high	91.2	Very high	59 Å²	59	48 Å²	48	36%	0.358	24%	0.237	S	C	.	.	H	α-helix	trans	-60.1	-31.9	178.4	172.7	0	0	0	0	111.6	L414 I415 W420 L421 T440	L414-V418 WeakPolarHBondContact O-CG2 3.35Å; L414-V418 PolarHBondContact O-N 2.99Å; I415-V418 PolarHBondContact O-N 3.15Å; V418-W420 VanDerWaalsContact C-N 3.3Å; V418-W420 PolarHBondContact O-N 3.37Å; V418-L421 WeakPolarHBondContact O-CB 3.42Å; V418-L421 PolarHBondContact O-N 2.99Å; V418-T440 HydrophobicContact CB-CG2 3.98Å; V418-T440 HydrophobicContact CG1-CG2 3.65Å
419	S	92.7	Very high	90.9	Very high	8 Å²	8	49.4 Å²	49.4	6%	0.056	25%	0.249	C	C	.	.	H	α-helix	trans	-63.8	-30.6	176.4	82.4	0	0	0	0	113.5	I415 V416 M417 L421	I415-S419 PolarHBondContact O-N 3.31Å; V416-S419 WeakPolarHBondContact O-CB 3.46Å; V416-S419 PolarHBondContact O-N 3.46Å; V416-S419 PolarHBondContact O-OG 3Å; M417-S419 PolarHBondContact O-N 3.34Å; S419-L421 PolarHBondContact O-N 2.91Å
420	W	90	Very high	90.6	Very high	72 Å²	72	51.3 Å²	51.3	27%	0.273	26%	0.261	S	S	.	.	H	α-helix	trans	-68.4	-17.5	176.9	74.4	29.8	0	0	0	113.3	V416 M417 V418 G422 F423 F845 P846	V416-W420 PolarHBondContact O-N 3.5Å; M417-W420 HydrophobicContact CB-CD2 4.38Å; M417-W420 HydrophobicContact CB-CZ2 4.19Å; M417-W420 HydrophobicContact CE-CH2 3.21Å; M417-W420 HydrophobicContact CE-CZ2 3.97Å; M417-W420 HydrophobicContact CE-CZ3 3.59Å; M417-W420 HydrophobicContact CG-CH2 4.36Å; M417-W420 HydrophobicContact CG-CZ2 4.39Å; M417-W420 PolarHBondContact O-N 3Å; M417-W420 PolarHBondContact O-NE1 3.17Å; M417-W420 VanDerWaalsContact O-NE1 3.15Å; M417-W420 HydrophobicContact SD-CD2 4.33Å; M417-W420 HydrophobicContact SD-CE3 3.72Å; M417-W420 HydrophobicContact SD-CH2 3.36Å; M417-W420 WeakPolarHBondContact SD-CH2 3.41Å; M417-W420 HydrophobicContact SD-CZ2 3.93Å; M417-W420 HydrophobicContact SD-CZ3 3.21Å; M417-W420 WeakPolarHBondContact SD-CZ3 3.33Å; V418-W420 VanDerWaalsContact C-N 3.3Å; V418-W420 PolarHBondContact O-N 3.37Å; W420-G422 PolarHBondContact O-N 3.25Å; W420-F423 HydrophobicContact CB-CD2 4.27Å; W420-F423 HydrophobicContact CB-CE2 4.15Å; W420-F423 WeakPolarHBondContact O-CD2 3.43Å; W420-F423 PolarHBondContact O-N 3.12Å; W420-F845 HydrophobicContact CB-CD1 4Å; W420-F845 HydrophobicContact CB-CE1 4.23Å; W420-P846 HydrophobicContact CE3-CB 3.77Å; W420-P846 HydrophobicContact CZ3-CB 3.58Å
421	L	89.8	Confident	90.4	Very high	80 Å²	80	51.8 Å²	51.8	42%	0.419	27%	0.27	S	S	.	.	G	3₁₀ helix	trans	-73	-18.2	-172.3	-65.5	174.4	0	0	0	111.2	V418 S419 F423 W424	V418-L421 WeakPolarHBondContact O-CB 3.42Å; V418-L421 PolarHBondContact O-N 2.99Å; S419-L421 PolarHBondContact O-N 2.91Å; L421-F423 PolarHBondContact O-N 3.46Å; L421-W424 PolarHBondContact O-N 2.88Å
422	G	88.3	Confident	90.2	Very high	12 Å²	12	52 Å²	52	12%	0.124	27%	0.274	C	S	.	.	G	3₁₀ helix	trans	-56.2	-34.6	172.7	0	0	0	0	0	113.6	W420 W424 I425 R433	W420-G422 PolarHBondContact O-N 3.25Å; G422-W424 PolarHBondContact O-N 3.44Å; G422-I425 PolarHBondContact O-N 2.78Å; G422-R433 PolarHBondContact O-NE 2.97Å; G422-R433 VanDerWaalsContact O-NE 3.16Å
423	F	90.2	Very high	90.1	Very high	4 Å²	4	52.4 Å²	52.4	2%	0.018	28%	0.276	C	S	.	.	G	3₁₀ helix	trans	-71.9	-14.3	-178.3	-45.5	-46.9	0	0	0	113.7	W420 L421 A478 E481 R842 F845	W420-F423 HydrophobicContact CB-CD2 4.27Å; W420-F423 HydrophobicContact CB-CE2 4.15Å; W420-F423 WeakPolarHBondContact O-CD2 3.43Å; W420-F423 PolarHBondContact O-N 3.12Å; L421-F423 PolarHBondContact O-N 3.46Å; F423-A478 HydrophobicContact CE1-CB 4.33Å; F423-A478 HydrophobicContact CZ-CB 3.89Å; F423-E481 WeakPolarHBondContact CD1-OE2 3.34Å; F423-E481 HydrophobicContact CE1-CB 4.19Å; F423-E481 HydrophobicContact CE1-CG 4.03Å; F423-E481 VanDerWaalsContact CE1-OE2 3.29Å; F423-E481 WeakPolarHBondContact CE1-OE2 3.47Å; F423-R842 HydrophobicContact CB-CG 3.76Å; F423-R842 PolarHBondContact O-NE 2.73Å; F423-R842 PolarHBondContact O-NH2 3.44Å; F423-F845 HydrophobicContact CE2-CB 3.8Å; F423-F845 HydrophobicContact CE2-CD1 4.14Å; F423-F845 HydrophobicContact CE2-CD2 4.12Å; F423-F845 AromaticContact CE2-CG 3.77Å; F423-F845 HydrophobicContact CE2-CG 3.77Å; F423-F845 HydrophobicContact CZ-CB 4.42Å; F423-F845 HydrophobicContact CZ-CD2 4.03Å; F423-F845 HydrophobicContact CZ-CE2 4.45Å; F423-F845 HydrophobicContact CZ-CG 4.18Å
424	W	88.3	Confident	90	Very high	170 Å²	170	53.2 Å²	53.2	64%	0.644	28%	0.281	S	S	*	.	G	3₁₀ helix	trans	-94.1	-15.3	179.4	-70.5	84.2	0	0	0	113.3	L421 G422	L421-W424 PolarHBondContact O-N 2.88Å; G422-W424 PolarHBondContact O-N 3.44Å
425	I	88.2	Confident	89.9	Confident	48 Å²	48	50.8 Å²	50.8	25%	0.246	27%	0.271	C	S	.	.	S	Bend	trans	-84.8	142.2	179	-66.5	167.6	0	0	0	109	G422 I427 A429 A432 R433 L436	G422-I425 PolarHBondContact O-N 2.78Å; I425-I427 PolarHBondContact O-N 2.88Å; I425-A429 HydrophobicContact CG2-CB 3.8Å; I425-A432 HydrophobicContact CG2-CB 4.29Å; I425-R433 HydrophobicContact CB-CG 4.07Å; I425-R433 HydrophobicContact CG2-CG 3.89Å; I425-R433 PolarHBondContact O-NE 2.95Å; I425-R433 PolarHBondContact O-NH2 3.28Å; I425-L436 HydrophobicContact CD1-CD1 3.27Å
426	D	85.4	Confident	89.8	Confident	53 Å²	53	51.9 Å²	51.9	28%	0.283	28%	0.276	S	S	.	.			trans	-55.8	136	175.3	-172	-27.6	0	0	0	110.7	K428 A429	D426-K428 PolarHBondContact O-N 3.3Å; D426-K428 WeakPolarHBondContact OD1-CB 3.11Å; D426-K428 WeakPolarHBondContact OD1-CG 3.46Å; D426-K428 PolarHBondContact OD1-N 3.42Å; D426-A429 WeakPolarHBondContact O-CB 3.25Å; D426-A429 PolarHBondContact O-N 3.16Å
427	I	84	Confident	89.7	Confident	5 Å²	5	52.4 Å²	52.4	3%	0.026	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-23.2	179.1	-159.3	151.7	0	0	0	113.1	I425 A429 A485 T489 Y833	I425-I427 PolarHBondContact O-N 2.88Å; I427-A429 VanDerWaalsContact C-N 3.27Å; I427-A429 PolarHBondContact O-N 3.29Å; I427-A485 VanDerWaalsContact CD1-C 3.48Å; I427-A485 HydrophobicContact CD1-CB 3.51Å; I427-T489 WeakPolarHBondContact CD1-OG1 3.5Å; I427-Y833 HydrophobicContact CG2-CD1 4.49Å
428	K	80.7	Confident	89.8	Confident	137 Å²	137	54.1 Å²	54.1	60%	0.596	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.4	-23.9	172.4	-63.7	176.4	-178.1	-179.1	0	112.7	D426 V430	D426-K428 PolarHBondContact O-N 3.3Å; D426-K428 WeakPolarHBondContact OD1-CB 3.11Å; D426-K428 WeakPolarHBondContact OD1-CG 3.46Å; D426-K428 PolarHBondContact OD1-N 3.42Å; K428-V430 PolarHBondContact O-N 3.12Å
429	A	87.1	Confident	89.9	Confident	38 Å²	38	56.1 Å²	56.1	31%	0.314	30%	0.3	S	S	.	.			trans	-83.1	51	177.9	0	0	0	0	0	112.3	I425 D426 I427 P431 A432 R433	I425-A429 HydrophobicContact CG2-CB 3.8Å; D426-A429 WeakPolarHBondContact O-CB 3.25Å; D426-A429 PolarHBondContact O-N 3.16Å; I427-A429 VanDerWaalsContact C-N 3.27Å; I427-A429 PolarHBondContact O-N 3.29Å; A429-P431 VanDerWaalsContact C-CD 3.42Å; A429-P431 VanDerWaalsContact C-N 3.34Å; A429-A432 HydrophobicContact CB-CB 4.42Å; A429-A432 WeakPolarHBondContact O-CB 3.32Å; A429-A432 PolarHBondContact O-N 3.41Å; A429-R433 PolarHBondContact O-N 2.97Å
430	V	88	Confident	90	Very high	45 Å²	45	56.1 Å²	56.1	27%	0.273	30%	0.299	S	S	.	.	H	α-helix	trans	-46	-46.2	-178.2	172.7	0	0	0	0	113.6	K428 A432 R433 V434 F482 Y486	K428-V430 PolarHBondContact O-N 3.12Å; V430-A432 VanDerWaalsContact C-N 3.28Å; V430-A432 PolarHBondContact O-N 3.06Å; V430-R433 PolarHBondContact O-N 3.23Å; V430-V434 HydrophobicContact CG1-CG2 4.01Å; V430-V434 WeakPolarHBondContact O-CB 3.23Å; V430-V434 WeakPolarHBondContact O-CG2 3.37Å; V430-V434 PolarHBondContact O-N 3.32Å; V430-F482 HydrophobicContact CG1-CZ 4.18Å; V430-F482 HydrophobicContact CG2-CZ 4.37Å; V430-Y486 HydrophobicContact CG2-CD2 3.88Å; V430-Y486 HydrophobicContact CG2-CE2 3.63Å
431	P	90.8	Very high	90.3	Very high	93 Å²	93	54.4 Å²	54.4	60%	0.604	30%	0.295	S	S	*	.	H	α-helix	trans	-60.9	-35.1	-179.6	-24.1	35.5	0	0	0	113.5	A429 T435	A429-P431 VanDerWaalsContact C-CD 3.42Å; A429-P431 VanDerWaalsContact C-N 3.34Å; P431-T435 VanDerWaalsContact O-CB 3.22Å; P431-T435 WeakPolarHBondContact O-CB 3.42Å; P431-T435 PolarHBondContact O-N 2.89Å; P431-T435 VanDerWaalsContact O-N 3.14Å; P431-T435 PolarHBondContact O-OG1 3.01Å
432	A	90.9	Very high	90.6	Very high	41 Å²	41	55.6 Å²	55.6	34%	0.339	30%	0.302	S	S	.	.	H	α-helix	trans	-72.6	-47.9	179.8	0	0	0	0	0	111.5	I425 A429 V430 T435 L436	I425-A432 HydrophobicContact CG2-CB 4.29Å; A429-A432 HydrophobicContact CB-CB 4.42Å; A429-A432 WeakPolarHBondContact O-CB 3.32Å; A429-A432 PolarHBondContact O-N 3.41Å; V430-A432 VanDerWaalsContact C-N 3.28Å; V430-A432 PolarHBondContact O-N 3.06Å; A432-T435 PolarHBondContact O-N 2.74Å; A432-L436 WeakPolarHBondContact O-CG 3.38Å; A432-L436 PolarHBondContact O-N 3.47Å
433	R	91.1	Very high	91	Very high	10 Å²	10	56.3 Å²	56.3	4%	0.038	31%	0.309	C	S	.	.	H	α-helix	trans	-62.3	-46.9	178.6	-73.1	-168.2	176	-152	12.9	112.3	G422 I425 A429 V430 T435 L436 G437 F482 D838	G422-R433 PolarHBondContact O-NE 2.97Å; G422-R433 VanDerWaalsContact O-NE 3.16Å; I425-R433 HydrophobicContact CB-CG 4.07Å; I425-R433 HydrophobicContact CG2-CG 3.89Å; I425-R433 PolarHBondContact O-NE 2.95Å; I425-R433 PolarHBondContact O-NH2 3.28Å; A429-R433 PolarHBondContact O-N 2.97Å; V430-R433 PolarHBondContact O-N 3.23Å; R433-T435 PolarHBondContact O-N 3.06Å; R433-L436 PolarHBondContact O-N 2.67Å; R433-G437 PolarHBondContact O-N 3.08Å; R433-G437 VanDerWaalsContact O-N 3.08Å; R433-F482 HydrophobicContact CB-CD2 3.91Å; R433-F482 HydrophobicContact CB-CE2 3.83Å; R433-F482 HydrophobicContact CB-CG 4.32Å; R433-F482 HydrophobicContact CB-CZ 4.2Å; R433-F482 VanDerWaalsContact CD-CE2 3.47Å; R433-F482 HydrophobicContact CG-CD2 4.29Å; R433-F482 HydrophobicContact CG-CE2 4.31Å; R433-D838 IonicContact CZ-OD1 2.68Å; R433-D838 VanDerWaalsContact CZ-OD1 3.24Å; R433-D838 IonicContact CZ-OD2 3.14Å; R433-D838 IonicContact NH1-OD1 2.72Å; R433-D838 PolarHBondContact NH1-OD1 3.19Å; R433-D838 IonicContact NH1-OD2 3.24Å; R433-D838 PolarHBondContact NH1-OD2 3.24Å; R433-D838 IonicContact NH2-OD1 3.35Å; R433-D838 PolarHBondContact NH2-OD1 3.41Å; R433-D838 IonicContact NH2-OD2 2.84Å; R433-D838 PolarHBondContact NH2-OD2 2.79Å
434	V	92.4	Very high	91.2	Very high	49 Å²	49	56.2 Å²	56.2	30%	0.297	31%	0.308	S	S	.	.	H	α-helix	trans	-61	-45.5	177.4	173.1	0	0	0	0	111.1	V430 L436 G437 L438 F482	V430-V434 HydrophobicContact CG1-CG2 4.01Å; V430-V434 WeakPolarHBondContact O-CB 3.23Å; V430-V434 WeakPolarHBondContact O-CG2 3.37Å; V430-V434 PolarHBondContact O-N 3.32Å; V434-L436 PolarHBondContact O-N 3.1Å; V434-G437 PolarHBondContact O-N 2.9Å; V434-L438 HydrophobicContact CG1-CD1 3.69Å; V434-L438 HydrophobicContact CG1-CG 4.22Å; V434-L438 WeakPolarHBondContact O-CB 3.33Å; V434-L438 WeakPolarHBondContact O-CG 3.26Å; V434-L438 PolarHBondContact O-N 3.03Å; V434-F482 HydrophobicContact CG2-CD1 4.32Å; V434-F482 HydrophobicContact CG2-CE1 3.41Å; V434-F482 VanDerWaalsContact CG2-CE1 3.41Å; V434-F482 HydrophobicContact CG2-CZ 3.94Å
435	T	93.9	Very high	91.6	Very high	53 Å²	53	52 Å²	52	33%	0.325	30%	0.298	S	S	.	.	H	α-helix	trans	-63.2	-43.1	-179	-58.8	0	0	0	0	111.4	P431 A432 R433 L438 L439	P431-T435 VanDerWaalsContact O-CB 3.22Å; P431-T435 WeakPolarHBondContact O-CB 3.42Å; P431-T435 PolarHBondContact O-N 2.89Å; P431-T435 VanDerWaalsContact O-N 3.14Å; P431-T435 PolarHBondContact O-OG1 3.01Å; A432-T435 PolarHBondContact O-N 2.74Å; R433-T435 PolarHBondContact O-N 3.06Å; T435-L438 PolarHBondContact O-N 2.87Å; T435-L439 HydrophobicContact CG2-CD1 3.73Å; T435-L439 HydrophobicContact CG2-CG 4.22Å; T435-L439 VanDerWaalsContact O-CB 3.3Å; T435-L439 WeakPolarHBondContact O-CB 3.14Å; T435-L439 WeakPolarHBondContact O-CG 3.33Å; T435-L439 PolarHBondContact O-N 3.41Å
436	L	93.1	Very high	92	Very high	53 Å²	53	53.6 Å²	53.6	28%	0.277	31%	0.31	S	S	.	.	H	α-helix	trans	-63	-46.8	177	-76.1	168.8	0	0	0	112.5	I425 A432 R433 V434 L438 L439 T440	I425-L436 HydrophobicContact CD1-CD1 3.27Å; A432-L436 WeakPolarHBondContact O-CG 3.38Å; A432-L436 PolarHBondContact O-N 3.47Å; R433-L436 PolarHBondContact O-N 2.67Å; V434-L436 PolarHBondContact O-N 3.1Å; L436-L438 PolarHBondContact O-N 3.15Å; L436-L439 PolarHBondContact O-N 3.28Å; L436-T440 WeakPolarHBondContact O-CG2 3.43Å; L436-T440 PolarHBondContact O-N 2.98Å; L436-T440 PolarHBondContact O-OG1 3.06Å
437	G	92.6	Very high	92.4	Very high	12 Å²	12	54.6 Å²	54.6	12%	0.124	31%	0.313	C	S	.	.	H	α-helix	trans	-65.4	-37.2	179.2	0	0	0	0	0	113.4	R433 V434 T440 L441	R433-G437 PolarHBondContact O-N 3.08Å; R433-G437 VanDerWaalsContact O-N 3.08Å; V434-G437 PolarHBondContact O-N 2.9Å; G437-T440 PolarHBondContact O-OG1 3.25Å; G437-L441 VanDerWaalsContact O-CB 3.3Å; G437-L441 WeakPolarHBondContact O-CB 3.42Å; G437-L441 PolarHBondContact O-N 3.14Å; G437-L441 VanDerWaalsContact O-N 3.16Å
438	L	94.4	Very high	92.8	Very high	94 Å²	94	55.8 Å²	55.8	49%	0.492	32%	0.322	S	S	.	.	H	α-helix	trans	-71.6	-37.2	175.4	-69.9	177.9	0	0	0	112.6	V434 T435 L436 L442	V434-L438 HydrophobicContact CG1-CD1 3.69Å; V434-L438 HydrophobicContact CG1-CG 4.22Å; V434-L438 WeakPolarHBondContact O-CB 3.33Å; V434-L438 WeakPolarHBondContact O-CG 3.26Å; V434-L438 PolarHBondContact O-N 3.03Å; T435-L438 PolarHBondContact O-N 2.87Å; L436-L438 PolarHBondContact O-N 3.15Å; L438-L442 WeakPolarHBondContact O-CB 3.21Å; L438-L442 PolarHBondContact O-N 2.95Å
439	L	95.7	Very high	93.5	Very high	101 Å²	101	53 Å²	53	53%	0.529	32%	0.32	S	S	.	.	H	α-helix	trans	-68.3	-41.9	177.7	-76.1	173.5	0	0	0	112.3	T435 L436 L442 G443	T435-L439 HydrophobicContact CG2-CD1 3.73Å; T435-L439 HydrophobicContact CG2-CG 4.22Å; T435-L439 VanDerWaalsContact O-CB 3.3Å; T435-L439 WeakPolarHBondContact O-CB 3.14Å; T435-L439 WeakPolarHBondContact O-CG 3.33Å; T435-L439 PolarHBondContact O-N 3.41Å; L436-L439 PolarHBondContact O-N 3.28Å; L439-L442 PolarHBondContact O-N 3.13Å; L439-G443 PolarHBondContact O-N 2.84Å
440	T	95.3	Very high	93.8	Very high	8 Å²	8	53.4 Å²	53.4	5%	0.049	32%	0.321	C	S	.	.	H	α-helix	trans	-66.9	-40.7	176.3	50.7	0	0	0	0	111.6	I415 V418 L436 G437 G443 L444	I415-T440 HydrophobicContact CG2-CG2 4.28Å; I415-T440 WeakPolarHBondContact CG2-O 3.33Å; V418-T440 HydrophobicContact CB-CG2 3.98Å; V418-T440 HydrophobicContact CG1-CG2 3.65Å; L436-T440 WeakPolarHBondContact O-CG2 3.43Å; L436-T440 PolarHBondContact O-N 2.98Å; L436-T440 PolarHBondContact O-OG1 3.06Å; G437-T440 PolarHBondContact O-OG1 3.25Å; T440-G443 PolarHBondContact O-N 3.14Å; T440-L444 WeakPolarHBondContact O-CB 3.49Å; T440-L444 PolarHBondContact O-N 3.04Å; T440-L444 VanDerWaalsContact O-N 3.12Å
441	L	96.3	Very high	94.1	Very high	36 Å²	36	51.6 Å²	51.6	19%	0.188	31%	0.309	C	S	.	.	H	α-helix	trans	-60.5	-45.8	173.9	-179.9	62	0	0	0	111.9	G437 L445 L472 V475 I476 L479	G437-L441 VanDerWaalsContact O-CB 3.3Å; G437-L441 WeakPolarHBondContact O-CB 3.42Å; G437-L441 PolarHBondContact O-N 3.14Å; G437-L441 VanDerWaalsContact O-N 3.16Å; L441-L445 HydrophobicContact CD1-CD1 4.06Å; L441-L445 HydrophobicContact CD1-CG 4.34Å; L441-L445 HydrophobicContact CG-CD1 4.04Å; L441-L445 WeakPolarHBondContact O-CB 3.37Å; L441-L445 VanDerWaalsContact O-CG 3.26Å; L441-L445 WeakPolarHBondContact O-CG 3.45Å; L441-L445 PolarHBondContact O-N 3.13Å; L441-L472 HydrophobicContact CD1-CD1 3.46Å; L441-L472 VanDerWaalsContact CD1-CD1 3.46Å; L441-V475 HydrophobicContact CB-CG1 3.94Å; L441-V475 HydrophobicContact CD1-CG1 4.4Å; L441-I476 HydrophobicContact CD1-CG1 4.13Å; L441-L479 HydrophobicContact CB-CD1 4.16Å; L441-L479 HydrophobicContact CD2-CD1 3.77Å
442	L	96.5	Very high	94.1	Very high	106 Å²	106	50 Å²	50	56%	0.555	30%	0.3	S	S	*	.	H	α-helix	trans	-66.9	-38.8	178.6	-178.7	61.1	0	0	0	112.4	L438 L439 L445 T446	L438-L442 WeakPolarHBondContact O-CB 3.21Å; L438-L442 PolarHBondContact O-N 2.95Å; L439-L442 PolarHBondContact O-N 3.13Å; L442-L445 PolarHBondContact O-N 3.19Å; L442-T446 WeakPolarHBondContact O-CB 3.48Å; L442-T446 PolarHBondContact O-N 3.32Å; L442-T446 PolarHBondContact O-OG1 2.8Å
443	G	95.6	Very high	94.2	Very high	26 Å²	26	52.1 Å²	52.1	27%	0.268	31%	0.313	S	S	.	.	H	α-helix	trans	-59.3	-54.5	177	0	0	0	0	0	112	L439 T440 L445 T446 E447	L439-G443 PolarHBondContact O-N 2.84Å; T440-G443 PolarHBondContact O-N 3.14Å; G443-L445 PolarHBondContact O-N 3.5Å; G443-T446 WeakPolarHBondContact O-CB 3.38Å; G443-T446 PolarHBondContact O-N 2.93Å; G443-E447 PolarHBondContact O-N 3.02Å
444	L	95.7	Very high	94.1	Very high	2 Å²	2	56.5 Å²	56.5	1%	0.01	33%	0.334	C	S	.	.	H	α-helix	trans	-60.6	-39.9	177.1	164.8	59.6	0	0	0	112.8	E412 I415 T440 T446 S448 L468 C471 L472 V475	E412-L444 VanDerWaalsContact CD-CD1 3.43Å; E412-L444 WeakPolarHBondContact OE1-CD1 3.36Å; E412-L444 WeakPolarHBondContact OE2-CD1 3.5Å; I415-L444 HydrophobicContact CG2-CB 4.16Å; T440-L444 WeakPolarHBondContact O-CB 3.49Å; T440-L444 PolarHBondContact O-N 3.04Å; T440-L444 VanDerWaalsContact O-N 3.12Å; L444-T446 VanDerWaalsContact C-N 3.29Å; L444-T446 PolarHBondContact O-N 3.42Å; L444-S448 WeakPolarHBondContact O-CB 3.48Å; L444-S448 PolarHBondContact O-N 3.08Å; L444-L468 HydrophobicContact CD1-CD2 4.42Å; L444-C471 HydrophobicContact CD1-CB 4.11Å; L444-C471 HydrophobicContact CD2-CB 4.22Å; L444-L472 VanDerWaalsContact CD2-CA 3.46Å; L444-L472 HydrophobicContact CD2-CB 4.01Å; L444-L472 HydrophobicContact CD2-CD1 4Å; L444-L472 HydrophobicContact CG-CD1 4.33Å; L444-V475 HydrophobicContact CD2-CB 4.19Å; L444-V475 HydrophobicContact CD2-CG2 3.76Å
445	L	96.2	Very high	94.1	Very high	83 Å²	83	54.8 Å²	54.8	44%	0.435	32%	0.323	S	S	.	.	H	α-helix	trans	-66.2	-32.1	174.2	-72.7	172.6	0	0	0	112.6	L441 L442 G443 S449 L472	L441-L445 HydrophobicContact CD1-CD1 4.06Å; L441-L445 HydrophobicContact CD1-CG 4.34Å; L441-L445 HydrophobicContact CG-CD1 4.04Å; L441-L445 WeakPolarHBondContact O-CB 3.37Å; L441-L445 VanDerWaalsContact O-CG 3.26Å; L441-L445 WeakPolarHBondContact O-CG 3.45Å; L441-L445 PolarHBondContact O-N 3.13Å; L442-L445 PolarHBondContact O-N 3.19Å; G443-L445 PolarHBondContact O-N 3.5Å; L445-S449 WeakPolarHBondContact O-CB 3.34Å; L445-S449 PolarHBondContact O-N 3.3Å; L445-S449 VanDerWaalsContact O-N 3.1Å; L445-L472 HydrophobicContact CD2-CD1 4.03Å; L445-L472 HydrophobicContact CD2-CD2 4.23Å; L445-L472 HydrophobicContact CG-CD1 4.32Å
446	T	95.8	Very high	94	Very high	81 Å²	81	53 Å²	53	50%	0.497	31%	0.313	S	S	.	.	H	α-helix	trans	-71	-47	177.8	-56.5	0	0	0	0	111	L442 G443 L444 S449 S450	L442-T446 WeakPolarHBondContact O-CB 3.48Å; L442-T446 PolarHBondContact O-N 3.32Å; L442-T446 PolarHBondContact O-OG1 2.8Å; G443-T446 WeakPolarHBondContact O-CB 3.38Å; G443-T446 PolarHBondContact O-N 2.93Å; L444-T446 VanDerWaalsContact C-N 3.29Å; L444-T446 PolarHBondContact O-N 3.42Å; T446-S449 PolarHBondContact O-N 3.06Å; T446-S450 PolarHBondContact O-N 2.95Å
447	E	94.1	Very high	93.9	Very high	73 Å²	73	61 Å²	61	34%	0.341	35%	0.345	S	S	.	.	H	α-helix	trans	-68.2	-41.3	176.9	-70.5	-59.4	164.4	0	0	112.3	E412 G443 S449 S450 V451	E412-E447 WeakPolarHBondContact OE1-CB 3.37Å; G443-E447 PolarHBondContact O-N 3.02Å; E447-S449 VanDerWaalsContact C-N 3.26Å; E447-S449 PolarHBondContact O-N 3.43Å; E447-S450 WeakPolarHBondContact O-CA 3.39Å; E447-S450 VanDerWaalsContact O-CB 3.25Å; E447-S450 WeakPolarHBondContact O-CB 3.37Å; E447-S450 PolarHBondContact O-N 2.81Å; E447-V451 WeakPolarHBondContact O-CG2 3.48Å; E447-V451 PolarHBondContact O-N 2.9Å
448	S	93.6	Very high	93.7	Very high	30 Å²	30	62.1 Å²	62.1	21%	0.21	35%	0.349	C	S	.	.	H	α-helix	trans	-56.5	-39.8	172.2	-179.7	0	0	0	0	112.4	L444 S452	L444-S448 WeakPolarHBondContact O-CB 3.48Å; L444-S448 PolarHBondContact O-N 3.08Å; S448-S452 VanDerWaalsContact O-CB 3.24Å; S448-S452 WeakPolarHBondContact O-CB 3.24Å; S448-S452 PolarHBondContact O-N 3.33Å; S448-S452 PolarHBondContact O-OG 3.46Å
449	S	94	Very high	93.6	Very high	79 Å²	79	64.9 Å²	64.9	55%	0.552	37%	0.37	S	S	*	.	H	α-helix	trans	-70.1	-34.3	172.8	-171.4	0	0	0	0	113.1	L445 T446 E447 S453	L445-S449 WeakPolarHBondContact O-CB 3.34Å; L445-S449 PolarHBondContact O-N 3.3Å; L445-S449 VanDerWaalsContact O-N 3.1Å; T446-S449 PolarHBondContact O-N 3.06Å; E447-S449 VanDerWaalsContact C-N 3.26Å; E447-S449 PolarHBondContact O-N 3.43Å; S449-S453 PolarHBondContact O-N 3.43Å; S449-S453 VanDerWaalsContact O-N 3.08Å
450	S	94.2	Very high	93.4	Very high	47 Å²	47	63.3 Å²	63.3	33%	0.329	36%	0.358	S	S	.	.	H	α-helix	trans	-62	-53.6	175.4	-176	0	0	0	0	110.7	T446 E447 S452 S453	T446-S450 PolarHBondContact O-N 2.95Å; E447-S450 WeakPolarHBondContact O-CA 3.39Å; E447-S450 VanDerWaalsContact O-CB 3.25Å; E447-S450 WeakPolarHBondContact O-CB 3.37Å; E447-S450 PolarHBondContact O-N 2.81Å; S450-S452 VanDerWaalsContact C-N 3.34Å; S450-S452 PolarHBondContact O-N 3.01Å; S450-S453 WeakPolarHBondContact O-CB 3.38Å; S450-S453 PolarHBondContact O-N 2.94Å; S450-S453 VanDerWaalsContact O-N 3.12Å; S450-S453 PolarHBondContact O-OG 2.92Å
451	V	92.9	Very high	93.2	Very high	6 Å²	6	68.6 Å²	68.6	4%	0.036	39%	0.385	C	S	.	.	H	α-helix	trans	-57.8	-45.6	175.2	173.5	0	0	0	0	111.3	T408 E447 S453 Q454 L455 I464 L468	T408-V451 HydrophobicContact CG2-CG2 3.75Å; E447-V451 WeakPolarHBondContact O-CG2 3.48Å; E447-V451 PolarHBondContact O-N 2.9Å; V451-S453 PolarHBondContact O-N 3.44Å; V451-Q454 PolarHBondContact O-N 3.26Å; V451-Q454 VanDerWaalsContact O-N 3.16Å; V451-L455 HydrophobicContact CG1-CD1 4.34Å; V451-I464 HydrophobicContact CG1-CD1 3.51Å; V451-I464 HydrophobicContact CG1-CG1 4.07Å; V451-L468 HydrophobicContact CB-CD1 4.35Å; V451-L468 HydrophobicContact CG1-CD1 4.19Å
452	S	91.9	Very high	93	Very high	59 Å²	59	67.9 Å²	67.9	41%	0.413	38%	0.38	S	S	.	.	H	α-helix	trans	-64.4	-23.5	179.7	-62.6	0	0	0	0	113.7	S448 S450	S448-S452 VanDerWaalsContact O-CB 3.24Å; S448-S452 WeakPolarHBondContact O-CB 3.24Å; S448-S452 PolarHBondContact O-N 3.33Å; S448-S452 PolarHBondContact O-OG 3.46Å; S450-S452 VanDerWaalsContact C-N 3.34Å; S450-S452 PolarHBondContact O-N 3.01Å
453	S	92.2	Very high	92.8	Very high	87 Å²	87	63.8 Å²	63.8	61%	0.608	36%	0.362	S	S	*	.	H	α-helix	trans	-78.3	-21.7	177.3	76.7	0	0	0	0	113.7	S449 S450 V451 L455	S449-S453 PolarHBondContact O-N 3.43Å; S449-S453 VanDerWaalsContact O-N 3.08Å; S450-S453 WeakPolarHBondContact O-CB 3.38Å; S450-S453 PolarHBondContact O-N 2.94Å; S450-S453 VanDerWaalsContact O-N 3.12Å; S450-S453 PolarHBondContact O-OG 2.92Å; V451-S453 PolarHBondContact O-N 3.44Å; S453-L455 VanDerWaalsContact C-N 3.32Å
454	Q	90.2	Very high	92.7	Very high	102 Å²	102	62.5 Å²	62.5	48%	0.477	35%	0.349	S	S	.	.	S	Bend	trans	-86.4	-5.1	179.4	-61	173.3	21.1	0	0	112.6	V229 V451	V229-Q454 VanDerWaalsContact CG2-O 3.28Å; V229-Q454 WeakPolarHBondContact CG2-O 3.38Å; V451-Q454 PolarHBondContact O-N 3.26Å; V451-Q454 VanDerWaalsContact O-N 3.16Å
455	L	91.7	Very high	92.6	Very high	13 Å²	13	63.9 Å²	63.9	7%	0.068	36%	0.357	C	S	.	.	S	Bend	trans	-121.1	145.9	-173.1	-67.2	174.1	0	0	0	111.8	V228 F324 V451 S453 K462 I464	V228-L455 HydrophobicContact CG1-CD2 4.16Å; F324-L455 HydrophobicContact CD1-CD1 3.82Å; F324-L455 HydrophobicContact CD1-CD2 4.2Å; F324-L455 HydrophobicContact CD2-CD2 4.09Å; F324-L455 HydrophobicContact CE1-CD1 3.66Å; F324-L455 HydrophobicContact CE1-CD2 3.89Å; F324-L455 HydrophobicContact CE1-CG 4.28Å; F324-L455 HydrophobicContact CE2-CD2 3.73Å; F324-L455 HydrophobicContact CG-CD2 4.31Å; F324-L455 HydrophobicContact CZ-CD1 4.25Å; F324-L455 HydrophobicContact CZ-CD2 3.64Å; F324-L455 HydrophobicContact CZ-CG 4.39Å; V451-L455 HydrophobicContact CG1-CD1 4.34Å; S453-L455 VanDerWaalsContact C-N 3.32Å; L455-K462 HydrophobicContact CD1-CD 4.19Å; L455-K462 VanDerWaalsContact CD1-CE 3.5Å; L455-I464 HydrophobicContact CD1-CG2 4.2Å
456	P	92.2	Very high	92.4	Very high	16 Å²	16	63.3 Å²	63.3	10%	0.104	36%	0.356	C	S	.	.			trans	-66.1	148.6	173.3	30.1	-35.9	0	0	0	110.5	V228 M231 L321 V458	V228-P456 HydrophobicContact CG1-CG 4.4Å; V228-P456 WeakPolarHBondContact O-CD 3.44Å; V228-P456 VanDerWaalsContact O-CG 3.26Å; V228-P456 WeakPolarHBondContact O-CG 3.26Å; M231-P456 HydrophobicContact CE-CB 4.09Å; M231-P456 HydrophobicContact CE-CG 3.58Å; M231-P456 HydrophobicContact SD-CG 4.41Å; L321-P456 HydrophobicContact CD1-CG 3.38Å; P456-V458 HydrophobicContact CG-CG1 4.25Å; P456-V458 PolarHBondContact O-N 2.88Å
457	K	89.8	Confident	92.3	Very high	219 Å²	219	59.5 Å²	59.5	95%	0.952	33%	0.333	S	S	*	.			trans	-72.7	96.2	173.1	-67.2	-176.2	-179.9	-179.6	0	109.8
458	V	89	Confident	92.3	Very high	36 Å²	36	56.3 Å²	56.3	22%	0.218	32%	0.318	C	S	.	.			trans	-94.9	151.8	175.5	-67.2	0	0	0	0	111.3	M231 P456 Y460 K462	M231-V458 HydrophobicContact CE-CG1 4.32Å; P456-V458 HydrophobicContact CG-CG1 4.25Å; P456-V458 PolarHBondContact O-N 2.88Å; V458-Y460 HydrophobicContact CB-CD1 4.2Å; V458-Y460 HydrophobicContact CB-CD2 4.44Å; V458-Y460 HydrophobicContact CB-CE1 3.86Å; V458-Y460 HydrophobicContact CB-CE2 4.1Å; V458-Y460 HydrophobicContact CB-CG 4.48Å; V458-Y460 HydrophobicContact CG1-CE1 4.06Å; V458-Y460 HydrophobicContact CG1-CE2 4.42Å; V458-Y460 HydrophobicContact CG2-CD2 4.14Å; V458-Y460 HydrophobicContact CG2-CE2 3.87Å; V458-Y460 WeakPolarHBondContact CG2-O 3.42Å; V458-K462 HydrophobicContact CG2-CD 3.87Å; V458-K462 HydrophobicContact CG2-CG 3.92Å
459	T	92.4	Very high	92.3	Very high	153 Å²	153	58.6 Å²	58.6	94%	0.939	33%	0.331	S	S	*	.	S	Bend	trans	-83.3	-9.7	-179.3	50.6	0	0	0	0	114
460	Y	92.2	Very high	92.3	Very high	67 Å²	67	56.4 Å²	56.4	26%	0.263	31%	0.314	S	S	.	.	S	Bend	trans	-106.2	155.5	178.3	56.3	-100.9	0	0	0	111.6	Y320 L321 R322 V458 K462	Y320-Y460 HydrophobicContact CD2-CE1 4.46Å; Y320-Y460 HydrophobicContact CE2-CE1 4.35Å; L321-Y460 HydrophobicContact CB-CE2 4.36Å; L321-Y460 PolarHBondContact N-OH 3.47Å; R322-Y460 HydrophobicContact CB-CD2 4.33Å; R322-Y460 HydrophobicContact CB-CE2 4.25Å; V458-Y460 HydrophobicContact CB-CD1 4.2Å; V458-Y460 HydrophobicContact CB-CD2 4.44Å; V458-Y460 HydrophobicContact CB-CE1 3.86Å; V458-Y460 HydrophobicContact CB-CE2 4.1Å; V458-Y460 HydrophobicContact CB-CG 4.48Å; V458-Y460 HydrophobicContact CG1-CE1 4.06Å; V458-Y460 HydrophobicContact CG1-CE2 4.42Å; V458-Y460 HydrophobicContact CG2-CD2 4.14Å; V458-Y460 HydrophobicContact CG2-CE2 3.87Å; V458-Y460 WeakPolarHBondContact CG2-O 3.42Å; Y460-K462 HydrophobicContact CE2-CG 4.4Å
461	L	90.8	Very high	92.4	Very high	120 Å²	120	54.2 Å²	54.2	63%	0.628	30%	0.299	S	S	*	.			trans	-71.6	134.9	175.6	-63.7	173.5	0	0	0	111.4
462	K	92.7	Very high	92.5	Very high	20 Å²	20	56.1 Å²	56.1	9%	0.087	31%	0.309	C	S	.	.			trans	-96.6	152.5	172.7	-52.5	178.4	-59.5	-57.4	0	110.1	L321 L455 V458 Y460 I464 D465 V466	L321-K462 HydrophobicContact CB-CD 4.22Å; L455-K462 HydrophobicContact CD1-CD 4.19Å; L455-K462 VanDerWaalsContact CD1-CE 3.5Å; V458-K462 HydrophobicContact CG2-CD 3.87Å; V458-K462 HydrophobicContact CG2-CG 3.92Å; Y460-K462 HydrophobicContact CE2-CG 4.4Å; K462-I464 HydrophobicContact CB-CG2 4.02Å; K462-I464 PolarHBondContact O-N 3.04Å; K462-D465 VanDerWaalsContact CB-OD2 3.29Å; K462-D465 WeakPolarHBondContact CB-OD2 3.36Å; K462-D465 VanDerWaalsContact CE-OD1 3.3Å; K462-D465 WeakPolarHBondContact CE-OD1 3.38Å; K462-D465 WeakPolarHBondContact CG-OD2 3.28Å; K462-D465 PolarHBondContact N-OD2 2.96Å; K462-D465 IonicContact NZ-OD1 2.62Å; K462-D465 PolarHBondContact NZ-OD1 2.7Å; K462-D465 IonicContact NZ-OD2 2.85Å; K462-D465 PolarHBondContact NZ-OD2 2.99Å; K462-D465 WeakPolarHBondContact O-CB 3.39Å; K462-D465 PolarHBondContact O-N 3.44Å; K462-V466 PolarHBondContact O-N 3.06Å
463	A	92.1	Very high	92.6	Very high	20 Å²	20	57.9 Å²	57.9	17%	0.165	31%	0.313	C	S	.	.	H	α-helix	trans	-57	-36.7	177.2	0	0	0	0	0	113	R322 V466 W467	R322-A463 PolarHBondContact O-N 3.31Å; A463-V466 PolarHBondContact O-N 3.18Å; A463-W467 PolarHBondContact O-N 2.87Å; A463-W467 VanDerWaalsContact O-N 3.17Å
464	I	92.6	Very high	92.8	Very high	0 Å²	0	55.2 Å²	55.2	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-65.5	-32.1	173.8	-162.1	158.7	0	0	0	113.6	F324 T408 V451 L455 K462 V466 W467 L468	F324-I464 HydrophobicContact CD1-CB 4.33Å; F324-I464 HydrophobicContact CD1-CD1 4.29Å; F324-I464 HydrophobicContact CD1-CG2 3.88Å; F324-I464 HydrophobicContact CE1-CD1 3.99Å; F324-I464 HydrophobicContact CE1-CG2 4.46Å; F324-I464 PolarHBondContact O-N 3.43Å; T408-I464 HydrophobicContact CG2-CD1 4.38Å; V451-I464 HydrophobicContact CG1-CD1 3.51Å; V451-I464 HydrophobicContact CG1-CG1 4.07Å; L455-I464 HydrophobicContact CD1-CG2 4.2Å; K462-I464 HydrophobicContact CB-CG2 4.02Å; K462-I464 PolarHBondContact O-N 3.04Å; I464-V466 VanDerWaalsContact C-N 3.33Å; I464-V466 PolarHBondContact O-N 3.36Å; I464-W467 PolarHBondContact O-N 2.86Å; I464-L468 HydrophobicContact CG1-CD1 4.22Å; I464-L468 HydrophobicContact CG1-CG 4.5Å; I464-L468 WeakPolarHBondContact O-CG 3.4Å; I464-L468 PolarHBondContact O-N 3.16Å
465	D	93.2	Very high	93	Very high	31 Å²	31	50.3 Å²	50.3	17%	0.166	27%	0.267	C	S	.	.	H	α-helix	trans	-67.3	-38.5	176.5	-55.8	-34	0	0	0	110.5	K462 T469	K462-D465 VanDerWaalsContact CB-OD2 3.29Å; K462-D465 WeakPolarHBondContact CB-OD2 3.36Å; K462-D465 VanDerWaalsContact CE-OD1 3.3Å; K462-D465 WeakPolarHBondContact CE-OD1 3.38Å; K462-D465 WeakPolarHBondContact CG-OD2 3.28Å; K462-D465 PolarHBondContact N-OD2 2.96Å; K462-D465 IonicContact NZ-OD1 2.62Å; K462-D465 PolarHBondContact NZ-OD1 2.7Å; K462-D465 IonicContact NZ-OD2 2.85Å; K462-D465 PolarHBondContact NZ-OD2 2.99Å; K462-D465 WeakPolarHBondContact O-CB 3.39Å; K462-D465 PolarHBondContact O-N 3.44Å; D465-T469 WeakPolarHBondContact O-CB 3.48Å; D465-T469 PolarHBondContact O-N 3.3Å; D465-T469 PolarHBondContact O-OG1 3.35Å
466	V	92.6	Very high	93.1	Very high	71 Å²	71	53.5 Å²	53.5	43%	0.43	28%	0.283	S	S	.	.	H	α-helix	trans	-64.4	-44.5	176.4	-179.9	0	0	0	0	110.3	K462 A463 I464 T469 V470	K462-V466 PolarHBondContact O-N 3.06Å; A463-V466 PolarHBondContact O-N 3.18Å; I464-V466 VanDerWaalsContact C-N 3.33Å; I464-V466 PolarHBondContact O-N 3.36Å; V466-T469 PolarHBondContact O-N 3.45Å; V466-V470 WeakPolarHBondContact O-CG2 3.47Å; V466-V470 PolarHBondContact O-N 2.89Å
467	W	94.2	Very high	93.2	Very high	0 Å²	0	54.2 Å²	54.2	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-56.8	-56.8	174.6	172.4	-92.9	0	0	0	112	Y409 V413 A463 I464 T469 V470 C471 F852 L853 Y856	Y409-W467 AromaticContact CD1-CD2 3.72Å; Y409-W467 HydrophobicContact CD1-CD2 3.72Å; Y409-W467 AromaticContact CD1-CE2 3.46Å; Y409-W467 VanDerWaalsContact CD1-CE2 3.46Å; Y409-W467 HydrophobicContact CD1-CE3 4.08Å; Y409-W467 HydrophobicContact CD1-CG 4.27Å; Y409-W467 AromaticContact CD1-CH2 3.94Å; Y409-W467 HydrophobicContact CD1-CH2 3.94Å; Y409-W467 AromaticContact CD1-CZ2 3.6Å; Y409-W467 HydrophobicContact CD1-CZ2 3.6Å; Y409-W467 HydrophobicContact CD1-CZ3 4.17Å; Y409-W467 AromaticContact CD1-NE1 3.85Å; Y409-W467 AromaticContact CE1-CD2 3.66Å; Y409-W467 HydrophobicContact CE1-CD2 3.66Å; Y409-W467 AromaticContact CE1-CE2 3.9Å; Y409-W467 AromaticContact CE1-CE3 3.96Å; Y409-W467 HydrophobicContact CE1-CE3 3.96Å; Y409-W467 AromaticContact CE1-CG 3.89Å; Y409-W467 HydrophobicContact CE1-CG 3.89Å; Y409-W467 HydrophobicContact CE1-CZ2 4.4Å; Y409-W467 HydrophobicContact CE1-CZ3 4.43Å; Y409-W467 HydrophobicContact CG-CZ2 4.48Å; V413-W467 HydrophobicContact CG2-CH2 3.99Å; V413-W467 HydrophobicContact CG2-CZ2 3.94Å; A463-W467 PolarHBondContact O-N 2.87Å; A463-W467 VanDerWaalsContact O-N 3.17Å; I464-W467 PolarHBondContact O-N 2.86Å; W467-T469 VanDerWaalsContact C-N 3.3Å; W467-T469 PolarHBondContact O-N 3.14Å; W467-V470 PolarHBondContact O-N 3.02Å; W467-V470 VanDerWaalsContact O-N 3.15Å; W467-C471 PolarHBondContact O-N 3.36Å; W467-C471 PolarHBondContact O-SG 3.01Å; W467-F852 AromaticContact CE3-CE1 3.76Å; W467-F852 HydrophobicContact CE3-CE1 3.76Å; W467-F852 AromaticContact CE3-CZ 3.72Å; W467-F852 HydrophobicContact CE3-CZ 3.72Å; W467-F852 HydrophobicContact CH2-CE1 4.48Å; W467-F852 AromaticContact CZ3-CE1 3.74Å; W467-F852 HydrophobicContact CZ3-CE1 3.74Å; W467-F852 HydrophobicContact CZ3-CZ 4.12Å; W467-L853 HydrophobicContact CH2-CD2 3.41Å; W467-L853 VanDerWaalsContact CH2-CD2 3.41Å; W467-L853 HydrophobicContact CZ3-CD2 3.82Å; W467-Y856 HydrophobicContact CB-CE2 3.94Å; W467-Y856 HydrophobicContact CD2-CE1 4.41Å; W467-Y856 AromaticContact CE3-CD1 3.57Å; W467-Y856 HydrophobicContact CE3-CD1 3.57Å; W467-Y856 AromaticContact CE3-CD2 3.93Å; W467-Y856 HydrophobicContact CE3-CD2 3.93Å; W467-Y856 AromaticContact CE3-CE1 3.62Å; W467-Y856 HydrophobicContact CE3-CE1 3.62Å; W467-Y856 AromaticContact CE3-CE2 3.97Å; W467-Y856 HydrophobicContact CE3-CE2 3.97Å; W467-Y856 AromaticContact CE3-CG 3.73Å; W467-Y856 HydrophobicContact CE3-CG 3.73Å; W467-Y856 AromaticContact CE3-CZ 3.83Å; W467-Y856 AromaticContact CZ3-CD1 3.69Å; W467-Y856 HydrophobicContact CZ3-CD1 3.69Å; W467-Y856 HydrophobicContact CZ3-CE1 4.1Å; W467-Y856 AromaticContact CZ3-CG 3.98Å; W467-Y856 HydrophobicContact CZ3-CG 3.98Å
468	L	94.3	Very high	93.3	Very high	6 Å²	6	44.3 Å²	44.3	3%	0.031	25%	0.25	C	S	.	.	H	α-helix	trans	-60.4	-39.5	-178.8	-67.8	169	0	0	0	111.8	E412 L444 V451 I464 L472	E412-L468 HydrophobicContact CG-CD2 4.18Å; E412-L468 WeakPolarHBondContact OE1-CD2 3.26Å; L444-L468 HydrophobicContact CD1-CD2 4.42Å; V451-L468 HydrophobicContact CB-CD1 4.35Å; V451-L468 HydrophobicContact CG1-CD1 4.19Å; I464-L468 HydrophobicContact CG1-CD1 4.22Å; I464-L468 HydrophobicContact CG1-CG 4.5Å; I464-L468 WeakPolarHBondContact O-CG 3.4Å; I464-L468 PolarHBondContact O-N 3.16Å; L468-L472 WeakPolarHBondContact O-CB 3.41Å; L468-L472 PolarHBondContact O-N 3.33Å
469	T	93.5	Very high	93.4	Very high	79 Å²	79	44.4 Å²	44.4	49%	0.485	25%	0.249	S	C	.	.	H	α-helix	trans	-64.6	-41.2	176.7	-58.2	0	0	0	0	111.9	D465 V466 W467 L472 L473	D465-T469 WeakPolarHBondContact O-CB 3.48Å; D465-T469 PolarHBondContact O-N 3.3Å; D465-T469 PolarHBondContact O-OG1 3.35Å; V466-T469 PolarHBondContact O-N 3.45Å; W467-T469 VanDerWaalsContact C-N 3.3Å; W467-T469 PolarHBondContact O-N 3.14Å; T469-L472 PolarHBondContact O-N 3.12Å; T469-L473 HydrophobicContact CG2-CD1 4.47Å; T469-L473 WeakPolarHBondContact O-CG 3.49Å; T469-L473 PolarHBondContact O-N 3.49Å
470	V	94.4	Very high	93.4	Very high	33 Å²	33	39.7 Å²	39.7	20%	0.2	23%	0.226	C	C	.	.	H	α-helix	trans	-68.9	-44.1	178.4	172.7	0	0	0	0	111.1	V466 W467 L472 L473 F474 F852	V466-V470 WeakPolarHBondContact O-CG2 3.47Å; V466-V470 PolarHBondContact O-N 2.89Å; W467-V470 PolarHBondContact O-N 3.02Å; W467-V470 VanDerWaalsContact O-N 3.15Å; V470-L472 PolarHBondContact O-N 3.37Å; V470-L473 PolarHBondContact O-N 3.48Å; V470-L473 VanDerWaalsContact O-N 3.15Å; V470-F474 HydrophobicContact CG1-CD2 3.79Å; V470-F474 HydrophobicContact CG1-CE2 3.56Å; V470-F474 VanDerWaalsContact O-CD2 3.26Å; V470-F474 WeakPolarHBondContact O-CD2 3.4Å; V470-F474 PolarHBondContact O-N 3.18Å; V470-F852 HydrophobicContact CB-CE1 4.25Å; V470-F852 HydrophobicContact CB-CE2 3.9Å; V470-F852 HydrophobicContact CB-CZ 3.74Å; V470-F852 HydrophobicContact CG1-CD1 3.88Å; V470-F852 HydrophobicContact CG1-CD2 3.72Å; V470-F852 HydrophobicContact CG1-CE1 3.75Å; V470-F852 HydrophobicContact CG1-CE2 3.58Å; V470-F852 HydrophobicContact CG1-CG 3.86Å; V470-F852 HydrophobicContact CG1-CZ 3.59Å; V470-F852 HydrophobicContact CG2-CE2 4.01Å; V470-F852 HydrophobicContact CG2-CZ 4.3Å
471	C	95.1	Very high	93.5	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-55.8	-39.5	172.1	-68.2	0	0	0	0	111.7	V416 L444 W467 F474 V475	V416-C471 HydrophobicContact CG2-CB 3.96Å; L444-C471 HydrophobicContact CD1-CB 4.11Å; L444-C471 HydrophobicContact CD2-CB 4.22Å; W467-C471 PolarHBondContact O-N 3.36Å; W467-C471 PolarHBondContact O-SG 3.01Å; C471-F474 PolarHBondContact O-N 3.02Å; C471-V475 PolarHBondContact O-N 3.2Å
472	L	95	Very high	93.4	Very high	47 Å²	47	33.1 Å²	33.1	25%	0.246	19%	0.194	C	C	.	.	H	α-helix	trans	-66.7	-40.2	178.1	-175.8	63.1	0	0	0	112.3	L441 L444 L445 L468 T469 V470 F474 V475 I476	L441-L472 HydrophobicContact CD1-CD1 3.46Å; L441-L472 VanDerWaalsContact CD1-CD1 3.46Å; L444-L472 VanDerWaalsContact CD2-CA 3.46Å; L444-L472 HydrophobicContact CD2-CB 4.01Å; L444-L472 HydrophobicContact CD2-CD1 4Å; L444-L472 HydrophobicContact CG-CD1 4.33Å; L445-L472 HydrophobicContact CD2-CD1 4.03Å; L445-L472 HydrophobicContact CD2-CD2 4.23Å; L445-L472 HydrophobicContact CG-CD1 4.32Å; L468-L472 WeakPolarHBondContact O-CB 3.41Å; L468-L472 PolarHBondContact O-N 3.33Å; T469-L472 PolarHBondContact O-N 3.12Å; V470-L472 PolarHBondContact O-N 3.37Å; L472-F474 VanDerWaalsContact C-N 3.32Å; L472-F474 PolarHBondContact O-N 3.49Å; L472-V475 PolarHBondContact O-N 2.88Å; L472-I476 HydrophobicContact CD1-CD1 4.06Å; L472-I476 HydrophobicContact CD1-CG1 4.37Å; L472-I476 HydrophobicContact CG-CD1 3.85Å; L472-I476 WeakPolarHBondContact O-CB 3.31Å; L472-I476 VanDerWaalsContact O-CG1 3.24Å; L472-I476 WeakPolarHBondContact O-CG1 3.46Å; L472-I476 PolarHBondContact O-N 3.36Å
473	L	95.2	Very high	93.4	Very high	95 Å²	95	34.4 Å²	34.4	50%	0.497	21%	0.209	S	C	.	.	H	α-helix	trans	-62.9	-37.5	173.1	-69.9	171	0	0	0	112.1	T469 V470 A477	T469-L473 HydrophobicContact CG2-CD1 4.47Å; T469-L473 WeakPolarHBondContact O-CG 3.49Å; T469-L473 PolarHBondContact O-N 3.49Å; V470-L473 PolarHBondContact O-N 3.48Å; V470-L473 VanDerWaalsContact O-N 3.15Å; L473-A477 VanDerWaalsContact O-CB 3.23Å; L473-A477 WeakPolarHBondContact O-CB 3.31Å; L473-A477 PolarHBondContact O-N 3.39Å
474	F	94.9	Very high	93.3	Very high	31 Å²	31	37.5 Å²	37.5	14%	0.136	22%	0.216	C	C	.	.	H	α-helix	trans	-64.1	-48.7	174.3	-83.4	-72.2	0	0	0	112.3	V416 V470 C471 L472 I476 A477 A478 F845 F849 F852	V416-F474 HydrophobicContact CG1-CB 4.15Å; V470-F474 HydrophobicContact CG1-CD2 3.79Å; V470-F474 HydrophobicContact CG1-CE2 3.56Å; V470-F474 VanDerWaalsContact O-CD2 3.26Å; V470-F474 WeakPolarHBondContact O-CD2 3.4Å; V470-F474 PolarHBondContact O-N 3.18Å; C471-F474 PolarHBondContact O-N 3.02Å; L472-F474 VanDerWaalsContact C-N 3.32Å; L472-F474 PolarHBondContact O-N 3.49Å; F474-I476 PolarHBondContact O-N 3.38Å; F474-A477 WeakPolarHBondContact O-CB 3.16Å; F474-A477 PolarHBondContact O-N 3.39Å; F474-A477 VanDerWaalsContact O-N 3.16Å; F474-A478 PolarHBondContact O-N 3.06Å; F474-F845 HydrophobicContact CB-CE2 4.34Å; F474-F845 HydrophobicContact CB-CZ 3.92Å; F474-F845 HydrophobicContact CD1-CD2 4.39Å; F474-F845 HydrophobicContact CD1-CE1 4.48Å; F474-F845 AromaticContact CD1-CE2 3.91Å; F474-F845 HydrophobicContact CD1-CE2 3.91Å; F474-F845 AromaticContact CD1-CZ 3.97Å; F474-F845 HydrophobicContact CD1-CZ 3.97Å; F474-F845 HydrophobicContact CG-CZ 4.42Å; F474-F845 VanDerWaalsContact O-CE2 3.26Å; F474-F845 WeakPolarHBondContact O-CE2 3.37Å; F474-F845 WeakPolarHBondContact O-CZ 3.42Å; F474-F849 HydrophobicContact CD1-CB 4.47Å; F474-F849 AromaticContact CD2-CD2 3.75Å; F474-F849 HydrophobicContact CD2-CD2 3.75Å; F474-F849 HydrophobicContact CD2-CE2 4.34Å; F474-F849 HydrophobicContact CE1-CB 4.11Å; F474-F849 AromaticContact CE2-CD2 3.75Å; F474-F849 HydrophobicContact CE2-CD2 3.75Å; F474-F849 HydrophobicContact CG-CD2 4.2Å; F474-F849 HydrophobicContact CZ-CB 4.16Å; F474-F849 HydrophobicContact CZ-CD2 4.2Å; F474-F852 HydrophobicContact CE2-CB 4.25Å; F474-F852 HydrophobicContact CE2-CD1 4.29Å; F474-F852 HydrophobicContact CE2-CG 4.33Å; F474-F852 HydrophobicContact CZ-CB 4.46Å
475	V	94.4	Very high	93.1	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-64.6	-39.5	178.9	177.2	0	0	0	0	111.8	V416 L441 L444 C471 L472 A477 A478 L479	V416-V475 HydrophobicContact CG2-CG2 4.28Å; L441-V475 HydrophobicContact CB-CG1 3.94Å; L441-V475 HydrophobicContact CD1-CG1 4.4Å; L444-V475 HydrophobicContact CD2-CB 4.19Å; L444-V475 HydrophobicContact CD2-CG2 3.76Å; C471-V475 PolarHBondContact O-N 3.2Å; L472-V475 PolarHBondContact O-N 2.88Å; V475-A477 VanDerWaalsContact C-N 3.34Å; V475-A478 PolarHBondContact O-N 3.46Å; V475-L479 PolarHBondContact O-N 2.95Å; V475-L479 VanDerWaalsContact O-N 3.14Å
476	I	94.7	Very high	92.8	Very high	79 Å²	79	42.3 Å²	42.3	41%	0.405	23%	0.233	S	C	.	.	H	α-helix	trans	-65.2	-37.8	173.6	-68.6	170.4	0	0	0	111.2	L441 L472 F474 L479 A480	L441-I476 HydrophobicContact CD1-CG1 4.13Å; L472-I476 HydrophobicContact CD1-CD1 4.06Å; L472-I476 HydrophobicContact CD1-CG1 4.37Å; L472-I476 HydrophobicContact CG-CD1 3.85Å; L472-I476 WeakPolarHBondContact O-CB 3.31Å; L472-I476 VanDerWaalsContact O-CG1 3.24Å; L472-I476 WeakPolarHBondContact O-CG1 3.46Å; L472-I476 PolarHBondContact O-N 3.36Å; F474-I476 PolarHBondContact O-N 3.38Å; I476-L479 PolarHBondContact O-N 3.02Å; I476-A480 WeakPolarHBondContact O-CB 3.36Å; I476-A480 PolarHBondContact O-N 3.43Å
477	A	93.3	Very high	92.5	Very high	32 Å²	32	45.6 Å²	45.6	26%	0.264	25%	0.248	S	C	.	.	H	α-helix	trans	-64.1	-39.4	176.1	0	0	0	0	0	112.1	L473 F474 V475 A480 E481	L473-A477 VanDerWaalsContact O-CB 3.23Å; L473-A477 WeakPolarHBondContact O-CB 3.31Å; L473-A477 PolarHBondContact O-N 3.39Å; F474-A477 WeakPolarHBondContact O-CB 3.16Å; F474-A477 PolarHBondContact O-N 3.39Å; F474-A477 VanDerWaalsContact O-N 3.16Å; V475-A477 VanDerWaalsContact C-N 3.34Å; A477-A480 PolarHBondContact O-N 3.16Å; A477-E481 VanDerWaalsContact O-CB 3.28Å; A477-E481 WeakPolarHBondContact O-CB 3.21Å; A477-E481 PolarHBondContact O-N 3.14Å
478	A	92.4	Very high	92.1	Very high	11 Å²	11	50.4 Å²	50.4	9%	0.091	27%	0.271	C	S	.	.	H	α-helix	trans	-63.7	-40.3	173.9	0	0	0	0	0	112.4	F423 F474 V475 F482 F845	F423-A478 HydrophobicContact CE1-CB 4.33Å; F423-A478 HydrophobicContact CZ-CB 3.89Å; F474-A478 PolarHBondContact O-N 3.06Å; V475-A478 PolarHBondContact O-N 3.46Å; A478-F482 PolarHBondContact O-N 2.96Å; A478-F482 VanDerWaalsContact O-N 3.11Å; A478-F845 HydrophobicContact CB-CE2 3.99Å; A478-F845 HydrophobicContact CB-CZ 4.14Å
479	L	92.3	Very high	91.4	Very high	37 Å²	37	51.9 Å²	51.9	19%	0.194	28%	0.281	C	S	.	.	H	α-helix	trans	-65.2	-42.3	173.3	-84.8	169.6	0	0	0	112.9	L441 V475 I476 F482 A483	L441-L479 HydrophobicContact CB-CD1 4.16Å; L441-L479 HydrophobicContact CD2-CD1 3.77Å; V475-L479 PolarHBondContact O-N 2.95Å; V475-L479 VanDerWaalsContact O-N 3.14Å; I476-L479 PolarHBondContact O-N 3.02Å; L479-F482 PolarHBondContact O-N 3.41Å; L479-A483 PolarHBondContact O-N 3.49Å
480	A	92.6	Very high	90.4	Very high	55 Å²	55	52 Å²	52	46%	0.455	28%	0.283	S	S	.	.	H	α-helix	trans	-68	-36.8	178.3	0	0	0	0	0	112	I476 A477 A483 Y484	I476-A480 WeakPolarHBondContact O-CB 3.36Å; I476-A480 PolarHBondContact O-N 3.43Å; A477-A480 PolarHBondContact O-N 3.16Å; A480-A483 PolarHBondContact O-N 3.49Å; A480-Y484 VanDerWaalsContact O-CB 3.28Å; A480-Y484 WeakPolarHBondContact O-CB 3.27Å; A480-Y484 PolarHBondContact O-N 2.92Å
481	E	92.2	Very high	89	Confident	23 Å²	23	60.2 Å²	60.2	11%	0.107	32%	0.316	C	S	.	.	H	α-helix	trans	-60.3	-49.4	172.7	-170.2	-83.4	179.1	0	0	110.8	F423 A477 A483 Y484 A485 I837 S841	F423-E481 WeakPolarHBondContact CD1-OE2 3.34Å; F423-E481 HydrophobicContact CE1-CB 4.19Å; F423-E481 HydrophobicContact CE1-CG 4.03Å; F423-E481 VanDerWaalsContact CE1-OE2 3.29Å; F423-E481 WeakPolarHBondContact CE1-OE2 3.47Å; A477-E481 VanDerWaalsContact O-CB 3.28Å; A477-E481 WeakPolarHBondContact O-CB 3.21Å; A477-E481 PolarHBondContact O-N 3.14Å; E481-A483 PolarHBondContact O-N 2.96Å; E481-Y484 PolarHBondContact O-N 3.38Å; E481-Y484 VanDerWaalsContact O-N 3.15Å; E481-A485 WeakPolarHBondContact O-CB 3.28Å; E481-A485 PolarHBondContact O-N 3.47Å; E481-I837 HydrophobicContact CG-CG2 4.27Å; E481-I837 WeakPolarHBondContact OE1-CG2 3.43Å; E481-S841 VanDerWaalsContact CD-OG 3.27Å; E481-S841 VanDerWaalsContact CG-OG 3.26Å; E481-S841 WeakPolarHBondContact CG-OG 3.39Å; E481-S841 VanDerWaalsContact OE1-CB 3.3Å; E481-S841 WeakPolarHBondContact OE1-CB 3.26Å; E481-S841 PolarHBondContact OE1-OG 3.21Å
482	F	90.5	Very high	87.2	Confident	25 Å²	25	64.6 Å²	64.6	11%	0.11	35%	0.347	C	S	.	.	H	α-helix	trans	-60	-45.8	177.8	164.9	-109.1	0	0	0	111.8	V430 R433 V434 A478 L479 Y484 A485 Y486	V430-F482 HydrophobicContact CG1-CZ 4.18Å; V430-F482 HydrophobicContact CG2-CZ 4.37Å; R433-F482 HydrophobicContact CB-CD2 3.91Å; R433-F482 HydrophobicContact CB-CE2 3.83Å; R433-F482 HydrophobicContact CB-CG 4.32Å; R433-F482 HydrophobicContact CB-CZ 4.2Å; R433-F482 VanDerWaalsContact CD-CE2 3.47Å; R433-F482 HydrophobicContact CG-CD2 4.29Å; R433-F482 HydrophobicContact CG-CE2 4.31Å; V434-F482 HydrophobicContact CG2-CD1 4.32Å; V434-F482 HydrophobicContact CG2-CE1 3.41Å; V434-F482 VanDerWaalsContact CG2-CE1 3.41Å; V434-F482 HydrophobicContact CG2-CZ 3.94Å; A478-F482 PolarHBondContact O-N 2.96Å; A478-F482 VanDerWaalsContact O-N 3.11Å; L479-F482 PolarHBondContact O-N 3.41Å; F482-Y484 VanDerWaalsContact C-N 3.29Å; F482-Y484 PolarHBondContact O-N 3.43Å; F482-A485 PolarHBondContact O-N 2.97Å; F482-Y486 WeakPolarHBondContact O-CB 3.16Å; F482-Y486 PolarHBondContact O-N 3.39Å
483	A	91.2	Very high	85	Confident	48 Å²	48	69.2 Å²	69.2	40%	0.397	37%	0.372	S	S	.	.	H	α-helix	trans	-60.2	-40.4	177.4	0	0	0	0	0	111.8	L479 A480 E481 L487	L479-A483 PolarHBondContact O-N 3.49Å; A480-A483 PolarHBondContact O-N 3.49Å; E481-A483 PolarHBondContact O-N 2.96Å; A483-L487 VanDerWaalsContact O-CG 3.3Å; A483-L487 WeakPolarHBondContact O-CG 3.3Å; A483-L487 PolarHBondContact O-N 3.15Å; A483-L487 VanDerWaalsContact O-N 3.14Å
484	Y	90.5	Very high	83	Confident	84 Å²	84	67.9 Å²	67.9	33%	0.329	37%	0.37	S	S	.	.	H	α-helix	trans	-69.7	-43.7	177.5	176.7	-97.8	0	0	0	112.7	M1 A480 E481 F482 Y486 L487 M488 I837	M1-Y484 PolarHBondContact SD-OH 3.27Å; A480-Y484 VanDerWaalsContact O-CB 3.28Å; A480-Y484 WeakPolarHBondContact O-CB 3.27Å; A480-Y484 PolarHBondContact O-N 2.92Å; E481-Y484 PolarHBondContact O-N 3.38Å; E481-Y484 VanDerWaalsContact O-N 3.15Å; F482-Y484 VanDerWaalsContact C-N 3.29Å; F482-Y484 PolarHBondContact O-N 3.43Å; Y484-Y486 VanDerWaalsContact C-N 3.32Å; Y484-Y486 PolarHBondContact O-N 2.79Å; Y484-L487 PolarHBondContact O-N 3.03Å; Y484-M488 HydrophobicContact CD1-CG 4.42Å; Y484-M488 HydrophobicContact CD2-CG 4.47Å; Y484-M488 HydrophobicContact CE1-CG 3.95Å; Y484-M488 HydrophobicContact CE2-CE 3.62Å; Y484-M488 HydrophobicContact CE2-CG 4.02Å; Y484-M488 WeakPolarHBondContact O-CB 3.45Å; Y484-M488 WeakPolarHBondContact O-CG 3.33Å; Y484-M488 PolarHBondContact O-N 3.37Å; Y484-I837 HydrophobicContact CD1-CD1 3.85Å; Y484-I837 HydrophobicContact CD1-CG2 4.23Å; Y484-I837 HydrophobicContact CE1-CD1 3.58Å; Y484-I837 HydrophobicContact CE1-CG1 4.23Å; Y484-I837 HydrophobicContact CE1-CG2 4.44Å
485	A	87.9	Confident	81.1	Confident	0 Å²	0	69 Å²	69	0%	0	38%	0.38	C	S	.	.	H	α-helix	trans	-63.8	-38.6	176.6	0	0	0	0	0	111.5	I427 E481 F482 M488 T489 I837	I427-A485 VanDerWaalsContact CD1-C 3.48Å; I427-A485 HydrophobicContact CD1-CB 3.51Å; E481-A485 WeakPolarHBondContact O-CB 3.28Å; E481-A485 PolarHBondContact O-N 3.47Å; F482-A485 PolarHBondContact O-N 2.97Å; A485-M488 PolarHBondContact O-N 3.02Å; A485-T489 PolarHBondContact O-N 3Å; A485-T489 PolarHBondContact O-OG1 3.15Å; A485-I837 HydrophobicContact CB-CB 4.3Å; A485-I837 HydrophobicContact CB-CD1 4.17Å; A485-I837 HydrophobicContact CB-CG2 4.37Å
486	Y	87.6	Confident	79.3	Confident	132 Å²	132	77.3 Å²	77.3	52%	0.518	42%	0.419	S	S	.	.	H	α-helix	trans	-62.6	-43.3	174.3	-179.2	-102.1	0	0	0	111.9	V430 F482 Y484 M488 T489	V430-Y486 HydrophobicContact CG2-CD2 3.88Å; V430-Y486 HydrophobicContact CG2-CE2 3.63Å; F482-Y486 WeakPolarHBondContact O-CB 3.16Å; F482-Y486 PolarHBondContact O-N 3.39Å; Y484-Y486 VanDerWaalsContact C-N 3.32Å; Y484-Y486 PolarHBondContact O-N 2.79Å; Y486-M488 VanDerWaalsContact C-N 3.35Å; Y486-M488 PolarHBondContact O-N 2.95Å; Y486-T489 PolarHBondContact O-N 3.11Å
487	L	86.6	Confident	77.8	Confident	140 Å²	140	80.4 Å²	80.4	73%	0.733	43%	0.426	S	S	*	.	H	α-helix	trans	-67.2	-32.2	175.9	-71.5	171	0	0	0	113.5	A483 Y484	A483-L487 VanDerWaalsContact O-CG 3.3Å; A483-L487 WeakPolarHBondContact O-CG 3.3Å; A483-L487 PolarHBondContact O-N 3.15Å; A483-L487 VanDerWaalsContact O-N 3.14Å; Y484-L487 PolarHBondContact O-N 3.03Å
488	M	85.8	Confident	76.4	Confident	101 Å²	101	82 Å²	82	50%	0.498	43%	0.428	S	S	.	.	H	α-helix	trans	-85.3	-7.6	178.9	-72.2	-68	167.1	0	0	113.8	Y484 A485 Y486 P490 I837	Y484-M488 HydrophobicContact CD1-CG 4.42Å; Y484-M488 HydrophobicContact CD2-CG 4.47Å; Y484-M488 HydrophobicContact CE1-CG 3.95Å; Y484-M488 HydrophobicContact CE2-CE 3.62Å; Y484-M488 HydrophobicContact CE2-CG 4.02Å; Y484-M488 WeakPolarHBondContact O-CB 3.45Å; Y484-M488 WeakPolarHBondContact O-CG 3.33Å; Y484-M488 PolarHBondContact O-N 3.37Å; A485-M488 PolarHBondContact O-N 3.02Å; Y486-M488 VanDerWaalsContact C-N 3.35Å; Y486-M488 PolarHBondContact O-N 2.95Å; M488-P490 WeakPolarHBondContact O-CD 3.3Å; M488-I837 HydrophobicContact CB-CD1 3.73Å; M488-I837 HydrophobicContact CG-CD1 4.11Å
489	T	79.4	Confident	75.1	Confident	38 Å²	38	84.4 Å²	84.4	23%	0.233	44%	0.443	C	S	.	.	S	Bend	trans	-71.8	121	173.8	-62.8	0	0	0	0	108.7	I427 A485 Y486 K491 Y833	I427-T489 WeakPolarHBondContact CD1-OG1 3.5Å; A485-T489 PolarHBondContact O-N 3Å; A485-T489 PolarHBondContact O-OG1 3.15Å; Y486-T489 PolarHBondContact O-N 3.11Å; T489-K491 PolarHBondContact O-N 3.01Å; T489-Y833 HydrophobicContact CG2-CE1 4.23Å
490	P	71.5	Confident	74.1	Confident	81 Å²	81	89.1 Å²	89.1	53%	0.526	46%	0.464	S	S	.	.			trans	-55.7	133.2	172.3	-21	32.3	0	0	0	108.8	M488 S492 Y833	M488-P490 WeakPolarHBondContact O-CD 3.3Å; P490-S492 PolarHBondContact O-N 2.61Å; P490-Y833 WeakPolarHBondContact CD-OH 3.4Å
491	K	65.7	Low	73.2	Confident	205 Å²	205	89.4 Å²	89.4	89%	0.891	46%	0.46	S	S	*	.			trans	-65.4	90.8	166	-67.3	178.4	-177.9	175.4	0	106.7	T489 D493	T489-K491 PolarHBondContact O-N 3.01Å; K491-D493 PolarHBondContact O-N 3.24Å
492	S	58.4	Low	72.3	Confident	93 Å²	93	94.6 Å²	94.6	65%	0.65	48%	0.478	S	S	*	.			trans	-58.1	132.1	166.4	64.2	0	0	0	0	106.3	P490	P490-S492 PolarHBondContact O-N 2.61Å
493	D	48	Very low	71.5	Confident	144 Å²	144	97.2 Å²	97.2	77%	0.77	49%	0.493	S	S	*	.			trans	-48.6	150.3	168.7	-61.4	-64.2	0	0	0	109.5	K491	K491-D493 PolarHBondContact O-N 3.24Å
494	S	54	Low	70.9	Confident	66 Å²	66	99.7 Å²	99.7	46%	0.462	50%	0.499	S	S	.	.	S	Bend	trans	-42.9	129.3	174.7	48.9	0	0	0	0	108.3	E496	S494-E496 PolarHBondContact O-N 3.36Å
495	P	54.1	Low	70.2	Confident	55 Å²	55	99 Å²	99	36%	0.357	50%	0.504	S	S	.	.			trans	-50.6	141.6	-166	24.3	-35.9	0	0	0	109.5	W497 E498	P495-W497 HydrophobicContact CG-CD2 4.37Å; P495-W497 HydrophobicContact CG-CZ2 3.79Å; P495-W497 CarbonylContact O-C 3.49Å; P495-W497 PolarHBondContact O-N 3.43Å; P495-E498 HydrophobicContact CG-CB 4.21Å; P495-E498 HydrophobicContact CG-CG 4.33Å; P495-E498 VanDerWaalsContact O-CB 3.31Å; P495-E498 WeakPolarHBondContact O-CB 3.28Å; P495-E498 PolarHBondContact O-N 3.04Å
496	E	56.3	Low	69.4	Low	175 Å²	175	103.8 Å²	103.8	82%	0.818	53%	0.525	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52	-28.5	-163.4	-167.5	169.8	-164.7	0	0	114.9	S494 P499	S494-E496 PolarHBondContact O-N 3.36Å; E496-P499 VanDerWaalsContact O-CD 3.29Å; E496-P499 WeakPolarHBondContact O-CD 3.48Å; E496-P499 VanDerWaalsContact O-CG 3.28Å; E496-P499 WeakPolarHBondContact O-CG 3.39Å
497	W	63.5	Low	68.9	Low	144 Å²	144	101.2 Å²	101.2	55%	0.545	52%	0.523	S	S	.	.	H	α-helix	trans	-72.1	-18.6	173	64.8	-100.9	0	0	0	115.3	P495 E500 V501	P495-W497 HydrophobicContact CG-CD2 4.37Å; P495-W497 HydrophobicContact CG-CZ2 3.79Å; P495-W497 CarbonylContact O-C 3.49Å; P495-W497 PolarHBondContact O-N 3.43Å; W497-E500 PolarHBondContact O-N 3.2Å; W497-V501 HydrophobicContact CB-CG2 4.45Å; W497-V501 HydrophobicContact CE3-CB 3.92Å; W497-V501 HydrophobicContact CE3-CG2 3.69Å; W497-V501 HydrophobicContact CZ3-CB 4.36Å; W497-V501 HydrophobicContact CZ3-CG2 4.42Å; W497-V501 VanDerWaalsContact O-CB 3.28Å; W497-V501 WeakPolarHBondContact O-CB 3.34Å; W497-V501 VanDerWaalsContact O-CG2 3.32Å; W497-V501 WeakPolarHBondContact O-CG2 3.47Å; W497-V501 PolarHBondContact O-N 3Å
498	E	63.2	Low	68.3	Low	64 Å²	64	99 Å²	99	30%	0.299	51%	0.511	S	S	.	.	H	α-helix	trans	-63.1	-46	-177.8	-124.9	-161.1	-117	0	0	113.1	P495 R502	P495-E498 HydrophobicContact CG-CB 4.21Å; P495-E498 HydrophobicContact CG-CG 4.33Å; P495-E498 VanDerWaalsContact O-CB 3.31Å; P495-E498 WeakPolarHBondContact O-CB 3.28Å; P495-E498 PolarHBondContact O-N 3.04Å; E498-R502 WeakPolarHBondContact O-CB 3.26Å; E498-R502 PolarHBondContact O-N 3.18Å; E498-R502 IonicContact OE2-NH2 3.73Å; E498-R502 PolarHBondContact OE2-NH2 3.17Å
499	P	66.9	Low	67.5	Low	63 Å²	63	97.7 Å²	97.7	41%	0.409	51%	0.506	S	S	.	.	H	α-helix	trans	-62.9	-42.7	168.5	23.6	-33.3	0	0	0	112.2	E496 R502 D503	E496-P499 VanDerWaalsContact O-CD 3.29Å; E496-P499 WeakPolarHBondContact O-CD 3.48Å; E496-P499 VanDerWaalsContact O-CG 3.28Å; E496-P499 WeakPolarHBondContact O-CG 3.39Å; P499-R502 PolarHBondContact O-N 2.65Å; P499-D503 WeakPolarHBondContact O-CB 3.3Å; P499-D503 PolarHBondContact O-N 3.23Å
500	E	70	Confident	67.1	Low	136 Å²	136	98.5 Å²	98.5	64%	0.636	51%	0.511	S	S	*	.	H	α-helix	trans	-63.1	-46.7	-179.9	-64.2	-167.9	137.4	0	0	113	W497 R502 D503 L504	W497-E500 PolarHBondContact O-N 3.2Å; E500-R502 VanDerWaalsContact C-N 3.35Å; E500-D503 CarbonylContact O-C 3.56Å; E500-D503 PolarHBondContact O-N 2.87Å; E500-L504 WeakPolarHBondContact O-CB 3.18Å; E500-L504 PolarHBondContact O-N 3.38Å
501	V	74.1	Confident	67.1	Low	61 Å²	61	100.6 Å²	100.6	37%	0.37	52%	0.518	S	S	.	.	H	α-helix	trans	-68.9	-36.2	177.1	170.3	0	0	0	0	110.2	W497 D503 L504 V505	W497-V501 HydrophobicContact CB-CG2 4.45Å; W497-V501 HydrophobicContact CE3-CB 3.92Å; W497-V501 HydrophobicContact CE3-CG2 3.69Å; W497-V501 HydrophobicContact CZ3-CB 4.36Å; W497-V501 HydrophobicContact CZ3-CG2 4.42Å; W497-V501 VanDerWaalsContact O-CB 3.28Å; W497-V501 WeakPolarHBondContact O-CB 3.34Å; W497-V501 VanDerWaalsContact O-CG2 3.32Å; W497-V501 WeakPolarHBondContact O-CG2 3.47Å; W497-V501 PolarHBondContact O-N 3Å; V501-D503 VanDerWaalsContact C-N 3.28Å; V501-D503 PolarHBondContact O-N 3.01Å; V501-L504 PolarHBondContact O-N 2.87Å; V501-V505 HydrophobicContact CG1-CG2 4.17Å; V501-V505 VanDerWaalsContact O-CB 3.22Å; V501-V505 WeakPolarHBondContact O-CB 3.42Å; V501-V505 WeakPolarHBondContact O-CG2 3.44Å; V501-V505 PolarHBondContact O-N 3.12Å
502	R	72.2	Confident	67.2	Low	131 Å²	131	101 Å²	101	49%	0.494	52%	0.515	S	S	.	.	H	α-helix	trans	-62.7	-36.9	172.4	-171.4	-175.3	-56.7	-95.5	2.7	111	E498 P499 E500 K506	E498-R502 WeakPolarHBondContact O-CB 3.26Å; E498-R502 PolarHBondContact O-N 3.18Å; E498-R502 IonicContact OE2-NH2 3.73Å; E498-R502 PolarHBondContact OE2-NH2 3.17Å; P499-R502 PolarHBondContact O-N 2.65Å; E500-R502 VanDerWaalsContact C-N 3.35Å; R502-K506 WeakPolarHBondContact O-CB 3.36Å; R502-K506 WeakPolarHBondContact O-CG 3.49Å; R502-K506 PolarHBondContact O-N 3.27Å
503	D	75.7	Confident	67.4	Low	80 Å²	80	98.8 Å²	98.8	43%	0.428	50%	0.498	S	S	.	.	H	α-helix	trans	-79.3	-34.1	176.8	-76.6	0.8	0	0	0	113.2	P499 E500 V501 K506 T507	P499-D503 WeakPolarHBondContact O-CB 3.3Å; P499-D503 PolarHBondContact O-N 3.23Å; E500-D503 CarbonylContact O-C 3.56Å; E500-D503 PolarHBondContact O-N 2.87Å; V501-D503 VanDerWaalsContact C-N 3.28Å; V501-D503 PolarHBondContact O-N 3.01Å; D503-K506 PolarHBondContact O-N 3.31Å; D503-K506 WeakPolarHBondContact OD1-CD 3.39Å; D503-K506 WeakPolarHBondContact OD1-CE 3Å; D503-K506 IonicContact OD1-NZ 2.83Å; D503-K506 PolarHBondContact OD1-NZ 3.4Å; D503-T507 WeakPolarHBondContact O-CB 3.29Å; D503-T507 PolarHBondContact O-N 3.19Å; D503-T507 PolarHBondContact O-OG1 2.96Å
504	L	77.3	Confident	67.8	Low	100 Å²	100	95.2 Å²	95.2	52%	0.524	50%	0.495	S	S	.	.	H	α-helix	trans	-64.1	-45.3	170.1	-173.5	72.6	0	0	0	110.7	E500 V501 T507 L508	E500-L504 WeakPolarHBondContact O-CB 3.18Å; E500-L504 PolarHBondContact O-N 3.38Å; V501-L504 PolarHBondContact O-N 2.87Å; L504-T507 PolarHBondContact O-N 3.5Å; L504-L508 HydrophobicContact CG-CD1 4.08Å; L504-L508 WeakPolarHBondContact O-CB 3.27Å; L504-L508 WeakPolarHBondContact O-CG 3.45Å; L504-L508 PolarHBondContact O-N 3.4Å
505	V	76.3	Confident	67.8	Low	69 Å²	69	95 Å²	95	42%	0.418	49%	0.486	S	S	.	.	H	α-helix	trans	-65.7	-41.8	176	169.3	0	0	0	0	110.9	V501 T507 L508 L509	V501-V505 HydrophobicContact CG1-CG2 4.17Å; V501-V505 VanDerWaalsContact O-CB 3.22Å; V501-V505 WeakPolarHBondContact O-CB 3.42Å; V501-V505 WeakPolarHBondContact O-CG2 3.44Å; V501-V505 PolarHBondContact O-N 3.12Å; V505-T507 VanDerWaalsContact C-N 3.33Å; V505-T507 PolarHBondContact O-N 3.11Å; V505-L508 PolarHBondContact O-N 3.18Å; V505-L509 HydrophobicContact CG1-CD1 3.75Å; V505-L509 HydrophobicContact CG1-CG 4.27Å; V505-L509 VanDerWaalsContact O-CB 3.26Å; V505-L509 WeakPolarHBondContact O-CB 3.34Å; V505-L509 WeakPolarHBondContact O-CG 3.34Å; V505-L509 PolarHBondContact O-N 3.15Å
506	K	71.5	Confident	67.8	Low	101 Å²	101	98 Å²	98	44%	0.439	50%	0.498	S	S	.	.	H	α-helix	trans	-55.2	-48.5	169.1	-76.8	169.6	-163.3	162.1	0	111	R502 D503 L509 V510	R502-K506 WeakPolarHBondContact O-CB 3.36Å; R502-K506 WeakPolarHBondContact O-CG 3.49Å; R502-K506 PolarHBondContact O-N 3.27Å; D503-K506 PolarHBondContact O-N 3.31Å; D503-K506 WeakPolarHBondContact OD1-CD 3.39Å; D503-K506 WeakPolarHBondContact OD1-CE 3Å; D503-K506 IonicContact OD1-NZ 2.83Å; D503-K506 PolarHBondContact OD1-NZ 3.4Å; K506-L509 PolarHBondContact O-N 3.47Å; K506-V510 WeakPolarHBondContact O-CB 3.43Å; K506-V510 VanDerWaalsContact O-CG2 3.29Å; K506-V510 WeakPolarHBondContact O-CG2 3.46Å; K506-V510 PolarHBondContact O-N 3.37Å
507	T	76.2	Confident	67.5	Low	79 Å²	79	94.7 Å²	94.7	49%	0.485	48%	0.478	S	S	.	.	H	α-helix	trans	-64.8	-44.5	-177.2	-57.4	0	0	0	0	111.9	D503 L504 V505 V510 N511	D503-T507 WeakPolarHBondContact O-CB 3.29Å; D503-T507 PolarHBondContact O-N 3.19Å; D503-T507 PolarHBondContact O-OG1 2.96Å; L504-T507 PolarHBondContact O-N 3.5Å; V505-T507 VanDerWaalsContact C-N 3.33Å; V505-T507 PolarHBondContact O-N 3.11Å; T507-V510 PolarHBondContact O-N 3.03Å; T507-N511 PolarHBondContact O-N 3.14Å
508	L	75.3	Confident	66.8	Low	92 Å²	92	89.3 Å²	89.3	48%	0.482	46%	0.462	S	S	.	.	H	α-helix	trans	-64.8	-42.4	175.7	-72.8	170.6	0	0	0	111.7	L504 V505 N511 Y512	L504-L508 HydrophobicContact CG-CD1 4.08Å; L504-L508 WeakPolarHBondContact O-CB 3.27Å; L504-L508 WeakPolarHBondContact O-CG 3.45Å; L504-L508 PolarHBondContact O-N 3.4Å; V505-L508 PolarHBondContact O-N 3.18Å; L508-N511 PolarHBondContact O-N 3.49Å; L508-Y512 WeakPolarHBondContact O-CB 3.32Å; L508-Y512 PolarHBondContact O-N 3.41Å
509	L	67.1	Low	66.2	Low	74 Å²	74	90.6 Å²	90.6	39%	0.387	48%	0.478	S	S	.	.	H	α-helix	trans	-63.6	-41.2	175.4	-75.4	169.6	0	0	0	112	V505 K506 Y512 T513	V505-L509 HydrophobicContact CG1-CD1 3.75Å; V505-L509 HydrophobicContact CG1-CG 4.27Å; V505-L509 VanDerWaalsContact O-CB 3.26Å; V505-L509 WeakPolarHBondContact O-CB 3.34Å; V505-L509 WeakPolarHBondContact O-CG 3.34Å; V505-L509 PolarHBondContact O-N 3.15Å; K506-L509 PolarHBondContact O-N 3.47Å; L509-Y512 PolarHBondContact O-N 3Å; L509-T513 WeakPolarHBondContact O-CB 3.21Å; L509-T513 WeakPolarHBondContact O-CG2 3.3Å; L509-T513 PolarHBondContact O-N 2.93Å; L509-T513 PolarHBondContact O-OG1 3.32Å
510	V	71.2	Confident	65.3	Low	55 Å²	55	93 Å²	93	33%	0.333	50%	0.495	S	S	.	.	H	α-helix	trans	-61.5	-44.8	174.6	167.7	0	0	0	0	110.7	K506 T507 G514 I516	K506-V510 WeakPolarHBondContact O-CB 3.43Å; K506-V510 VanDerWaalsContact O-CG2 3.29Å; K506-V510 WeakPolarHBondContact O-CG2 3.46Å; K506-V510 PolarHBondContact O-N 3.37Å; T507-V510 PolarHBondContact O-N 3.03Å; V510-G514 WeakPolarHBondContact O-CA 3.41Å; V510-G514 PolarHBondContact O-N 2.9Å; V510-I516 HydrophobicContact CG2-CG1 4.18Å
511	N	73.4	Confident	64.4	Low	126 Å²	126	88.3 Å²	88.3	67%	0.674	48%	0.476	S	S	*	.	H	α-helix	trans	-66.4	-41.9	176.9	-80.4	-13.9	0	0	0	113.4	T507 L508	T507-N511 PolarHBondContact O-N 3.14Å; L508-N511 PolarHBondContact O-N 3.49Å
512	Y	66	Low	63.3	Low	212 Å²	212	91.4 Å²	91.4	83%	0.831	49%	0.485	S	S	*	.	H	α-helix	trans	-77.8	-31.2	-176.9	-112.8	-83.5	0	0	0	113.9	L508 L509	L508-Y512 WeakPolarHBondContact O-CB 3.32Å; L508-Y512 PolarHBondContact O-N 3.41Å; L509-Y512 PolarHBondContact O-N 3Å
513	T	64.2	Low	62.2	Low	48 Å²	48	86.5 Å²	86.5	29%	0.294	47%	0.47	S	S	.	.	H	α-helix	trans	-99.8	-10.7	-177.7	66.6	0	0	0	0	113.5	L509 E515	L509-T513 WeakPolarHBondContact O-CB 3.21Å; L509-T513 WeakPolarHBondContact O-CG2 3.3Å; L509-T513 PolarHBondContact O-N 2.93Å; L509-T513 PolarHBondContact O-OG1 3.32Å; T513-E515 WeakPolarHBondContact O-CG 3.48Å; T513-E515 PolarHBondContact O-N 2.82Å; T513-E515 VanDerWaalsContact O-N 3.12Å; T513-E515 PolarHBondContact OG1-O 3.08Å; T513-E515 VanDerWaalsContact OG1-O 3.09Å
514	G	54.6	Low	60.6	Low	68 Å²	68	89.1 Å²	89.1	70%	0.701	48%	0.477	S	S	*	.	S	Bend	trans	64.8	6.2	-174.4	0	0	0	0	0	114.1	V510	V510-G514 WeakPolarHBondContact O-CA 3.41Å; V510-G514 PolarHBondContact O-N 2.9Å
515	E	55.5	Low	58.8	Low	61 Å²	61	85.4 Å²	85.4	29%	0.285	46%	0.458	S	S	.	.	S	Bend	trans	-141.2	127.9	-164.4	-68.6	-179.1	157.6	0	0	111.3	T513 R517 K524	T513-E515 WeakPolarHBondContact O-CG 3.48Å; T513-E515 PolarHBondContact O-N 2.82Å; T513-E515 VanDerWaalsContact O-N 3.12Å; T513-E515 PolarHBondContact OG1-O 3.08Å; T513-E515 VanDerWaalsContact OG1-O 3.09Å; E515-R517 HydrophobicContact CB-CG 4.31Å; E515-R517 PolarHBondContact O-N 3.42Å; E515-R517 IonicContact OE2-CZ 3.71Å; E515-R517 IonicContact OE2-NE 2.63Å; E515-R517 PolarHBondContact OE2-NE 3.03Å; E515-R517 VanDerWaalsContact OE2-NE 3.12Å; E515-R517 IonicContact OE2-NH2 3.72Å; E515-R517 PolarHBondContact OE2-NH2 2.57Å; E515-K524 WeakPolarHBondContact OE1-CE 3.27Å; E515-K524 IonicContact OE1-NZ 3.47Å; E515-K524 PolarHBondContact OE1-NZ 2.7Å; E515-K524 WeakPolarHBondContact OE2-CE 3.3Å; E515-K524 IonicContact OE2-NZ 3.62Å
516	I	53.3	Low	57.2	Low	119 Å²	119	92.5 Å²	92.5	61%	0.61	48%	0.477	S	S	*	.			trans	-70.7	101.2	172.5	-58.1	169.5	0	0	0	108.5	V510	V510-I516 HydrophobicContact CG2-CG1 4.18Å
517	R	50.9	Low	56	Low	105 Å²	105	93.9 Å²	93.9	40%	0.396	49%	0.485	S	S	.	.			trans	-104.6	138.4	175.7	-62.7	-176.4	-174.6	177.8	4.3	110.6	E515 C519	E515-R517 HydrophobicContact CB-CG 4.31Å; E515-R517 PolarHBondContact O-N 3.42Å; E515-R517 IonicContact OE2-CZ 3.71Å; E515-R517 IonicContact OE2-NE 2.63Å; E515-R517 PolarHBondContact OE2-NE 3.03Å; E515-R517 VanDerWaalsContact OE2-NE 3.12Å; E515-R517 IonicContact OE2-NH2 3.72Å; E515-R517 PolarHBondContact OE2-NH2 2.57Å; R517-C519 PolarHBondContact O-N 2.79Å
518	C	47.2	Very low	54.4	Low	31 Å²	31	95.9 Å²	95.9	21%	0.209	49%	0.489	C	S	.	.			trans	-71.5	121.2	178.5	-178.1	0	0	0	0	110.6	C520 C521 F522	C518-C520 PolarHBondContact O-N 3.49Å; C518-C521 PolarHBondContact O-N 3.12Å; C518-F522 PolarHBondContact O-N 3Å
519	C	52	Low	52.5	Low	92 Å²	92	100.6 Å²	100.6	62%	0.622	51%	0.505	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.5	-22.5	-179	-167.2	0	0	0	0	114.1	R517	R517-C519 PolarHBondContact O-N 2.79Å
520	C	47.3	Very low	51	Low	114 Å²	114	101.7 Å²	101.7	77%	0.77	52%	0.517	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.5	-19.7	179	-60	0	0	0	0	114	C518	C518-C520 PolarHBondContact O-N 3.49Å
521	C	51.3	Low	49.1	Very low	37 Å²	37	107 Å²	107	25%	0.25	54%	0.541	C	S	.	.	T	Hydrogen-bonded Turn	trans	-134.6	-15.2	-167.3	-59	0	0	0	0	114.5	C518 T523 L613	C518-C521 PolarHBondContact O-N 3.12Å; C521-T523 HydrophobicContact CB-CG2 4.27Å; C521-T523 VanDerWaalsContact CB-OG1 3.32Å; C521-T523 WeakPolarHBondContact CB-OG1 3.48Å; C521-T523 PolarHBondContact O-N 3.16Å; C521-L613 HydrophobicContact CB-CD1 4.33Å; C521-L613 HydrophobicContact CB-CD2 4.37Å
522	F	51.6	Low	47.3	Very low	125 Å²	125	109.1 Å²	109.1	55%	0.548	55%	0.545	S	S	.	.			trans	54.5	2.1	-168.5	-96.7	-91.5	0	0	0	116.2	C518	C518-F522 PolarHBondContact O-N 3Å
523	T	49	Very low	45.6	Very low	29 Å²	29	109.9 Å²	109.9	18%	0.178	55%	0.546	C	S	.	.			trans	-76.5	140.3	178.7	50.3	0	0	0	0	112.5	C521 N525	C521-T523 HydrophobicContact CB-CG2 4.27Å; C521-T523 VanDerWaalsContact CB-OG1 3.32Å; C521-T523 WeakPolarHBondContact CB-OG1 3.48Å; C521-T523 PolarHBondContact O-N 3.16Å; T523-N525 PolarHBondContact O-N 2.7Å; T523-N525 VanDerWaalsContact O-N 3.12Å
524	K	41.2	Very low	44	Very low	135 Å²	135	114.3 Å²	114.3	59%	0.587	57%	0.568	S	S	*	*			trans	-65.8	99.8	162.1	-66.1	-177.5	175.4	-162.1	0	109.4	E515	E515-K524 WeakPolarHBondContact OE1-CE 3.27Å; E515-K524 IonicContact OE1-NZ 3.47Å; E515-K524 PolarHBondContact OE1-NZ 2.7Å; E515-K524 WeakPolarHBondContact OE2-CE 3.3Å; E515-K524 IonicContact OE2-NZ 3.62Å
525	N	40.1	Very low	43	Very low	21 Å²	21	118.4 Å²	118.4	11%	0.112	57%	0.574	C	S	.	*			trans	-161	126.6	161.1	-114.9	-59.5	0	0	0	113.1	T523 H527 K595 V596	T523-N525 PolarHBondContact O-N 2.7Å; T523-N525 VanDerWaalsContact O-N 3.12Å; N525-H527 VanDerWaalsContact C-N 3.28Å; N525-H527 PolarHBondContact O-N 3.16Å; N525-K595 WeakPolarHBondContact CB-O 3.42Å; N525-K595 PolarHBondContact ND2-O 2.75Å; N525-K595 PolarHBondContact OD1-O 2.95Å; N525-V596 PolarHBondContact ND2-O 2.73Å
526	R	43.4	Very low	41.8	Very low	219 Å²	219	122 Å²	122	83%	0.826	60%	0.595	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.3	24.2	-170.6	-68.2	-179.6	172	172.5	-3.3	114.4
527	H	45.4	Very low	40.7	Very low	129 Å²	129	123.2 Å²	123.2	60%	0.597	60%	0.603	S	S	*	*	T	Hydrogen-bonded Turn	trans	-126	11.5	-165.9	-71.2	-49.2	0	0	0	116.9	N525 K529	N525-H527 VanDerWaalsContact C-N 3.28Å; N525-H527 PolarHBondContact O-N 3.16Å; H527-K529 PolarHBondContact O-N 3.29Å
528	H	42.6	Very low	39.7	Very low	122 Å²	122	125.8 Å²	125.8	57%	0.565	63%	0.625	S	S	*	*			trans	-82.1	93.4	168	-80.2	-83.1	0	0	0	111.2
529	K	35.9	Very low	39	Very low	190 Å²	190	133.8 Å²	133.8	83%	0.826	66%	0.659	S	S	*	*			trans	-74.8	134.4	154.5	-91.4	-172.9	172.5	-175.3	0	108.4	H527 I531	H527-K529 PolarHBondContact O-N 3.29Å; K529-I531 PolarHBondContact O-N 3.29Å
530	P	35.4	Very low	37.8	Very low	97 Å²	97	141 Å²	141	63%	0.63	67%	0.673	S	S	*	*			trans	-65.5	127.3	168.8	27.7	-32.3	0	0	0	109.1	F532	P530-F532 HydrophobicContact CB-CD2 4.43Å; P530-F532 HydrophobicContact CB-CE2 4.25Å; P530-F532 HydrophobicContact CG-CD2 4.24Å; P530-F532 HydrophobicContact CG-CE2 3.85Å; P530-F532 PolarHBondContact O-N 3.37Å; P530-F532 VanDerWaalsContact O-N 3.09Å
531	I	30.9	Very low	37	Very low	167 Å²	167	141 Å²	141	86%	0.856	68%	0.675	S	S	*	*			trans	-76.5	94.5	168	-63.3	168.8	0	0	0	106.2	K529	K529-I531 PolarHBondContact O-N 3.29Å
532	F	35.4	Very low	36	Very low	170 Å²	170	150.5 Å²	150.5	75%	0.746	71%	0.705	S	S	*	*			trans	-64.6	132.8	160.3	-78.1	-84.9	0	0	0	107.9	P530 D534	P530-F532 HydrophobicContact CB-CD2 4.43Å; P530-F532 HydrophobicContact CB-CE2 4.25Å; P530-F532 HydrophobicContact CG-CD2 4.24Å; P530-F532 HydrophobicContact CG-CE2 3.85Å; P530-F532 PolarHBondContact O-N 3.37Å; P530-F532 VanDerWaalsContact O-N 3.09Å; F532-D534 PolarHBondContact O-N 3.29Å
533	R	30.2	Very low	35	Very low	228 Å²	228	149 Å²	149	86%	0.86	71%	0.711	S	S	*	*			trans	-89.8	94.9	-178	-162.5	177.4	-173.3	-180	0.1	107	N535	R533-N535 PolarHBondContact O-N 3.27Å
534	D	30.6	Very low	34.2	Very low	142 Å²	142	156.8 Å²	156.8	76%	0.759	74%	0.744	S	S	*	*			trans	-58.2	104.3	178	-71.4	-34.1	0	0	0	110.2	F532	F532-D534 PolarHBondContact O-N 3.29Å
535	N	33.5	Very low	33.6	Very low	154 Å²	154	159.1 Å²	159.1	82%	0.824	76%	0.757	S	S	*	*			trans	-92.3	108	159.1	-94.8	2.5	0	0	0	107	R533	R533-N535 PolarHBondContact O-N 3.27Å
536	N	30.4	Very low	33.2	Very low	135 Å²	135	162.8 Å²	162.8	72%	0.722	78%	0.782	S	S	*	*			trans	-57.7	168.8	-178.3	-71.5	-47.6	0	0	0	114
537	N	30.3	Very low	32.7	Very low	146 Å²	146	161.8 Å²	161.8	78%	0.781	79%	0.787	S	S	*	*			trans	85.5	79.9	163.4	-52.4	-18.8	0	0	0	116.4
538	N	30.8	Very low	31.9	Very low	159 Å²	159	160.2 Å²	160.2	85%	0.85	79%	0.79	S	S	*	*	S	Bend		-167.2	154.9	104.8	-92.1	-27.2	0	0	0	112.3
539	Q	31.3	Very low	31.3	Very low	198 Å²	198	162.5 Å²	162.5	93%	0.925	80%	0.801	S	S	*	*			trans	67.9	71.4	170.9	-62	179.8	-4.7	0	0	117.8
540	R	26.2	Very low	31.1	Very low	244 Å²	244	160 Å²	160	92%	0.921	80%	0.795	S	S	*	*			trans	-119.6	107.7	150	-142.3	-172.7	-167.3	-178.6	3	107.8
541	S	31.5	Very low	31	Very low	115 Å²	115	161.5 Å²	161.5	80%	0.804	80%	0.798	S	S	*	*			trans	172.3	139.8	156.6	-84.8	0	0	0	0	112.7
542	R	30.7	Very low	31.1	Very low	235 Å²	235	160 Å²	160	89%	0.887	79%	0.792	S	S	*	*			trans	66.5	105.1	172.9	-55.4	178.2	-174	-173.9	0.3	114.4
543	S	29.7	Very low	30.9	Very low	95 Å²	95	160.2 Å²	160.2	66%	0.664	79%	0.792	S	S	*	*			cis	62.8	90.6	44.6	87.2	0	0	0	0	114.3
544	H	32	Very low	31.1	Very low	191 Å²	191	155.9 Å²	155.9	88%	0.884	78%	0.782	S	S	*	*				-169.4	168	109.6	-97.8	-70.8	0	0	0	111
545	Q	28.7	Very low	31.2	Very low	184 Å²	184	157.4 Å²	157.4	86%	0.86	78%	0.782	S	S	*	*			trans	-100.1	-176.3	-167.4	-122.1	-173.4	-25.5	0	0	111.3
546	P	31.2	Very low	31	Very low	99 Å²	99	159.2 Å²	159.2	64%	0.643	78%	0.782	S	S	*	*			trans	-103.6	161.1	-130.8	40.8	-31.5	0	0	0	114.2
547	Q	34.2	Very low	31.2	Very low	198 Å²	198	160.2 Å²	160.2	93%	0.925	79%	0.787	S	S	*	*			trans	-165.1	169.2	138.5	-109.2	147.7	1.1	0	0	112.8
548	S	27.6	Very low	31.1	Very low	95 Å²	95	160.1 Å²	160.1	66%	0.664	79%	0.786	S	S	*	*			trans	-99	162.1	-160.3	53.1	0	0	0	0	114.8
549	H	30.3	Very low	31.2	Very low	171 Å²	171	157.1 Å²	157.1	79%	0.792	78%	0.778	S	S	*	*			trans	76.1	128.9	151.1	-96.1	-83.7	0	0	0	119.8
550	I	32.3	Very low	31.3	Very low	137 Å²	137	155.9 Å²	155.9	70%	0.703	77%	0.771	S	S	*	*			trans	96.2	135.9	142.2	-64.9	160.5	0	0	0	119.1
551	D	33.6	Very low	31.8	Very low	129 Å²	129	148.5 Å²	148.5	69%	0.69	75%	0.754	S	S	*	*			trans	71.7	95.8	165.4	-70.2	-34.3	0	0	0	124.3
552	N	31.8	Very low	31.8	Very low	136 Å²	136	153 Å²	153	73%	0.727	75%	0.753	S	S	*	*				45.1	126.9	108.4	-75.6	-50.8	0	0	0	122.2
553	K	31.3	Very low	31.7	Very low	173 Å²	173	147.9 Å²	147.9	75%	0.752	74%	0.743	S	S	*	*			trans	86.3	130.3	136.8	-82.7	177.2	174.9	174.5	0	121.9
554	H	35.4	Very low	32	Very low	138 Å²	138	150.8 Å²	150.8	64%	0.639	75%	0.75	S	S	*	*			trans	95.1	110.5	141	-72.8	-42.4	0	0	0	123
555	K	33.4	Very low	31.8	Very low	174 Å²	174	150.2 Å²	150.2	76%	0.757	75%	0.747	S	S	*	*				69.9	118	125.6	-71.2	174.4	176.5	175.1	0	120.9
556	K	29.5	Very low	32.1	Very low	192 Å²	192	147 Å²	147	84%	0.835	75%	0.745	S	S	*	*				36	127.6	119.9	-68.9	-175.8	171.9	-174.4	0	118.7
557	L	32.9	Very low	31.9	Very low	156 Å²	156	149.9 Å²	149.9	82%	0.817	76%	0.755	S	S	*	*				-170.2	175.2	89.7	-145.4	64.4	0	0	0	112.3
558	N	29.9	Very low	32.1	Very low	144 Å²	144	145.6 Å²	145.6	77%	0.77	75%	0.745	S	S	*	*			trans	-87.1	164.4	-174.5	-53	-35.3	0	0	0	113.3
559	S	31.7	Very low	32.2	Very low	96 Å²	96	149.8 Å²	149.8	67%	0.671	75%	0.754	S	S	*	*				151.5	150.2	101.5	63.5	0	0	0	0	115.4
560	H	34.2	Very low	32.1	Very low	171 Å²	171	149.5 Å²	149.5	79%	0.792	75%	0.75	S	S	*	*			trans	61.5	152	150.1	-68.4	-45.3	0	0	0	119.2
561	T	35.4	Very low	32	Very low	90 Å²	90	149.7 Å²	149.7	55%	0.552	76%	0.758	S	S	*	*			cis	-167.9	150.4	-2	11.4	0	0	0	0	110.2
562	R	31.5	Very low	31.8	Very low	210 Å²	210	150 Å²	150	79%	0.792	76%	0.757	S	S	*	*			trans	59.2	160.9	142	-61.2	-176.7	-144.7	159.3	7.3	120.1
563	D	30.5	Very low	31.5	Very low	127 Å²	127	152.3 Å²	152.3	68%	0.679	76%	0.761	S	S	*	*			cis	-167.4	-176.8	-25.2	-87.2	-23.4	0	0	0	106.7
564	I	34.2	Very low	31.6	Very low	156 Å²	156	150 Å²	150	80%	0.8	76%	0.764	S	S	*	*			trans	76.8	118.7	163	-46.1	171.8	0	0	0	115
565	E	29.3	Very low	31.2	Very low	179 Å²	179	152 Å²	152	84%	0.836	78%	0.775	S	S	*	*			cis	107.2	110.4	20.9	-174.5	172.1	-141.6	0	0	113.8
566	S	33.7	Very low	31	Very low	116 Å²	116	154.1 Å²	154.1	81%	0.811	78%	0.784	S	S	*	*			trans	166.7	121.5	142.5	59.3	0	0	0	0	114.1
567	D	27.6	Very low	30.8	Very low	160 Å²	160	154.7 Å²	154.7	86%	0.856	79%	0.787	S	S	*	*			trans	-81	-178.5	155.3	-86.7	-36.4	0	0	0	109.3
568	P	37.6	Very low	30.5	Very low	108 Å²	108	153 Å²	153	70%	0.701	79%	0.788	S	S	*	*			cis	-158.4	-163.5	32.8	47.1	-23.2	0	0	0	119.6
569	E	30.7	Very low	30.5	Very low	183 Å²	183	150.9 Å²	150.9	86%	0.855	79%	0.785	S	S	*	*			trans	64.9	155.7	157.6	-69.4	-172.6	146.2	0	0	120.6
570	F	28.1	Very low	30.2	Very low	164 Å²	164	157.3 Å²	157.3	72%	0.719	79%	0.794	S	S	*	*			cis	167.4	130.2	-24.9	-175.2	-87.6	0	0	0	104.8
571	T	30.2	Very low	29.8	Very low	141 Å²	141	155.2 Å²	155.2	87%	0.865	79%	0.794	S	S	*	*			trans	170.9	174	150.4	31.6	0	0	0	0	113.9
572	M	28.9	Very low	29.4	Very low	137 Å²	137	155.8 Å²	155.8	68%	0.675	80%	0.801	S	S	*	*			trans	-121.5	142.4	-147.9	-67.7	160.3	29.5	0	0	116.7
573	K	26.3	Very low	29.2	Very low	184 Å²	184	156.7 Å²	156.7	80%	0.8	80%	0.804	S	S	*	*			trans	59.1	176.8	139.4	-68.9	178.4	-177	173.6	0	118.7
574	P	32.5	Very low	29	Very low	125 Å²	125	155.5 Å²	155.5	81%	0.812	81%	0.806	S	S	*	*			cis	-127.8	-167.1	-31.6	28.9	-6.4	0	0	0	114.1
575	M	26.4	Very low	28.8	Very low	179 Å²	179	158.6 Å²	158.6	88%	0.882	81%	0.808	S	S	*	*			trans	-61.6	151.6	179.3	-54.7	161	71.2	0	0	116.8
576	K	29.9	Very low	28.7	Very low	218 Å²	218	158 Å²	158	95%	0.948	80%	0.804	S	S	*	*			trans	-165.3	161.2	134.4	-110.8	164.2	-173.9	176.9	0	114.7
577	K	25.2	Very low	28.5	Very low	204 Å²	204	159.6 Å²	159.6	89%	0.887	80%	0.803	S	S	*	*			trans	-102	144.8	-175.5	-66.3	167.7	174.5	168.5	0	112.7
578	S	27.7	Very low	28.6	Very low	122 Å²	122	160.7 Å²	160.7	85%	0.853	80%	0.8	S	S	*	*			trans	-177.8	169.1	150.3	-108.1	0	0	0	0	108.8
579	S	29.5	Very low	28.3	Very low	99 Å²	99	161.3 Å²	161.3	69%	0.692	81%	0.806	S	S	*	*			cis	-160.5	114.5	-22.7	42.8	0	0	0	0	107.2
580	R	24.7	Very low	28.7	Very low	231 Å²	231	157.3 Å²	157.3	87%	0.872	80%	0.795	S	S	*	*				47.5	137.1	105.9	-137.6	-173.4	-174.4	173.9	0.3	116.9
581	T	26.5	Very low	29.4	Very low	127 Å²	127	154.7 Å²	154.7	78%	0.779	79%	0.788	S	S	*	*			trans	66.9	146.6	168.8	55.4	0	0	0	0	116.8
582	S	26.1	Very low	30.2	Very low	101 Å²	101	153.7 Å²	153.7	71%	0.706	78%	0.777	S	S	*	*			cis	-174.4	143.7	-11.9	46.7	0	0	0	0	110.4
583	R	28.6	Very low	31.1	Very low	229 Å²	229	152.7 Å²	152.7	86%	0.864	77%	0.766	S	S	*	*			trans	-175.8	125.1	134.3	-108.7	166.4	174.1	164.8	-1.4	112.4
584	S	25.6	Very low	31.8	Very low	102 Å²	102	144.1 Å²	144.1	71%	0.713	73%	0.729	S	S	*	*			trans	-76.8	138.9	162	171.9	0	0	0	0	109.4
585	R	30	Very low	32.7	Very low	221 Å²	221	145.5 Å²	145.5	83%	0.834	72%	0.722	S	S	*	*			trans	-135.1	125.9	149.1	-72.9	-171.3	-176.1	166.1	2.1	108
586	H	27.6	Very low	33.7	Very low	166 Å²	166	138.6 Å²	138.6	77%	0.769	69%	0.69	S	S	*	*			trans	-55.2	156.3	158.3	-75.1	-113.9	0	0	0	109.6
587	I	29.9	Very low	34.9	Very low	151 Å²	151	130.3 Å²	130.3	77%	0.774	66%	0.659	S	S	*	*				174	133.8	126.2	-90.2	153.8	0	0	0	110.4
588	K	29.9	Very low	36.2	Very low	183 Å²	183	125 Å²	125	80%	0.796	64%	0.638	S	S	*	*			trans	61.4	107.7	165.7	-73.7	165.1	-174.6	-177.1	0	118.3	T590	K588-T590 PolarHBondContact O-N 3.19Å
589	S	29.6	Very low	37.2	Very low	120 Å²	120	121.5 Å²	121.5	84%	0.839	61%	0.613	S	S	*	*			trans	-59.3	95.9	162.6	49.8	0	0	0	0	111.9
590	T	40.2	Very low	38.2	Very low	100 Å²	100	123.7 Å²	123.7	61%	0.613	61%	0.607	S	S	*	*			trans	-94	123.3	159.6	52.9	0	0	0	0	108.4	K588 L592	K588-T590 PolarHBondContact O-N 3.19Å; T590-L592 VanDerWaalsContact C-N 3.31Å; T590-L592 PolarHBondContact O-N 3.38Å
591	N	41.6	Very low	39.2	Very low	108 Å²	108	117.1 Å²	117.1	58%	0.578	59%	0.586	S	S	*	*			trans	-66.6	91.1	176	-78.5	-27.2	0	0	0	109.2	R593 Y600	N591-R593 PolarHBondContact O-N 2.92Å; N591-R593 VanDerWaalsContact O-N 3.16Å; N591-Y600 HydrophobicContact CB-CD1 3.62Å; N591-Y600 HydrophobicContact CB-CE1 4.33Å; N591-Y600 HydrophobicContact CB-CG 4.11Å; N591-Y600 VanDerWaalsContact O-CD1 3.26Å; N591-Y600 WeakPolarHBondContact O-CD1 3.22Å; N591-Y600 WeakPolarHBondContact O-CE1 3.38Å
592	L	48.4	Very low	40.2	Very low	121 Å²	121	116.8 Å²	116.8	63%	0.634	59%	0.586	S	S	*	*			trans	-71.8	108.6	-178	-87.9	140.4	0	0	0	110.4	T590 C594	T590-L592 VanDerWaalsContact C-N 3.31Å; T590-L592 PolarHBondContact O-N 3.38Å; L592-C594 PolarHBondContact O-N 3.25Å
593	R	47.9	Very low	41.4	Very low	116 Å²	116	115.7 Å²	115.7	44%	0.438	58%	0.575	S	S	.	*	B	Isolated β-bridge	trans	-58.8	114.8	179.1	-161.8	174.6	-164.5	-101	-6.5	110.3	N591 K595 E598 Y600	N591-R593 PolarHBondContact O-N 2.92Å; N591-R593 VanDerWaalsContact O-N 3.16Å; R593-K595 PolarHBondContact O-N 3.5Å; R593-E598 IonicContact CZ-OE1 3.51Å; R593-E598 IonicContact NH1-OE1 2.66Å; R593-E598 PolarHBondContact NH1-OE1 3.03Å; R593-E598 IonicContact NH2-OE1 3.65Å; R593-E598 PolarHBondContact NH2-OE1 3.23Å; R593-E598 IonicContact NH2-OE2 2.7Å; R593-E598 PolarHBondContact NH2-OE2 2.73Å; R593-Y600 HydrophobicContact CB-CD1 4.35Å; R593-Y600 HydrophobicContact CB-CE1 3.86Å; R593-Y600 HydrophobicContact CG-CE1 4.09Å
594	C	41.2	Very low	42.3	Very low	4 Å²	4	107.7 Å²	107.7	3%	0.027	55%	0.553	C	S	.	*			trans	-58	109	177.4	176.1	0	0	0	0	111.3	L592 V596 C597 E598 S599	L592-C594 PolarHBondContact O-N 3.25Å; C594-V596 PolarHBondContact O-N 2.88Å; C594-C597 HydrophobicContact CB-CB 4.22Å; C594-C597 WeakPolarHBondContact CB-SG 3.49Å; C594-C597 PolarHBondContact O-N 3Å; C594-C597 VanDerWaalsContact O-N 3.13Å; C594-C597 WeakPolarHBondContact SG-CB 3.38Å; C594-C597 PolarHBondContact SG-N 2.87Å; C594-C597 CovalentContact SG-SG 2.04Å; C594-C597 PolarHBondContact SG-SG 3.13Å; C594-E598 WeakPolarHBondContact O-CA 3.41Å; C594-E598 PolarHBondContact O-N 3.26Å; C594-S599 WeakPolarHBondContact CB-O 3.4Å; C594-S599 PolarHBondContact N-O 3.43Å
595	K	50.8	Low	43.4	Very low	153 Å²	153	105.5 Å²	105.5	67%	0.665	54%	0.537	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-5.9	-179.8	-75.6	-175	177.6	177.3	0	115.4	N525 R593	N525-K595 WeakPolarHBondContact CB-O 3.42Å; N525-K595 PolarHBondContact ND2-O 2.75Å; N525-K595 PolarHBondContact OD1-O 2.95Å; R593-K595 PolarHBondContact O-N 3.5Å
596	V	46.2	Very low	44.5	Very low	35 Å²	35	99.2 Å²	99.2	21%	0.212	52%	0.524	C	S	.	.	T	Hydrogen-bonded Turn	trans	-109.4	-28.4	178.6	-178.8	0	0	0	0	111.9	N525 C594 A609 L613	N525-V596 PolarHBondContact ND2-O 2.73Å; C594-V596 PolarHBondContact O-N 2.88Å; V596-A609 HydrophobicContact CG1-CB 4.33Å; V596-L613 HydrophobicContact CG1-CD1 4.37Å
597	C	54.9	Low	45.6	Very low	44 Å²	44	91.6 Å²	91.6	30%	0.297	49%	0.489	S	S	.	.	T	Hydrogen-bonded Turn	trans	-135.4	-1.6	-165.1	68	0	0	0	0	115.4	C594 S599 C607	C594-C597 HydrophobicContact CB-CB 4.22Å; C594-C597 WeakPolarHBondContact CB-SG 3.49Å; C594-C597 PolarHBondContact O-N 3Å; C594-C597 VanDerWaalsContact O-N 3.13Å; C594-C597 WeakPolarHBondContact SG-CB 3.38Å; C594-C597 PolarHBondContact SG-N 2.87Å; C594-C597 CovalentContact SG-SG 2.04Å; C594-C597 PolarHBondContact SG-SG 3.13Å; C597-S599 PolarHBondContact O-N 3.09Å; C597-S599 PolarHBondContact SG-OG 3.3Å; C597-C607 HydrophobicContact CB-CB 4.38Å; C597-C607 WeakPolarHBondContact SG-CB 3.32Å; C597-C607 PolarHBondContact SG-SG 3.45Å
598	E	52.8	Low	46.6	Very low	93 Å²	93	89.3 Å²	89.3	44%	0.435	48%	0.484	S	S	.	.			trans	53.2	-4.2	-179.6	-58.2	-159.6	133.1	0	0	117.4	R593 C594	R593-E598 IonicContact CZ-OE1 3.51Å; R593-E598 IonicContact NH1-OE1 2.66Å; R593-E598 PolarHBondContact NH1-OE1 3.03Å; R593-E598 IonicContact NH2-OE1 3.65Å; R593-E598 PolarHBondContact NH2-OE1 3.23Å; R593-E598 IonicContact NH2-OE2 2.7Å; R593-E598 PolarHBondContact NH2-OE2 2.73Å; C594-E598 WeakPolarHBondContact O-CA 3.41Å; C594-E598 PolarHBondContact O-N 3.26Å
599	S	49.3	Very low	47.7	Very low	47 Å²	47	82 Å²	82	33%	0.329	46%	0.458	S	S	.	.			trans	-67.1	141.1	174.7	63.7	0	0	0	0	111.6	C594 C597 Q601	C594-S599 WeakPolarHBondContact CB-O 3.4Å; C594-S599 PolarHBondContact N-O 3.43Å; C597-S599 PolarHBondContact O-N 3.09Å; C597-S599 PolarHBondContact SG-OG 3.3Å; S599-Q601 PolarHBondContact O-N 2.65Å
600	Y	51.3	Low	48.8	Very low	145 Å²	145	77 Å²	77	57%	0.569	42%	0.423	S	S	*	.	B	Isolated β-bridge	trans	-83.8	101.5	167.8	-69.1	-63.5	0	0	0	108.6	N591 R593	N591-Y600 HydrophobicContact CB-CD1 3.62Å; N591-Y600 HydrophobicContact CB-CE1 4.33Å; N591-Y600 HydrophobicContact CB-CG 4.11Å; N591-Y600 VanDerWaalsContact O-CD1 3.26Å; N591-Y600 WeakPolarHBondContact O-CD1 3.22Å; N591-Y600 WeakPolarHBondContact O-CE1 3.38Å; R593-Y600 HydrophobicContact CB-CD1 4.35Å; R593-Y600 HydrophobicContact CB-CE1 3.86Å; R593-Y600 HydrophobicContact CG-CE1 4.09Å
601	Q	45.3	Very low	49.5	Very low	94 Å²	94	76.1 Å²	76.1	44%	0.439	43%	0.425	S	S	.	.			trans	-133.8	148.3	168	-77.4	-160.4	-24.6	0	0	109.7	S599 V603 T606	S599-Q601 PolarHBondContact O-N 2.65Å; Q601-V603 PolarHBondContact O-N 3.39Å; Q601-T606 PolarHBondContact OE1-OG1 2.98Å
602	P	47.3	Very low	50.1	Low	120 Å²	120	81.3 Å²	81.3	78%	0.779	44%	0.437	S	S	*	.	S	Bend	trans	-67.5	-3.8	-175.3	26.7	-35.4	0	0	0	114.6
603	V	50.9	Low	50.5	Low	77 Å²	77	79 Å²	79	47%	0.467	43%	0.425	S	S	.	.			trans	-140.2	113.5	178.1	-173.2	0	0	0	0	109.8	Q601 C605 T606	Q601-V603 PolarHBondContact O-N 3.39Å; V603-C605 HydrophobicContact CG1-CB 4.47Å; V603-C605 PolarHBondContact O-N 3.46Å; V603-T606 HydrophobicContact CB-CG2 4.19Å; V603-T606 HydrophobicContact CG1-CG2 4.15Å; V603-T606 PolarHBondContact O-N 2.79Å; V603-T606 PolarHBondContact O-OG1 3.28Å; V603-T606 VanDerWaalsContact O-OG1 3.05Å
604	C	46.9	Very low	50.7	Low	61 Å²	61	82.7 Å²	82.7	41%	0.412	44%	0.444	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-12.8	-175.4	-167.2	0	0	0	0	114.6
605	C	50.1	Low	50.7	Low	56 Å²	56	85 Å²	85	38%	0.378	46%	0.46	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.8	3.7	-172.9	-56.9	0	0	0	0	115	V603	V603-C605 HydrophobicContact CG1-CB 4.47Å; V603-C605 PolarHBondContact O-N 3.46Å
606	T	52.2	Low	50.4	Low	89 Å²	89	83.2 Å²	83.2	55%	0.546	46%	0.463	S	S	.	.			trans	-96.5	-2.6	-176.7	48.8	0	0	0	0	115.1	Q601 V603	Q601-T606 PolarHBondContact OE1-OG1 2.98Å; V603-T606 HydrophobicContact CB-CG2 4.19Å; V603-T606 HydrophobicContact CG1-CG2 4.15Å; V603-T606 PolarHBondContact O-N 2.79Å; V603-T606 PolarHBondContact O-OG1 3.28Å; V603-T606 VanDerWaalsContact O-OG1 3.05Å
607	C	50.1	Low	50.5	Low	7 Å²	7	89.6 Å²	89.6	5%	0.047	49%	0.491	C	S	.	.	S	Bend	trans	-77.2	150.3	-175.7	83.8	0	0	0	0	113	C597 A609 C610 A611	C597-C607 HydrophobicContact CB-CB 4.38Å; C597-C607 WeakPolarHBondContact SG-CB 3.32Å; C597-C607 PolarHBondContact SG-SG 3.45Å; C607-A609 PolarHBondContact O-N 3.17Å; C607-A609 VanDerWaalsContact O-N 3.13Å; C607-C610 PolarHBondContact O-N 2.88Å; C607-C610 PolarHBondContact SG-N 3.27Å; C607-C610 PolarHBondContact SG-SG 2.99Å; C607-A611 PolarHBondContact O-N 3.36Å
608	P	51.9	Low	49.9	Very low	103 Å²	103	89.3 Å²	89.3	67%	0.669	49%	0.492	S	S	*	.	H	α-helix	trans	-58.7	-26.5	179.6	-26.5	35.2	0	0	0	114.7	R612	P608-R612 WeakPolarHBondContact O-CG 3.46Å; P608-R612 PolarHBondContact O-N 2.82Å
609	A	52.3	Low	49.2	Very low	29 Å²	29	89.6 Å²	89.6	24%	0.24	50%	0.501	C	S	.	.	H	α-helix	trans	-72.5	-44.8	177.3	0	0	0	0	0	112.3	V596 C607 A611 R612 L613	V596-A609 HydrophobicContact CG1-CB 4.33Å; C607-A609 PolarHBondContact O-N 3.17Å; C607-A609 VanDerWaalsContact O-N 3.13Å; A609-A611 VanDerWaalsContact C-N 3.27Å; A609-A611 PolarHBondContact O-N 3.4Å; A609-R612 PolarHBondContact O-N 2.99Å; A609-R612 VanDerWaalsContact O-N 3.13Å; A609-L613 WeakPolarHBondContact O-CG 3.46Å; A609-L613 PolarHBondContact O-N 3.1Å; A609-L613 VanDerWaalsContact O-N 3.15Å
610	C	52.5	Low	48.8	Very low	15 Å²	15	98 Å²	98	10%	0.101	53%	0.526	C	S	.	.	H	α-helix	trans	-63.8	-33	176.4	-72.5	0	0	0	0	112.2	C607	C607-C610 PolarHBondContact O-N 2.88Å; C607-C610 PolarHBondContact SG-N 3.27Å; C607-C610 PolarHBondContact SG-SG 2.99Å
611	A	55.5	Low	48	Very low	81 Å²	81	100.7 Å²	100.7	67%	0.669	54%	0.541	S	S	*	.	H	α-helix	trans	-66.1	-35.4	173.5	0	0	0	0	0	113.1	C607 A609	C607-A611 PolarHBondContact O-N 3.36Å; A609-A611 VanDerWaalsContact C-N 3.27Å; A609-A611 PolarHBondContact O-N 3.4Å
612	R	55.2	Low	47.3	Very low	217 Å²	217	105 Å²	105	82%	0.819	56%	0.558	S	S	*	*	H	α-helix	trans	-74.6	-31.1	177.3	-72.9	177.7	-178.8	-174.9	0.6	113.3	P608 A609	P608-R612 WeakPolarHBondContact O-CG 3.46Å; P608-R612 PolarHBondContact O-N 2.82Å; A609-R612 PolarHBondContact O-N 2.99Å; A609-R612 VanDerWaalsContact O-N 3.13Å
613	L	55	Low	46.4	Very low	73 Å²	73	108.7 Å²	108.7	38%	0.382	57%	0.565	S	S	.	*	T	Hydrogen-bonded Turn	trans	-91.1	8.1	-171.5	-70.2	167.3	0	0	0	115.3	C521 V596 A609 C615	C521-L613 HydrophobicContact CB-CD1 4.33Å; C521-L613 HydrophobicContact CB-CD2 4.37Å; V596-L613 HydrophobicContact CG1-CD1 4.37Å; A609-L613 WeakPolarHBondContact O-CG 3.46Å; A609-L613 PolarHBondContact O-N 3.1Å; A609-L613 VanDerWaalsContact O-N 3.15Å; L613-C615 PolarHBondContact O-N 3.24Å; L613-C615 VanDerWaalsContact O-N 3.12Å
614	K	53.2	Low	45.2	Very low	194 Å²	194	109.9 Å²	109.9	84%	0.843	57%	0.572	S	S	*	*	T	Hydrogen-bonded Turn	trans	46.7	42.2	178.1	-66.5	-177.2	177.9	175.2	0	114
615	C	40.5	Very low	44.2	Very low	52 Å²	52	116.1 Å²	116.1	35%	0.351	60%	0.596	S	S	.	*			trans	-57.4	130.6	-171.4	-146.1	0	0	0	0	112.1	L613 E617 A618	L613-C615 PolarHBondContact O-N 3.24Å; L613-C615 VanDerWaalsContact O-N 3.12Å; C615-E617 PolarHBondContact O-N 2.84Å; C615-A618 HydrophobicContact CB-CB 4.47Å; C615-A618 VanDerWaalsContact O-CB 3.32Å; C615-A618 WeakPolarHBondContact O-CB 3.42Å; C615-A618 PolarHBondContact O-N 2.78Å; C615-A618 VanDerWaalsContact O-N 3.09Å
616	P	45.3	Very low	43.1	Very low	115 Å²	115	118.3 Å²	118.3	75%	0.747	61%	0.607	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.3	-23.5	-173.2	24.8	-34.4	0	0	0	114
617	E	47.9	Very low	41.7	Very low	170 Å²	170	123.5 Å²	123.5	79%	0.794	62%	0.622	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.4	-4.2	178.8	-64	173.4	166.2	0	0	113.5	C615	C615-E617 PolarHBondContact O-N 2.84Å
618	A	43	Very low	40.6	Very low	37 Å²	37	129.7 Å²	129.7	31%	0.306	65%	0.653	S	S	.	*	S	Bend	trans	-61.5	131.9	174.9	0	0	0	0	0	109.3	C615 R620	C615-A618 HydrophobicContact CB-CB 4.47Å; C615-A618 VanDerWaalsContact O-CB 3.32Å; C615-A618 WeakPolarHBondContact O-CB 3.42Å; C615-A618 PolarHBondContact O-N 2.78Å; C615-A618 VanDerWaalsContact O-N 3.09Å; A618-R620 PolarHBondContact O-N 2.93Å
619	P	38.3	Very low	39.2	Very low	99 Å²	99	129.6 Å²	129.6	64%	0.643	66%	0.655	S	S	*	*			trans	-63.8	99.9	178.7	25.5	-33	0	0	0	108.4	K621	P619-K621 PolarHBondContact O-N 3.2Å
620	R	40	Very low	38.2	Very low	224 Å²	224	134.3 Å²	134.3	85%	0.845	68%	0.681	S	S	*	*			trans	-54.1	112.9	173.9	-65.8	-175.9	-173.1	-174.2	2.3	106.2	A618 K622	A618-R620 PolarHBondContact O-N 2.93Å; R620-K622 PolarHBondContact O-N 3.43Å
621	K	35.7	Very low	36.8	Very low	201 Å²	201	142.7 Å²	142.7	87%	0.874	72%	0.716	S	S	*	*			trans	-51.9	109.7	165.5	-78.3	-174.6	176.4	-178.8	0	105.3	P619 Q623	P619-K621 PolarHBondContact O-N 3.2Å; K621-Q623 PolarHBondContact O-N 3.47Å; K621-Q623 VanDerWaalsContact O-N 3.09Å
622	K	28.7	Very low	35.5	Very low	185 Å²	185	147.5 Å²	147.5	80%	0.804	72%	0.724	S	S	*	*			trans	-50.9	124.9	164	-75.9	-178.8	175.6	177.6	0	104.6	R620 T624	R620-K622 PolarHBondContact O-N 3.43Å; K622-T624 PolarHBondContact O-N 3.38Å; K622-T624 PolarHBondContact O-OG1 3Å
623	Q	29.4	Very low	34.2	Very low	197 Å²	197	142.2 Å²	142.2	92%	0.921	72%	0.72	S	S	*	*			trans	-68.7	73.7	158.9	-77.8	-179.9	-19.6	0	0	106.3	K621 Q625	K621-Q623 PolarHBondContact O-N 3.47Å; K621-Q623 VanDerWaalsContact O-N 3.09Å; Q623-Q625 PolarHBondContact O-N 2.96Å
624	T	26.5	Very low	32.8	Very low	102 Å²	102	148.3 Å²	148.3	63%	0.626	74%	0.744	S	S	*	*			trans	-54	124.8	157.8	-43	0	0	0	0	104.8	K622 V626	K622-T624 PolarHBondContact O-N 3.38Å; K622-T624 PolarHBondContact O-OG1 3Å; T624-V626 HydrophobicContact CG2-CG2 4.27Å; T624-V626 PolarHBondContact O-N 3.33Å
625	Q	25.6	Very low	31.7	Very low	193 Å²	193	147.3 Å²	147.3	90%	0.902	75%	0.746	S	S	*	*			trans	-64.9	81.6	169.7	-72.6	-179.3	-23.6	0	0	108.2	Q623 K627	Q623-Q625 PolarHBondContact O-N 2.96Å; Q625-K627 PolarHBondContact O-N 3.46Å; Q625-K627 VanDerWaalsContact O-N 3.13Å
626	V	25.9	Very low	31.1	Very low	102 Å²	102	154 Å²	154	62%	0.618	77%	0.769	S	S	*	*			trans	-79.5	99	172.2	-174.4	0	0	0	0	106.2	T624 I628	T624-V626 HydrophobicContact CG2-CG2 4.27Å; T624-V626 PolarHBondContact O-N 3.33Å; V626-I628 HydrophobicContact CB-CG1 4.38Å; V626-I628 HydrophobicContact CG1-CG1 3.77Å; V626-I628 PolarHBondContact O-N 3.32Å
627	K	23.2	Very low	30.2	Very low	198 Å²	198	152.8 Å²	152.8	86%	0.861	76%	0.764	S	S	*	*			trans	-52.9	94.7	152.2	-74.7	175.1	172.6	177.8	0	107.3	Q625 S629	Q625-K627 PolarHBondContact O-N 3.46Å; Q625-K627 VanDerWaalsContact O-N 3.13Å; K627-S629 VanDerWaalsContact C-N 3.29Å; K627-S629 PolarHBondContact O-N 2.93Å
628	I	27.3	Very low	29.3	Very low	137 Å²	137	151.6 Å²	151.6	70%	0.703	76%	0.761	S	S	*	*			trans	-76.3	91.3	169.9	-62.5	179.7	0	0	0	106.4	V626 T630	V626-I628 HydrophobicContact CB-CG1 4.38Å; V626-I628 HydrophobicContact CG1-CG1 3.77Å; V626-I628 PolarHBondContact O-N 3.32Å; I628-T630 HydrophobicContact CG2-CG2 4.25Å; I628-T630 PolarHBondContact O-N 3.42Å
629	S	23.2	Very low	28.6	Very low	101 Å²	101	158.4 Å²	158.4	71%	0.706	78%	0.784	S	S	*	*			trans	-74.9	97.9	160.2	60	0	0	0	0	108.2	K627 K631	K627-S629 VanDerWaalsContact C-N 3.29Å; K627-S629 PolarHBondContact O-N 2.93Å; S629-K631 VanDerWaalsContact C-N 3.27Å; S629-K631 PolarHBondContact O-N 3.09Å
630	T	29.6	Very low	27.9	Very low	127 Å²	127	158.3 Å²	158.3	78%	0.779	79%	0.786	S	S	*	*			trans	-70.3	89.8	159.4	29.1	0	0	0	0	108.4	I628 H632	I628-T630 HydrophobicContact CG2-CG2 4.25Å; I628-T630 PolarHBondContact O-N 3.42Å; T630-H632 PolarHBondContact O-N 3.3Å; T630-H632 VanDerWaalsContact O-N 3.1Å
631	K	24.1	Very low	27.4	Very low	192 Å²	192	155 Å²	155	84%	0.835	78%	0.783	S	S	*	*			trans	-61.8	107.4	159.5	-86.8	-176.5	173.9	179.1	0	107.6	S629	S629-K631 VanDerWaalsContact C-N 3.27Å; S629-K631 PolarHBondContact O-N 3.09Å
632	H	27.7	Very low	26.9	Very low	181 Å²	181	151.7 Å²	151.7	84%	0.838	78%	0.775	S	S	*	*			trans	-147.2	130.5	144.8	-104.2	-80.5	0	0	0	109.7	T630	T630-H632 PolarHBondContact O-N 3.3Å; T630-H632 VanDerWaalsContact O-N 3.1Å
633	S	29.2	Very low	26.8	Very low	107 Å²	107	150.4 Å²	150.4	75%	0.748	77%	0.772	S	S	*	*			trans	49.4	109.4	167.6	45.6	0	0	0	0	119.4
634	K	25.4	Very low	26.6	Very low	201 Å²	201	146.4 Å²	146.4	87%	0.874	76%	0.757	S	S	*	*			trans	1.3	125.7	136	-55.8	167.9	-178.6	176	0	113.6
635	L	29.2	Very low	26.6	Very low	172 Å²	172	148.3 Å²	148.3	90%	0.901	76%	0.759	S	S	*	*				-149.1	153.9	78	-110.7	105.5	0	0	0	115
636	K	27.5	Very low	26.6	Very low	192 Å²	192	144.5 Å²	144.5	84%	0.835	74%	0.744	S	S	*	*			trans	-58.7	132.5	178	-77.4	173.6	168.5	179.6	0	112.8
637	S	26.5	Very low	26.5	Very low	90 Å²	90	148.2 Å²	148.2	63%	0.629	75%	0.752	S	S	*	*				71.5	129.3	104.1	85.9	0	0	0	0	115.6
638	I	29.1	Very low	26.7	Very low	145 Å²	145	148 Å²	148	74%	0.744	75%	0.751	S	S	*	*				-171	146.8	75.1	-98.4	148.4	0	0	0	111.3
639	K	28.6	Very low	26.4	Very low	181 Å²	181	145.4 Å²	145.4	79%	0.787	75%	0.745	S	S	*	*			trans	6.5	118.7	149.6	-58.6	174.3	-179.8	179.8	0	117.1
640	S	24.5	Very low	26.6	Very low	96 Å²	96	150.1 Å²	150.1	67%	0.671	75%	0.749	S	S	*	*				50.9	119.5	87.8	77.6	0	0	0	0	115.6
641	I	27.8	Very low	26.3	Very low	155 Å²	155	150.8 Å²	150.8	80%	0.795	74%	0.743	S	S	*	*			trans	179.7	126.9	132.8	-93.3	153.2	0	0	0	110
642	N	25.6	Very low	26.4	Very low	131 Å²	131	148.3 Å²	148.3	70%	0.701	74%	0.738	S	S	*	*			trans	34.3	145.2	146.5	-60.8	-7.5	0	0	0	125.5
643	H	26.2	Very low	26.4	Very low	159 Å²	159	146.5 Å²	146.5	74%	0.736	73%	0.734	S	S	*	*			trans	77.4	132.1	134.5	-88.2	-68.2	0	0	0	121.5
644	N	25.6	Very low	26.2	Very low	112 Å²	112	145.9 Å²	145.9	60%	0.599	73%	0.73	S	S	*	*			trans	81.4	122.5	140.7	-78.1	20.9	0	0	0	120.9
645	E	26.6	Very low	26.3	Very low	143 Å²	143	142.7 Å²	142.7	67%	0.668	72%	0.723	S	S	*	*				90.2	125.6	125.2	-76.8	178.6	-126.8	0	0	121.1
646	N	26.2	Very low	26.3	Very low	113 Å²	113	142.2 Å²	142.2	60%	0.604	72%	0.72	S	S	*	*			trans	66.7	114.9	132.2	-69.3	-41.8	0	0	0	119.9
647	K	24	Very low	26.3	Very low	180 Å²	180	138.9 Å²	138.9	78%	0.783	71%	0.71	S	S	*	*				45.2	141.6	120.6	-68.4	175.1	171.5	171.6	0	119.3
648	K	25.9	Very low	26.4	Very low	192 Å²	192	141.5 Å²	141.5	84%	0.835	72%	0.717	S	S	*	*			trans	85.1	111.3	167.8	-60.8	170.1	-179	179.7	0	112.3
649	S	22.9	Very low	26.3	Very low	84 Å²	84	140 Å²	140	59%	0.587	72%	0.719	S	S	*	*				89.5	139.8	52.8	71.2	0	0	0	0	113
650	Y	25.8	Very low	26.2	Very low	199 Å²	199	136.6 Å²	136.6	78%	0.78	72%	0.718	S	S	*	*			trans	75	115.9	-179	-54.8	-77.1	0	0	0	113.6
651	Q	24.3	Very low	26.7	Very low	142 Å²	142	136.4 Å²	136.4	66%	0.664	72%	0.715	S	S	*	*				82.7	147.7	50.8	-164.5	-176.9	19.1	0	0	111.6
652	I	25.4	Very low	26.9	Very low	139 Å²	139	137.6 Å²	137.6	71%	0.713	72%	0.721	S	S	*	*			trans	82.1	107.5	177.8	-48.8	164.8	0	0	0	111.6
653	N	28.1	Very low	26.9	Very low	144 Å²	144	137 Å²	137	77%	0.77	72%	0.716	S	S	*	*				-148.3	125.8	59.8	-111	-34.4	0	0	0	113.8
654	S	24.9	Very low	26.9	Very low	94 Å²	94	138.6 Å²	138.6	66%	0.657	72%	0.721	S	S	*	*			trans	-67.9	146	148.1	47.7	0	0	0	0	110.1
655	N	27.5	Very low	27.2	Very low	134 Å²	134	138.7 Å²	138.7	72%	0.717	73%	0.731	S	S	*	*			trans	178.4	150.4	132.9	-88.4	-18.1	0	0	0	111.2
656	L	30	Very low	27.3	Very low	161 Å²	161	138.9 Å²	138.9	84%	0.843	74%	0.735	S	S	*	*			trans	92.2	79.7	-177.8	-59.7	162.4	0	0	0	114.5
657	I	27.3	Very low	27.2	Very low	123 Å²	123	143.2 Å²	143.2	63%	0.631	75%	0.748	S	S	*	*			cis	83.8	118.4	49.8	-58.2	162.5	0	0	0	112.9
658	N	27.2	Very low	27.4	Very low	144 Å²	144	143.8 Å²	143.8	77%	0.77	75%	0.751	S	S	*	*			trans	86.9	131.9	154.1	-70.6	-8.6	0	0	0	124.4
659	S	28.4	Very low	27.5	Very low	113 Å²	113	141.2 Å²	141.2	79%	0.79	75%	0.751	S	S	*	*			trans	72.6	98.9	138.2	55.8	0	0	0	0	121.8
660	S	25.5	Very low	27.6	Very low	110 Å²	110	146.5 Å²	146.5	77%	0.769	76%	0.764	S	S	*	*				-68	-176.5	128.8	62.6	0	0	0	0	110.9
661	P	35.9	Very low	27.5	Very low	93 Å²	93	142.1 Å²	142.1	60%	0.604	76%	0.762	S	S	*	*			cis	-130.8	171.7	-9.8	40.6	-25.7	0	0	0	114	I663	P661-I663 HydrophobicContact CB-CD1 4.45Å; P661-I663 HydrophobicContact CB-CG1 4.39Å
662	I	30.8	Very low	27.7	Very low	179 Å²	179	143.7 Å²	143.7	92%	0.918	77%	0.773	S	S	*	*			trans	-128.2	121	149.1	-64.5	-175	0	0	0	109.8
663	I	27.2	Very low	27.6	Very low	118 Å²	118	144.4 Å²	144.4	61%	0.605	77%	0.773	S	S	*	*			trans	-118.4	139.2	-174.2	-79.7	174.4	0	0	0	108.2	P661	P661-I663 HydrophobicContact CB-CD1 4.45Å; P661-I663 HydrophobicContact CB-CG1 4.39Å
664	K	25.8	Very low	27.5	Very low	194 Å²	194	145.2 Å²	145.2	84%	0.843	77%	0.773	S	S	*	*			trans	58.6	110.4	163.1	-66.6	162.1	-165.8	169.6	0	118.7
665	S	31.5	Very low	27.5	Very low	113 Å²	113	150 Å²	150	79%	0.79	78%	0.782	S	S	*	*				-146.6	151.3	127.3	62.7	0	0	0	0	109.1
666	I	28.7	Very low	27.5	Very low	148 Å²	148	151.3 Å²	151.3	76%	0.759	79%	0.789	S	S	*	*			cis	-151.2	149.3	-34.4	-115.6	151.7	0	0	0	106.4	K668	I666-K668 PolarHBondContact O-N 3.19Å
667	K	24.8	Very low	27.1	Very low	204 Å²	204	154 Å²	154	89%	0.887	79%	0.794	S	S	*	*			trans	-76.4	114.8	171.7	-72.7	176.3	177.1	176	0	110.4
668	K	27.1	Very low	27.1	Very low	192 Å²	192	157 Å²	157	84%	0.835	81%	0.805	S	S	*	*			trans	173.5	140.6	156.1	-94.6	155.1	-176.7	-174.4	0	105	I666	I666-K668 PolarHBondContact O-N 3.19Å
669	T	28.5	Very low	27	Very low	138 Å²	138	155.3 Å²	155.3	85%	0.847	81%	0.805	S	S	*	*			cis	-147.4	162.7	25.5	-18.4	0	0	0	0	110.9
670	K	24.5	Very low	26.9	Very low	195 Å²	195	158.1 Å²	158.1	85%	0.848	81%	0.809	S	S	*	*			trans	-74.8	173.1	170.3	-73.3	175.6	174.2	176.4	0	111.3
671	S	24.4	Very low	27	Very low	106 Å²	106	158 Å²	158	74%	0.741	80%	0.8	S	S	*	*			trans	62.2	89.8	159.3	61.1	0	0	0	0	119.1
672	I	28.6	Very low	26.7	Very low	176 Å²	176	160.7 Å²	160.7	90%	0.903	81%	0.807	S	S	*	*				-128	115.9	125.2	-62.3	-175.3	0	0	0	107.4
673	Q	23.9	Very low	26.6	Very low	153 Å²	153	157.7 Å²	157.7	72%	0.715	79%	0.793	S	S	*	*			trans	-83.8	161.4	173.9	-80.8	-174.2	-19.7	0	0	111
674	Q	24.3	Very low	26.8	Very low	161 Å²	161	157.3 Å²	157.3	75%	0.752	80%	0.801	S	S	*	*			trans	55.4	93.1	151.9	-66.9	163.6	1.3	0	0	118.1
675	K	25.1	Very low	26.9	Very low	196 Å²	196	153 Å²	153	85%	0.852	79%	0.794	S	S	*	*				166.7	99.5	117.4	-89.9	161.2	-177.1	176.2	0	110.5
676	N	27.5	Very low	27	Very low	161 Å²	161	156.2 Å²	156.2	86%	0.861	80%	0.796	S	S	*	*			trans	176.9	89.2	131.2	-88.9	-15	0	0	0	109.9	Q678	N676-Q678 PolarHBondContact O-N 3.12Å
677	K	23.2	Very low	27.5	Very low	218 Å²	218	156.5 Å²	156.5	95%	0.948	80%	0.798	S	S	*	*			trans	-68	106.3	159.6	-83.4	177.8	171.4	176.3	0	107.7
678	Q	25.5	Very low	27.8	Very low	184 Å²	184	152.4 Å²	152.4	86%	0.86	79%	0.785	S	S	*	*			trans	-136.6	132.9	153.7	-103.3	172.4	3.6	0	0	109.5	N676 I680	N676-Q678 PolarHBondContact O-N 3.12Å; Q678-I680 PolarHBondContact O-N 3.26Å
679	S	25.1	Very low	28.3	Very low	110 Å²	110	149.5 Å²	149.5	77%	0.769	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-65.4	117.6	-168.3	47.7	0	0	0	0	112.4	N681	S679-N681 PolarHBondContact O-N 3.33Å
680	I	27.3	Very low	28.6	Very low	171 Å²	171	151.5 Å²	151.5	88%	0.877	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-70.8	118	164.3	-63.8	175.4	0	0	0	107.1	Q678	Q678-I680 PolarHBondContact O-N 3.26Å
681	N	26.6	Very low	29.2	Very low	109 Å²	109	146.3 Å²	146.3	58%	0.583	76%	0.763	S	S	*	*	P	Polyproline II helix	trans	-85.1	148.9	-160	-162.8	11.7	0	0	0	112.5	S679 D683	S679-N681 PolarHBondContact O-N 3.33Å; N681-D683 PolarHBondContact ND2-OD2 3.03Å; N681-D683 PolarHBondContact O-N 3.48Å
682	I	29.7	Very low	29.6	Very low	148 Å²	148	145.7 Å²	145.7	76%	0.759	75%	0.751	S	S	*	*			trans	-87	12.4	-167.5	-65.5	171.1	0	0	0	112.4	S684	I682-S684 VanDerWaalsContact C-N 3.34Å; I682-S684 PolarHBondContact O-N 3.09Å
683	D	29.8	Very low	29.9	Very low	117 Å²	117	145.5 Å²	145.5	63%	0.626	74%	0.74	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.8	51	-165	-66.8	-10.8	0	0	0	114.8	N681	N681-D683 PolarHBondContact ND2-OD2 3.03Å; N681-D683 PolarHBondContact O-N 3.48Å
684	S	31.6	Very low	30.4	Very low	109 Å²	109	145.9 Å²	145.9	76%	0.762	74%	0.742	S	S	*	*	T	Hydrogen-bonded Turn	trans	-142.5	1.4	178.4	-68.8	0	0	0	0	116.8	I682 H686	I682-S684 VanDerWaalsContact C-N 3.34Å; I682-S684 PolarHBondContact O-N 3.09Å; S684-H686 VanDerWaalsContact C-N 3.32Å; S684-H686 PolarHBondContact O-N 2.99Å
685	C	28.2	Very low	30.9	Very low	105 Å²	105	145.7 Å²	145.7	71%	0.709	74%	0.741	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.5	4.2	-177.7	-72.2	0	0	0	0	116
686	H	33	Very low	31.3	Very low	180 Å²	180	142.3 Å²	142.3	83%	0.833	73%	0.732	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111.5	11.5	-163.8	-127.5	-67.2	0	0	0	117	S684	S684-H686 VanDerWaalsContact C-N 3.32Å; S684-H686 PolarHBondContact O-N 2.99Å
687	I	38.3	Very low	31.6	Very low	153 Å²	153	140.1 Å²	140.1	79%	0.785	72%	0.72	S	S	*	*	S	Bend	trans	-118.6	-3.8	-171	-67.5	178.9	0	0	0	114.2
688	L	32.7	Very low	32.1	Very low	119 Å²	119	137.4 Å²	137.4	62%	0.623	71%	0.714	S	S	*	*	S	Bend	trans	-118.4	1.1	-171.7	-78.3	165.1	0	0	0	116.1	L692	L688-L692 HydrophobicContact CB-CD1 4.44Å; L688-L692 WeakPolarHBondContact O-CD1 3.25Å
689	I	35.8	Very low	32.3	Very low	131 Å²	131	132.9 Å²	132.9	67%	0.672	70%	0.703	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.7	-27.5	-166.1	-64.2	177.2	0	0	0	114.1
690	E	36.1	Very low	32.6	Very low	179 Å²	179	136.9 Å²	136.9	84%	0.836	71%	0.707	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.8	-38.9	178.3	-72.5	-170.3	135.1	0	0	115.2	L692	E690-L692 VanDerWaalsContact C-N 3.35Å; E690-L692 PolarHBondContact O-N 3.07Å
691	P	36.7	Very low	32.8	Very low	87 Å²	87	137.2 Å²	137.2	57%	0.565	71%	0.705	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.5	-21.8	179.3	-17.9	32.4	0	0	0	114.2
692	L	33.5	Very low	33	Very low	92 Å²	92	137.5 Å²	137.5	48%	0.482	71%	0.712	S	S	.	*	H	α-helix	trans	-84.8	-9.1	-168.8	-93.4	167.8	0	0	0	114.9	L688 E690	L688-L692 HydrophobicContact CB-CD1 4.44Å; L688-L692 WeakPolarHBondContact O-CD1 3.25Å; E690-L692 VanDerWaalsContact C-N 3.35Å; E690-L692 PolarHBondContact O-N 3.07Å
693	Y	33.7	Very low	32.9	Very low	173 Å²	173	140.2 Å²	140.2	68%	0.678	72%	0.718	S	S	*	*	H	α-helix	trans	-80.5	-21.2	178.3	-147.5	-94.2	0	0	0	113.3
694	Q	34.3	Very low	32.8	Very low	160 Å²	160	144.7 Å²	144.7	75%	0.748	73%	0.732	S	S	*	*	H	α-helix	trans	-90.4	-23	-176.5	-76.3	174.6	-47.5	0	0	114.4
695	E	34.6	Very low	32.7	Very low	158 Å²	158	145 Å²	145	74%	0.738	73%	0.734	S	S	*	*	H	α-helix	trans	-83	-24.4	174.5	-75.7	-124.1	136	0	0	113.7	L697	E695-L697 PolarHBondContact O-N 3.23Å
696	L	33.9	Very low	32.6	Very low	124 Å²	124	144.2 Å²	144.2	65%	0.649	74%	0.736	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.3	-7.5	-171.6	-92.5	162.3	0	0	0	115.4
697	L	35	Very low	32.2	Very low	116 Å²	116	143 Å²	143	61%	0.607	73%	0.734	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.4	-13.7	176.9	-79.6	163	0	0	0	114	E695	E695-L697 PolarHBondContact O-N 3.23Å
698	L	33.9	Very low	31.8	Very low	160 Å²	160	145.6 Å²	145.6	84%	0.838	74%	0.74	S	S	*	*	S	Bend	trans	-91.6	7.2	-174.8	-83.4	161.3	0	0	0	115.2
699	S	29.5	Very low	31.5	Very low	89 Å²	89	146 Å²	146	62%	0.622	74%	0.742	S	S	*	*	S	Bend	trans	-124.1	15.6	-168.3	58.1	0	0	0	0	116.6
700	K	31.1	Very low	31.2	Very low	194 Å²	194	147.2 Å²	147.2	84%	0.843	75%	0.749	S	S	*	*			trans	-122.6	88.2	176.7	-76.3	-174.9	178	176	0	113.7
701	Q	31.2	Very low	30.8	Very low	179 Å²	179	145.3 Å²	145.3	84%	0.836	75%	0.745	S	S	*	*			trans	-123.4	126.6	156.1	-81.8	-69.4	-5.6	0	0	108.6	K703	Q701-K703 PolarHBondContact O-N 3Å
702	P	30.4	Very low	30.5	Very low	114 Å²	114	146.5 Å²	146.5	74%	0.74	76%	0.755	S	S	*	*			trans	-88.4	110.7	-168.3	32.9	-32.9	0	0	0	112.8
703	K	27	Very low	30.3	Very low	205 Å²	205	149 Å²	149	89%	0.891	77%	0.768	S	S	*	*			trans	-87.6	104.6	158.1	-69.4	-171.5	-180	-176.1	0	109.6	Q701	Q701-K703 PolarHBondContact O-N 3Å
704	K	29.7	Very low	30.1	Very low	212 Å²	212	146.9 Å²	146.9	92%	0.922	77%	0.767	S	S	*	*			trans	-102.3	95.4	161.6	-91.1	-171	174.1	-177.7	0	109.4
705	S	28.1	Very low	29.8	Very low	114 Å²	114	145.8 Å²	145.8	80%	0.797	77%	0.766	S	S	*	*			trans	-101.5	160.1	158.6	53.3	0	0	0	0	109.8
706	A	26	Very low	29.7	Very low	90 Å²	90	143.9 Å²	143.9	74%	0.744	76%	0.761	S	S	*	*			trans	-71.2	-175.2	-162.8	0	0	0	0	0	116.5
707	L	25	Very low	29.6	Very low	153 Å²	153	143.4 Å²	143.4	80%	0.801	76%	0.759	S	S	*	*			trans	82	101.4	172.2	-66.3	127.2	0	0	0	117.6
708	K	29.9	Very low	29.4	Very low	209 Å²	209	144.4 Å²	144.4	91%	0.909	77%	0.765	S	S	*	*				-147.5	118.3	117	-114.1	173.6	-174.3	-179.4	0	112.2
709	I	26	Very low	29.3	Very low	128 Å²	128	143.5 Å²	143.5	66%	0.656	76%	0.76	S	S	*	*			trans	-66.4	136.9	162.8	-68.8	154.9	0	0	0	107.9
710	N	30.3	Very low	29.3	Very low	155 Å²	155	145.4 Å²	145.4	83%	0.829	76%	0.762	S	S	*	*			trans	-164.4	120.2	135.1	-105.4	-0.9	0	0	0	112.4
711	N	27.3	Very low	29.1	Very low	140 Å²	140	142.8 Å²	142.8	75%	0.749	76%	0.757	S	S	*	*			trans	-21.5	142	166.8	-56.5	-14.2	0	0	0	118.3
712	S	30	Very low	29.1	Very low	111 Å²	111	139.9 Å²	139.9	78%	0.776	76%	0.757	S	S	*	*			trans	135.4	141	143.2	64.8	0	0	0	0	112
713	I	28.9	Very low	29	Very low	145 Å²	145	141.6 Å²	141.6	74%	0.744	76%	0.76	S	S	*	*			cis	-159.6	139.5	-8.5	-117.8	166.5	0	0	0	108.2
714	I	29.7	Very low	29.3	Very low	128 Å²	128	140.6 Å²	140.6	66%	0.656	76%	0.755	S	S	*	*			trans	57.9	117	144.9	-61.5	178.4	0	0	0	120.7
715	N	28.6	Very low	29.3	Very low	137 Å²	137	138.6 Å²	138.6	73%	0.733	75%	0.749	S	S	*	*			trans	63.2	149.6	143.5	-61.2	5.5	0	0	0	119.9
716	N	32.6	Very low	29.3	Very low	118 Å²	118	140.7 Å²	140.7	63%	0.631	75%	0.751	S	S	*	*			cis	-152.8	143.5	13.4	-125.7	-0.6	0	0	0	112.8
717	N	31.6	Very low	29.3	Very low	114 Å²	114	145 Å²	145	61%	0.61	75%	0.753	S	S	*	*			trans	61	125	137.9	-64.3	-8.5	0	0	0	124.3
718	N	31.2	Very low	29.5	Very low	138 Å²	138	144.8 Å²	144.8	74%	0.738	75%	0.751	S	S	*	*			trans	77.8	142.6	137.5	-60.3	-7.4	0	0	0	117.9
719	L	30.3	Very low	29.3	Very low	140 Å²	140	141.5 Å²	141.5	73%	0.733	75%	0.748	S	S	*	*			cis	-152.2	126.9	22	-156.1	83.8	0	0	0	112.6
720	I	29.6	Very low	29.4	Very low	130 Å²	130	141.5 Å²	141.5	67%	0.667	76%	0.755	S	S	*	*			trans	64.8	118.4	134	-67.6	178.3	0	0	0	123.7
721	N	27.4	Very low	29.4	Very low	138 Å²	138	143.9 Å²	143.9	74%	0.738	76%	0.758	S	S	*	*			trans	41.7	134.1	134.7	-50.7	-18.4	0	0	0	121.3
722	S	32	Very low	29.4	Very low	118 Å²	118	143.9 Å²	143.9	83%	0.825	76%	0.757	S	S	*	*				-169.5	140.4	59.9	37.7	0	0	0	0	116.5
723	N	28.5	Very low	29.2	Very low	150 Å²	150	147 Å²	147	80%	0.802	77%	0.765	S	S	*	*			trans	-35.7	144.2	173.9	-56.3	-45.8	0	0	0	120.2
724	K	31.7	Very low	29.2	Very low	184 Å²	184	147.9 Å²	147.9	80%	0.8	77%	0.766	S	S	*	*				-171	115.6	103.1	-101.3	170.7	-178.7	177.7	0	115.5
725	Q	31.3	Very low	29.1	Very low	170 Å²	170	151.3 Å²	151.3	79%	0.794	78%	0.776	S	S	*	*			trans	58.7	109.5	135.7	-62.1	176.4	-14.8	0	0	121.2
726	L	26.5	Very low	28.9	Very low	159 Å²	159	153.9 Å²	153.9	83%	0.832	78%	0.781	S	S	*	*				70	109.6	70	-102.6	146.6	0	0	0	116.5
727	K	26.5	Very low	28.6	Very low	180 Å²	180	156.6 Å²	156.6	78%	0.783	79%	0.79	S	S	*	*				178.5	148.8	106.8	-104	175.4	-179	177.2	0	116.6
728	I	29.8	Very low	28.4	Very low	149 Å²	149	158.4 Å²	158.4	76%	0.764	80%	0.799	S	S	*	*			trans	77.9	92	157.9	-55.4	147.4	0	0	0	118.7
729	T	26	Very low	28.3	Very low	139 Å²	139	159 Å²	159	85%	0.853	80%	0.801	S	S	*	*			trans	-145.8	93.8	140.3	52.2	0	0	0	0	110.4
730	T	28.2	Very low	28.2	Very low	129 Å²	129	159 Å²	159	79%	0.791	80%	0.8	S	S	*	*			trans	-156.4	108.5	166.1	36.6	0	0	0	0	109.6
731	F	28.7	Very low	28	Very low	204 Å²	204	159.4 Å²	159.4	90%	0.895	80%	0.804	S	S	*	*			trans	-150.2	143.4	156.6	-118.2	-84.9	0	0	0	109.5
732	L	28.7	Very low	28.1	Very low	140 Å²	140	159.9 Å²	159.9	73%	0.733	81%	0.806	S	S	*	*			trans	71.8	54.9	171.7	-53.4	178	0	0	0	118.2
733	N	25.3	Very low	28.1	Very low	178 Å²	178	163.5 Å²	163.5	95%	0.952	81%	0.807	S	S	*	*				-89.5	101.1	129.2	-107.5	-24.5	0	0	0	107.4
734	H	28.6	Very low	27.9	Very low	163 Å²	163	161.2 Å²	161.2	76%	0.755	80%	0.803	S	S	*	*			trans	-132.6	141.7	173.4	-137.8	-79.6	0	0	0	109.4
735	K	27.3	Very low	27.7	Very low	200 Å²	200	160.1 Å²	160.1	87%	0.87	80%	0.804	S	S	*	*			trans	76.7	74.6	-173.9	-59.6	-176.5	172.6	179.2	0	116.5
736	K	25.2	Very low	27.6	Very low	191 Å²	191	161.3 Å²	161.3	83%	0.83	81%	0.807	S	S	*	*			trans	-130.3	149.2	130.3	-133.3	176.7	-174.7	-179.6	0	108.7
737	Q	26	Very low	27.6	Very low	175 Å²	175	163.1 Å²	163.1	82%	0.818	81%	0.811	S	S	*	*			trans	66	93.4	178.5	-67.6	148.3	-63	0	0	116.9
738	N	27.4	Very low	27.6	Very low	151 Å²	151	159.3 Å²	159.3	81%	0.807	81%	0.807	S	S	*	*				-166.5	146.2	118.7	-101.7	-15.3	0	0	0	110.9
739	I	29.2	Very low	27.6	Very low	150 Å²	150	158.6 Å²	158.6	77%	0.769	81%	0.805	S	S	*	*			trans	63.4	92.8	164.7	-55.2	156.3	0	0	0	113.1
740	I	27.8	Very low	27.7	Very low	142 Å²	142	157.5 Å²	157.5	73%	0.728	79%	0.794	S	S	*	*				54.6	108.1	58.4	-57.6	-179	0	0	0	112.8
741	N	26.5	Very low	27.7	Very low	138 Å²	138	158.1 Å²	158.1	74%	0.738	79%	0.792	S	S	*	*			trans	78.4	136.5	162.7	-61	-13.5	0	0	0	120.5
742	N	28.4	Very low	27.8	Very low	148 Å²	148	156.8 Å²	156.8	79%	0.791	79%	0.786	S	S	*	*			trans	89.1	125.3	156.8	-61.2	-19.9	0	0	0	120.3
743	K	31.4	Very low	27.8	Very low	193 Å²	193	156.6 Å²	156.6	84%	0.839	78%	0.781	S	S	*	*			trans	73.3	78.7	167.7	-56.9	175.5	-176.1	178.7	0	113.5
744	S	26	Very low	28	Very low	103 Å²	103	154.9 Å²	154.9	72%	0.72	77%	0.767	S	S	*	*			cis	51.7	105.7	41.2	73.2	0	0	0	0	114.6
745	I	27.4	Very low	28.1	Very low	161 Å²	161	154.6 Å²	154.6	83%	0.826	77%	0.767	S	S	*	*			trans	150.2	127.9	148	-78.4	156.4	0	0	0	108.6
746	K	28.5	Very low	28.3	Very low	194 Å²	194	152.1 Å²	152.1	84%	0.843	76%	0.758	S	S	*	*	S	Bend	trans	75.8	48.2	-176.2	-61.1	175.9	180	176.1	0	118
747	Q	27.5	Very low	28.6	Very low	198 Å²	198	148.7 Å²	148.7	93%	0.925	75%	0.745	S	S	*	*			trans	-139.4	71.7	152.3	-117	175.2	-0.8	0	0	110.2
748	S	26.1	Very low	28.8	Very low	99 Å²	99	146.9 Å²	146.9	69%	0.692	74%	0.736	S	S	*	*			trans	-145.6	78.6	-176.4	58	0	0	0	0	110.3
749	N	28.8	Very low	29	Very low	135 Å²	135	146 Å²	146	72%	0.722	73%	0.726	S	S	*	*	S	Bend	trans	-164.9	-21.1	156.7	-100.5	-21.4	0	0	0	115.1	N751	N749-N751 PolarHBondContact O-N 3.48Å
750	D	29.2	Very low	29.1	Very low	116 Å²	116	145.9 Å²	145.9	62%	0.62	72%	0.718	S	S	*	*	G	3₁₀ helix	trans	-83.2	-9.8	-171.2	-61.8	-34	0	0	0	115.7	K752 Q753	D750-K752 PolarHBondContact O-N 3.44Å; D750-Q753 PolarHBondContact O-N 3.45Å
751	N	28.7	Very low	29.2	Very low	141 Å²	141	146.1 Å²	146.1	75%	0.754	71%	0.71	S	S	*	*	G	3₁₀ helix	trans	-74.7	14.5	-179.9	-76.7	-7.1	0	0	0	115.2	N749	N749-N751 PolarHBondContact O-N 3.48Å
752	K	29.2	Very low	29.6	Very low	177 Å²	177	144.7 Å²	144.7	77%	0.77	70%	0.699	S	S	*	*	G	3₁₀ helix	trans	-118	-7.7	171.2	-83.8	-175.6	174.9	177.5	0	115.4	D750	D750-K752 PolarHBondContact O-N 3.44Å
753	Q	30.4	Very low	29.9	Very low	136 Å²	136	142 Å²	142	64%	0.636	68%	0.684	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.7	-26.3	177	-72.4	-175.9	-12.7	0	0	113.8	D750 Q755 H757	D750-Q753 PolarHBondContact O-N 3.45Å; Q753-Q755 PolarHBondContact O-N 3.03Å; Q753-H757 PolarHBondContact O-N 3.16Å
754	Q	29.2	Very low	30	Very low	141 Å²	141	137.6 Å²	137.6	66%	0.659	67%	0.667	S	S	*	*	H	α-helix	trans	-75.5	-21.3	-178	-70.2	-179.1	-10.2	0	0	114.6
755	Q	29.8	Very low	30.5	Very low	158 Å²	158	136.3 Å²	136.3	74%	0.738	65%	0.651	S	S	*	*	H	α-helix	trans	-85.4	-27.4	174.2	-75	177.3	-15.7	0	0	113.5	Q753 H759	Q753-Q755 PolarHBondContact O-N 3.03Å; Q755-H759 PolarHBondContact O-N 3.25Å
756	Q	31	Very low	30.9	Very low	148 Å²	148	132.7 Å²	132.7	69%	0.692	63%	0.633	S	S	*	*	H	α-helix	trans	-76.8	-34.3	172.8	-76.6	-179.4	-22.1	0	0	112.3	H758 H759 Y760	Q756-H758 PolarHBondContact O-N 2.88Å; Q756-H759 PolarHBondContact O-N 3.41Å; Q756-Y760 PolarHBondContact O-N 3.04Å
757	H	31.3	Very low	31.3	Very low	119 Å²	119	129.2 Å²	129.2	55%	0.551	62%	0.62	S	S	*	*	H	α-helix	trans	-62	-40	171.6	-96.6	-84.8	0	0	0	112.6	Q753 H759 Y760 Y761	Q753-H757 PolarHBondContact O-N 3.16Å; H757-H759 VanDerWaalsContact C-N 3.35Å; H757-H759 PolarHBondContact O-N 3.5Å; H757-Y760 PolarHBondContact O-N 3.37Å; H757-Y761 WeakPolarHBondContact O-CB 3.15Å; H757-Y761 WeakPolarHBondContact O-CD2 3.28Å; H757-Y761 PolarHBondContact O-N 3.13Å
758	H	30.7	Very low	31.6	Very low	136 Å²	136	122.5 Å²	122.5	63%	0.63	60%	0.595	S	S	*	*	H	α-helix	trans	-65	-35	177	-107	-81	0	0	0	113.5	Q756 H762	Q756-H758 PolarHBondContact O-N 2.88Å; H758-H762 PolarHBondContact O-N 3.5Å; H758-H762 VanDerWaalsContact O-N 3.07Å
759	H	32.9	Very low	32.1	Very low	132 Å²	132	121.7 Å²	121.7	61%	0.611	58%	0.583	S	S	*	*	H	α-helix	trans	-76.1	-38.5	177.9	-128.2	-58	0	0	0	112.7	Q755 Q756 H757 H762 D763	Q755-H759 PolarHBondContact O-N 3.25Å; Q756-H759 PolarHBondContact O-N 3.41Å; H757-H759 VanDerWaalsContact C-N 3.35Å; H757-H759 PolarHBondContact O-N 3.5Å; H759-H762 PolarHBondContact O-N 2.84Å; H759-D763 PolarHBondContact O-N 3.34Å
760	Y	31	Very low	32.7	Very low	149 Å²	149	122 Å²	122	58%	0.584	58%	0.58	S	S	*	*	H	α-helix	trans	-65.7	-38.7	175	-168.9	-97.4	0	0	0	112.1	Q756 H757 Q764	Q756-Y760 PolarHBondContact O-N 3.04Å; H757-Y760 PolarHBondContact O-N 3.37Å; Y760-Q764 HydrophobicContact CD1-CG 4.41Å; Y760-Q764 HydrophobicContact CE1-CG 4.11Å; Y760-Q764 VanDerWaalsContact CE1-NE2 3.25Å; Y760-Q764 PolarHBondContact O-N 3.15Å; Y760-Q764 PolarHBondContact OH-NE2 3.34Å
761	Y	29.3	Very low	33.1	Very low	147 Å²	147	122.8 Å²	122.8	58%	0.576	58%	0.578	S	S	*	*	H	α-helix	trans	-65.7	-39.1	171.1	-93.6	-93.4	0	0	0	112.2	H757 Q764 I765	H757-Y761 WeakPolarHBondContact O-CB 3.15Å; H757-Y761 WeakPolarHBondContact O-CD2 3.28Å; H757-Y761 PolarHBondContact O-N 3.13Å; Y761-Q764 PolarHBondContact O-N 2.93Å; Y761-I765 VanDerWaalsContact O-CB 3.28Å; Y761-I765 WeakPolarHBondContact O-CB 3.45Å; Y761-I765 WeakPolarHBondContact O-CD1 3.35Å; Y761-I765 WeakPolarHBondContact O-CG1 3.03Å; Y761-I765 PolarHBondContact O-N 3.38Å
762	H	34	Very low	33.6	Very low	108 Å²	108	121.3 Å²	121.3	50%	0.5	57%	0.57	S	S	.	*	H	α-helix	trans	-66.2	-37.2	176.3	-104.2	-85	0	0	0	113.5	H758 H759 I765 N766	H758-H762 PolarHBondContact O-N 3.5Å; H758-H762 VanDerWaalsContact O-N 3.07Å; H759-H762 PolarHBondContact O-N 2.84Å; H762-I765 PolarHBondContact O-N 3.42Å; H762-N766 WeakPolarHBondContact O-CB 3.39Å; H762-N766 PolarHBondContact O-N 2.74Å
763	D	35.3	Very low	34.3	Very low	90 Å²	90	121.3 Å²	121.3	48%	0.481	57%	0.565	S	S	.	*	H	α-helix	trans	-75.2	-34.9	175.9	-80.9	-26.3	0	0	0	113	H759 I765 N766 Q767	H759-D763 PolarHBondContact O-N 3.34Å; D763-I765 VanDerWaalsContact C-N 3.33Å; D763-N766 PolarHBondContact O-N 2.97Å; D763-Q767 WeakPolarHBondContact O-CB 3.43Å; D763-Q767 WeakPolarHBondContact O-CG 3.49Å; D763-Q767 PolarHBondContact O-N 3.48Å
764	Q	34.8	Very low	34.8	Very low	102 Å²	102	122 Å²	122	48%	0.477	56%	0.563	S	S	.	*	H	α-helix	trans	-65.8	-35.8	168.6	-75.1	-154	-2.7	0	0	112.1	Y760 Y761 S768	Y760-Q764 HydrophobicContact CD1-CG 4.41Å; Y760-Q764 HydrophobicContact CE1-CG 4.11Å; Y760-Q764 VanDerWaalsContact CE1-NE2 3.25Å; Y760-Q764 PolarHBondContact O-N 3.15Å; Y760-Q764 PolarHBondContact OH-NE2 3.34Å; Y761-Q764 PolarHBondContact O-N 2.93Å; Q764-S768 VanDerWaalsContact O-CB 3.25Å; Q764-S768 WeakPolarHBondContact O-CB 3.17Å; Q764-S768 PolarHBondContact O-N 2.81Å; Q764-S768 PolarHBondContact O-OG 3.13Å
765	I	34.8	Very low	35.4	Very low	76 Å²	76	122.5 Å²	122.5	39%	0.39	56%	0.56	S	S	.	*	H	α-helix	trans	-69	-36.3	173.7	-71.5	165.8	0	0	0	111.2	Y761 H762 D763 S768 N769	Y761-I765 VanDerWaalsContact O-CB 3.28Å; Y761-I765 WeakPolarHBondContact O-CB 3.45Å; Y761-I765 WeakPolarHBondContact O-CD1 3.35Å; Y761-I765 WeakPolarHBondContact O-CG1 3.03Å; Y761-I765 PolarHBondContact O-N 3.38Å; H762-I765 PolarHBondContact O-N 3.42Å; D763-I765 VanDerWaalsContact C-N 3.33Å; I765-S768 WeakPolarHBondContact CA-OG 3.5Å; I765-S768 PolarHBondContact O-OG 3.41Å; I765-N769 WeakPolarHBondContact CG2-ND2 3.34Å; I765-N769 WeakPolarHBondContact O-CB 3.46Å; I765-N769 PolarHBondContact O-N 2.85Å; I765-N769 PolarHBondContact O-ND2 2.84Å; I765-N769 VanDerWaalsContact O-ND2 3.13Å
766	N	35.7	Very low	35.9	Very low	84 Å²	84	121.6 Å²	121.6	45%	0.449	55%	0.553	S	S	.	*	H	α-helix	trans	-73	-37.9	174.8	-83	-23.2	0	0	0	112.8	H762 D763 N769 Q770	H762-N766 WeakPolarHBondContact O-CB 3.39Å; H762-N766 PolarHBondContact O-N 2.74Å; D763-N766 PolarHBondContact O-N 2.97Å; N766-N769 PolarHBondContact O-N 3.49Å; N766-Q770 WeakPolarHBondContact O-CB 3.33Å; N766-Q770 PolarHBondContact O-N 2.84Å
767	Q	37	Very low	36.6	Very low	122 Å²	122	117.5 Å²	117.5	57%	0.57	54%	0.536	S	S	*	.	H	α-helix	trans	-68.4	-37.7	171.9	-74.4	-170.5	4.7	0	0	112.2	D763 K771	D763-Q767 WeakPolarHBondContact O-CB 3.43Å; D763-Q767 WeakPolarHBondContact O-CG 3.49Å; D763-Q767 PolarHBondContact O-N 3.48Å; Q767-K771 WeakPolarHBondContact O-CB 3.12Å; Q767-K771 WeakPolarHBondContact O-CG 3.35Å; Q767-K771 PolarHBondContact O-N 3.34Å
768	S	35.2	Very low	37.3	Very low	57 Å²	57	115.1 Å²	115.1	40%	0.399	53%	0.527	S	S	.	.	H	α-helix	trans	-68.5	-36.8	173.9	73.4	0	0	0	0	111.2	Q764 I765 K771 L772	Q764-S768 VanDerWaalsContact O-CB 3.25Å; Q764-S768 WeakPolarHBondContact O-CB 3.17Å; Q764-S768 PolarHBondContact O-N 2.81Å; Q764-S768 PolarHBondContact O-OG 3.13Å; I765-S768 WeakPolarHBondContact CA-OG 3.5Å; I765-S768 PolarHBondContact O-OG 3.41Å; S768-K771 PolarHBondContact O-N 2.78Å; S768-L772 WeakPolarHBondContact O-CB 3.42Å; S768-L772 PolarHBondContact O-N 2.84Å
769	N	36.6	Very low	37.8	Very low	81 Å²	81	113.6 Å²	113.6	43%	0.433	52%	0.523	S	S	.	.	H	α-helix	trans	-72.2	-35	174.2	-76.4	-28.9	0	0	0	113.8	I765 N766 L772 W773	I765-N769 WeakPolarHBondContact CG2-ND2 3.34Å; I765-N769 WeakPolarHBondContact O-CB 3.46Å; I765-N769 PolarHBondContact O-N 2.85Å; I765-N769 PolarHBondContact O-ND2 2.84Å; I765-N769 VanDerWaalsContact O-ND2 3.13Å; N766-N769 PolarHBondContact O-N 3.49Å; N769-L772 CarbonylContact O-C 3.57Å; N769-L772 PolarHBondContact O-N 2.86Å; N769-W773 VanDerWaalsContact O-CB 3.3Å; N769-W773 WeakPolarHBondContact O-CB 3.29Å; N769-W773 PolarHBondContact O-N 3.06Å
770	Q	39.9	Very low	38.2	Very low	143 Å²	143	111.7 Å²	111.7	67%	0.668	52%	0.517	S	S	*	.	H	α-helix	trans	-68.4	-41	170.7	-81.2	-172.6	-10.3	0	0	111.4	N766 L772 W773 Y774	N766-Q770 WeakPolarHBondContact O-CB 3.33Å; N766-Q770 PolarHBondContact O-N 2.84Å; Q770-L772 VanDerWaalsContact C-N 3.34Å; Q770-W773 PolarHBondContact O-N 2.73Å; Q770-Y774 VanDerWaalsContact O-CB 3.27Å; Q770-Y774 WeakPolarHBondContact O-CB 3.31Å; Q770-Y774 PolarHBondContact O-N 2.73Å
771	K	37.8	Very low	38.6	Very low	131 Å²	131	111.9 Å²	111.9	57%	0.57	52%	0.521	S	S	*	.	H	α-helix	trans	-60.7	-43.9	168.9	-76.1	175.2	179.3	175.2	0	110.6	Q767 S768 W773 Y774 Y775	Q767-K771 WeakPolarHBondContact O-CB 3.12Å; Q767-K771 WeakPolarHBondContact O-CG 3.35Å; Q767-K771 PolarHBondContact O-N 3.34Å; S768-K771 PolarHBondContact O-N 2.78Å; K771-W773 PolarHBondContact O-N 3.34Å; K771-Y774 PolarHBondContact O-N 3.46Å; K771-Y775 HydrophobicContact CB-CD2 4.26Å; K771-Y775 HydrophobicContact CB-CE2 4.22Å; K771-Y775 WeakPolarHBondContact O-CB 3.39Å; K771-Y775 WeakPolarHBondContact O-CD2 3.49Å; K771-Y775 PolarHBondContact O-N 2.69Å
772	L	39.3	Very low	39	Very low	111 Å²	111	108.2 Å²	108.2	58%	0.581	52%	0.516	S	S	*	.	H	α-helix	trans	-63.2	-40	176.7	-131	81.9	0	0	0	111.8	S768 N769 Q770 K776	S768-L772 WeakPolarHBondContact O-CB 3.42Å; S768-L772 PolarHBondContact O-N 2.84Å; N769-L772 CarbonylContact O-C 3.57Å; N769-L772 PolarHBondContact O-N 2.86Å; Q770-L772 VanDerWaalsContact C-N 3.34Å; L772-K776 WeakPolarHBondContact O-CA 3.03Å; L772-K776 WeakPolarHBondContact O-CB 3.48Å; L772-K776 PolarHBondContact O-N 3.27Å
773	W	44.1	Very low	39.3	Very low	177 Å²	177	107.2 Å²	107.2	67%	0.67	51%	0.514	S	S	*	.	H	α-helix	trans	-68.8	-40.6	177.2	-175.2	89.4	0	0	0	111.4	N769 Q770 K771 K776 N777	N769-W773 VanDerWaalsContact O-CB 3.3Å; N769-W773 WeakPolarHBondContact O-CB 3.29Å; N769-W773 PolarHBondContact O-N 3.06Å; Q770-W773 PolarHBondContact O-N 2.73Å; K771-W773 PolarHBondContact O-N 3.34Å; W773-K776 PolarHBondContact O-N 3.18Å; W773-N777 VanDerWaalsContact CH2-ND2 3.27Å; W773-N777 WeakPolarHBondContact CH2-ND2 3.38Å; W773-N777 WeakPolarHBondContact CZ2-ND2 3.27Å; W773-N777 WeakPolarHBondContact CZ3-ND2 3.39Å; W773-N777 VanDerWaalsContact O-CB 3.31Å; W773-N777 WeakPolarHBondContact O-CB 3.28Å; W773-N777 PolarHBondContact O-N 2.83Å
774	Y	41	Very low	39.5	Very low	150 Å²	150	105.9 Å²	105.9	59%	0.588	51%	0.512	S	S	*	.	H	α-helix	trans	-63.5	-48.5	173.3	-171.9	-102.4	0	0	0	111.3	Q770 K771 K776 N777 I778	Q770-Y774 VanDerWaalsContact O-CB 3.27Å; Q770-Y774 WeakPolarHBondContact O-CB 3.31Å; Q770-Y774 PolarHBondContact O-N 2.73Å; K771-Y774 PolarHBondContact O-N 3.46Å; Y774-K776 PolarHBondContact O-N 3Å; Y774-N777 PolarHBondContact O-N 3.05Å; Y774-I778 HydrophobicContact CD1-CD1 3.69Å; Y774-I778 HydrophobicContact CE1-CD1 3.31Å; Y774-I778 HydrophobicContact CE1-CG1 4.47Å; Y774-I778 HydrophobicContact CG-CD1 4.45Å; Y774-I778 WeakPolarHBondContact O-CB 3.02Å; Y774-I778 WeakPolarHBondContact O-CG1 3.4Å; Y774-I778 PolarHBondContact O-N 2.04Å
775	Y	42	Very low	39.6	Very low	152 Å²	152	104.9 Å²	104.9	60%	0.596	52%	0.515	S	S	*	.	H	α-helix	trans	-65.2	-34.8	174.3	-74.6	-56.7	0	0	0	112.6	K771 I778 L779	K771-Y775 HydrophobicContact CB-CD2 4.26Å; K771-Y775 HydrophobicContact CB-CE2 4.22Å; K771-Y775 WeakPolarHBondContact O-CB 3.39Å; K771-Y775 WeakPolarHBondContact O-CD2 3.49Å; K771-Y775 PolarHBondContact O-N 2.69Å; Y775-I778 PolarHBondContact O-N 3.27Å; Y775-L779 WeakPolarHBondContact O-CA 3.17Å; Y775-L779 WeakPolarHBondContact O-CB 3.5Å; Y775-L779 PolarHBondContact O-N 3.06Å
776	K	40.8	Very low	39.6	Very low	139 Å²	139	107.4 Å²	107.4	60%	0.604	52%	0.523	S	S	*	.	H	α-helix	trans	-74.9	-29.4	176.7	-165.4	175.2	-171.7	-178.2	0	111.9	L772 W773 Y774 N780	L772-K776 WeakPolarHBondContact O-CA 3.03Å; L772-K776 WeakPolarHBondContact O-CB 3.48Å; L772-K776 PolarHBondContact O-N 3.27Å; W773-K776 PolarHBondContact O-N 3.18Å; Y774-K776 PolarHBondContact O-N 3Å; K776-N780 WeakPolarHBondContact O-CB 3.3Å; K776-N780 PolarHBondContact O-N 3.13Å
777	N	45.6	Very low	39.6	Very low	61 Å²	61	111.3 Å²	111.3	33%	0.326	54%	0.536	S	S	.	.	H	α-helix	trans	-75.8	-36.2	169.7	-88.7	-22.6	0	0	0	112.8	W773 Y774 K781	W773-N777 VanDerWaalsContact CH2-ND2 3.27Å; W773-N777 WeakPolarHBondContact CH2-ND2 3.38Å; W773-N777 WeakPolarHBondContact CZ2-ND2 3.27Å; W773-N777 WeakPolarHBondContact CZ3-ND2 3.39Å; W773-N777 VanDerWaalsContact O-CB 3.31Å; W773-N777 WeakPolarHBondContact O-CB 3.28Å; W773-N777 PolarHBondContact O-N 2.83Å; Y774-N777 PolarHBondContact O-N 3.05Å; N777-K781 WeakPolarHBondContact O-CB 3.44Å; N777-K781 WeakPolarHBondContact O-CG 3.32Å; N777-K781 PolarHBondContact O-N 3.24Å
778	I	45.1	Very low	39.4	Very low	70 Å²	70	110.8 Å²	110.8	36%	0.359	55%	0.545	S	S	.	.	H	α-helix	trans	-65.7	-46.8	169.1	-72.6	173.4	0	0	0	109.4	Y774 Y775 N780 K781 C782	Y774-I778 HydrophobicContact CD1-CD1 3.69Å; Y774-I778 HydrophobicContact CE1-CD1 3.31Å; Y774-I778 HydrophobicContact CE1-CG1 4.47Å; Y774-I778 HydrophobicContact CG-CD1 4.45Å; Y774-I778 WeakPolarHBondContact O-CB 3.02Å; Y774-I778 WeakPolarHBondContact O-CG1 3.4Å; Y774-I778 PolarHBondContact O-N 2.04Å; Y775-I778 PolarHBondContact O-N 3.27Å; I778-N780 VanDerWaalsContact C-N 3.32Å; I778-N780 PolarHBondContact O-N 3.43Å; I778-K781 CarbonylContact O-C 3.57Å; I778-K781 PolarHBondContact O-N 3.45Å; I778-K781 VanDerWaalsContact O-N 3.12Å; I778-C782 WeakPolarHBondContact O-CB 3.47Å; I778-C782 PolarHBondContact O-N 2.86Å; I778-C782 PolarHBondContact O-SG 3.33Å
779	L	41.2	Very low	39.4	Very low	104 Å²	104	113.9 Å²	113.9	55%	0.545	55%	0.554	S	S	.	*	H	α-helix	trans	-62.4	-38	176.8	-159.7	80.2	0	0	0	111.1	Y775 C782 L783	Y775-L779 WeakPolarHBondContact O-CA 3.17Å; Y775-L779 WeakPolarHBondContact O-CB 3.5Å; Y775-L779 PolarHBondContact O-N 3.06Å; L779-C782 PolarHBondContact O-N 3.04Å; L779-L783 HydrophobicContact CD1-CD1 4.41Å; L779-L783 HydrophobicContact CD2-CD1 4.36Å; L779-L783 HydrophobicContact CG-CD1 3.79Å; L779-L783 VanDerWaalsContact O-CB 3.26Å; L779-L783 WeakPolarHBondContact O-CB 3.5Å; L779-L783 WeakPolarHBondContact O-CD1 3.31Å; L779-L783 PolarHBondContact O-N 3.34Å
780	N	42.7	Very low	39.1	Very low	91 Å²	91	116 Å²	116	49%	0.487	57%	0.565	S	S	.	*	H	α-helix	trans	-70.9	-32.1	173.2	-81.4	-11.2	0	0	0	113.3	K776 I778 S784	K776-N780 WeakPolarHBondContact O-CB 3.3Å; K776-N780 PolarHBondContact O-N 3.13Å; I778-N780 VanDerWaalsContact C-N 3.32Å; I778-N780 PolarHBondContact O-N 3.43Å; N780-S784 WeakPolarHBondContact O-CB 3.28Å; N780-S784 PolarHBondContact O-N 2.86Å; N780-S784 PolarHBondContact O-OG 3.19Å
781	K	38.3	Very low	38.6	Very low	154 Å²	154	114 Å²	114	67%	0.67	56%	0.564	S	S	*	*	H	α-helix	trans	-74.8	-33.3	172.3	-79.4	-178.9	172.7	-177.1	0	112.6	N777 I778 S784 C785	N777-K781 WeakPolarHBondContact O-CB 3.44Å; N777-K781 WeakPolarHBondContact O-CG 3.32Å; N777-K781 PolarHBondContact O-N 3.24Å; I778-K781 CarbonylContact O-C 3.57Å; I778-K781 PolarHBondContact O-N 3.45Å; I778-K781 VanDerWaalsContact O-N 3.12Å; K781-S784 WeakPolarHBondContact CA-OG 3.32Å; K781-S784 PolarHBondContact O-OG 2.89Å; K781-C785 PolarHBondContact O-N 3.35Å; K781-C785 PolarHBondContact O-SG 3.22Å; K781-C785 VanDerWaalsContact O-SG 3.34Å
782	C	37.9	Very low	38	Very low	69 Å²	69	112 Å²	112	47%	0.466	57%	0.566	S	S	.	*	H	α-helix	trans	-71.6	-39.3	170.3	-69.8	0	0	0	0	110.9	I778 L779 C785 F786	I778-C782 WeakPolarHBondContact O-CB 3.47Å; I778-C782 PolarHBondContact O-N 2.86Å; I778-C782 PolarHBondContact O-SG 3.33Å; L779-C782 PolarHBondContact O-N 3.04Å; C782-C785 CarbonylContact O-C 3.58Å; C782-C785 WeakPolarHBondContact O-CB 3.26Å; C782-C785 PolarHBondContact O-N 3.06Å; C782-F786 WeakPolarHBondContact O-CB 3.2Å; C782-F786 PolarHBondContact O-N 2.87Å
783	L	40.9	Very low	37.5	Very low	87 Å²	87	115.3 Å²	115.3	46%	0.455	58%	0.579	S	S	.	*	H	α-helix	trans	-71.4	-25.4	171.1	-98	91.7	0	0	0	112.8	L779 F786 K787	L779-L783 HydrophobicContact CD1-CD1 4.41Å; L779-L783 HydrophobicContact CD2-CD1 4.36Å; L779-L783 HydrophobicContact CG-CD1 3.79Å; L779-L783 VanDerWaalsContact O-CB 3.26Å; L779-L783 WeakPolarHBondContact O-CB 3.5Å; L779-L783 WeakPolarHBondContact O-CD1 3.31Å; L779-L783 PolarHBondContact O-N 3.34Å; L783-F786 PolarHBondContact O-N 2.84Å; L783-K787 VanDerWaalsContact O-CB 3.23Å; L783-K787 WeakPolarHBondContact O-CB 3.34Å; L783-K787 WeakPolarHBondContact O-CG 3.19Å; L783-K787 PolarHBondContact O-N 2.95Å
784	S	38.4	Very low	36.7	Very low	63 Å²	63	115.8 Å²	115.8	44%	0.441	59%	0.588	S	S	.	*	H	α-helix	trans	-73.8	-34.7	169.4	69.9	0	0	0	0	111	N780 K781 C788	N780-S784 WeakPolarHBondContact O-CB 3.28Å; N780-S784 PolarHBondContact O-N 2.86Å; N780-S784 PolarHBondContact O-OG 3.19Å; K781-S784 WeakPolarHBondContact CA-OG 3.32Å; K781-S784 PolarHBondContact O-OG 2.89Å; S784-C788 PolarHBondContact O-N 3.35Å; S784-C788 VanDerWaalsContact O-N 3.15Å
785	C	36.6	Very low	36.1	Very low	81 Å²	81	118.2 Å²	118.2	55%	0.547	60%	0.602	S	S	.	*	H	α-helix	trans	-65.5	-41.2	166.8	-68.5	0	0	0	0	112.1	K781 C782 C788 M789	K781-C785 PolarHBondContact O-N 3.35Å; K781-C785 PolarHBondContact O-SG 3.22Å; K781-C785 VanDerWaalsContact O-SG 3.34Å; C782-C785 CarbonylContact O-C 3.58Å; C782-C785 WeakPolarHBondContact O-CB 3.26Å; C782-C785 PolarHBondContact O-N 3.06Å; C785-C788 CarbonylContact O-C 3.58Å; C785-C788 PolarHBondContact O-N 2.62Å; C785-M789 PolarHBondContact O-N 3.44Å
786	F	36	Very low	35.5	Very low	129 Å²	129	117.9 Å²	117.9	57%	0.566	61%	0.606	S	S	*	*	H	α-helix	trans	-70.5	-33.5	177.7	-116.1	-98.1	0	0	0	112.7	C782 L783 C788 M789 L790	C782-F786 WeakPolarHBondContact O-CB 3.2Å; C782-F786 PolarHBondContact O-N 2.87Å; L783-F786 PolarHBondContact O-N 2.84Å; F786-C788 VanDerWaalsContact C-N 3.26Å; F786-C788 PolarHBondContact O-N 3.32Å; F786-M789 CarbonylContact O-C 3.53Å; F786-M789 WeakPolarHBondContact O-CA 3.4Å; F786-M789 WeakPolarHBondContact O-CB 3.37Å; F786-M789 PolarHBondContact O-N 3.47Å; F786-L790 HydrophobicContact CD1-CD1 3.7Å; F786-L790 HydrophobicContact CE1-CD1 4.22Å; F786-L790 WeakPolarHBondContact O-CD1 3.47Å; F786-L790 PolarHBondContact O-N 3.39Å
787	K	35.7	Very low	35	Very low	166 Å²	166	115 Å²	115	72%	0.722	60%	0.603	S	S	*	*	H	α-helix	trans	-70.9	-17.8	169.9	-83.4	-172.9	167.4	-172.6	0	113.5	L783 M789	L783-K787 VanDerWaalsContact O-CB 3.23Å; L783-K787 WeakPolarHBondContact O-CB 3.34Å; L783-K787 WeakPolarHBondContact O-CG 3.19Å; L783-K787 PolarHBondContact O-N 2.95Å; K787-M789 VanDerWaalsContact C-N 3.33Å
788	C	33.2	Very low	34.4	Very low	111 Å²	111	118.4 Å²	118.4	75%	0.75	62%	0.621	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.6	-3.3	163.5	-73.5	0	0	0	0	113.3	S784 C785 F786	S784-C788 PolarHBondContact O-N 3.35Å; S784-C788 VanDerWaalsContact O-N 3.15Å; C785-C788 CarbonylContact O-C 3.58Å; C785-C788 PolarHBondContact O-N 2.62Å; F786-C788 VanDerWaalsContact C-N 3.26Å; F786-C788 PolarHBondContact O-N 3.32Å
789	M	34.3	Very low	34	Very low	121 Å²	121	120.7 Å²	120.7	60%	0.596	63%	0.632	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.9	-17.2	-178.5	-151.7	174.7	-73.6	0	0	113.1	C785 F786 K787	C785-M789 PolarHBondContact O-N 3.44Å; F786-M789 CarbonylContact O-C 3.53Å; F786-M789 WeakPolarHBondContact O-CA 3.4Å; F786-M789 WeakPolarHBondContact O-CB 3.37Å; F786-M789 PolarHBondContact O-N 3.47Å; K787-M789 VanDerWaalsContact C-N 3.33Å
790	L	31	Very low	33.7	Very low	125 Å²	125	121 Å²	121	65%	0.654	64%	0.635	S	S	*	*	S	Bend	trans	-109	84.8	161.8	-70.7	84.8	0	0	0	107.7	F786	F786-L790 HydrophobicContact CD1-CD1 3.7Å; F786-L790 HydrophobicContact CE1-CD1 4.22Å; F786-L790 WeakPolarHBondContact O-CD1 3.47Å; F786-L790 PolarHBondContact O-N 3.39Å
791	P	28	Very low	33.1	Very low	101 Å²	101	122.6 Å²	122.6	66%	0.656	64%	0.641	S	S	*	*	S	Bend		-133.6	104.3	66.5	34.3	-18	0	0	0	113.7
792	C	26.8	Very low	33	Very low	91 Å²	91	120.5 Å²	120.5	62%	0.615	64%	0.637	S	S	*	*			trans	-134.8	30.6	166.9	-92.1	0	0	0	0	113
793	Q	28.2	Very low	32.8	Very low	180 Å²	180	124.6 Å²	124.6	84%	0.841	65%	0.647	S	S	*	*	S	Bend	trans	-112.3	136.8	151.3	-71.4	-175.1	-35.1	0	0	107
794	Q	27.1	Very low	32.6	Very low	186 Å²	186	126.7 Å²	126.7	87%	0.869	66%	0.657	S	S	*	*	S	Bend	trans	74.4	109.5	-172.6	-55.4	177.8	-15.8	0	0	116.8	Q796	Q794-Q796 PolarHBondContact O-N 2.83Å
795	K	28.9	Very low	32.5	Very low	201 Å²	201	128.9 Å²	128.9	87%	0.874	66%	0.663	S	S	*	*	S	Bend	trans	56.6	-11.4	147.7	-103.4	176.2	176.5	177.9	0	123.7
796	Q	29.4	Very low	32.4	Very low	145 Å²	145	128.8 Å²	128.8	68%	0.678	66%	0.664	S	S	*	*			trans	-96	-15.1	-169.9	-130.2	74.3	3.6	0	0	117.7	Q794	Q794-Q796 PolarHBondContact O-N 2.83Å
797	S	29.7	Very low	32.4	Very low	79 Å²	79	129.7 Å²	129.7	55%	0.552	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85	-14.3	-169.4	52.7	0	0	0	0	116.1	I799	S797-I799 VanDerWaalsContact C-N 3.34Å; S797-I799 PolarHBondContact O-N 2.77Å
798	L	32.1	Very low	32.4	Very low	132 Å²	132	125.2 Å²	125.2	69%	0.691	66%	0.664	S	S	*	*	H	α-helix	trans	-73.5	-22.7	-179.7	-129.6	83.6	0	0	0	113.7	N802	L798-N802 PolarHBondContact O-ND2 2.97Å
799	I	36.9	Very low	32.4	Very low	118 Å²	118	130.1 Å²	130.1	61%	0.605	67%	0.672	S	S	*	*	H	α-helix	trans	-86.9	-32	-167.7	-65	170.9	0	0	0	112.4	S797	S797-I799 VanDerWaalsContact C-N 3.34Å; S797-I799 PolarHBondContact O-N 2.77Å
800	N	34.8	Very low	32.3	Very low	111 Å²	111	133.8 Å²	133.8	59%	0.594	69%	0.685	S	S	*	*	H	α-helix	trans	-86.5	-24.5	179.6	-83	-19.3	0	0	0	114.2	K803 I804	N800-K803 PolarHBondContact O-N 3.26Å; N800-I804 PolarHBondContact O-N 2.72Å
801	M	32	Very low	32.2	Very low	124 Å²	124	132.8 Å²	132.8	61%	0.611	69%	0.687	S	S	*	*	H	α-helix	trans	-63	-42.8	170.8	-81.2	-82.5	-83.6	0	0	111.3	K803 I804 L805	M801-K803 PolarHBondContact O-N 3.31Å; M801-K803 VanDerWaalsContact O-N 3.15Å; M801-I804 PolarHBondContact O-N 3.32Å; M801-I804 VanDerWaalsContact O-N 3.07Å; M801-L805 PolarHBondContact O-N 3.49Å
802	N	35.3	Very low	32.3	Very low	110 Å²	110	137.3 Å²	137.3	59%	0.588	70%	0.697	S	S	*	*	H	α-helix	trans	-62.5	-20.7	176.4	-71.1	-12.1	0	0	0	113.6	L798	L798-N802 PolarHBondContact O-ND2 2.97Å
803	K	34.4	Very low	32.6	Very low	155 Å²	155	138.1 Å²	138.1	67%	0.674	70%	0.703	S	S	*	*	H	α-helix	trans	-88.8	-12.3	177.8	-140.6	172.9	-172.5	176.8	0	113.8	N800 M801 S806	N800-K803 PolarHBondContact O-N 3.26Å; M801-K803 PolarHBondContact O-N 3.31Å; M801-K803 VanDerWaalsContact O-N 3.15Å; K803-S806 PolarHBondContact O-OG 3.12Å
804	I	36.2	Very low	32.9	Very low	132 Å²	132	137.3 Å²	137.3	68%	0.677	70%	0.703	S	S	*	*	H	α-helix	trans	-100.8	-30.4	175.3	-64.9	172.9	0	0	0	110.5	N800 M801 S806	N800-I804 PolarHBondContact O-N 2.72Å; M801-I804 PolarHBondContact O-N 3.32Å; M801-I804 VanDerWaalsContact O-N 3.07Å; I804-S806 PolarHBondContact O-N 2.74Å
805	L	35.3	Very low	32.9	Very low	109 Å²	109	139.3 Å²	139.3	57%	0.571	70%	0.703	S	S	*	*	G	3₁₀ helix	trans	-67.8	-12.9	174.8	-86.4	155.1	0	0	0	114.9	M801	M801-L805 PolarHBondContact O-N 3.49Å
806	S	35.7	Very low	32.9	Very low	79 Å²	79	139.1 Å²	139.1	55%	0.552	70%	0.702	S	S	*	*	G	3₁₀ helix	trans	-75.9	-18	-179.6	54.2	0	0	0	0	115	K803 I804	K803-S806 PolarHBondContact O-OG 3.12Å; I804-S806 PolarHBondContact O-N 2.74Å
807	N	36.6	Very low	32.9	Very low	147 Å²	147	140.3 Å²	140.3	79%	0.786	71%	0.71	S	S	*	*	G	3₁₀ helix	trans	-105.8	13	-164.9	-82.5	-16.6	0	0	0	116.2
808	S	34.2	Very low	32.7	Very low	73 Å²	73	143.6 Å²	143.6	51%	0.51	72%	0.721	S	S	.	*			trans	-126.8	112.1	173.1	76.5	0	0	0	0	113.4	K810	S808-K810 PolarHBondContact O-N 3.39Å
809	K	32.8	Very low	32.7	Very low	213 Å²	213	142.3 Å²	142.3	93%	0.926	72%	0.719	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.3	22.8	-175.3	-69.4	-178.1	174.7	177.6	0	114.9
810	K	33.1	Very low	32.3	Very low	199 Å²	199	142.1 Å²	142.1	87%	0.865	72%	0.724	S	S	*	*	T	Hydrogen-bonded Turn	trans	-125.1	-5	-176.5	-85.4	-173.9	173.1	-178.9	0	116.6	S808	S808-K810 PolarHBondContact O-N 3.39Å
811	C	28.5	Very low	31.9	Very low	103 Å²	103	145 Å²	145	70%	0.696	74%	0.739	S	S	*	*			trans	-105.1	56.3	176.6	-69.9	0	0	0	0	113
812	K	30.4	Very low	31.9	Very low	197 Å²	197	145.4 Å²	145.4	86%	0.857	75%	0.749	S	S	*	*			trans	-102.8	6.7	-178.8	-94	-170.5	174.5	-173.7	0	115.5
813	S	34.2	Very low	31.5	Very low	108 Å²	108	146.8 Å²	146.8	76%	0.755	76%	0.761	S	S	*	*			trans	-94	-13.9	-174.9	52.5	0	0	0	0	115.8	R815	S813-R815 PolarHBondContact O-N 2.89Å
814	I	32.9	Very low	31.3	Very low	163 Å²	163	147.9 Å²	147.9	84%	0.836	77%	0.768	S	S	*	*			trans	-93	74.3	176.9	-53.5	179.5	0	0	0	108.6
815	R	28.4	Very low	31	Very low	228 Å²	228	148.9 Å²	148.9	86%	0.86	78%	0.775	S	S	*	*			trans	-73.7	135.8	166.1	-105.1	-179.8	177.2	162.4	-1.9	108.7	S813 M817	S813-R815 PolarHBondContact O-N 2.89Å; R815-M817 PolarHBondContact O-N 2.81Å
816	F	28.7	Very low	30.6	Very low	197 Å²	197	151 Å²	151	86%	0.864	79%	0.787	S	S	*	*			trans	-43.1	121.5	168.3	-80.5	-110.9	0	0	0	111.3	N818	F816-N818 PolarHBondContact O-N 3.48Å; F816-N818 VanDerWaalsContact O-N 3.11Å
817	M	29.5	Very low	30.2	Very low	169 Å²	169	154 Å²	154	83%	0.833	80%	0.797	S	S	*	*			trans	-74.2	96.7	159.1	-87.5	-161.3	168.4	0	0	108.5	R815 T819	R815-M817 PolarHBondContact O-N 2.81Å; M817-T819 VanDerWaalsContact C-N 3.32Å; M817-T819 PolarHBondContact O-N 2.71Å
818	N	25.8	Very low	29.9	Very low	149 Å²	149	154.6 Å²	154.6	80%	0.797	80%	0.8	S	S	*	*			trans	-64.2	97.5	155.2	-78.1	-10.9	0	0	0	107.9	F816	F816-N818 PolarHBondContact O-N 3.48Å; F816-N818 VanDerWaalsContact O-N 3.11Å
819	T	30.8	Very low	29.7	Very low	105 Å²	105	156.3 Å²	156.3	64%	0.644	81%	0.812	S	S	*	*			trans	-117.2	89.9	166.2	41	0	0	0	0	109.9	M817	M817-T819 VanDerWaalsContact C-N 3.32Å; M817-T819 PolarHBondContact O-N 2.71Å
820	T	29.3	Very low	29.7	Very low	114 Å²	114	152.1 Å²	152.1	70%	0.699	81%	0.81	S	S	*	*				53.8	105	123.7	55.7	0	0	0	0	118.7	T822	T820-T822 PolarHBondContact O-N 2.78Å; T820-T822 VanDerWaalsContact O-N 3.17Å
821	N	26.6	Very low	29.8	Very low	170 Å²	170	146.6 Å²	146.6	91%	0.909	80%	0.801	S	S	*	*			trans	0.8	94.4	146.2	-63	-7.7	0	0	0	117
822	T	30.9	Very low	30.9	Very low	134 Å²	134	148.2 Å²	148.2	82%	0.822	80%	0.802	S	S	*	*			trans	-134.5	116.1	145.6	47.5	0	0	0	0	108.6	T820 H824	T820-T822 PolarHBondContact O-N 2.78Å; T820-T822 VanDerWaalsContact O-N 3.17Å; T822-H824 PolarHBondContact O-N 3.19Å
823	T	26.4	Very low	32	Very low	138 Å²	138	144.3 Å²	144.3	85%	0.847	78%	0.783	S	S	*	*			trans	-72.8	108	-178.8	45.5	0	0	0	0	111
824	H	31.1	Very low	33.2	Very low	178 Å²	178	143.5 Å²	143.5	82%	0.824	77%	0.767	S	S	*	*			trans	-145.5	109	162.2	-109.8	-76.1	0	0	0	112.2	T822	T822-H824 PolarHBondContact O-N 3.19Å
825	N	29.6	Very low	35.1	Very low	154 Å²	154	136.2 Å²	136.2	82%	0.824	73%	0.73	S	S	*	*			trans	29.6	114.8	161.2	-66	-7.8	0	0	0	120.4
826	N	27.6	Very low	37.6	Very low	152 Å²	152	133.8 Å²	133.8	81%	0.813	73%	0.726	S	S	*	*			trans	-58.1	164.9	162.5	-74.7	-38.4	0	0	0	113.9
827	N	27.7	Very low	40.3	Very low	144 Å²	144	126.5 Å²	126.5	77%	0.77	70%	0.695	S	S	*	*			trans	79.2	95.6	164.6	-53.8	-21.1	0	0	0	117
828	N	29.4	Very low	43.1	Very low	158 Å²	158	118.5 Å²	118.5	85%	0.845	66%	0.656	S	S	*	*			trans	-179.9	71.1	131	-90.8	-27.2	0	0	0	111.8
829	S	30.2	Very low	45.9	Very low	110 Å²	110	113.4 Å²	113.4	77%	0.769	64%	0.635	S	S	*	*	S	Bend	trans	-95.3	131	167.5	46.9	0	0	0	0	109.8
830	S	32.6	Very low	48.7	Very low	125 Å²	125	116.1 Å²	116.1	87%	0.874	63%	0.634	S	S	*	*	S	Bend	trans	76.5	32.2	179.2	70.6	0	0	0	0	119	L832	S830-L832 PolarHBondContact O-N 3.25Å
831	A	35.7	Very low	51.6	Low	82 Å²	82	111.5 Å²	111.5	68%	0.678	61%	0.607	S	S	*	*			trans	-64.8	121.3	164.2	0	0	0	0	0	111.2	Y833	A831-Y833 PolarHBondContact O-N 2.79Å
832	L	50.3	Low	54.7	Low	137 Å²	137	106.1 Å²	106.1	72%	0.717	57%	0.574	S	S	*	*			trans	-52	133.1	163.4	-92.2	131.3	0	0	0	108.9	S830 E834	S830-L832 PolarHBondContact O-N 3.25Å; L832-E834 PolarHBondContact O-N 2.76Å
833	Y	53.4	Low	57.4	Low	116 Å²	116	105 Å²	105	46%	0.455	56%	0.562	S	S	.	*			trans	-76.8	74.6	175.8	-167.6	-92.7	0	0	0	109.4	I427 T489 P490 A831 S835	I427-Y833 HydrophobicContact CG2-CD1 4.49Å; T489-Y833 HydrophobicContact CG2-CE1 4.23Å; P490-Y833 WeakPolarHBondContact CD-OH 3.4Å; A831-Y833 PolarHBondContact O-N 2.79Å; Y833-S835 PolarHBondContact O-N 3.42Å
834	E	60.4	Low	60.5	Low	90 Å²	90	101.1 Å²	101.1	42%	0.421	54%	0.536	S	S	.	.			trans	-70.3	119.7	175.4	-175.4	158.2	147	0	0	109.2	L832 K836 A839 R842	L832-E834 PolarHBondContact O-N 2.76Å; E834-K836 PolarHBondContact O-N 2.98Å; E834-A839 HydrophobicContact CG-CB 4.41Å; E834-A839 VanDerWaalsContact OE1-CB 3.3Å; E834-A839 WeakPolarHBondContact OE1-CB 3.37Å; E834-R842 VanDerWaalsContact CD-CZ 3.49Å; E834-R842 IonicContact OE1-CZ 3.12Å; E834-R842 IonicContact OE1-NH1 3.66Å; E834-R842 PolarHBondContact OE1-NH1 3.3Å; E834-R842 IonicContact OE1-NH2 2.62Å; E834-R842 IonicContact OE2-CZ 3.46Å; E834-R842 IonicContact OE2-NH1 2.72Å; E834-R842 PolarHBondContact OE2-NH1 2.87Å; E834-R842 IonicContact OE2-NH2 3.36Å; E834-R842 PolarHBondContact OE2-NH2 2.96Å
835	S	72.4	Confident	63.4	Low	10 Å²	10	93.4 Å²	93.4	7%	0.07	50%	0.5	C	S	.	.			trans	-67.2	132.5	171.9	97.5	0	0	0	0	108	Y833 I837 D838 A839	Y833-S835 PolarHBondContact O-N 3.42Å; S835-I837 PolarHBondContact O-N 2.93Å; S835-D838 VanDerWaalsContact CB-OD2 3.27Å; S835-D838 WeakPolarHBondContact CB-OD2 3.23Å; S835-D838 PolarHBondContact O-N 2.9Å; S835-D838 VanDerWaalsContact O-N 3.16Å; S835-D838 PolarHBondContact OG-N 3.16Å; S835-D838 VanDerWaalsContact OG-N 3.12Å; S835-D838 PolarHBondContact OG-OD2 2.79Å; S835-A839 PolarHBondContact O-N 3.13Å
836	K	81.7	Confident	66.3	Low	177 Å²	177	87.7 Å²	87.7	77%	0.77	47%	0.471	S	S	*	.	H	α-helix	trans	-59.2	-18.4	178	-65.6	-175.1	179.2	-177.8	0	112.5	E834 Y840	E834-K836 PolarHBondContact O-N 2.98Å; K836-Y840 WeakPolarHBondContact O-CD2 3.42Å; K836-Y840 WeakPolarHBondContact O-CE2 3.4Å
837	I	85	Confident	69.4	Low	44 Å²	44	84.8 Å²	84.8	23%	0.226	46%	0.455	C	S	.	.	H	α-helix	trans	-77.1	-51.8	179	-58.1	158.5	0	0	0	108.7	E481 Y484 A485 M488 S835 A839 Y840 S841	E481-I837 HydrophobicContact CG-CG2 4.27Å; E481-I837 WeakPolarHBondContact OE1-CG2 3.43Å; Y484-I837 HydrophobicContact CD1-CD1 3.85Å; Y484-I837 HydrophobicContact CD1-CG2 4.23Å; Y484-I837 HydrophobicContact CE1-CD1 3.58Å; Y484-I837 HydrophobicContact CE1-CG1 4.23Å; Y484-I837 HydrophobicContact CE1-CG2 4.44Å; A485-I837 HydrophobicContact CB-CB 4.3Å; A485-I837 HydrophobicContact CB-CD1 4.17Å; A485-I837 HydrophobicContact CB-CG2 4.37Å; M488-I837 HydrophobicContact CB-CD1 3.73Å; M488-I837 HydrophobicContact CG-CD1 4.11Å; S835-I837 PolarHBondContact O-N 2.93Å; I837-A839 PolarHBondContact O-N 3.45Å; I837-Y840 PolarHBondContact O-N 2.94Å; I837-S841 PolarHBondContact O-N 3.17Å; I837-S841 PolarHBondContact O-OG 3.12Å
838	D	87.4	Confident	72.5	Confident	1 Å²	1	79.5 Å²	79.5	1%	0.005	43%	0.429	C	S	.	.	H	α-helix	trans	-51.9	-43	175.1	-68.1	-65.9	0	0	0	111.6	R433 S835 Y840 S841 R842	R433-D838 IonicContact CZ-OD1 2.68Å; R433-D838 VanDerWaalsContact CZ-OD1 3.24Å; R433-D838 IonicContact CZ-OD2 3.14Å; R433-D838 IonicContact NH1-OD1 2.72Å; R433-D838 PolarHBondContact NH1-OD1 3.19Å; R433-D838 IonicContact NH1-OD2 3.24Å; R433-D838 PolarHBondContact NH1-OD2 3.24Å; R433-D838 IonicContact NH2-OD1 3.35Å; R433-D838 PolarHBondContact NH2-OD1 3.41Å; R433-D838 IonicContact NH2-OD2 2.84Å; R433-D838 PolarHBondContact NH2-OD2 2.79Å; S835-D838 VanDerWaalsContact CB-OD2 3.27Å; S835-D838 WeakPolarHBondContact CB-OD2 3.23Å; S835-D838 PolarHBondContact O-N 2.9Å; S835-D838 VanDerWaalsContact O-N 3.16Å; S835-D838 PolarHBondContact OG-N 3.16Å; S835-D838 VanDerWaalsContact OG-N 3.12Å; S835-D838 PolarHBondContact OG-OD2 2.79Å; D838-Y840 VanDerWaalsContact C-N 3.3Å; D838-Y840 PolarHBondContact O-N 3.28Å; D838-S841 PolarHBondContact O-N 3.2Å; D838-S841 VanDerWaalsContact O-N 3.11Å; D838-R842 VanDerWaalsContact O-CG 3.27Å; D838-R842 WeakPolarHBondContact O-CG 3.4Å; D838-R842 PolarHBondContact O-N 2.69Å
839	A	86.2	Confident	75.6	Confident	42 Å²	42	72.1 Å²	72.1	35%	0.347	39%	0.389	S	S	.	.	H	α-helix	trans	-55.5	-41	178.8	0	0	0	0	0	113	E834 S835 I837	E834-A839 HydrophobicContact CG-CB 4.41Å; E834-A839 VanDerWaalsContact OE1-CB 3.3Å; E834-A839 WeakPolarHBondContact OE1-CB 3.37Å; S835-A839 PolarHBondContact O-N 3.13Å; I837-A839 PolarHBondContact O-N 3.45Å
840	Y	88.4	Confident	78.6	Confident	162 Å²	162	73.8 Å²	73.8	64%	0.635	38%	0.383	S	S	*	.	H	α-helix	trans	-75.8	-41	173.8	-68.5	-62	0	0	0	111.8	K836 I837 D838 R842 L843 I844	K836-Y840 WeakPolarHBondContact O-CD2 3.42Å; K836-Y840 WeakPolarHBondContact O-CE2 3.4Å; I837-Y840 PolarHBondContact O-N 2.94Å; D838-Y840 VanDerWaalsContact C-N 3.3Å; D838-Y840 PolarHBondContact O-N 3.28Å; Y840-R842 VanDerWaalsContact C-N 3.31Å; Y840-R842 PolarHBondContact O-N 3.24Å; Y840-L843 PolarHBondContact O-N 3.34Å; Y840-I844 WeakPolarHBondContact O-CB 3.47Å; Y840-I844 WeakPolarHBondContact O-CG1 3.21Å; Y840-I844 PolarHBondContact O-N 3.49Å
841	S	90.9	Very high	81.5	Confident	18 Å²	18	71.4 Å²	71.4	13%	0.126	36%	0.363	C	S	.	.	H	α-helix	trans	-59.5	-39.2	-179.3	-56.4	0	0	0	0	112.4	E481 I837 D838 L843 I844 F845	E481-S841 VanDerWaalsContact CD-OG 3.27Å; E481-S841 VanDerWaalsContact CG-OG 3.26Å; E481-S841 WeakPolarHBondContact CG-OG 3.39Å; E481-S841 VanDerWaalsContact OE1-CB 3.3Å; E481-S841 WeakPolarHBondContact OE1-CB 3.26Å; E481-S841 PolarHBondContact OE1-OG 3.21Å; I837-S841 PolarHBondContact O-N 3.17Å; I837-S841 PolarHBondContact O-OG 3.12Å; D838-S841 PolarHBondContact O-N 3.2Å; D838-S841 VanDerWaalsContact O-N 3.11Å; S841-L843 PolarHBondContact O-N 3.24Å; S841-L843 VanDerWaalsContact O-N 3.12Å; S841-I844 PolarHBondContact O-N 3.45Å; S841-F845 WeakPolarHBondContact O-CB 3.34Å; S841-F845 PolarHBondContact O-N 2.8Å
842	R	90.7	Very high	84.3	Confident	56 Å²	56	69 Å²	69	21%	0.211	34%	0.337	C	S	.	.	H	α-helix	trans	-53.9	-28.4	175.5	-76.4	172.1	-168	176.3	7.9	114.5	F423 E834 D838 Y840 P846	F423-R842 HydrophobicContact CB-CG 3.76Å; F423-R842 PolarHBondContact O-NE 2.73Å; F423-R842 PolarHBondContact O-NH2 3.44Å; E834-R842 VanDerWaalsContact CD-CZ 3.49Å; E834-R842 IonicContact OE1-CZ 3.12Å; E834-R842 IonicContact OE1-NH1 3.66Å; E834-R842 PolarHBondContact OE1-NH1 3.3Å; E834-R842 IonicContact OE1-NH2 2.62Å; E834-R842 IonicContact OE2-CZ 3.46Å; E834-R842 IonicContact OE2-NH1 2.72Å; E834-R842 PolarHBondContact OE2-NH1 2.87Å; E834-R842 IonicContact OE2-NH2 3.36Å; E834-R842 PolarHBondContact OE2-NH2 2.96Å; D838-R842 VanDerWaalsContact O-CG 3.27Å; D838-R842 WeakPolarHBondContact O-CG 3.4Å; D838-R842 PolarHBondContact O-N 2.69Å; Y840-R842 VanDerWaalsContact C-N 3.31Å; Y840-R842 PolarHBondContact O-N 3.24Å; R842-P846 VanDerWaalsContact O-CD 3.31Å; R842-P846 WeakPolarHBondContact O-CD 3.21Å; R842-P846 WeakPolarHBondContact O-CG 3.44Å
843	L	89.1	Confident	86.4	Confident	111 Å²	111	63.9 Å²	63.9	58%	0.581	31%	0.31	S	S	*	.	H	α-helix	trans	-105.8	-41.6	-180	-177.6	138.7	0	0	0	112.1	Y840 S841 P846 I847	Y840-L843 PolarHBondContact O-N 3.34Å; S841-L843 PolarHBondContact O-N 3.24Å; S841-L843 VanDerWaalsContact O-N 3.12Å; L843-P846 WeakPolarHBondContact O-CD 3.47Å; L843-P846 WeakPolarHBondContact O-CG 3.35Å; L843-I847 HydrophobicContact CD2-CD1 3.58Å; L843-I847 HydrophobicContact CG-CD1 3.75Å; L843-I847 WeakPolarHBondContact O-CB 3.22Å; L843-I847 WeakPolarHBondContact O-CD1 3.47Å; L843-I847 VanDerWaalsContact O-CG1 3.27Å; L843-I847 WeakPolarHBondContact O-CG1 2.97Å; L843-I847 PolarHBondContact O-N 2.88Å
844	I	90.6	Very high	88.2	Confident	56 Å²	56	65 Å²	65	29%	0.287	32%	0.318	S	S	.	.	H	α-helix	trans	-65.4	-43.5	-178.1	-69.8	174.1	0	0	0	111.7	W6 Y840 S841 S848	W6-I844 HydrophobicContact CZ2-CG2 3.8Å; Y840-I844 WeakPolarHBondContact O-CB 3.47Å; Y840-I844 WeakPolarHBondContact O-CG1 3.21Å; Y840-I844 PolarHBondContact O-N 3.49Å; S841-I844 PolarHBondContact O-N 3.45Å; I844-S848 WeakPolarHBondContact O-CB 3.14Å; I844-S848 PolarHBondContact O-N 3.34Å; I844-S848 PolarHBondContact O-OG 2.93Å
845	F	92	Very high	89.7	Confident	16 Å²	16	65.7 Å²	65.7	7%	0.07	32%	0.323	C	S	.	.	H	α-helix	trans	-63.4	-55.3	-177	-166.2	-87.7	0	0	0	113.1	V416 W420 F423 F474 A478 S841 I847 S848 F849	V416-F845 HydrophobicContact CG1-CE1 4.08Å; V416-F845 HydrophobicContact CG1-CZ 4.42Å; W420-F845 HydrophobicContact CB-CD1 4Å; W420-F845 HydrophobicContact CB-CE1 4.23Å; F423-F845 HydrophobicContact CE2-CB 3.8Å; F423-F845 HydrophobicContact CE2-CD1 4.14Å; F423-F845 HydrophobicContact CE2-CD2 4.12Å; F423-F845 AromaticContact CE2-CG 3.77Å; F423-F845 HydrophobicContact CE2-CG 3.77Å; F423-F845 HydrophobicContact CZ-CB 4.42Å; F423-F845 HydrophobicContact CZ-CD2 4.03Å; F423-F845 HydrophobicContact CZ-CE2 4.45Å; F423-F845 HydrophobicContact CZ-CG 4.18Å; F474-F845 HydrophobicContact CB-CE2 4.34Å; F474-F845 HydrophobicContact CB-CZ 3.92Å; F474-F845 HydrophobicContact CD1-CD2 4.39Å; F474-F845 HydrophobicContact CD1-CE1 4.48Å; F474-F845 AromaticContact CD1-CE2 3.91Å; F474-F845 HydrophobicContact CD1-CE2 3.91Å; F474-F845 AromaticContact CD1-CZ 3.97Å; F474-F845 HydrophobicContact CD1-CZ 3.97Å; F474-F845 HydrophobicContact CG-CZ 4.42Å; F474-F845 VanDerWaalsContact O-CE2 3.26Å; F474-F845 WeakPolarHBondContact O-CE2 3.37Å; F474-F845 WeakPolarHBondContact O-CZ 3.42Å; A478-F845 HydrophobicContact CB-CE2 3.99Å; A478-F845 HydrophobicContact CB-CZ 4.14Å; S841-F845 WeakPolarHBondContact O-CB 3.34Å; S841-F845 PolarHBondContact O-N 2.8Å; F845-I847 VanDerWaalsContact C-N 3.35Å; F845-I847 PolarHBondContact O-N 3.43Å; F845-S848 PolarHBondContact O-N 3.03Å; F845-S848 PolarHBondContact O-OG 3.15Å; F845-F849 PolarHBondContact O-N 3.05Å
846	P	90.9	Very high	90.7	Very high	35 Å²	35	66.2 Å²	66.2	23%	0.227	32%	0.324	C	S	.	.	H	α-helix	trans	-62.8	-38	179.5	24	-34.9	0	0	0	113.3	W420 R842 L843 F849 F850	W420-P846 HydrophobicContact CE3-CB 3.77Å; W420-P846 HydrophobicContact CZ3-CB 3.58Å; R842-P846 VanDerWaalsContact O-CD 3.31Å; R842-P846 WeakPolarHBondContact O-CD 3.21Å; R842-P846 WeakPolarHBondContact O-CG 3.44Å; L843-P846 WeakPolarHBondContact O-CD 3.47Å; L843-P846 WeakPolarHBondContact O-CG 3.35Å; P846-F849 PolarHBondContact O-N 3.46Å; P846-F850 WeakPolarHBondContact O-CB 3.27Å; P846-F850 PolarHBondContact O-N 2.68Å
847	I	91.9	Very high	91.1	Very high	91 Å²	91	61.1 Å²	61.1	47%	0.467	30%	0.3	S	S	.	.	H	α-helix	trans	-64.4	-46.3	178.1	-68.2	175.1	0	0	0	110.6	L843 F845 F849 F850 V851	L843-I847 HydrophobicContact CD2-CD1 3.58Å; L843-I847 HydrophobicContact CG-CD1 3.75Å; L843-I847 WeakPolarHBondContact O-CB 3.22Å; L843-I847 WeakPolarHBondContact O-CD1 3.47Å; L843-I847 VanDerWaalsContact O-CG1 3.27Å; L843-I847 WeakPolarHBondContact O-CG1 2.97Å; L843-I847 PolarHBondContact O-N 2.88Å; F845-I847 VanDerWaalsContact C-N 3.35Å; F845-I847 PolarHBondContact O-N 3.43Å; I847-F849 VanDerWaalsContact C-N 3.33Å; I847-F849 PolarHBondContact O-N 2.84Å; I847-F850 PolarHBondContact O-N 2.74Å; I847-V851 HydrophobicContact CG2-CG2 4.45Å; I847-V851 WeakPolarHBondContact O-CG2 3.32Å; I847-V851 PolarHBondContact O-N 2.99Å
848	S	93	Very high	91.3	Very high	32 Å²	32	64.6 Å²	64.6	22%	0.224	31%	0.314	C	S	.	.	H	α-helix	trans	-65	-35.4	179.4	55.1	0	0	0	0	112.8	I844 F845 F852	I844-S848 WeakPolarHBondContact O-CB 3.14Å; I844-S848 PolarHBondContact O-N 3.34Å; I844-S848 PolarHBondContact O-OG 2.93Å; F845-S848 PolarHBondContact O-N 3.03Å; F845-S848 PolarHBondContact O-OG 3.15Å; S848-F852 PolarHBondContact O-N 3.09Å; S848-F852 VanDerWaalsContact O-N 3.12Å
849	F	94.4	Very high	91.3	Very high	4 Å²	4	70.1 Å²	70.1	2%	0.018	34%	0.338	C	S	.	.	H	α-helix	trans	-69.5	-41.3	172.3	-172.7	-118.6	0	0	0	112.5	V413 V416 M417 F474 F845 P846 I847 V851 F852 L853	V413-F849 HydrophobicContact CG1-CE1 4.3Å; V413-F849 HydrophobicContact CG2-CE1 4.4Å; V413-F849 HydrophobicContact CG2-CZ 4.18Å; V416-F849 HydrophobicContact CB-CE1 4.11Å; V416-F849 HydrophobicContact CB-CE2 4.18Å; V416-F849 HydrophobicContact CB-CZ 3.87Å; V416-F849 HydrophobicContact CG1-CD1 3.94Å; V416-F849 HydrophobicContact CG1-CD2 3.82Å; V416-F849 HydrophobicContact CG1-CE1 3.91Å; V416-F849 HydrophobicContact CG1-CE2 3.81Å; V416-F849 HydrophobicContact CG1-CG 3.89Å; V416-F849 HydrophobicContact CG1-CZ 3.85Å; V416-F849 HydrophobicContact CG2-CE2 4.15Å; V416-F849 HydrophobicContact CG2-CZ 4.14Å; M417-F849 HydrophobicContact SD-CD1 4.41Å; M417-F849 HydrophobicContact SD-CE1 4.43Å; F474-F849 HydrophobicContact CD1-CB 4.47Å; F474-F849 AromaticContact CD2-CD2 3.75Å; F474-F849 HydrophobicContact CD2-CD2 3.75Å; F474-F849 HydrophobicContact CD2-CE2 4.34Å; F474-F849 HydrophobicContact CE1-CB 4.11Å; F474-F849 AromaticContact CE2-CD2 3.75Å; F474-F849 HydrophobicContact CE2-CD2 3.75Å; F474-F849 HydrophobicContact CG-CD2 4.2Å; F474-F849 HydrophobicContact CZ-CB 4.16Å; F474-F849 HydrophobicContact CZ-CD2 4.2Å; F845-F849 PolarHBondContact O-N 3.05Å; P846-F849 PolarHBondContact O-N 3.46Å; I847-F849 VanDerWaalsContact C-N 3.33Å; I847-F849 PolarHBondContact O-N 2.84Å; F849-V851 PolarHBondContact O-N 3.24Å; F849-F852 HydrophobicContact CD2-CD1 4.01Å; F849-F852 AromaticContact CE2-CD1 3.92Å; F849-F852 HydrophobicContact CE2-CD1 3.92Å; F849-F852 HydrophobicContact CE2-CE1 4.28Å; F849-F852 WeakPolarHBondContact O-CB 3.34Å; F849-F852 PolarHBondContact O-N 2.72Å; F849-F852 VanDerWaalsContact O-N 3.16Å; F849-L853 HydrophobicContact CD1-CD1 3.94Å; F849-L853 HydrophobicContact CD1-CG 4.32Å; F849-L853 HydrophobicContact CE1-CD1 3.73Å; F849-L853 HydrophobicContact CE1-CD2 4.18Å; F849-L853 HydrophobicContact CE1-CG 4.08Å; F849-L853 HydrophobicContact CE2-CD2 4.43Å; F849-L853 HydrophobicContact CZ-CD1 4.32Å; F849-L853 HydrophobicContact CZ-CD2 3.93Å; F849-L853 HydrophobicContact CZ-CG 4.2Å; F849-L853 WeakPolarHBondContact O-CG 3.39Å; F849-L853 PolarHBondContact O-N 3.39Å
850	F	93.1	Very high	91.1	Very high	145 Å²	145	70.4 Å²	70.4	64%	0.636	33%	0.33	S	S	*	.	H	α-helix	trans	-62.9	-40.8	176.7	-173.4	-94.7	0	0	0	112.6	P846 I847 F852 L853 F854	P846-F850 WeakPolarHBondContact O-CB 3.27Å; P846-F850 PolarHBondContact O-N 2.68Å; I847-F850 PolarHBondContact O-N 2.74Å; F850-F852 VanDerWaalsContact C-N 3.34Å; F850-L853 PolarHBondContact O-N 2.9Å; F850-F854 PolarHBondContact O-N 2.66Å
851	V	93.9	Very high	91	Very high	74 Å²	74	68.2 Å²	68.2	45%	0.448	33%	0.329	S	S	.	.	H	α-helix	trans	-62.1	-41.5	172.7	170	0	0	0	0	111.2	I847 F849 F854 I855	I847-V851 HydrophobicContact CG2-CG2 4.45Å; I847-V851 WeakPolarHBondContact O-CG2 3.32Å; I847-V851 PolarHBondContact O-N 2.99Å; F849-V851 PolarHBondContact O-N 3.24Å; V851-F854 PolarHBondContact O-N 2.93Å; V851-I855 HydrophobicContact CG1-CD1 3.73Å; V851-I855 HydrophobicContact CG1-CG1 4.49Å; V851-I855 VanDerWaalsContact O-CG1 3.29Å; V851-I855 WeakPolarHBondContact O-CG1 3.01Å; V851-I855 PolarHBondContact O-N 3.37Å
852	F	93.9	Very high	90.7	Very high	32 Å²	32	71.2 Å²	71.2	14%	0.14	34%	0.343	C	S	.	.	H	α-helix	trans	-61.3	-46.1	173.3	165.1	-107.6	0	0	0	112.3	W467 V470 F474 S848 F849 F850 F854 I855 Y856	W467-F852 AromaticContact CE3-CE1 3.76Å; W467-F852 HydrophobicContact CE3-CE1 3.76Å; W467-F852 AromaticContact CE3-CZ 3.72Å; W467-F852 HydrophobicContact CE3-CZ 3.72Å; W467-F852 HydrophobicContact CH2-CE1 4.48Å; W467-F852 AromaticContact CZ3-CE1 3.74Å; W467-F852 HydrophobicContact CZ3-CE1 3.74Å; W467-F852 HydrophobicContact CZ3-CZ 4.12Å; V470-F852 HydrophobicContact CB-CE1 4.25Å; V470-F852 HydrophobicContact CB-CE2 3.9Å; V470-F852 HydrophobicContact CB-CZ 3.74Å; V470-F852 HydrophobicContact CG1-CD1 3.88Å; V470-F852 HydrophobicContact CG1-CD2 3.72Å; V470-F852 HydrophobicContact CG1-CE1 3.75Å; V470-F852 HydrophobicContact CG1-CE2 3.58Å; V470-F852 HydrophobicContact CG1-CG 3.86Å; V470-F852 HydrophobicContact CG1-CZ 3.59Å; V470-F852 HydrophobicContact CG2-CE2 4.01Å; V470-F852 HydrophobicContact CG2-CZ 4.3Å; F474-F852 HydrophobicContact CE2-CB 4.25Å; F474-F852 HydrophobicContact CE2-CD1 4.29Å; F474-F852 HydrophobicContact CE2-CG 4.33Å; F474-F852 HydrophobicContact CZ-CB 4.46Å; S848-F852 PolarHBondContact O-N 3.09Å; S848-F852 VanDerWaalsContact O-N 3.12Å; F849-F852 HydrophobicContact CD2-CD1 4.01Å; F849-F852 AromaticContact CE2-CD1 3.92Å; F849-F852 HydrophobicContact CE2-CD1 3.92Å; F849-F852 HydrophobicContact CE2-CE1 4.28Å; F849-F852 WeakPolarHBondContact O-CB 3.34Å; F849-F852 PolarHBondContact O-N 2.72Å; F849-F852 VanDerWaalsContact O-N 3.16Å; F850-F852 VanDerWaalsContact C-N 3.34Å; F852-F854 VanDerWaalsContact C-N 3.33Å; F852-F854 PolarHBondContact O-N 3.12Å; F852-I855 PolarHBondContact O-N 3.29Å; F852-Y856 HydrophobicContact CE2-CD2 4.21Å; F852-Y856 HydrophobicContact CZ-CD2 4.11Å; F852-Y856 HydrophobicContact CZ-CG 4.38Å; F852-Y856 WeakPolarHBondContact O-CB 3.18Å; F852-Y856 PolarHBondContact O-N 2.98Å
853	L	94.2	Very high	90	Very high	29 Å²	29	69.7 Å²	69.7	15%	0.152	34%	0.338	C	S	.	.	H	α-helix	trans	-56.5	-48	176.3	-68.4	172.2	0	0	0	111	V413 W467 F849 F850 Y856 W857	V413-L853 HydrophobicContact CG2-CD2 3.96Å; W467-L853 HydrophobicContact CH2-CD2 3.41Å; W467-L853 VanDerWaalsContact CH2-CD2 3.41Å; W467-L853 HydrophobicContact CZ3-CD2 3.82Å; F849-L853 HydrophobicContact CD1-CD1 3.94Å; F849-L853 HydrophobicContact CD1-CG 4.32Å; F849-L853 HydrophobicContact CE1-CD1 3.73Å; F849-L853 HydrophobicContact CE1-CD2 4.18Å; F849-L853 HydrophobicContact CE1-CG 4.08Å; F849-L853 HydrophobicContact CE2-CD2 4.43Å; F849-L853 HydrophobicContact CZ-CD1 4.32Å; F849-L853 HydrophobicContact CZ-CD2 3.93Å; F849-L853 HydrophobicContact CZ-CG 4.2Å; F849-L853 WeakPolarHBondContact O-CG 3.39Å; F849-L853 PolarHBondContact O-N 3.39Å; F850-L853 PolarHBondContact O-N 2.9Å; L853-Y856 PolarHBondContact O-N 3.21Å; L853-W857 WeakPolarHBondContact O-CB 3.08Å; L853-W857 PolarHBondContact O-N 3.11Å
854	F	92.6	Very high	89.1	Confident	141 Å²	141	65.7 Å²	65.7	62%	0.618	32%	0.321	S	S	*	.	H	α-helix	trans	-60.3	-47.6	178.8	-174.5	-94.5	0	0	0	112	F850 V851 F852 Y856 F858	F850-F854 PolarHBondContact O-N 2.66Å; V851-F854 PolarHBondContact O-N 2.93Å; F852-F854 VanDerWaalsContact C-N 3.33Å; F852-F854 PolarHBondContact O-N 3.12Å; F854-Y856 PolarHBondContact O-N 2.85Å; F854-F858 WeakPolarHBondContact O-CB 3.48Å; F854-F858 PolarHBondContact O-N 3.46Å
855	I	92.2	Very high	88.2	Confident	103 Å²	103	72.2 Å²	72.2	53%	0.528	35%	0.348	S	S	.	.	H	α-helix	trans	-62.7	-43.2	178.9	-68	167	0	0	0	111.3	V851 F852 F859	V851-I855 HydrophobicContact CG1-CD1 3.73Å; V851-I855 HydrophobicContact CG1-CG1 4.49Å; V851-I855 VanDerWaalsContact O-CG1 3.29Å; V851-I855 WeakPolarHBondContact O-CG1 3.01Å; V851-I855 PolarHBondContact O-N 3.37Å; F852-I855 PolarHBondContact O-N 3.29Å; I855-F859 WeakPolarHBondContact O-CB 3.44Å; I855-F859 PolarHBondContact O-N 2.8Å
856	Y	91.9	Very high	86.5	Confident	22 Å²	22	76.8 Å²	76.8	9%	0.086	37%	0.373	C	S	.	.	H	α-helix	trans	-64.7	-48.8	-179.4	-173.5	-90.6	0	0	0	111.8	M326 Y409 W467 F852 L853 F854 F859 Y860	M326-Y856 HydrophobicContact CE-CE1 3.92Å; Y409-Y856 HydrophobicContact CD1-CE1 4.49Å; Y409-Y856 AromaticContact CE1-CE1 3.6Å; Y409-Y856 HydrophobicContact CE1-CE1 3.6Å; Y409-Y856 AromaticContact CE1-CZ 3.97Å; Y409-Y856 PolarHBondContact OH-OH 3.24Å; W467-Y856 HydrophobicContact CB-CE2 3.94Å; W467-Y856 HydrophobicContact CD2-CE1 4.41Å; W467-Y856 AromaticContact CE3-CD1 3.57Å; W467-Y856 HydrophobicContact CE3-CD1 3.57Å; W467-Y856 AromaticContact CE3-CD2 3.93Å; W467-Y856 HydrophobicContact CE3-CD2 3.93Å; W467-Y856 AromaticContact CE3-CE1 3.62Å; W467-Y856 HydrophobicContact CE3-CE1 3.62Å; W467-Y856 AromaticContact CE3-CE2 3.97Å; W467-Y856 HydrophobicContact CE3-CE2 3.97Å; W467-Y856 AromaticContact CE3-CG 3.73Å; W467-Y856 HydrophobicContact CE3-CG 3.73Å; W467-Y856 AromaticContact CE3-CZ 3.83Å; W467-Y856 AromaticContact CZ3-CD1 3.69Å; W467-Y856 HydrophobicContact CZ3-CD1 3.69Å; W467-Y856 HydrophobicContact CZ3-CE1 4.1Å; W467-Y856 AromaticContact CZ3-CG 3.98Å; W467-Y856 HydrophobicContact CZ3-CG 3.98Å; F852-Y856 HydrophobicContact CE2-CD2 4.21Å; F852-Y856 HydrophobicContact CZ-CD2 4.11Å; F852-Y856 HydrophobicContact CZ-CG 4.38Å; F852-Y856 WeakPolarHBondContact O-CB 3.18Å; F852-Y856 PolarHBondContact O-N 2.98Å; L853-Y856 PolarHBondContact O-N 3.21Å; F854-Y856 PolarHBondContact O-N 2.85Å; Y856-F859 PolarHBondContact O-N 3.32Å; Y856-Y860 PolarHBondContact O-N 3Å
857	W	90	Very high	86.3	Confident	70 Å²	70	78.9 Å²	78.9	27%	0.265	38%	0.38	S	S	.	.	H	α-helix	trans	-71.8	-30.8	179.3	-72.7	112.1	0	0	0	112.9	M326 I405 Y409 L853 Y860 L861	M326-W857 HydrophobicContact CE-CH2 4.46Å; M326-W857 HydrophobicContact CE-CZ3 4.02Å; I405-W857 HydrophobicContact CD1-CH2 4.42Å; I405-W857 HydrophobicContact CG1-CH2 4.18Å; Y409-W857 HydrophobicContact CD1-CH2 4.34Å; Y409-W857 AromaticContact CD1-CZ2 3.91Å; Y409-W857 HydrophobicContact CD1-CZ2 3.91Å; Y409-W857 HydrophobicContact CE1-CZ2 4.41Å; Y409-W857 HydrophobicContact CG-CH2 4.34Å; Y409-W857 HydrophobicContact CG-CZ2 4.09Å; L853-W857 WeakPolarHBondContact O-CB 3.08Å; L853-W857 PolarHBondContact O-N 3.11Å; W857-Y860 AromaticContact CE3-CD1 3.52Å; W857-Y860 HydrophobicContact CE3-CD1 3.52Å; W857-Y860 HydrophobicContact CE3-CE1 4.22Å; W857-Y860 HydrophobicContact CE3-CG 4.06Å; W857-Y860 AromaticContact CZ3-CD1 3.67Å; W857-Y860 HydrophobicContact CZ3-CD1 3.67Å; W857-Y860 AromaticContact CZ3-CE1 3.99Å; W857-Y860 HydrophobicContact CZ3-CE1 3.99Å; W857-Y860 HydrophobicContact CZ3-CG 4.18Å; W857-Y860 WeakPolarHBondContact O-CB 3.26Å; W857-Y860 PolarHBondContact O-N 3.2Å; W857-L861 WeakPolarHBondContact O-CG 3.29Å; W857-L861 PolarHBondContact O-N 3.43Å
858	F	90.2	Very high	86	Confident	117 Å²	117	78.2 Å²	78.2	51%	0.513	38%	0.376	S	S	.	.	H	α-helix	trans	-62.9	-44.4	170	179.2	-104.2	0	0	0	111.6	F854 Y860 L861 I862	F854-F858 WeakPolarHBondContact O-CB 3.48Å; F854-F858 PolarHBondContact O-N 3.46Å; F858-Y860 VanDerWaalsContact C-N 3.33Å; F858-Y860 PolarHBondContact O-N 3.01Å; F858-L861 PolarHBondContact O-N 2.62Å; F858-I862 HydrophobicContact CD1-CD1 3.93Å; F858-I862 HydrophobicContact CE1-CD1 3.45Å; F858-I862 VanDerWaalsContact CE1-CD1 3.45Å; F858-I862 HydrophobicContact CE2-CD1 4.5Å; F858-I862 HydrophobicContact CZ-CD1 3.78Å; F858-I862 PolarHBondContact O-N 3.28Å; F858-I862 VanDerWaalsContact O-N 3.13Å
859	F	87	Confident	85.6	Confident	117 Å²	117	80.8 Å²	80.8	51%	0.513	38%	0.384	S	S	.	.	H	α-helix	trans	-63.1	-39	174.4	-173.7	-111.7	0	0	0	112	I855 Y856 I862 L863	I855-F859 WeakPolarHBondContact O-CB 3.44Å; I855-F859 PolarHBondContact O-N 2.8Å; Y856-F859 PolarHBondContact O-N 3.32Å; F859-I862 PolarHBondContact O-N 3.12Å; F859-L863 HydrophobicContact CD1-CD1 3.88Å; F859-L863 HydrophobicContact CD1-CG 4.13Å; F859-L863 HydrophobicContact CE1-CD1 3.35Å; F859-L863 HydrophobicContact CE1-CD2 4.33Å; F859-L863 HydrophobicContact CE1-CG 3.83Å; F859-L863 HydrophobicContact CE2-CD2 4.17Å; F859-L863 HydrophobicContact CE2-CG 4.28Å; F859-L863 HydrophobicContact CZ-CD1 3.77Å; F859-L863 HydrophobicContact CZ-CD2 3.9Å; F859-L863 HydrophobicContact CZ-CG 3.9Å; F859-L863 WeakPolarHBondContact O-CB 3.36Å; F859-L863 WeakPolarHBondContact O-CG 3.4Å; F859-L863 PolarHBondContact O-N 3.33Å
860	Y	82.9	Confident	85.1	Confident	47 Å²	47	85.3 Å²	85.3	18%	0.184	41%	0.406	C	S	.	.	H	α-helix	trans	-58.2	-48.6	170.9	166.5	-117.1	0	0	0	112.6	M326 I401 Y856 W857 F858 I862 L863 A864	M326-Y860 HydrophobicContact CB-CD2 3.88Å; M326-Y860 HydrophobicContact CB-CE2 3.84Å; M326-Y860 HydrophobicContact CE-CD1 4.48Å; M326-Y860 HydrophobicContact CE-CD2 3.49Å; M326-Y860 VanDerWaalsContact CE-CD2 3.49Å; M326-Y860 HydrophobicContact CE-CE2 4.13Å; M326-Y860 HydrophobicContact CE-CG 3.64Å; M326-Y860 HydrophobicContact CG-CD2 3.38Å; M326-Y860 HydrophobicContact CG-CE2 3.46Å; M326-Y860 VanDerWaalsContact CG-CE2 3.46Å; M326-Y860 HydrophobicContact CG-CG 4.45Å; M326-Y860 HydrophobicContact SD-CD2 3.3Å; M326-Y860 WeakPolarHBondContact SD-CD2 3.41Å; M326-Y860 HydrophobicContact SD-CE2 4.04Å; M326-Y860 HydrophobicContact SD-CG 3.94Å; I401-Y860 HydrophobicContact CD1-CE2 4Å; Y856-Y860 PolarHBondContact O-N 3Å; W857-Y860 AromaticContact CE3-CD1 3.52Å; W857-Y860 HydrophobicContact CE3-CD1 3.52Å; W857-Y860 HydrophobicContact CE3-CE1 4.22Å; W857-Y860 HydrophobicContact CE3-CG 4.06Å; W857-Y860 AromaticContact CZ3-CD1 3.67Å; W857-Y860 HydrophobicContact CZ3-CD1 3.67Å; W857-Y860 AromaticContact CZ3-CE1 3.99Å; W857-Y860 HydrophobicContact CZ3-CE1 3.99Å; W857-Y860 HydrophobicContact CZ3-CG 4.18Å; W857-Y860 WeakPolarHBondContact O-CB 3.26Å; W857-Y860 PolarHBondContact O-N 3.2Å; F858-Y860 VanDerWaalsContact C-N 3.33Å; F858-Y860 PolarHBondContact O-N 3.01Å; Y860-I862 PolarHBondContact O-N 3.07Å; Y860-L863 CarbonylContact O-C 3.6Å; Y860-L863 PolarHBondContact O-N 3.23Å; Y860-L863 VanDerWaalsContact O-N 3.08Å; Y860-A864 HydrophobicContact CD2-CB 4.11Å; Y860-A864 HydrophobicContact CE2-CB 3.76Å; Y860-A864 VanDerWaalsContact O-CB 3.23Å; Y860-A864 WeakPolarHBondContact O-CB 3.47Å; Y860-A864 PolarHBondContact O-N 3.41Å
861	L	85	Confident	84.6	Confident	116 Å²	116	81.6 Å²	81.6	61%	0.607	39%	0.391	S	S	*	.	H	α-helix	trans	-60.9	-34.4	-179.1	-71.4	172.7	0	0	0	112.4	W857 F858 K865	W857-L861 WeakPolarHBondContact O-CG 3.29Å; W857-L861 PolarHBondContact O-N 3.43Å; F858-L861 PolarHBondContact O-N 2.62Å; L861-K865 PolarHBondContact O-N 2.9Å
862	I	84.8	Confident	84	Confident	81 Å²	81	82.1 Å²	82.1	42%	0.415	39%	0.387	S	S	.	.	H	α-helix	trans	-65.7	-54.5	170	-66.4	169.4	0	0	0	110.1	F858 F859 Y860 A864 K865	F858-I862 HydrophobicContact CD1-CD1 3.93Å; F858-I862 HydrophobicContact CE1-CD1 3.45Å; F858-I862 VanDerWaalsContact CE1-CD1 3.45Å; F858-I862 HydrophobicContact CE2-CD1 4.5Å; F858-I862 HydrophobicContact CZ-CD1 3.78Å; F858-I862 PolarHBondContact O-N 3.28Å; F858-I862 VanDerWaalsContact O-N 3.13Å; F859-I862 PolarHBondContact O-N 3.12Å; Y860-I862 PolarHBondContact O-N 3.07Å; I862-A864 PolarHBondContact O-N 3.45Å; I862-A864 VanDerWaalsContact O-N 3.17Å; I862-K865 WeakPolarHBondContact O-CB 3.36Å; I862-K865 PolarHBondContact O-N 3.15Å; I862-K865 VanDerWaalsContact O-N 3.1Å
863	L	76.5	Confident	83.3	Confident	24 Å²	24	85.6 Å²	85.6	13%	0.126	41%	0.405	C	S	.	.	H	α-helix	trans	-63.8	-21.4	-177	-72	-163.3	0	0	0	115	K323 F859 Y860	K323-L863 HydrophobicContact CD-CB 4.46Å; K323-L863 HydrophobicContact CD-CD1 4.11Å; K323-L863 HydrophobicContact CG-CD1 4.1Å; K323-L863 PolarHBondContact NZ-O 3.03Å; F859-L863 HydrophobicContact CD1-CD1 3.88Å; F859-L863 HydrophobicContact CD1-CG 4.13Å; F859-L863 HydrophobicContact CE1-CD1 3.35Å; F859-L863 HydrophobicContact CE1-CD2 4.33Å; F859-L863 HydrophobicContact CE1-CG 3.83Å; F859-L863 HydrophobicContact CE2-CD2 4.17Å; F859-L863 HydrophobicContact CE2-CG 4.28Å; F859-L863 HydrophobicContact CZ-CD1 3.77Å; F859-L863 HydrophobicContact CZ-CD2 3.9Å; F859-L863 HydrophobicContact CZ-CG 3.9Å; F859-L863 WeakPolarHBondContact O-CB 3.36Å; F859-L863 WeakPolarHBondContact O-CG 3.4Å; F859-L863 PolarHBondContact O-N 3.33Å; Y860-L863 CarbonylContact O-C 3.6Å; Y860-L863 PolarHBondContact O-N 3.23Å; Y860-L863 VanDerWaalsContact O-N 3.08Å
864	A	71	Confident	82.4	Confident	27 Å²	27	90 Å²	90	22%	0.223	42%	0.424	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.7	-11.3	179.1	0	0	0	0	0	113.5	R398 Y860 I862	R398-A864 PolarHBondContact NH2-O 3.23Å; Y860-A864 HydrophobicContact CD2-CB 4.11Å; Y860-A864 HydrophobicContact CE2-CB 3.76Å; Y860-A864 VanDerWaalsContact O-CB 3.23Å; Y860-A864 WeakPolarHBondContact O-CB 3.47Å; Y860-A864 PolarHBondContact O-N 3.41Å; I862-A864 PolarHBondContact O-N 3.45Å; I862-A864 VanDerWaalsContact O-N 3.17Å
865	K	70.7	Confident	81.6	Confident	193 Å²	193	85.8 Å²	85.8	84%	0.839	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.3	-31.9	170	-170.6	177.6	178.5	-177.9	0	111.4	L861 I862	L861-K865 PolarHBondContact O-N 2.9Å; I862-K865 WeakPolarHBondContact O-CB 3.36Å; I862-K865 PolarHBondContact O-N 3.15Å; I862-K865 VanDerWaalsContact O-N 3.1Å
866	D	56.6	Low	80.6	Confident	112 Å²	112	84.2 Å²	84.2	60%	0.599	40%	0.397	S	S	*	.			trans	-63.4	0	165.2	-53.1	-25.7	0	0	0	111.9	K323 K328	K323-D866 IonicContact NZ-OD2 3.84Å; K323-D866 PolarHBondContact NZ-OD2 3.24Å; K328-D866 WeakPolarHBondContact CE-OXT 3.35Å; K328-D866 PolarHBondContact NZ-O 3.32Å; K328-D866 PolarHBondContact NZ-OXT 2.91Å

Retrieved 866 of 866 residues in 233.7 ms (Link to these results)

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