A0A3Q0KK43_SCHMA Loading...

Notch

AlphaFold DB , UniProt , Accession A0A3Q0KK43, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,215 aa.

						>A0A3Q0KK43_SCHMA|A0A3Q0KK43
MNIEIIPFIIHLFIIIVILFNGLYLCDEWKHVNNQLSMPYNPCQPNPCQNSAECVNIQDWSRTTSLEKFNTLSDYYCVCLKGWTGQNCTEDIDDCVIHPCLNGGICENKPNMRFFCHCPTGYVGQTCEYRDPCQLNPCLNGGTCHSDPFGQFTCICPQWYNGVRCEQEINPCYPTSPCLGEKSVCHLLTSKNRTVSGPSFSIHKSEYIVDFLCECDPNYFGRYCDKKRNSCKFHNCKNGATCLQNKEHFVCLCPLGFTGPICSTPTNTTEYLYPNVNTLIRNQSMKTNVFRKNSTENIKLLYDHCYQLGCNKAKTGDNICQAKCIYAKCLNVEDELEKDCQYWVKCLQTTEHIVNYYNKTTCVEQFKNGKCQPECNRNECYMDGFDCLQNISQCVSFEFCLQSYGDGVCQSQCNTIQCGYDGGDCEYEQRNNSLSIKYILLHLKTNQSEFKLNRNHYLGNLGIILQSIVRIAKDDITQELLLEDILNKNQIKVLLEVTSQSNNSCKTTEGNMCTSDSVQLLKPNELKIYILAALSTIQYKSLFSIINLNFVDSPSQSHFKAPWEVESSNDTRISKEAIGLYVCICILAGIIIILILFLVFQYDNNWRKPLKRVKTKGIWCPPVLSIYSKPSQVDLLGQQSSVYFTGLKSAVGVTEPPLTTMTINESKYFDNKLKQTPSASSFFQEYLNSSTANEKDTFLLSNVSKYNHEEMIAGLLSDKIPRTDISLNDDFSPSCKKKRLTQDKLTSDMIPNNANLFTVPKYLGNLFSEETGSFQHFGEEEKHKQDECKFDLKNRYDSLLPQESSKITNNESLNLDSTYGKKANIKIMGSDNKEVFKIISSLDGLHPCNVTQKSRIEQVIDDNKCQNKGVEMLSNKAGTEDYLDDNLSKNIVGDQSLLHLAAHMNVGHDIINKICHNEPNQRPLGTLYVDSFGRTALTSAAAANSLESVKSLYQLEKEALLNKKPVKSVKSHQITTPKPTCRSRRRYQVCESRQCSPIIVAIQAGNDEVVKCLLDEGCPYNTVDQYGRNVVHWAAVTNSVKILAYLAQCKGFARLMNMKDDWDRTPIMLAIREGCQEAVEFLLDKQAKVEIIDCMENDCLSLCTEKGYKKIHEILINYIRSRNSDTKSITRDKKVNIFKENADVSKQELGLSSMLQSAPSMAPVTTAMTTTPVRHSAENICRMNEFDWVSLSDDQVSEDYSDCDPFIEDMTEDFN
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	40.4	Very low	66.5	Low	232 Å²	232	126 Å²	126	100%	1.143	63%	0.63	S	S	*	*				0	145.7	0	-68.5	177.7	-78	0	0	107.9
2	N	43.3	Very low	67.6	Low	111 Å²	111	124.3 Å²	124.3	59%	0.594	62%	0.624	S	S	*	*			trans	16.5	96.7	-177.2	-63.7	22	0	0	0	117.4	E4 I5	N2-E4 PolarHBondContact O-N 3.02Å; N2-I5 HydrophobicContact CB-CD1 3.94Å; N2-I5 HydrophobicContact CB-CG1 4.06Å; N2-I5 PolarHBondContact O-N 2.92Å
3	I	54.1	Low	68.2	Low	143 Å²	143	123.7 Å²	123.7	73%	0.733	62%	0.615	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58	-27.4	174.7	-68.6	169	0	0	0	111.9	I5 I6	I3-I5 PolarHBondContact O-N 2.75Å; I3-I5 VanDerWaalsContact O-N 3.1Å; I3-I6 HydrophobicContact CG2-CD1 4.34Å; I3-I6 WeakPolarHBondContact O-CB 3.23Å; I3-I6 WeakPolarHBondContact O-CG1 3.29Å; I3-I6 PolarHBondContact O-N 3.2Å; I3-I6 VanDerWaalsContact O-N 3.11Å
4	E	60.8	Low	69	Low	162 Å²	162	120.6 Å²	120.6	76%	0.757	60%	0.601	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.8	-14	177.4	-59.6	-179.4	146.6	0	0	114.7	N2 P7	N2-E4 PolarHBondContact O-N 3.02Å; E4-P7 WeakPolarHBondContact O-CD 3.36Å
5	I	72.4	Confident	69.5	Low	92 Å²	92	118.1 Å²	118.1	47%	0.472	59%	0.589	S	S	.	*	H	α-helix	trans	-78.3	-23.1	176.9	-58.6	175.9	0	0	0	111.3	N2 I3 F8 I9	N2-I5 HydrophobicContact CB-CD1 3.94Å; N2-I5 HydrophobicContact CB-CG1 4.06Å; N2-I5 PolarHBondContact O-N 2.92Å; I3-I5 PolarHBondContact O-N 2.75Å; I3-I5 VanDerWaalsContact O-N 3.1Å; I5-F8 WeakPolarHBondContact O-CB 3.41Å; I5-F8 PolarHBondContact O-N 2.94Å; I5-F8 VanDerWaalsContact O-N 3.14Å; I5-I9 HydrophobicContact CG2-CD1 3.75Å; I5-I9 HydrophobicContact CG2-CG1 3.96Å; I5-I9 PolarHBondContact O-N 3.35Å
6	I	73.2	Confident	69.8	Low	95 Å²	95	115.6 Å²	115.6	49%	0.487	58%	0.577	S	S	.	*	H	α-helix	trans	-60.8	-47.1	-174.8	-60.9	172.2	0	0	0	112.7	I3 F8 I9 I10	I3-I6 HydrophobicContact CG2-CD1 4.34Å; I3-I6 WeakPolarHBondContact O-CB 3.23Å; I3-I6 WeakPolarHBondContact O-CG1 3.29Å; I3-I6 PolarHBondContact O-N 3.2Å; I3-I6 VanDerWaalsContact O-N 3.11Å; I6-F8 VanDerWaalsContact C-N 3.27Å; I6-F8 PolarHBondContact O-N 3.15Å; I6-I9 PolarHBondContact O-N 3.2Å; I6-I10 HydrophobicContact CG2-CD1 3.82Å; I6-I10 HydrophobicContact CG2-CG1 4.48Å; I6-I10 WeakPolarHBondContact O-CG1 3.46Å; I6-I10 PolarHBondContact O-N 3.49Å
7	P	74.7	Confident	70.2	Confident	76 Å²	76	112.4 Å²	112.4	49%	0.494	57%	0.565	S	S	.	*	H	α-helix	trans	-61.6	-34.1	175.6	-22.5	34.5	0	0	0	113.1	E4 I10 H11	E4-P7 WeakPolarHBondContact O-CD 3.36Å; P7-I10 PolarHBondContact O-N 3.45Å; P7-H11 WeakPolarHBondContact O-CB 3.43Å; P7-H11 PolarHBondContact O-N 3.36Å
8	F	76.9	Confident	70.3	Confident	164 Å²	164	112.2 Å²	112.2	72%	0.719	57%	0.565	S	S	*	*	H	α-helix	trans	-69.3	-42.6	177.8	-117.7	-82.4	0	0	0	111.9	I5 I6 H11 L12	I5-F8 WeakPolarHBondContact O-CB 3.41Å; I5-F8 PolarHBondContact O-N 2.94Å; I5-F8 VanDerWaalsContact O-N 3.14Å; I6-F8 VanDerWaalsContact C-N 3.27Å; I6-F8 PolarHBondContact O-N 3.15Å; F8-H11 PolarHBondContact O-N 3.43Å; F8-L12 WeakPolarHBondContact O-CB 3.45Å; F8-L12 PolarHBondContact O-N 3.24Å
9	I	78	Confident	70	Confident	102 Å²	102	112.1 Å²	112.1	52%	0.523	57%	0.565	S	S	.	*	H	α-helix	trans	-61.2	-45.7	172.8	-69.6	171.1	0	0	0	110.1	I5 I6 L12 F13	I5-I9 HydrophobicContact CG2-CD1 3.75Å; I5-I9 HydrophobicContact CG2-CG1 3.96Å; I5-I9 PolarHBondContact O-N 3.35Å; I6-I9 PolarHBondContact O-N 3.2Å; I9-L12 PolarHBondContact O-N 3.14Å; I9-F13 WeakPolarHBondContact O-CB 3.24Å; I9-F13 PolarHBondContact O-N 3.41Å
10	I	80.3	Confident	69.4	Low	89 Å²	89	113.2 Å²	113.2	46%	0.456	57%	0.566	S	S	.	*	H	α-helix	trans	-62.5	-45.2	178.7	-68.6	168.8	0	0	0	111.1	I6 P7 F13 I14	I6-I10 HydrophobicContact CG2-CD1 3.82Å; I6-I10 HydrophobicContact CG2-CG1 4.48Å; I6-I10 WeakPolarHBondContact O-CG1 3.46Å; I6-I10 PolarHBondContact O-N 3.49Å; P7-I10 PolarHBondContact O-N 3.45Å; I10-F13 PolarHBondContact O-N 2.75Å; I10-I14 HydrophobicContact CG2-CD1 3.74Å; I10-I14 HydrophobicContact CG2-CG1 4.44Å; I10-I14 WeakPolarHBondContact O-CB 3.11Å; I10-I14 VanDerWaalsContact O-CG1 3.28Å; I10-I14 WeakPolarHBondContact O-CG1 3.44Å; I10-I14 PolarHBondContact O-N 3.43Å
11	H	77.6	Confident	68.7	Low	120 Å²	120	112.4 Å²	112.4	56%	0.556	56%	0.564	S	S	*	*	H	α-helix	trans	-63.6	-41.6	176.3	-105.5	-71.4	0	0	0	112.6	P7 F8 F13 I14 I15	P7-H11 WeakPolarHBondContact O-CB 3.43Å; P7-H11 PolarHBondContact O-N 3.36Å; F8-H11 PolarHBondContact O-N 3.43Å; H11-F13 VanDerWaalsContact C-N 3.34Å; H11-I14 PolarHBondContact O-N 3.12Å; H11-I15 WeakPolarHBondContact O-CB 3.2Å; H11-I15 VanDerWaalsContact O-CG1 3.26Å; H11-I15 WeakPolarHBondContact O-CG1 3.22Å; H11-I15 PolarHBondContact O-N 3.27Å
12	L	79.4	Confident	69.2	Low	105 Å²	105	104.7 Å²	104.7	55%	0.55	54%	0.544	S	S	.	.	H	α-helix	trans	-63.9	-41.2	176.5	-163.7	74	0	0	0	111	F8 I9 I15 I16	F8-L12 WeakPolarHBondContact O-CB 3.45Å; F8-L12 PolarHBondContact O-N 3.24Å; I9-L12 PolarHBondContact O-N 3.14Å; L12-I15 PolarHBondContact O-N 2.71Å; L12-I16 HydrophobicContact CG-CD1 4.17Å; L12-I16 WeakPolarHBondContact O-CB 3.39Å; L12-I16 WeakPolarHBondContact O-CD1 3.42Å; L12-I16 VanDerWaalsContact O-CG1 3.25Å; L12-I16 WeakPolarHBondContact O-CG1 3.44Å; L12-I16 PolarHBondContact O-N 3.39Å
13	F	75.8	Confident	69.4	Low	117 Å²	117	106.1 Å²	106.1	51%	0.513	55%	0.551	S	S	.	*	H	α-helix	trans	-65.2	-41	176.1	-142	-84.8	0	0	0	111.8	I9 I10 H11 I16 V17 I592	I9-F13 WeakPolarHBondContact O-CB 3.24Å; I9-F13 PolarHBondContact O-N 3.41Å; I10-F13 PolarHBondContact O-N 2.75Å; H11-F13 VanDerWaalsContact C-N 3.34Å; F13-I16 PolarHBondContact O-N 2.9Å; F13-V17 HydrophobicContact CD1-CG2 3.89Å; F13-V17 HydrophobicContact CE1-CG2 4.11Å; F13-V17 WeakPolarHBondContact O-CB 3.24Å; F13-V17 WeakPolarHBondContact O-CG2 3.29Å; F13-V17 PolarHBondContact O-N 2.96Å; F13-I592 HydrophobicContact CZ-CD1 4.48Å
14	I	78.9	Confident	68.7	Low	81 Å²	81	109.1 Å²	109.1	42%	0.415	55%	0.554	S	S	.	*	H	α-helix	trans	-63.8	-42.5	174.2	-71.8	168.2	0	0	0	110.9	I10 H11 V17 I18	I10-I14 HydrophobicContact CG2-CD1 3.74Å; I10-I14 HydrophobicContact CG2-CG1 4.44Å; I10-I14 WeakPolarHBondContact O-CB 3.11Å; I10-I14 VanDerWaalsContact O-CG1 3.28Å; I10-I14 WeakPolarHBondContact O-CG1 3.44Å; I10-I14 PolarHBondContact O-N 3.43Å; H11-I14 PolarHBondContact O-N 3.12Å; I14-V17 PolarHBondContact O-N 3.47Å; I14-I18 HydrophobicContact CG2-CD1 3.65Å; I14-I18 HydrophobicContact CG2-CG1 4.35Å; I14-I18 WeakPolarHBondContact O-CB 3.42Å; I14-I18 VanDerWaalsContact O-CG1 3.26Å; I14-I18 WeakPolarHBondContact O-CG1 3.38Å; I14-I18 PolarHBondContact O-N 3.2Å
15	I	76.4	Confident	67.5	Low	83 Å²	83	108.5 Å²	108.5	43%	0.426	56%	0.556	S	S	.	*	H	α-helix	trans	-63.8	-45.1	176.7	-71.8	164.3	0	0	0	110.7	H11 L12 I18 L19	H11-I15 WeakPolarHBondContact O-CB 3.2Å; H11-I15 VanDerWaalsContact O-CG1 3.26Å; H11-I15 WeakPolarHBondContact O-CG1 3.22Å; H11-I15 PolarHBondContact O-N 3.27Å; L12-I15 PolarHBondContact O-N 2.71Å; I15-I18 PolarHBondContact O-N 3.22Å; I15-L19 HydrophobicContact CG2-CD1 3.72Å; I15-L19 HydrophobicContact CG2-CG 4.33Å; I15-L19 WeakPolarHBondContact O-CB 3.5Å; I15-L19 VanDerWaalsContact O-CG 3.25Å; I15-L19 WeakPolarHBondContact O-CG 3.36Å; I15-L19 PolarHBondContact O-N 3.41Å
16	I	75.6	Confident	65.5	Low	78 Å²	78	110.3 Å²	110.3	40%	0.4	58%	0.575	S	S	.	*	H	α-helix	trans	-59.7	-48.7	174.6	-70.1	164.1	0	0	0	110.4	L12 F13 I18 L19 F20	L12-I16 HydrophobicContact CG-CD1 4.17Å; L12-I16 WeakPolarHBondContact O-CB 3.39Å; L12-I16 WeakPolarHBondContact O-CD1 3.42Å; L12-I16 VanDerWaalsContact O-CG1 3.25Å; L12-I16 WeakPolarHBondContact O-CG1 3.44Å; L12-I16 PolarHBondContact O-N 3.39Å; F13-I16 PolarHBondContact O-N 2.9Å; I16-I18 VanDerWaalsContact C-N 3.34Å; I16-I18 PolarHBondContact O-N 2.9Å; I16-L19 PolarHBondContact O-N 2.9Å; I16-F20 HydrophobicContact CG2-CD2 3.89Å; I16-F20 HydrophobicContact CG2-CE2 4.22Å; I16-F20 WeakPolarHBondContact O-CB 3.36Å; I16-F20 WeakPolarHBondContact O-CD2 3.43Å; I16-F20 PolarHBondContact O-N 2.82Å
17	V	75.5	Confident	63.6	Low	61 Å²	61	112.7 Å²	112.7	37%	0.37	59%	0.589	S	S	.	*	H	α-helix	trans	-63.7	-36.3	179.7	168.5	0	0	0	0	112.2	F13 I14 N21	F13-V17 HydrophobicContact CD1-CG2 3.89Å; F13-V17 HydrophobicContact CE1-CG2 4.11Å; F13-V17 WeakPolarHBondContact O-CB 3.24Å; F13-V17 WeakPolarHBondContact O-CG2 3.29Å; F13-V17 PolarHBondContact O-N 2.96Å; I14-V17 PolarHBondContact O-N 3.47Å; V17-N21 WeakPolarHBondContact CG1-ND2 3.48Å; V17-N21 WeakPolarHBondContact O-CB 2.9Å; V17-N21 VanDerWaalsContact O-CG 3.24Å; V17-N21 PolarHBondContact O-N 3.14Å; V17-N21 PolarHBondContact O-ND2 3.08Å
18	I	73	Confident	61.5	Low	108 Å²	108	116.9 Å²	116.9	55%	0.554	60%	0.601	S	S	*	*	H	α-helix	trans	-70.4	-44.8	175.1	-71.7	170.3	0	0	0	111.1	I14 I15 I16 G22	I14-I18 HydrophobicContact CG2-CD1 3.65Å; I14-I18 HydrophobicContact CG2-CG1 4.35Å; I14-I18 WeakPolarHBondContact O-CB 3.42Å; I14-I18 VanDerWaalsContact O-CG1 3.26Å; I14-I18 WeakPolarHBondContact O-CG1 3.38Å; I14-I18 PolarHBondContact O-N 3.2Å; I15-I18 PolarHBondContact O-N 3.22Å; I16-I18 VanDerWaalsContact C-N 3.34Å; I16-I18 PolarHBondContact O-N 2.9Å; I18-G22 PolarHBondContact O-N 2.97Å
19	L	64.4	Low	59.3	Low	111 Å²	111	120 Å²	120	58%	0.581	61%	0.609	S	S	*	*	H	α-helix	trans	-65	-39.2	179.5	-71.9	171.2	0	0	0	112.3	I15 I16	I15-L19 HydrophobicContact CG2-CD1 3.72Å; I15-L19 HydrophobicContact CG2-CG 4.33Å; I15-L19 WeakPolarHBondContact O-CB 3.5Å; I15-L19 VanDerWaalsContact O-CG 3.25Å; I15-L19 WeakPolarHBondContact O-CG 3.36Å; I15-L19 PolarHBondContact O-N 3.41Å; I16-L19 PolarHBondContact O-N 2.9Å
20	F	57.8	Low	57.2	Low	133 Å²	133	123.5 Å²	123.5	58%	0.583	62%	0.62	S	S	*	*	H	α-helix	trans	-77.9	-37.6	177.5	-84.6	-87.6	0	0	0	113.4	I16	I16-F20 HydrophobicContact CG2-CD2 3.89Å; I16-F20 HydrophobicContact CG2-CE2 4.22Å; I16-F20 WeakPolarHBondContact O-CB 3.36Å; I16-F20 WeakPolarHBondContact O-CD2 3.43Å; I16-F20 PolarHBondContact O-N 2.82Å
21	N	55.2	Low	55	Low	98 Å²	98	128.1 Å²	128.1	52%	0.524	64%	0.639	S	S	.	*	H	α-helix	trans	-73.8	-28.8	176.1	-72.9	-27.8	0	0	0	112.9	V17 L23 Y24	V17-N21 WeakPolarHBondContact CG1-ND2 3.48Å; V17-N21 WeakPolarHBondContact O-CB 2.9Å; V17-N21 VanDerWaalsContact O-CG 3.24Å; V17-N21 PolarHBondContact O-N 3.14Å; V17-N21 PolarHBondContact O-ND2 3.08Å; N21-L23 PolarHBondContact O-N 3.22Å; N21-L23 VanDerWaalsContact O-N 3.15Å; N21-Y24 PolarHBondContact O-N 3.33Å
22	G	50.4	Low	53	Low	69 Å²	69	127.8 Å²	127.8	71%	0.711	65%	0.646	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.9	-7.8	177.4	0	0	0	0	0	114.8	I18	I18-G22 PolarHBondContact O-N 2.97Å
23	L	48.4	Very low	50.8	Low	141 Å²	141	129.4 Å²	129.4	74%	0.738	66%	0.655	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.3	0.6	-178.3	-81	165.7	0	0	0	114.4	N21	N21-L23 PolarHBondContact O-N 3.22Å; N21-L23 VanDerWaalsContact O-N 3.15Å
24	Y	39.4	Very low	48.9	Very low	206 Å²	206	131.5 Å²	131.5	81%	0.808	67%	0.671	S	S	*	*	S	Bend	trans	-138.3	15.3	-166.8	-101	-72.3	0	0	0	117.1	N21	N21-Y24 PolarHBondContact O-N 3.33Å
25	L	35.4	Very low	46.6	Very low	150 Å²	150	136.8 Å²	136.8	79%	0.785	69%	0.694	S	S	*	*			trans	-136.9	86.6	179.2	-75	174.2	0	0	0	113.2
26	C	30	Very low	44.8	Very low	130 Å²	130	140.4 Å²	140.4	88%	0.878	71%	0.714	S	S	*	*			trans	-172.9	88.9	142.6	-107.5	0	0	0	0	110.3
27	D	31.9	Very low	43.1	Very low	145 Å²	145	142 Å²	142	78%	0.775	73%	0.732	S	S	*	*			trans	-154.8	150	142.4	-118.9	-31.2	0	0	0	111.7
28	E	31.3	Very low	41.2	Very low	163 Å²	163	147.4 Å²	147.4	76%	0.762	76%	0.755	S	S	*	*			trans	26.6	128.8	174.2	-54.9	-157.8	129.3	0	0	122.2
29	W	31.8	Very low	40.5	Very low	230 Å²	230	148.1 Å²	148.1	87%	0.871	77%	0.767	S	S	*	*				179.8	159.7	112.9	-110.1	58.8	0	0	0	114.1
30	K	33.9	Very low	40.6	Very low	176 Å²	176	151 Å²	151	77%	0.765	77%	0.771	S	S	*	*			trans	79.6	77.2	165.9	-65.3	179	-179	174.2	0	120.6
31	H	32.7	Very low	41.4	Very low	185 Å²	185	147.1 Å²	147.1	86%	0.856	76%	0.757	S	S	*	*				10.3	136.3	114.3	-82	-63.5	0	0	0	121.4
32	V	35.9	Very low	42.4	Very low	114 Å²	114	142.9 Å²	142.9	69%	0.691	73%	0.734	S	S	*	*				90.3	131	129.7	169.1	0	0	0	0	121.2
33	N	32.5	Very low	44.1	Very low	139 Å²	139	140.6 Å²	140.6	74%	0.743	71%	0.707	S	S	*	*			trans	63.1	101.3	162.8	-68.5	-9.4	0	0	0	120.7
34	N	35.8	Very low	45.6	Very low	161 Å²	161	140.6 Å²	140.6	86%	0.861	70%	0.703	S	S	*	*				-169	144.3	97.3	-97.5	-28.5	0	0	0	112.8
35	Q	31.4	Very low	47.4	Very low	192 Å²	192	136.6 Å²	136.6	90%	0.897	70%	0.703	S	S	*	*			trans	-85.6	123.6	169.1	-72	-179	-48.1	0	0	110.7
36	L	38.2	Very low	49.6	Very low	159 Å²	159	133.8 Å²	133.8	83%	0.832	69%	0.689	S	S	*	*			trans	-160.4	117.9	157.6	-113.9	132.3	0	0	0	110.2
37	S	39.9	Very low	52.3	Low	112 Å²	112	128.7 Å²	128.7	78%	0.783	65%	0.654	S	S	*	*			trans	13.9	104.1	169.2	57.5	0	0	0	0	118.1
38	M	35.8	Very low	55.1	Low	174 Å²	174	122.1 Å²	122.1	86%	0.857	62%	0.619	S	S	*	*	P	Polyproline II helix	trans	-73	146.1	167	-60.4	-158.2	-54.3	0	0	111.5
39	P	57.5	Low	57.7	Low	122 Å²	122	119 Å²	119	79%	0.792	61%	0.605	S	S	*	*	P	Polyproline II helix	trans	-72	155.3	175	31	-35.4	0	0	0	112.3
40	Y	67.9	Low	60	Low	171 Å²	171	110.6 Å²	110.6	67%	0.671	58%	0.577	S	S	*	*	P	Polyproline II helix	trans	-66	132.8	172.9	174.1	-105.3	0	0	0	111.1	P42	Y40-P42 HydrophobicContact CE1-CB 4.05Å
41	N	73.2	Confident	62.2	Low	53 Å²	53	107 Å²	107	28%	0.283	57%	0.574	S	S	.	*			trans	-120.6	113.5	176.1	179.5	-7	0	0	0	109.2	C43 Q44	N41-C43 PolarHBondContact O-N 3.27Å; N41-C43 WeakPolarHBondContact OD1-CB 2.94Å; N41-C43 PolarHBondContact OD1-N 2.84Å; N41-Q44 HydrophobicContact CB-CB 4.4Å; N41-Q44 HydrophobicContact CB-CG 4.49Å; N41-Q44 PolarHBondContact O-N 2.84Å
42	P	77.9	Confident	64.6	Low	9 Å²	9	98.4 Å²	98.4	6%	0.058	54%	0.535	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-10.4	-177.5	30.7	-37.1	0	0	0	114.1	Y40 N56 D74 Y75	Y40-P42 HydrophobicContact CE1-CB 4.05Å; P42-N56 HydrophobicContact CG-CB 4.11Å; P42-N56 VanDerWaalsContact CG-OD1 3.25Å; P42-N56 WeakPolarHBondContact CG-OD1 3.45Å; P42-D74 HydrophobicContact CB-CB 3.63Å; P42-D74 HydrophobicContact CG-CB 3.79Å; P42-D74 WeakPolarHBondContact CG-O 3.04Å; P42-Y75 HydrophobicContact CB-CD1 4.48Å
43	C	85.3	Confident	67	Low	21 Å²	21	98.5 Å²	98.5	14%	0.142	53%	0.527	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.8	9.7	169.8	-70.8	0	0	0	0	113.7	N41 P45 N46 C54 V55	N41-C43 PolarHBondContact O-N 3.27Å; N41-C43 WeakPolarHBondContact OD1-CB 2.94Å; N41-C43 PolarHBondContact OD1-N 2.84Å; C43-P45 CarbonylContact C-O 3.36Å; C43-P45 CarbonylContact O-C 3.59Å; C43-N46 WeakPolarHBondContact O-CA 2.96Å; C43-N46 PolarHBondContact O-N 3.05Å; C43-C54 WeakPolarHBondContact CA-SG 3.31Å; C43-C54 HydrophobicContact CB-CB 3.75Å; C43-C54 WeakPolarHBondContact CB-SG 3.43Å; C43-C54 WeakPolarHBondContact SG-CB 3.33Å; C43-C54 CovalentContact SG-SG 2.04Å; C43-C54 PolarHBondContact SG-SG 3.18Å; C43-V55 PolarHBondContact SG-N 3.04Å
44	Q	79.6	Confident	69.6	Low	140 Å²	140	93.1 Å²	93.1	65%	0.654	50%	0.5	S	S	*	.	S	Bend	trans	-125.8	114.4	172.2	-70.7	-168	-49.7	0	0	111.3	N41	N41-Q44 HydrophobicContact CB-CB 4.4Å; N41-Q44 HydrophobicContact CB-CG 4.49Å; N41-Q44 PolarHBondContact O-N 2.84Å
45	P	76.6	Confident	71.9	Confident	123 Å²	123	86.4 Å²	86.4	80%	0.799	47%	0.465	S	S	*	.	S	Bend	cis	-66	157.1	-4.5	30.7	-36.6	0	0	0	112.4	C43 P47	C43-P45 CarbonylContact C-O 3.36Å; C43-P45 CarbonylContact O-C 3.59Å; P45-P47 VanDerWaalsContact O-CD 3.24Å; P45-P47 WeakPolarHBondContact O-CD 3.43Å
46	N	82.9	Confident	74.1	Confident	91 Å²	91	78 Å²	78	49%	0.487	43%	0.427	S	S	.	.			trans	-65.6	116.7	-178.8	-179.5	10.6	0	0	0	111	C43 C48 C54	C43-N46 WeakPolarHBondContact O-CA 2.96Å; C43-N46 PolarHBondContact O-N 3.05Å; N46-C48 WeakPolarHBondContact OD1-CB 3.46Å; N46-C48 PolarHBondContact OD1-N 3.31Å; N46-C54 WeakPolarHBondContact OD1-CB 3.34Å
47	P	87.3	Confident	75.7	Confident	23 Å²	23	74 Å²	74	15%	0.149	41%	0.405	C	S	.	.			trans	-79.1	-19	178.7	32	-34.3	0	0	0	113.5	P45 C54 Y75 N87	P45-P47 VanDerWaalsContact O-CD 3.24Å; P45-P47 WeakPolarHBondContact O-CD 3.43Å; P47-C54 VanDerWaalsContact CD-SG 3.52Å; P47-Y75 HydrophobicContact CB-CD2 4.27Å; P47-Y75 HydrophobicContact CB-CE1 3.99Å; P47-Y75 HydrophobicContact CB-CE2 3.64Å; P47-Y75 VanDerWaalsContact CB-CZ 3.48Å; P47-Y75 HydrophobicContact CG-CD1 3.93Å; P47-Y75 HydrophobicContact CG-CD2 3.43Å; P47-Y75 VanDerWaalsContact CG-CD2 3.43Å; P47-Y75 HydrophobicContact CG-CE1 3.82Å; P47-Y75 HydrophobicContact CG-CE2 3.33Å; P47-Y75 HydrophobicContact CG-CG 3.76Å; P47-N87 PolarHBondContact O-ND2 3.45Å
48	C	89.4	Confident	76.9	Confident	7 Å²	7	74 Å²	74	5%	0.047	39%	0.393	C	S	.	.			trans	-83.6	129.8	-170.4	-54.3	0	0	0	0	112.2	N46 A52 C54 C77	N46-C48 WeakPolarHBondContact OD1-CB 3.46Å; N46-C48 PolarHBondContact OD1-N 3.31Å; C48-A52 HydrophobicContact CB-CB 4.01Å; C48-A52 WeakPolarHBondContact CB-O 3.29Å; C48-C54 HydrophobicContact CB-CB 4.35Å; C48-C54 WeakPolarHBondContact SG-CA 3.39Å; C48-C54 WeakPolarHBondContact SG-CB 3.45Å; C48-C77 WeakPolarHBondContact CA-SG 3.4Å; C48-C77 HydrophobicContact CB-CB 3.75Å; C48-C77 WeakPolarHBondContact CB-SG 3.4Å; C48-C77 VanDerWaalsContact SG-CA 3.5Å; C48-C77 WeakPolarHBondContact SG-CB 3.28Å; C48-C77 CovalentContact SG-SG 2.02Å; C48-C77 PolarHBondContact SG-SG 2.88Å
49	Q	85.8	Confident	78	Confident	98 Å²	98	71.3 Å²	71.3	46%	0.458	38%	0.382	S	S	.	.			trans	-96	176	-178.4	-60.1	-55.8	-46.3	0	0	112.2	S51 A52 N87 T89	Q49-S51 PolarHBondContact O-N 3.27Å; Q49-S51 VanDerWaalsContact O-N 3.1Å; Q49-A52 VanDerWaalsContact O-CB 3.22Å; Q49-A52 WeakPolarHBondContact O-CB 3.2Å; Q49-A52 PolarHBondContact O-N 3.18Å; Q49-N87 WeakPolarHBondContact CB-O 3.36Å; Q49-N87 PolarHBondContact N-O 2.83Å; Q49-T89 HydrophobicContact CB-CG2 3.87Å; Q49-T89 HydrophobicContact CG-CG2 3.68Å
50	N	80.3	Confident	77.6	Confident	53 Å²	53	71.4 Å²	71.4	28%	0.283	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.8	35.6	174.1	-64.1	-52.7	0	0	0	114.9	A52 L80 W83 C88	N50-A52 PolarHBondContact O-N 3.49Å; N50-L80 WeakPolarHBondContact O-CD1 3.28Å; N50-W83 HydrophobicContact CB-CD2 3.91Å; N50-W83 HydrophobicContact CB-CG 4.05Å; N50-W83 HydrophobicContact CB-CZ2 4.23Å; N50-W83 VanDerWaalsContact CG-CZ2 3.44Å; N50-W83 WeakPolarHBondContact ND2-CH2 3.45Å; N50-W83 WeakPolarHBondContact ND2-CZ3 3.34Å; N50-W83 WeakPolarHBondContact OD1-CZ2 2.95Å; N50-C88 PolarHBondContact ND2-O 3.48Å
51	S	79.9	Confident	76.4	Confident	101 Å²	101	67.9 Å²	67.9	71%	0.706	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.8	22.6	-176.9	-46.7	0	0	0	0	115.1	Q49	Q49-S51 PolarHBondContact O-N 3.27Å; Q49-S51 VanDerWaalsContact O-N 3.1Å
52	A	83	Confident	75	Confident	4 Å²	4	76.7 Å²	76.7	3%	0.033	40%	0.396	C	S	.	.	P	Polyproline II helix	trans	-67.8	144	170.3	0	0	0	0	0	112.1	C48 Q49 N50 C77 V78 C88	C48-A52 HydrophobicContact CB-CB 4.01Å; C48-A52 WeakPolarHBondContact CB-O 3.29Å; Q49-A52 VanDerWaalsContact O-CB 3.22Å; Q49-A52 WeakPolarHBondContact O-CB 3.2Å; Q49-A52 PolarHBondContact O-N 3.18Å; N50-A52 PolarHBondContact O-N 3.49Å; A52-C77 HydrophobicContact CB-CB 4.45Å; A52-V78 WeakPolarHBondContact CA-O 3.22Å; A52-V78 WeakPolarHBondContact CB-O 3.21Å; A52-C88 HydrophobicContact CB-CB 3.68Å; A52-C88 WeakPolarHBondContact CB-SG 3.23Å
53	E	86.8	Confident	73.3	Confident	115 Å²	115	80.7 Å²	80.7	54%	0.537	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	124.2	178.8	-175.4	-178.4	-163.7	0	0	110	V55 C77 V78	E53-V55 HydrophobicContact CG-CG2 4.23Å; E53-C77 CarbonylContact O-C 3.56Å; E53-C77 WeakPolarHBondContact O-CA 3.16Å; E53-V78 HydrophobicContact CB-CB 4.13Å; E53-V78 HydrophobicContact CB-CG2 4.43Å; E53-V78 PolarHBondContact N-O 3.22Å; E53-V78 PolarHBondContact O-N 3.12Å
54	C	87.1	Confident	71.1	Confident	26 Å²	26	85.2 Å²	85.2	18%	0.176	45%	0.448	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	129.9	171.1	-173	0	0	0	0	110.5	C43 N46 P47 C48	C43-C54 WeakPolarHBondContact CA-SG 3.31Å; C43-C54 HydrophobicContact CB-CB 3.75Å; C43-C54 WeakPolarHBondContact CB-SG 3.43Å; C43-C54 WeakPolarHBondContact SG-CB 3.33Å; C43-C54 CovalentContact SG-SG 2.04Å; C43-C54 PolarHBondContact SG-SG 3.18Å; N46-C54 WeakPolarHBondContact OD1-CB 3.34Å; P47-C54 VanDerWaalsContact CD-SG 3.52Å; C48-C54 HydrophobicContact CB-CB 4.35Å; C48-C54 WeakPolarHBondContact SG-CA 3.39Å; C48-C54 WeakPolarHBondContact SG-CB 3.45Å
55	V	83.7	Confident	69.4	Low	21 Å²	21	83.7 Å²	83.7	13%	0.127	45%	0.453	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	118.6	-179.9	-175.6	0	0	0	0	109.7	C43 E53 I57 W60 Y75 Y76 V78	C43-V55 PolarHBondContact SG-N 3.04Å; E53-V55 HydrophobicContact CG-CG2 4.23Å; V55-I57 PolarHBondContact O-N 3Å; V55-W60 HydrophobicContact CG1-CE3 3.48Å; V55-W60 VanDerWaalsContact CG1-CE3 3.48Å; V55-W60 HydrophobicContact CG1-CZ3 3.8Å; V55-Y75 WeakPolarHBondContact O-CA 3.21Å; V55-Y76 HydrophobicContact CB-CD1 3.98Å; V55-Y76 HydrophobicContact CB-CE1 3.53Å; V55-Y76 HydrophobicContact CG1-CD1 4.31Å; V55-Y76 HydrophobicContact CG1-CE1 3.59Å; V55-Y76 HydrophobicContact CG2-CE1 4.2Å; V55-Y76 PolarHBondContact N-O 3.29Å; V55-Y76 PolarHBondContact O-N 3.16Å; V55-V78 HydrophobicContact CG2-CG2 3.95Å
56	N	78.8	Confident	67.4	Low	15 Å²	15	86 Å²	86	8%	0.08	46%	0.457	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	123.4	173.1	176.4	11.5	0	0	0	109.9	P42 Q58 D59 W60	P42-N56 HydrophobicContact CG-CB 4.11Å; P42-N56 VanDerWaalsContact CG-OD1 3.25Å; P42-N56 WeakPolarHBondContact CG-OD1 3.45Å; N56-Q58 PolarHBondContact O-N 3.39Å; N56-Q58 WeakPolarHBondContact OD1-CB 3.28Å; N56-Q58 PolarHBondContact OD1-N 2.79Å; N56-D59 HydrophobicContact CB-CB 4.28Å; N56-D59 WeakPolarHBondContact CB-OD2 3.48Å; N56-D59 PolarHBondContact ND2-OD2 2.02Å; N56-D59 PolarHBondContact O-N 3.31Å; N56-D59 VanDerWaalsContact O-N 3.14Å; N56-W60 PolarHBondContact O-N 3.41Å
57	I	70.7	Confident	65.3	Low	74 Å²	74	90.5 Å²	90.5	38%	0.379	48%	0.475	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67	-24.8	-178.9	-64.2	172.7	0	0	0	111	V55 W60 S61 S73 D74 Y76	V55-I57 PolarHBondContact O-N 3Å; I57-W60 WeakPolarHBondContact O-CB 3.44Å; I57-W60 PolarHBondContact O-N 3.25Å; I57-S61 PolarHBondContact O-OG 3.26Å; I57-S61 VanDerWaalsContact O-OG 3.13Å; I57-S73 WeakPolarHBondContact CD1-O 3.41Å; I57-D74 WeakPolarHBondContact CB-O 3.32Å; I57-D74 PolarHBondContact N-O 3.38Å; I57-Y76 HydrophobicContact CG1-CD1 4.3Å
58	Q	65.6	Low	63	Low	113 Å²	113	98.7 Å²	98.7	53%	0.528	51%	0.509	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-34.8	175.4	-53.4	-171.6	11.5	0	0	112	N56 S61	N56-Q58 PolarHBondContact O-N 3.39Å; N56-Q58 WeakPolarHBondContact OD1-CB 3.28Å; N56-Q58 PolarHBondContact OD1-N 2.79Å; Q58-S61 VanDerWaalsContact O-CB 3.23Å; Q58-S61 WeakPolarHBondContact O-CB 3.02Å; Q58-S61 PolarHBondContact O-N 3.31Å; Q58-S61 PolarHBondContact O-OG 3.03Å
59	D	58.1	Low	60.7	Low	118 Å²	118	107.5 Å²	107.5	63%	0.631	55%	0.546	S	S	*	.	G	3₁₀ helix	trans	-74.3	-28.3	174.2	-71.9	-55.5	0	0	0	112.4	N56 S61	N56-D59 HydrophobicContact CB-CB 4.28Å; N56-D59 WeakPolarHBondContact CB-OD2 3.48Å; N56-D59 PolarHBondContact ND2-OD2 2.02Å; N56-D59 PolarHBondContact O-N 3.31Å; N56-D59 VanDerWaalsContact O-N 3.14Å; D59-S61 PolarHBondContact O-N 3.05Å
60	W	49.4	Very low	58.4	Low	123 Å²	123	111 Å²	111	47%	0.466	57%	0.568	S	S	.	*	G	3₁₀ helix	trans	-63.3	-17.6	171.7	-155.1	-92	0	0	0	113.5	V55 N56 I57 R62 T63 Y76	V55-W60 HydrophobicContact CG1-CE3 3.48Å; V55-W60 VanDerWaalsContact CG1-CE3 3.48Å; V55-W60 HydrophobicContact CG1-CZ3 3.8Å; N56-W60 PolarHBondContact O-N 3.41Å; I57-W60 WeakPolarHBondContact O-CB 3.44Å; I57-W60 PolarHBondContact O-N 3.25Å; W60-R62 PolarHBondContact O-N 2.78Å; W60-T63 PolarHBondContact O-N 2.75Å; W60-Y76 HydrophobicContact CE3-CE1 4.19Å; W60-Y76 VanDerWaalsContact CH2-OH 3.23Å; W60-Y76 WeakPolarHBondContact CH2-OH 3.48Å; W60-Y76 HydrophobicContact CZ3-CE1 4.22Å; W60-Y76 WeakPolarHBondContact CZ3-OH 3.21Å
61	S	42.6	Very low	56.6	Low	97 Å²	97	113 Å²	113	68%	0.678	58%	0.583	S	S	*	*	G	3₁₀ helix	trans	-70.1	14.5	-170.6	-63.4	0	0	0	0	115.8	I57 Q58 D59	I57-S61 PolarHBondContact O-OG 3.26Å; I57-S61 VanDerWaalsContact O-OG 3.13Å; Q58-S61 VanDerWaalsContact O-CB 3.23Å; Q58-S61 WeakPolarHBondContact O-CB 3.02Å; Q58-S61 PolarHBondContact O-N 3.31Å; Q58-S61 PolarHBondContact O-OG 3.03Å; D59-S61 PolarHBondContact O-N 3.05Å
62	R	44.4	Very low	55.5	Low	239 Å²	239	117.4 Å²	117.4	90%	0.902	60%	0.597	S	S	*	*	G	3₁₀ helix	trans	-109.9	-7.5	171.7	-61.7	-170.2	-170.6	177.7	8.4	114.5	W60	W60-R62 PolarHBondContact O-N 2.78Å
63	T	41	Very low	54.5	Low	92 Å²	92	118.6 Å²	118.6	56%	0.564	61%	0.605	S	S	*	*	S	Bend	trans	-137.8	119.9	-177.9	29	0	0	0	0	112.7	W60	W60-T63 PolarHBondContact O-N 2.75Å
64	T	40.2	Very low	54.1	Low	117 Å²	117	116.9 Å²	116.9	72%	0.718	60%	0.6	S	S	*	*	S	Bend	trans	57.7	89.6	166.9	48.9	0	0	0	0	117.9
65	S	43.5	Very low	53.9	Low	108 Å²	108	117.8 Å²	117.8	76%	0.755	60%	0.6	S	S	*	*			trans	33.3	103.8	131.3	57.1	0	0	0	0	119.1
66	L	35.9	Very low	54	Low	171 Å²	171	120.6 Å²	120.6	90%	0.895	61%	0.609	S	S	*	*			trans	-4.4	125.7	136.8	-68.3	159.2	0	0	0	116.1
67	E	37.4	Very low	54.4	Low	186 Å²	186	120.6 Å²	120.6	87%	0.869	61%	0.61	S	S	*	*				-160.7	155	94.2	-105.1	179.9	-152.3	0	0	111.5
68	K	38.5	Very low	55.2	Low	195 Å²	195	118.9 Å²	118.9	85%	0.848	60%	0.603	S	S	*	*			trans	68.1	64	159	-157.6	-175.8	-175.7	177.4	0	118.6
69	F	41.8	Very low	56	Low	191 Å²	191	115.6 Å²	115.6	84%	0.838	59%	0.591	S	S	*	*			trans	-137.6	130.6	136	-106.5	-80.3	0	0	0	110	T71	F69-T71 HydrophobicContact CD1-CG2 4.28Å
70	N	37.3	Very low	56.9	Low	172 Å²	172	114.3 Å²	114.3	92%	0.92	58%	0.584	S	S	*	*			trans	-121.9	70.2	-174.4	-157.6	25.8	0	0	0	108.6
71	T	43.7	Very low	58	Low	96 Å²	96	116.8 Å²	116.8	59%	0.589	60%	0.598	S	S	*	*			trans	-136.9	141.1	-173.4	39.7	0	0	0	0	109.9	F69 S73	F69-T71 HydrophobicContact CD1-CG2 4.28Å; T71-S73 VanDerWaalsContact C-N 3.26Å; T71-S73 PolarHBondContact O-N 2.91Å
72	L	55.7	Low	59.4	Low	193 Å²	193	112.6 Å²	112.6	100%	1.01	57%	0.57	S	S	*	*	S	Bend	trans	-82.8	48.7	-158.7	-152.8	81.4	0	0	0	114.1
73	S	62.3	Low	61.1	Low	29 Å²	29	102.9 Å²	102.9	20%	0.203	53%	0.534	C	S	.	.			trans	-137.5	135.4	-171	-165.6	0	0	0	0	112.1	I57 T71 Y75 Q86	I57-S73 WeakPolarHBondContact CD1-O 3.41Å; T71-S73 VanDerWaalsContact C-N 3.26Å; T71-S73 PolarHBondContact O-N 2.91Å; S73-Y75 VanDerWaalsContact C-N 3.34Å; S73-Y75 WeakPolarHBondContact OG-CD1 3.26Å; S73-Y75 VanDerWaalsContact OG-CE1 3.28Å; S73-Y75 WeakPolarHBondContact OG-CE1 3.24Å; S73-Y75 PolarHBondContact OG-O 3.31Å; S73-Q86 PolarHBondContact OG-NE2 2.79Å
74	D	77.7	Confident	63	Low	78 Å²	78	101.7 Å²	101.7	42%	0.417	53%	0.526	S	S	.	.	S	Bend	trans	-86.1	-0.6	179.7	-65.7	-69.5	0	0	0	113.9	P42 I57	P42-D74 HydrophobicContact CB-CB 3.63Å; P42-D74 HydrophobicContact CG-CB 3.79Å; P42-D74 WeakPolarHBondContact CG-O 3.04Å; I57-D74 WeakPolarHBondContact CB-O 3.32Å; I57-D74 PolarHBondContact N-O 3.38Å
75	Y	83.1	Confident	65	Low	45 Å²	45	97 Å²	97	18%	0.176	50%	0.502	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	164.6	177.8	69.5	-92.5	0	0	0	111.5	P42 P47 V55 S73 N87	P42-Y75 HydrophobicContact CB-CD1 4.48Å; P47-Y75 HydrophobicContact CB-CD2 4.27Å; P47-Y75 HydrophobicContact CB-CE1 3.99Å; P47-Y75 HydrophobicContact CB-CE2 3.64Å; P47-Y75 VanDerWaalsContact CB-CZ 3.48Å; P47-Y75 HydrophobicContact CG-CD1 3.93Å; P47-Y75 HydrophobicContact CG-CD2 3.43Å; P47-Y75 VanDerWaalsContact CG-CD2 3.43Å; P47-Y75 HydrophobicContact CG-CE1 3.82Å; P47-Y75 HydrophobicContact CG-CE2 3.33Å; P47-Y75 HydrophobicContact CG-CG 3.76Å; V55-Y75 WeakPolarHBondContact O-CA 3.21Å; S73-Y75 VanDerWaalsContact C-N 3.34Å; S73-Y75 WeakPolarHBondContact OG-CD1 3.26Å; S73-Y75 VanDerWaalsContact OG-CE1 3.28Å; S73-Y75 WeakPolarHBondContact OG-CE1 3.24Å; S73-Y75 PolarHBondContact OG-O 3.31Å; Y75-N87 PolarHBondContact OH-OD1 3.37Å
76	Y	85.4	Confident	66.9	Low	81 Å²	81	97.5 Å²	97.5	32%	0.318	49%	0.492	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	160.1	158.8	85	-87.5	0	0	0	110.7	V55 I57 W60 V78	V55-Y76 HydrophobicContact CB-CD1 3.98Å; V55-Y76 HydrophobicContact CB-CE1 3.53Å; V55-Y76 HydrophobicContact CG1-CD1 4.31Å; V55-Y76 HydrophobicContact CG1-CE1 3.59Å; V55-Y76 HydrophobicContact CG2-CE1 4.2Å; V55-Y76 PolarHBondContact N-O 3.29Å; V55-Y76 PolarHBondContact O-N 3.16Å; I57-Y76 HydrophobicContact CG1-CD1 4.3Å; W60-Y76 HydrophobicContact CE3-CE1 4.19Å; W60-Y76 VanDerWaalsContact CH2-OH 3.23Å; W60-Y76 WeakPolarHBondContact CH2-OH 3.48Å; W60-Y76 HydrophobicContact CZ3-CE1 4.22Å; W60-Y76 WeakPolarHBondContact CZ3-OH 3.21Å; Y76-V78 HydrophobicContact CE2-CG2 3.65Å
77	C	88.7	Confident	69.3	Low	14 Å²	14	91.5 Å²	91.5	10%	0.095	46%	0.461	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	134.5	-179.9	-58.7	0	0	0	0	111.9	C48 A52 E53 C79 Q86 C88	C48-C77 WeakPolarHBondContact CA-SG 3.4Å; C48-C77 HydrophobicContact CB-CB 3.75Å; C48-C77 WeakPolarHBondContact CB-SG 3.4Å; C48-C77 VanDerWaalsContact SG-CA 3.5Å; C48-C77 WeakPolarHBondContact SG-CB 3.28Å; C48-C77 CovalentContact SG-SG 2.02Å; C48-C77 PolarHBondContact SG-SG 2.88Å; A52-C77 HydrophobicContact CB-CB 4.45Å; E53-C77 CarbonylContact O-C 3.56Å; E53-C77 WeakPolarHBondContact O-CA 3.16Å; C77-C79 PolarHBondContact O-N 3.44Å; C77-Q86 WeakPolarHBondContact CB-O 3.25Å; C77-Q86 PolarHBondContact SG-O 3.07Å; C77-C88 WeakPolarHBondContact CB-SG 3.48Å
78	V	86.5	Confident	71.7	Confident	39 Å²	39	82.7 Å²	82.7	24%	0.236	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	98.9	170.1	-175.6	0	0	0	0	108.8	A52 E53 V55 Y76	A52-V78 WeakPolarHBondContact CA-O 3.22Å; A52-V78 WeakPolarHBondContact CB-O 3.21Å; E53-V78 HydrophobicContact CB-CB 4.13Å; E53-V78 HydrophobicContact CB-CG2 4.43Å; E53-V78 PolarHBondContact N-O 3.22Å; E53-V78 PolarHBondContact O-N 3.12Å; V55-V78 HydrophobicContact CG2-CG2 3.95Å; Y76-V78 HydrophobicContact CE2-CG2 3.65Å
79	C	83.8	Confident	73.8	Confident	43 Å²	43	77.1 Å²	77.1	29%	0.291	40%	0.402	S	S	.	.			trans	-71.3	135.4	-176.8	-53.3	0	0	0	0	112.8	C77 W83 C88	C77-C79 PolarHBondContact O-N 3.44Å; C79-W83 HydrophobicContact CB-CB 4.24Å; C79-W83 WeakPolarHBondContact CB-O 3.49Å; C79-C88 WeakPolarHBondContact CA-SG 3.35Å; C79-C88 HydrophobicContact CB-CB 3.7Å; C79-C88 WeakPolarHBondContact CB-SG 3.48Å; C79-C88 PolarHBondContact N-SG 2.97Å; C79-C88 VanDerWaalsContact N-SG 3.42Å; C79-C88 WeakPolarHBondContact SG-CA 3.01Å; C79-C88 WeakPolarHBondContact SG-CB 3.25Å; C79-C88 CovalentContact SG-SG 2.04Å; C79-C88 PolarHBondContact SG-SG 3Å
80	L	76.9	Confident	75.7	Confident	91 Å²	91	73.2 Å²	73.2	48%	0.476	39%	0.387	S	S	.	.			trans	-65.3	149	169.8	-64.5	-175	0	0	0	110.8	N50 G82 W83	N50-L80 WeakPolarHBondContact O-CD1 3.28Å; L80-G82 PolarHBondContact O-N 3.41Å; L80-G82 VanDerWaalsContact O-N 3.07Å; L80-W83 PolarHBondContact O-N 2.99Å
81	K	72.5	Confident	77.4	Confident	176 Å²	176	67.8 Å²	67.8	77%	0.765	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.7	112.8	-177.9	-177.1	-179.2	178.4	-178.8	0	111.2
82	G	71	Confident	78.9	Confident	9 Å²	9	66.7 Å²	66.7	9%	0.093	35%	0.347	C	S	.	.	T	Hydrogen-bonded Turn	trans	122.8	-17.4	-172.5	0	0	0	0	0	113	L80 I92	L80-G82 PolarHBondContact O-N 3.41Å; L80-G82 VanDerWaalsContact O-N 3.07Å; G82-I92 WeakPolarHBondContact O-CB 3.11Å; G82-I92 WeakPolarHBondContact O-CG1 3.26Å; G82-I92 PolarHBondContact O-N 3.18Å
83	W	79.5	Confident	79.9	Confident	35 Å²	35	61.6 Å²	61.6	13%	0.133	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	150.3	-179	-64.9	99.8	0	0	0	113.3	N50 C79 L80 C88 E90 D91 P110 N111	N50-W83 HydrophobicContact CB-CD2 3.91Å; N50-W83 HydrophobicContact CB-CG 4.05Å; N50-W83 HydrophobicContact CB-CZ2 4.23Å; N50-W83 VanDerWaalsContact CG-CZ2 3.44Å; N50-W83 WeakPolarHBondContact ND2-CH2 3.45Å; N50-W83 WeakPolarHBondContact ND2-CZ3 3.34Å; N50-W83 WeakPolarHBondContact OD1-CZ2 2.95Å; C79-W83 HydrophobicContact CB-CB 4.24Å; C79-W83 WeakPolarHBondContact CB-O 3.49Å; L80-W83 PolarHBondContact O-N 2.99Å; W83-C88 HydrophobicContact CB-CB 4.34Å; W83-E90 CarbonylContact C-O 3.45Å; W83-E90 VanDerWaalsContact CA-O 3.3Å; W83-E90 WeakPolarHBondContact CA-O 3.4Å; W83-E90 VanDerWaalsContact CE3-C 3.5Å; W83-D91 HydrophobicContact CE3-CB 4.38Å; W83-D91 HydrophobicContact CH2-CB 4.31Å; W83-D91 HydrophobicContact CZ3-CB 3.96Å; W83-P110 HydrophobicContact CH2-CB 4.41Å; W83-P110 HydrophobicContact CZ2-CB 4.44Å; W83-N111 PolarHBondContact NE1-OD1 2.96Å
84	T	80.9	Confident	80.6	Confident	66 Å²	66	60.9 Å²	60.9	41%	0.405	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	-178.5	176.3	-177.6	0	0	0	0	111.2	C88 T89 E90 I92	T84-C88 CarbonylContact O-C 3.25Å; T84-C88 VanDerWaalsContact O-CA 3.28Å; T84-C88 WeakPolarHBondContact O-CA 2.99Å; T84-T89 PolarHBondContact O-N 3.05Å; T84-T89 VanDerWaalsContact O-N 3.09Å; T84-E90 HydrophobicContact CG2-CB 3.64Å; T84-E90 PolarHBondContact N-O 2.91Å; T84-E90 WeakPolarHBondContact O-CB 3.5Å; T84-E90 PolarHBondContact O-N 2.88Å; T84-I92 HydrophobicContact CG2-CD1 4.48Å; T84-I92 HydrophobicContact CG2-CG1 4.03Å
85	G	83	Confident	80.9	Confident	20 Å²	20	58.2 Å²	58.2	21%	0.206	30%	0.302	C	S	.	.	S	Bend	trans	87.6	161.1	-174.2	0	0	0	0	0	113.2	N87 C88	G85-N87 PolarHBondContact O-N 2.59Å; G85-N87 VanDerWaalsContact O-N 3.16Å; G85-C88 PolarHBondContact O-N 3.33Å
86	Q	83.2	Confident	80.8	Confident	118 Å²	118	60.8 Å²	60.8	55%	0.551	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.5	-37.8	-172.1	-176.7	178.1	-11.4	0	0	113.4	S73 C77	S73-Q86 PolarHBondContact OG-NE2 2.79Å; C77-Q86 WeakPolarHBondContact CB-O 3.25Å; C77-Q86 PolarHBondContact SG-O 3.07Å
87	N	87.3	Confident	80.6	Confident	45 Å²	45	62.8 Å²	62.8	24%	0.241	34%	0.337	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106.4	14.9	-179.8	-64.4	11.1	0	0	0	112.5	P47 Q49 Y75 G85 T89	P47-N87 PolarHBondContact O-ND2 3.45Å; Q49-N87 WeakPolarHBondContact CB-O 3.36Å; Q49-N87 PolarHBondContact N-O 2.83Å; Y75-N87 PolarHBondContact OH-OD1 3.37Å; G85-N87 PolarHBondContact O-N 2.59Å; G85-N87 VanDerWaalsContact O-N 3.16Å; N87-T89 HydrophobicContact CB-CG2 4.16Å
88	C	86.7	Confident	80.3	Confident	0 Å²	0	69.6 Å²	69.6	0%	0	37%	0.367	C	S	.	.	S	Bend	trans	59.6	42.5	-179	-51	0	0	0	0	114.3	N50 A52 C77 C79 W83 T84 G85	N50-C88 PolarHBondContact ND2-O 3.48Å; A52-C88 HydrophobicContact CB-CB 3.68Å; A52-C88 WeakPolarHBondContact CB-SG 3.23Å; C77-C88 WeakPolarHBondContact CB-SG 3.48Å; C79-C88 WeakPolarHBondContact CA-SG 3.35Å; C79-C88 HydrophobicContact CB-CB 3.7Å; C79-C88 WeakPolarHBondContact CB-SG 3.48Å; C79-C88 PolarHBondContact N-SG 2.97Å; C79-C88 VanDerWaalsContact N-SG 3.42Å; C79-C88 WeakPolarHBondContact SG-CA 3.01Å; C79-C88 WeakPolarHBondContact SG-CB 3.25Å; C79-C88 CovalentContact SG-SG 2.04Å; C79-C88 PolarHBondContact SG-SG 3Å; W83-C88 HydrophobicContact CB-CB 4.34Å; T84-C88 CarbonylContact O-C 3.25Å; T84-C88 VanDerWaalsContact O-CA 3.28Å; T84-C88 WeakPolarHBondContact O-CA 2.99Å; G85-C88 PolarHBondContact O-N 3.33Å
89	T	83.7	Confident	80.2	Confident	79 Å²	79	68.8 Å²	68.8	49%	0.485	36%	0.363	S	S	.	.			trans	-102.9	-8.8	-173.5	46.3	0	0	0	0	114.9	Q49 T84 N87	Q49-T89 HydrophobicContact CB-CG2 3.87Å; Q49-T89 HydrophobicContact CG-CG2 3.68Å; T84-T89 PolarHBondContact O-N 3.05Å; T84-T89 VanDerWaalsContact O-N 3.09Å; N87-T89 HydrophobicContact CB-CG2 4.16Å
90	E	80.5	Confident	80.6	Confident	109 Å²	109	67.9 Å²	67.9	51%	0.509	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	126.2	-176.2	-64.2	162.8	-165.4	0	0	110.2	W83 T84	W83-E90 CarbonylContact C-O 3.45Å; W83-E90 VanDerWaalsContact CA-O 3.3Å; W83-E90 WeakPolarHBondContact CA-O 3.4Å; W83-E90 VanDerWaalsContact CE3-C 3.5Å; T84-E90 HydrophobicContact CG2-CB 3.64Å; T84-E90 PolarHBondContact N-O 2.91Å; T84-E90 WeakPolarHBondContact O-CB 3.5Å; T84-E90 PolarHBondContact O-N 2.88Å
91	D	73.6	Confident	81.2	Confident	58 Å²	58	67.9 Å²	67.9	31%	0.31	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	148.9	178.7	-171.7	58.2	0	0	0	111.4	W83 N108 P110	W83-D91 HydrophobicContact CE3-CB 4.38Å; W83-D91 HydrophobicContact CH2-CB 4.31Å; W83-D91 HydrophobicContact CZ3-CB 3.96Å; D91-N108 PolarHBondContact OD2-ND2 3.24Å; D91-P110 HydrophobicContact CB-CB 4.45Å; D91-P110 WeakPolarHBondContact OD1-CA 3.41Å
92	I	75.7	Confident	82	Confident	72 Å²	72	63.3 Å²	63.3	37%	0.369	34%	0.341	S	S	.	.	P	Polyproline II helix	trans	-103.1	116.1	-179.6	-61.7	171.8	0	0	0	109.8	G82 T84 D94	G82-I92 WeakPolarHBondContact O-CB 3.11Å; G82-I92 WeakPolarHBondContact O-CG1 3.26Å; G82-I92 PolarHBondContact O-N 3.18Å; T84-I92 HydrophobicContact CG2-CD1 4.48Å; T84-I92 HydrophobicContact CG2-CG1 4.03Å; I92-D94 PolarHBondContact O-N 2.03Å; I92-D94 VanDerWaalsContact O-N 3.1Å
93	D	76.6	Confident	82.8	Confident	87 Å²	87	66 Å²	66	47%	0.465	37%	0.368	S	S	.	.			trans	-69.3	104	176.8	-173.6	-12.2	0	0	0	111.8	C95 V96 N108	D93-C95 WeakPolarHBondContact OD1-CB 3.29Å; D93-C95 PolarHBondContact OD1-N 3.14Å; D93-V96 HydrophobicContact CB-CG2 4.19Å; D93-N108 WeakPolarHBondContact CA-OD1 3.46Å
94	D	75.7	Confident	83.3	Confident	14 Å²	14	65 Å²	65	8%	0.075	37%	0.368	C	S	.	.			trans	-90	-1	179.1	-97.6	-66.7	0	0	0	113.3	I92 I97 N108 R113 F114	I92-D94 PolarHBondContact O-N 2.03Å; I92-D94 VanDerWaalsContact O-N 3.1Å; D94-I97 VanDerWaalsContact O-CG1 3.24Å; D94-I97 WeakPolarHBondContact O-CG1 3.46Å; D94-N108 PolarHBondContact N-OD1 2.93Å; D94-N108 VanDerWaalsContact N-OD1 3.12Å; D94-R113 HydrophobicContact CB-CB 3.84Å; D94-R113 VanDerWaalsContact CG-CZ 3.45Å; D94-R113 IonicContact OD1-CZ 3.87Å; D94-R113 IonicContact OD1-NE 3.9Å; D94-R113 IonicContact OD1-NH1 2.75Å; D94-R113 IonicContact OD1-NH2 3.34Å; D94-R113 PolarHBondContact OD1-NH2 3.44Å; D94-R113 WeakPolarHBondContact OD2-CB 3.19Å; D94-R113 IonicContact OD2-CZ 3.72Å; D94-R113 IonicContact OD2-NE 2.67Å; D94-R113 PolarHBondContact OD2-NE 2.99Å; D94-R113 IonicContact OD2-NH2 2.7Å; D94-R113 PolarHBondContact OD2-NH2 3.32Å; D94-F114 HydrophobicContact CB-CD1 4.27Å
95	C	84.2	Confident	83.7	Confident	21 Å²	21	67.5 Å²	67.5	14%	0.142	38%	0.378	C	S	.	.	S	Bend	trans	-81.1	-17.6	174.6	-84.5	0	0	0	0	113.8	D93 I97 H98 C106 E107 N108	D93-C95 WeakPolarHBondContact OD1-CB 3.29Å; D93-C95 PolarHBondContact OD1-N 3.14Å; C95-I97 PolarHBondContact O-N 2.8Å; C95-I97 VanDerWaalsContact O-N 3.09Å; C95-H98 PolarHBondContact O-N 3.21Å; C95-C106 WeakPolarHBondContact CA-SG 3.22Å; C95-C106 HydrophobicContact CB-CB 3.94Å; C95-C106 WeakPolarHBondContact CB-SG 3.04Å; C95-C106 WeakPolarHBondContact SG-CB 3.42Å; C95-C106 CovalentContact SG-SG 2.04Å; C95-C106 PolarHBondContact SG-SG 2.88Å; C95-E107 PolarHBondContact SG-N 2.83Å; C95-N108 HydrophobicContact CB-CB 4.46Å; C95-N108 PolarHBondContact SG-N 3.34Å
96	V	81.4	Confident	84	Confident	100 Å²	100	68.5 Å²	68.5	61%	0.606	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.4	-29.8	178.1	-175.8	0	0	0	0	112.4	D93 H98	D93-V96 HydrophobicContact CB-CG2 4.19Å; V96-H98 VanDerWaalsContact C-N 3.3Å; V96-H98 PolarHBondContact O-N 3.02Å; V96-H98 PolarHBondContact O-ND1 3.42Å
97	I	80.7	Confident	84.2	Confident	122 Å²	122	66.2 Å²	66.2	63%	0.626	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.7	4.3	177.9	59.5	164.8	0	0	0	114.8	D94 C95	D94-I97 VanDerWaalsContact O-CG1 3.24Å; D94-I97 WeakPolarHBondContact O-CG1 3.46Å; C95-I97 PolarHBondContact O-N 2.8Å; C95-I97 VanDerWaalsContact O-N 3.09Å
98	H	83.2	Confident	83.8	Confident	158 Å²	158	66.3 Å²	66.3	73%	0.731	37%	0.371	S	S	*	.			trans	50.6	58	177.6	-61.8	66.4	0	0	0	113.8	C95 V96 C100	C95-H98 PolarHBondContact O-N 3.21Å; V96-H98 VanDerWaalsContact C-N 3.3Å; V96-H98 PolarHBondContact O-N 3.02Å; V96-H98 PolarHBondContact O-ND1 3.42Å; H98-C100 VanDerWaalsContact C-N 3.29Å; H98-C100 PolarHBondContact O-N 3.31Å
99	P	85.2	Confident	83.1	Confident	22 Å²	22	67.5 Å²	67.5	14%	0.143	38%	0.376	C	S	.	.			trans	-72	-16.2	-170	30	-36.1	0	0	0	114.8	C106 F114 T126	P99-C106 VanDerWaalsContact CD-SG 3.56Å; P99-C106 VanDerWaalsContact CG-SG 3.55Å; P99-F114 HydrophobicContact CB-CD1 4.22Å; P99-F114 HydrophobicContact CB-CD2 4.12Å; P99-F114 HydrophobicContact CB-CE1 3.86Å; P99-F114 HydrophobicContact CB-CE2 3.77Å; P99-F114 HydrophobicContact CB-CG 4.35Å; P99-F114 HydrophobicContact CB-CZ 3.63Å; P99-F114 HydrophobicContact CG-CB 4.29Å; P99-F114 HydrophobicContact CG-CD1 3.81Å; P99-F114 HydrophobicContact CG-CD2 3.55Å; P99-F114 HydrophobicContact CG-CE1 3.97Å; P99-F114 HydrophobicContact CG-CE2 3.74Å; P99-F114 HydrophobicContact CG-CG 3.6Å; P99-F114 HydrophobicContact CG-CZ 3.95Å; P99-T126 HydrophobicContact CB-CG2 4.42Å; P99-T126 WeakPolarHBondContact O-CB 3.38Å; P99-T126 WeakPolarHBondContact O-CG2 3.48Å
100	C	90.4	Very high	82.2	Confident	23 Å²	23	65.3 Å²	65.3	16%	0.155	36%	0.363	C	S	.	.			trans	-84.5	130.3	-172.8	-50.7	0	0	0	0	112.8	H98 G104 C106 C116	H98-C100 VanDerWaalsContact C-N 3.29Å; H98-C100 PolarHBondContact O-N 3.31Å; C100-G104 WeakPolarHBondContact CB-O 3.23Å; C100-C106 WeakPolarHBondContact SG-CA 3.19Å; C100-C106 VanDerWaalsContact SG-CB 3.54Å; C100-C116 WeakPolarHBondContact CA-SG 3.19Å; C100-C116 HydrophobicContact CB-CB 3.79Å; C100-C116 WeakPolarHBondContact CB-SG 3.12Å; C100-C116 VanDerWaalsContact SG-CA 3.51Å; C100-C116 WeakPolarHBondContact SG-CB 3.31Å; C100-C116 CovalentContact SG-SG 2.03Å; C100-C116 PolarHBondContact SG-SG 3.36Å
101	L	90.1	Very high	81.2	Confident	91 Å²	91	65 Å²	65	48%	0.476	37%	0.366	S	S	.	.			trans	-97.7	174.7	178.7	-53	-177	0	0	0	111.5	G103 G104 T126 E128	L101-G103 PolarHBondContact O-N 3.44Å; L101-G104 PolarHBondContact O-N 2.99Å; L101-T126 WeakPolarHBondContact CA-O 3.41Å; L101-T126 WeakPolarHBondContact CB-O 3.49Å; L101-T126 PolarHBondContact N-O 2.04Å; L101-E128 HydrophobicContact CD1-CB 4.03Å
102	N	90.5	Very high	80.5	Confident	81 Å²	81	65.7 Å²	65.7	43%	0.433	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.6	20.5	172.4	-63.5	-42.2	0	0	0	116.1	P119 Y122 C127	N102-P119 VanDerWaalsContact O-CG 3.31Å; N102-P119 WeakPolarHBondContact O-CG 3.45Å; N102-Y122 HydrophobicContact CB-CD1 3.71Å; N102-Y122 HydrophobicContact CB-CD2 4.19Å; N102-Y122 HydrophobicContact CB-CE1 3.78Å; N102-Y122 HydrophobicContact CB-CE2 4.24Å; N102-Y122 HydrophobicContact CB-CG 3.92Å; N102-Y122 VanDerWaalsContact CG-CE1 3.48Å; N102-Y122 WeakPolarHBondContact ND2-CD1 3.47Å; N102-Y122 WeakPolarHBondContact ND2-CE1 3.16Å; N102-C127 PolarHBondContact ND2-O 2.76Å
103	G	87.5	Confident	80.2	Confident	65 Å²	65	66.9 Å²	66.9	67%	0.67	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	88.9	13.1	-177.8	0	0	0	0	0	114.8	L101	L101-G103 PolarHBondContact O-N 3.44Å
104	G	89.3	Confident	80.4	Confident	13 Å²	13	65 Å²	65	13%	0.134	36%	0.355	C	S	.	.	P	Polyproline II helix	trans	-65.7	142.4	173.5	0	0	0	0	0	113	C100 L101 H117	C100-G104 WeakPolarHBondContact CB-O 3.23Å; L101-G104 PolarHBondContact O-N 2.99Å; G104-H117 WeakPolarHBondContact CA-O 3.34Å
105	I	89.5	Confident	80.8	Confident	120 Å²	120	66 Å²	66	62%	0.615	36%	0.359	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.4	127.6	-179.6	-58.6	168.5	0	0	0	109.1	C116 H117	I105-C116 WeakPolarHBondContact O-CA 3.47Å; I105-H117 HydrophobicContact CB-CB 4.29Å; I105-H117 PolarHBondContact N-O 3.27Å; I105-H117 PolarHBondContact O-N 2.82Å
106	C	89.6	Confident	81.1	Confident	40 Å²	40	65.4 Å²	65.4	27%	0.27	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	134.3	178.2	-161.1	0	0	0	0	111.7	C95 P99 C100	C95-C106 WeakPolarHBondContact CA-SG 3.22Å; C95-C106 HydrophobicContact CB-CB 3.94Å; C95-C106 WeakPolarHBondContact CB-SG 3.04Å; C95-C106 WeakPolarHBondContact SG-CB 3.42Å; C95-C106 CovalentContact SG-SG 2.04Å; C95-C106 PolarHBondContact SG-SG 2.88Å; P99-C106 VanDerWaalsContact CD-SG 3.56Å; P99-C106 VanDerWaalsContact CG-SG 3.55Å; C100-C106 WeakPolarHBondContact SG-CA 3.19Å; C100-C106 VanDerWaalsContact SG-CB 3.54Å
107	E	86.1	Confident	81.4	Confident	71 Å²	71	64.2 Å²	64.2	33%	0.332	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	124.5	170.1	-164.1	-168.1	161.1	0	0	110.1	C95 K109 F114 F115 H117	C95-E107 PolarHBondContact SG-N 2.83Å; E107-K109 WeakPolarHBondContact OE1-CE 3.03Å; E107-K109 IonicContact OE1-NZ 2.71Å; E107-K109 PolarHBondContact OE1-NZ 3.2Å; E107-K109 WeakPolarHBondContact OE2-CE 3.41Å; E107-K109 IonicContact OE2-NZ 3.35Å; E107-K109 PolarHBondContact OE2-NZ 2.03Å; E107-F114 CarbonylContact O-C 3.55Å; E107-F114 WeakPolarHBondContact O-CA 3.29Å; E107-F115 PolarHBondContact N-O 3.14Å; E107-F115 PolarHBondContact O-N 3.26Å; E107-H117 IonicContact OE2-CD2 3.8Å; E107-H117 IonicContact OE2-CE1 2.66Å; E107-H117 IonicContact OE2-NE2 3.4Å; E107-H117 PolarHBondContact OE2-NE2 3.43Å
108	N	79.9	Confident	81.9	Confident	46 Å²	46	60.6 Å²	60.6	25%	0.246	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	131.1	177.9	-175.1	58.6	0	0	0	109.7	D91 D93 D94 C95 R113	D91-N108 PolarHBondContact OD2-ND2 3.24Å; D93-N108 WeakPolarHBondContact CA-OD1 3.46Å; D94-N108 PolarHBondContact N-OD1 2.93Å; D94-N108 VanDerWaalsContact N-OD1 3.12Å; C95-N108 HydrophobicContact CB-CB 4.46Å; C95-N108 PolarHBondContact SG-N 3.34Å; N108-R113 PolarHBondContact OD1-O 3.5Å
109	K	72.6	Confident	82.1	Confident	25 Å²	25	55.3 Å²	55.3	11%	0.109	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	108.6	-174.8	-67	-60.7	-164	-176	0	110.6	E107 N111 M112 R113 F115 N962	E107-K109 WeakPolarHBondContact OE1-CE 3.03Å; E107-K109 IonicContact OE1-NZ 2.71Å; E107-K109 PolarHBondContact OE1-NZ 3.2Å; E107-K109 WeakPolarHBondContact OE2-CE 3.41Å; E107-K109 IonicContact OE2-NZ 3.35Å; E107-K109 PolarHBondContact OE2-NZ 2.03Å; K109-N111 PolarHBondContact O-N 3.07Å; K109-M112 HydrophobicContact CB-CB 3.91Å; K109-M112 CarbonylContact O-C 3.59Å; K109-M112 WeakPolarHBondContact O-CA 3.19Å; K109-M112 PolarHBondContact O-N 3.37Å; K109-R113 PolarHBondContact N-O 3.4Å; K109-R113 PolarHBondContact O-N 2.87Å; K109-F115 HydrophobicContact CG-CB 3.79Å; K109-N962 WeakPolarHBondContact CE-OD1 3.02Å; K109-N962 VanDerWaalsContact NZ-CG 3.28Å; K109-N962 PolarHBondContact NZ-OD1 3.38Å
110	P	63.5	Low	82.1	Confident	33 Å²	33	61.1 Å²	61.1	21%	0.214	34%	0.343	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.9	133.1	177.9	21.1	-32.2	0	0	0	111.6	W83 D91 M112	W83-P110 HydrophobicContact CH2-CB 4.41Å; W83-P110 HydrophobicContact CZ2-CB 4.44Å; D91-P110 HydrophobicContact CB-CB 4.45Å; D91-P110 WeakPolarHBondContact OD1-CA 3.41Å; P110-M112 VanDerWaalsContact C-N 3.28Å; P110-M112 PolarHBondContact O-N 3.03Å
111	N	59.2	Low	82	Confident	104 Å²	104	60.5 Å²	60.5	56%	0.556	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.6	-5.9	-167	-51.3	-82	0	0	0	117.6	W83 K109	W83-N111 PolarHBondContact NE1-OD1 2.96Å; K109-N111 PolarHBondContact O-N 3.07Å
112	M	59.1	Low	82	Confident	72 Å²	72	59.7 Å²	59.7	36%	0.355	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-122.6	3.2	178.3	-70.9	179.6	66.3	0	0	113.9	K109 P110 F114 K963	K109-M112 HydrophobicContact CB-CB 3.91Å; K109-M112 CarbonylContact O-C 3.59Å; K109-M112 WeakPolarHBondContact O-CA 3.19Å; K109-M112 PolarHBondContact O-N 3.37Å; P110-M112 VanDerWaalsContact C-N 3.28Å; P110-M112 PolarHBondContact O-N 3.03Å; M112-F114 VanDerWaalsContact C-N 3.34Å; M112-F114 PolarHBondContact O-N 3.12Å; M112-K963 HydrophobicContact CE-CB 4.21Å
113	R	70.5	Confident	81.8	Confident	96 Å²	96	57 Å²	57	36%	0.362	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	67.9	-82.1	-175.2	-44.7	-168.5	78.4	-155.6	-0.8	110.9	D94 N108 K109	D94-R113 HydrophobicContact CB-CB 3.84Å; D94-R113 VanDerWaalsContact CG-CZ 3.45Å; D94-R113 IonicContact OD1-CZ 3.87Å; D94-R113 IonicContact OD1-NE 3.9Å; D94-R113 IonicContact OD1-NH1 2.75Å; D94-R113 IonicContact OD1-NH2 3.34Å; D94-R113 PolarHBondContact OD1-NH2 3.44Å; D94-R113 WeakPolarHBondContact OD2-CB 3.19Å; D94-R113 IonicContact OD2-CZ 3.72Å; D94-R113 IonicContact OD2-NE 2.67Å; D94-R113 PolarHBondContact OD2-NE 2.99Å; D94-R113 IonicContact OD2-NH2 2.7Å; D94-R113 PolarHBondContact OD2-NH2 3.32Å; N108-R113 PolarHBondContact OD1-O 3.5Å; K109-R113 PolarHBondContact N-O 3.4Å; K109-R113 PolarHBondContact O-N 2.87Å
114	F	80.5	Confident	81.6	Confident	47 Å²	47	54.6 Å²	54.6	21%	0.206	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	161.6	-179.9	65.8	-92.7	0	0	0	111.5	D94 P99 E107 M112 T126	D94-F114 HydrophobicContact CB-CD1 4.27Å; P99-F114 HydrophobicContact CB-CD1 4.22Å; P99-F114 HydrophobicContact CB-CD2 4.12Å; P99-F114 HydrophobicContact CB-CE1 3.86Å; P99-F114 HydrophobicContact CB-CE2 3.77Å; P99-F114 HydrophobicContact CB-CG 4.35Å; P99-F114 HydrophobicContact CB-CZ 3.63Å; P99-F114 HydrophobicContact CG-CB 4.29Å; P99-F114 HydrophobicContact CG-CD1 3.81Å; P99-F114 HydrophobicContact CG-CD2 3.55Å; P99-F114 HydrophobicContact CG-CE1 3.97Å; P99-F114 HydrophobicContact CG-CE2 3.74Å; P99-F114 HydrophobicContact CG-CG 3.6Å; P99-F114 HydrophobicContact CG-CZ 3.95Å; E107-F114 CarbonylContact O-C 3.55Å; E107-F114 WeakPolarHBondContact O-CA 3.29Å; M112-F114 VanDerWaalsContact C-N 3.34Å; M112-F114 PolarHBondContact O-N 3.12Å; F114-T126 HydrophobicContact CE2-CG2 3.92Å; F114-T126 HydrophobicContact CZ-CG2 3.98Å
115	F	84.5	Confident	81.4	Confident	37 Å²	37	60 Å²	60	16%	0.162	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	137.3	167.9	-175.3	-96.2	0	0	0	109.5	E107 K109 H117 K963	E107-F115 PolarHBondContact N-O 3.14Å; E107-F115 PolarHBondContact O-N 3.26Å; K109-F115 HydrophobicContact CG-CB 3.79Å; F115-H117 AromaticContact CD1-CD2 3.92Å; F115-H117 AromaticContact CD1-CE1 3.72Å; F115-H117 AromaticContact CD1-ND1 3.97Å; F115-H117 AromaticContact CD1-NE2 3.68Å; F115-H117 AromaticContact CE1-CE1 3.65Å; F115-H117 AromaticContact CE1-ND1 3.59Å; F115-K963 HydrophobicContact CE2-CD 4.1Å; F115-K963 HydrophobicContact CE2-CG 4.42Å
116	C	88.9	Confident	81.3	Confident	7 Å²	7	55.7 Å²	55.7	5%	0.047	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	114.3	176.8	-66.4	0	0	0	0	110.4	C100 I105 C118 Q125	C100-C116 WeakPolarHBondContact CA-SG 3.19Å; C100-C116 HydrophobicContact CB-CB 3.79Å; C100-C116 WeakPolarHBondContact CB-SG 3.12Å; C100-C116 VanDerWaalsContact SG-CA 3.51Å; C100-C116 WeakPolarHBondContact SG-CB 3.31Å; C100-C116 CovalentContact SG-SG 2.03Å; C100-C116 PolarHBondContact SG-SG 3.36Å; I105-C116 WeakPolarHBondContact O-CA 3.47Å; C116-C118 PolarHBondContact O-N 2.81Å; C116-C118 PolarHBondContact O-SG 3.26Å; C116-Q125 WeakPolarHBondContact CB-O 3.4Å; C116-Q125 PolarHBondContact SG-O 2.83Å
117	H	89.6	Confident	81.3	Confident	75 Å²	75	53.8 Å²	53.8	35%	0.347	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	102.8	172.3	-66.3	-83.2	0	0	0	109.1	G104 I105 E107 F115	G104-H117 WeakPolarHBondContact CA-O 3.34Å; I105-H117 HydrophobicContact CB-CB 4.29Å; I105-H117 PolarHBondContact N-O 3.27Å; I105-H117 PolarHBondContact O-N 2.82Å; E107-H117 IonicContact OE2-CD2 3.8Å; E107-H117 IonicContact OE2-CE1 2.66Å; E107-H117 IonicContact OE2-NE2 3.4Å; E107-H117 PolarHBondContact OE2-NE2 3.43Å; F115-H117 AromaticContact CD1-CD2 3.92Å; F115-H117 AromaticContact CD1-CE1 3.72Å; F115-H117 AromaticContact CD1-ND1 3.97Å; F115-H117 AromaticContact CD1-NE2 3.68Å; F115-H117 AromaticContact CE1-CE1 3.65Å; F115-H117 AromaticContact CE1-ND1 3.59Å
118	C	89.9	Confident	81.5	Confident	46 Å²	46	53.3 Å²	53.3	31%	0.311	28%	0.279	S	S	.	.	P	Polyproline II helix	trans	-81.7	135.8	-171.9	-56.1	0	0	0	0	113.3	C116 Y122 C127	C116-C118 PolarHBondContact O-N 2.81Å; C116-C118 PolarHBondContact O-SG 3.26Å; C118-Y122 WeakPolarHBondContact CB-O 3.36Å; C118-C127 WeakPolarHBondContact CA-SG 3.5Å; C118-C127 HydrophobicContact CB-CB 3.69Å; C118-C127 WeakPolarHBondContact CB-SG 3.49Å; C118-C127 WeakPolarHBondContact SG-CA 3.48Å; C118-C127 WeakPolarHBondContact SG-CB 3.42Å; C118-C127 CovalentContact SG-SG 2.03Å; C118-C127 PolarHBondContact SG-SG 2.96Å
119	P	88.7	Confident	81.9	Confident	47 Å²	47	55.6 Å²	55.6	31%	0.305	29%	0.285	S	S	.	.	P	Polyproline II helix	trans	-71.2	153.9	174.8	28.5	-32.5	0	0	0	111.6	N102 G121 Y122	N102-P119 VanDerWaalsContact O-CG 3.31Å; N102-P119 WeakPolarHBondContact O-CG 3.45Å; P119-G121 PolarHBondContact O-N 3.24Å; P119-Y122 HydrophobicContact CG-CD2 4.1Å; P119-Y122 PolarHBondContact O-N 3.04Å
120	T	85.3	Confident	82.6	Confident	145 Å²	145	62 Å²	62	89%	0.89	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.5	118.2	-174.7	-51.8	0	0	0	0	112.9
121	G	86.9	Confident	83.6	Confident	10 Å²	10	62 Å²	62	10%	0.103	31%	0.306	C	S	.	.	T	Hydrogen-bonded Turn	trans	99.7	3.4	-178.3	0	0	0	0	0	115.4	P119 R130 D131	P119-G121 PolarHBondContact O-N 3.24Å; G121-R130 CarbonylContact O-C 3.44Å; G121-R130 WeakPolarHBondContact O-CA 3.44Å; G121-D131 PolarHBondContact O-N 2.8Å
122	Y	90.4	Very high	84.9	Confident	74 Å²	74	58 Å²	58	29%	0.29	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	145.2	169.6	-64.6	-86.7	0	0	0	112	N102 C118 P119 Y129	N102-Y122 HydrophobicContact CB-CD1 3.71Å; N102-Y122 HydrophobicContact CB-CD2 4.19Å; N102-Y122 HydrophobicContact CB-CE1 3.78Å; N102-Y122 HydrophobicContact CB-CE2 4.24Å; N102-Y122 HydrophobicContact CB-CG 3.92Å; N102-Y122 VanDerWaalsContact CG-CE1 3.48Å; N102-Y122 WeakPolarHBondContact ND2-CD1 3.47Å; N102-Y122 WeakPolarHBondContact ND2-CE1 3.16Å; C118-Y122 WeakPolarHBondContact CB-O 3.36Å; P119-Y122 HydrophobicContact CG-CD2 4.1Å; P119-Y122 PolarHBondContact O-N 3.04Å; Y122-Y129 CarbonylContact C-O 3.53Å; Y122-Y129 WeakPolarHBondContact CA-O 3.33Å; Y122-Y129 WeakPolarHBondContact CD1-O 3.43Å
123	V	86	Confident	86.4	Confident	25 Å²	25	55.5 Å²	55.5	15%	0.152	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	159.7	176.6	-62.3	0	0	0	0	109.8	C127 E128 Y129 D131	V123-C127 CarbonylContact O-C 3.07Å; V123-E128 PolarHBondContact O-N 3.19Å; V123-Y129 PolarHBondContact N-O 2.97Å; V123-Y129 WeakPolarHBondContact O-CA 3.49Å; V123-Y129 WeakPolarHBondContact O-CB 3.39Å; V123-Y129 PolarHBondContact O-N 3.3Å; V123-Y129 VanDerWaalsContact O-O 3.11Å; V123-D131 HydrophobicContact CG1-CB 4.14Å
124	G	84.1	Confident	87.2	Confident	14 Å²	14	55 Å²	55	14%	0.144	28%	0.277	C	S	.	.	S	Bend	trans	146.2	-168.9	179.5	0	0	0	0	0	113.2	E128 P148	G124-E128 WeakPolarHBondContact CA-OE2 3.28Å; G124-P148 WeakPolarHBondContact CA-O 2.88Å
125	Q	84.3	Confident	87.5	Confident	126 Å²	126	59.9 Å²	59.9	59%	0.589	30%	0.304	S	S	*	.	S	Bend	trans	-90.5	-28.3	164.9	-68.1	-169	4.8	0	0	111.8	C116 E128	C116-Q125 WeakPolarHBondContact CB-O 3.4Å; C116-Q125 PolarHBondContact SG-O 2.83Å; Q125-E128 PolarHBondContact N-OE1 3.1Å; Q125-E128 PolarHBondContact N-OE2 2.94Å
126	T	88	Confident	87.6	Confident	30 Å²	30	64.1 Å²	64.1	18%	0.184	33%	0.329	C	S	.	.	S	Bend	trans	-118	18.5	173.7	58.3	0	0	0	0	112	P99 L101 F114 E128	P99-T126 HydrophobicContact CB-CG2 4.42Å; P99-T126 WeakPolarHBondContact O-CB 3.38Å; P99-T126 WeakPolarHBondContact O-CG2 3.48Å; L101-T126 WeakPolarHBondContact CA-O 3.41Å; L101-T126 WeakPolarHBondContact CB-O 3.49Å; L101-T126 PolarHBondContact N-O 2.04Å; F114-T126 HydrophobicContact CE2-CG2 3.92Å; F114-T126 HydrophobicContact CZ-CG2 3.98Å; T126-E128 VanDerWaalsContact C-OE2 3.26Å; T126-E128 WeakPolarHBondContact CA-OE2 3.26Å; T126-E128 PolarHBondContact N-OE2 2.88Å; T126-E128 PolarHBondContact O-N 3.17Å; T126-E128 PolarHBondContact OG1-OE2 3.44Å
127	C	90.2	Very high	87.6	Confident	0 Å²	0	64.3 Å²	64.3	0%	0	33%	0.33	C	S	.	.	S	Bend	trans	62.5	28.8	-177.7	-46.2	0	0	0	0	113.7	N102 C118 V123	N102-C127 PolarHBondContact ND2-O 2.76Å; C118-C127 WeakPolarHBondContact CA-SG 3.5Å; C118-C127 HydrophobicContact CB-CB 3.69Å; C118-C127 WeakPolarHBondContact CB-SG 3.49Å; C118-C127 WeakPolarHBondContact SG-CA 3.48Å; C118-C127 WeakPolarHBondContact SG-CB 3.42Å; C118-C127 CovalentContact SG-SG 2.03Å; C118-C127 PolarHBondContact SG-SG 2.96Å; V123-C127 CarbonylContact O-C 3.07Å
128	E	88.9	Confident	87.7	Confident	60 Å²	60	61.4 Å²	61.4	28%	0.28	32%	0.318	S	S	.	.			trans	-75.2	-22.9	-170.1	65.9	-85.3	-149.3	0	0	114.4	L101 V123 G124 Q125 T126	L101-E128 HydrophobicContact CD1-CB 4.03Å; V123-E128 PolarHBondContact O-N 3.19Å; G124-E128 WeakPolarHBondContact CA-OE2 3.28Å; Q125-E128 PolarHBondContact N-OE1 3.1Å; Q125-E128 PolarHBondContact N-OE2 2.94Å; T126-E128 VanDerWaalsContact C-OE2 3.26Å; T126-E128 WeakPolarHBondContact CA-OE2 3.26Å; T126-E128 PolarHBondContact N-OE2 2.88Å; T126-E128 PolarHBondContact O-N 3.17Å; T126-E128 PolarHBondContact OG1-OE2 3.44Å
129	Y	88.5	Confident	87.6	Confident	94 Å²	94	61.9 Å²	61.9	37%	0.369	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	148.6	-179.1	-49.2	-69.1	0	0	0	111.8	Y122 V123	Y122-Y129 CarbonylContact C-O 3.53Å; Y122-Y129 WeakPolarHBondContact CA-O 3.33Å; Y122-Y129 WeakPolarHBondContact CD1-O 3.43Å; V123-Y129 PolarHBondContact N-O 2.97Å; V123-Y129 WeakPolarHBondContact O-CA 3.49Å; V123-Y129 WeakPolarHBondContact O-CB 3.39Å; V123-Y129 PolarHBondContact O-N 3.3Å; V123-Y129 VanDerWaalsContact O-O 3.11Å
130	R	87.1	Confident	87.3	Confident	161 Å²	161	60.9 Å²	60.9	61%	0.608	31%	0.309	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77	138.7	164.2	177.3	-179.2	-73.2	-103	1.5	109.1	G121 P132	G121-R130 CarbonylContact O-C 3.44Å; G121-R130 WeakPolarHBondContact O-CA 3.44Å; R130-P132 VanDerWaalsContact O-CD 3.28Å; R130-P132 WeakPolarHBondContact O-CD 3.25Å
131	D	85.3	Confident	87	Confident	31 Å²	31	56.7 Å²	56.7	17%	0.166	30%	0.295	C	S	.	.			trans	-59	113.9	175.7	171.5	21.6	0	0	0	111.5	G121 V123 C133 Q134 S146	G121-D131 PolarHBondContact O-N 2.8Å; V123-D131 HydrophobicContact CG1-CB 4.14Å; D131-C133 PolarHBondContact O-N 3.04Å; D131-C133 VanDerWaalsContact OD1-CB 3.31Å; D131-C133 WeakPolarHBondContact OD1-CB 3.3Å; D131-C133 PolarHBondContact OD1-N 2.84Å; D131-Q134 HydrophobicContact CB-CG 4.14Å; D131-Q134 PolarHBondContact O-N 2.81Å; D131-S146 VanDerWaalsContact OD1-CB 3.28Å; D131-S146 WeakPolarHBondContact OD1-CB 3.46Å; D131-S146 PolarHBondContact OD1-OG 3.21Å
132	P	86.6	Confident	87	Confident	21 Å²	21	56.9 Å²	56.9	14%	0.136	30%	0.297	C	S	.	.	G	3₁₀ helix	trans	-68.4	-21	178.5	29.3	-36.6	0	0	0	113.2	R130 Q134 L135 Q151 F152	R130-P132 VanDerWaalsContact O-CD 3.28Å; R130-P132 WeakPolarHBondContact O-CD 3.25Å; P132-Q134 VanDerWaalsContact C-N 3.26Å; P132-Q134 PolarHBondContact O-N 2.84Å; P132-L135 PolarHBondContact O-N 3.08Å; P132-Q151 WeakPolarHBondContact CG-O 3.47Å; P132-F152 HydrophobicContact CB-CB 4.17Å; P132-F152 HydrophobicContact CB-CD1 4.28Å; P132-F152 HydrophobicContact CG-CB 3.89Å
133	C	90.6	Very high	86.9	Confident	19 Å²	19	57.1 Å²	57.1	13%	0.128	31%	0.306	C	S	.	.	G	3₁₀ helix	trans	-70.7	-19.8	-179.8	-70	0	0	0	0	113.3	D131 L135 N136 C144 H145 S146	D131-C133 PolarHBondContact O-N 3.04Å; D131-C133 VanDerWaalsContact OD1-CB 3.31Å; D131-C133 WeakPolarHBondContact OD1-CB 3.3Å; D131-C133 PolarHBondContact OD1-N 2.84Å; C133-L135 PolarHBondContact O-N 2.96Å; C133-L135 VanDerWaalsContact O-N 3.11Å; C133-N136 PolarHBondContact O-N 2.88Å; C133-C144 WeakPolarHBondContact CA-SG 3.15Å; C133-C144 HydrophobicContact CB-CB 3.73Å; C133-C144 WeakPolarHBondContact CB-SG 3.44Å; C133-C144 WeakPolarHBondContact SG-CB 3.39Å; C133-C144 CovalentContact SG-SG 2.04Å; C133-C144 PolarHBondContact SG-SG 3.22Å; C133-H145 VanDerWaalsContact SG-C 3.51Å; C133-S146 PolarHBondContact SG-N 2.9Å; C133-S146 VanDerWaalsContact SG-N 3.42Å
134	Q	86.6	Confident	87.2	Confident	86 Å²	86	57.4 Å²	57.4	40%	0.402	31%	0.309	S	S	.	.	G	3₁₀ helix	trans	-57.3	-24.2	170.8	-65.4	-162.7	-29.4	0	0	113.6	D131 P132 N136	D131-Q134 HydrophobicContact CB-CG 4.14Å; D131-Q134 PolarHBondContact O-N 2.81Å; P132-Q134 VanDerWaalsContact C-N 3.26Å; P132-Q134 PolarHBondContact O-N 2.84Å; Q134-N136 VanDerWaalsContact C-N 3.28Å; Q134-N136 PolarHBondContact O-N 3.5Å
135	L	86.4	Confident	87.5	Confident	149 Å²	149	61.3 Å²	61.3	78%	0.78	32%	0.323	S	S	*	.	G	3₁₀ helix	trans	-84.6	1.6	177.9	-61.5	177.7	0	0	0	113.5	P132 C133	P132-L135 PolarHBondContact O-N 3.08Å; C133-L135 PolarHBondContact O-N 2.96Å; C133-L135 VanDerWaalsContact O-N 3.11Å
136	N	86.4	Confident	87.7	Confident	127 Å²	127	57.6 Å²	57.6	68%	0.679	31%	0.311	S	S	*	.			trans	45.4	59.1	-173.3	-62.7	-75.5	0	0	0	112.4	C133 Q134 C138	C133-N136 PolarHBondContact O-N 2.88Å; Q134-N136 VanDerWaalsContact C-N 3.28Å; Q134-N136 PolarHBondContact O-N 3.5Å; N136-C138 PolarHBondContact O-N 2.86Å
137	P	90.3	Very high	87.2	Confident	11 Å²	11	58.2 Å²	58.2	7%	0.071	31%	0.313	C	S	.	.			trans	-65.4	-27.5	-173.9	26.6	-34.5	0	0	0	112.7	C144 F152 R164	P137-C144 VanDerWaalsContact CG-SG 3.51Å; P137-F152 HydrophobicContact CB-CD1 4.28Å; P137-F152 HydrophobicContact CB-CD2 3.94Å; P137-F152 HydrophobicContact CB-CE1 4.11Å; P137-F152 HydrophobicContact CB-CE2 3.77Å; P137-F152 HydrophobicContact CB-CG 4.21Å; P137-F152 HydrophobicContact CB-CZ 3.86Å; P137-F152 HydrophobicContact CG-CB 4.25Å; P137-F152 HydrophobicContact CG-CD1 4.17Å; P137-F152 HydrophobicContact CG-CD2 3.66Å; P137-F152 HydrophobicContact CG-CE1 4.49Å; P137-F152 HydrophobicContact CG-CE2 4.04Å; P137-F152 HydrophobicContact CG-CG 3.76Å; P137-F152 HydrophobicContact CG-CZ 4.44Å; P137-R164 VanDerWaalsContact O-CZ 3.25Å; P137-R164 PolarHBondContact O-NE 2.96Å; P137-R164 PolarHBondContact O-NH2 3.3Å
138	C	91.5	Very high	86.4	Confident	13 Å²	13	60.5 Å²	60.5	9%	0.088	33%	0.328	C	S	.	.			trans	-77.9	130.7	-177.6	-47.9	0	0	0	0	112.2	N136 G142 C144 C154	N136-C138 PolarHBondContact O-N 2.86Å; C138-G142 WeakPolarHBondContact CB-O 3.36Å; C138-C144 VanDerWaalsContact SG-CA 3.56Å; C138-C144 VanDerWaalsContact SG-CB 3.53Å; C138-C154 WeakPolarHBondContact CA-SG 3.23Å; C138-C154 HydrophobicContact CB-CB 3.81Å; C138-C154 WeakPolarHBondContact CB-SG 3.22Å; C138-C154 WeakPolarHBondContact SG-CA 3.06Å; C138-C154 WeakPolarHBondContact SG-CB 3.27Å; C138-C154 CovalentContact SG-SG 2.03Å; C138-C154 PolarHBondContact SG-SG 3.07Å
139	L	88.2	Confident	86	Confident	57 Å²	57	63.5 Å²	63.5	30%	0.298	34%	0.34	S	S	.	.			trans	-94.8	172.9	177.7	-53.4	-177.2	0	0	0	110.8	G141 G142 R164 E166	L139-G141 PolarHBondContact O-N 2.75Å; L139-G142 PolarHBondContact O-N 2.83Å; L139-R164 WeakPolarHBondContact CB-O 3.46Å; L139-R164 HydrophobicContact CG-CB 4.47Å; L139-R164 PolarHBondContact N-O 3.11Å; L139-E166 HydrophobicContact CD1-CB 3.96Å
140	N	81.2	Confident	85.5	Confident	25 Å²	25	60.1 Å²	60.1	13%	0.134	34%	0.335	C	S	.	.	T	Hydrogen-bonded Turn	trans	53.3	27.3	167.4	-58.5	-37.4	0	0	0	115.4	P157 Y160 C165	N140-P157 VanDerWaalsContact O-CG 3.31Å; N140-P157 WeakPolarHBondContact O-CG 3.15Å; N140-Y160 HydrophobicContact CB-CD1 3.51Å; N140-Y160 HydrophobicContact CB-CD2 4.4Å; N140-Y160 HydrophobicContact CB-CE1 3.48Å; N140-Y160 VanDerWaalsContact CB-CE1 3.48Å; N140-Y160 HydrophobicContact CB-CE2 4.4Å; N140-Y160 HydrophobicContact CB-CG 4.01Å; N140-Y160 VanDerWaalsContact CG-CE1 3.41Å; N140-Y160 WeakPolarHBondContact ND2-CD1 3.46Å; N140-Y160 VanDerWaalsContact ND2-CE1 3.27Å; N140-Y160 WeakPolarHBondContact ND2-CE1 3.47Å; N140-C165 PolarHBondContact ND2-O 3.26Å
141	G	80.1	Confident	85.3	Confident	58 Å²	58	58.3 Å²	58.3	60%	0.598	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.8	14.8	-178.8	0	0	0	0	0	115.4	L139	L139-G141 PolarHBondContact O-N 2.75Å
142	G	86.2	Confident	85.4	Confident	14 Å²	14	59.8 Å²	59.8	14%	0.144	34%	0.338	C	S	.	.	P	Polyproline II helix	trans	-65.5	139.3	171.9	0	0	0	0	0	113.3	C138 L139 I155	C138-G142 WeakPolarHBondContact CB-O 3.36Å; L139-G142 PolarHBondContact O-N 2.83Å; G142-I155 CarbonylContact C-O 3.49Å; G142-I155 VanDerWaalsContact CA-O 3.32Å; G142-I155 WeakPolarHBondContact CA-O 3.17Å
143	T	89.5	Confident	85.6	Confident	78 Å²	78	63.1 Å²	63.1	48%	0.479	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	128.7	177	-55.3	0	0	0	0	110.2	C154 I155	T143-C154 CarbonylContact O-C 3.48Å; T143-C154 WeakPolarHBondContact O-CA 3.17Å; T143-I155 PolarHBondContact N-O 2.89Å; T143-I155 PolarHBondContact O-N 3.12Å
144	C	91.6	Very high	85.6	Confident	31 Å²	31	63 Å²	63	21%	0.209	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	133.8	179	-167.5	0	0	0	0	111.9	C133 P137 C138	C133-C144 WeakPolarHBondContact CA-SG 3.15Å; C133-C144 HydrophobicContact CB-CB 3.73Å; C133-C144 WeakPolarHBondContact CB-SG 3.44Å; C133-C144 WeakPolarHBondContact SG-CB 3.39Å; C133-C144 CovalentContact SG-SG 2.04Å; C133-C144 PolarHBondContact SG-SG 3.22Å; P137-C144 VanDerWaalsContact CG-SG 3.51Å; C138-C144 VanDerWaalsContact SG-CA 3.56Å; C138-C144 VanDerWaalsContact SG-CB 3.53Å
145	H	90.9	Very high	85.8	Confident	97 Å²	97	63.6 Å²	63.6	45%	0.449	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	127	166.6	-63.1	-86.1	0	0	0	109.9	C133 F152 T153 I155	C133-H145 VanDerWaalsContact SG-C 3.51Å; H145-F152 CarbonylContact O-C 3.55Å; H145-F152 WeakPolarHBondContact O-CA 3.13Å; H145-T153 PolarHBondContact N-O 3.28Å; H145-T153 PolarHBondContact O-N 3.19Å; H145-I155 WeakPolarHBondContact NE2-CD1 3.39Å
146	S	87.1	Confident	85.8	Confident	47 Å²	47	58.1 Å²	58.1	33%	0.329	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	142.9	174.9	51	0	0	0	0	111.3	D131 C133 Q151	D131-S146 VanDerWaalsContact OD1-CB 3.28Å; D131-S146 WeakPolarHBondContact OD1-CB 3.46Å; D131-S146 PolarHBondContact OD1-OG 3.21Å; C133-S146 PolarHBondContact SG-N 2.9Å; C133-S146 VanDerWaalsContact SG-N 3.42Å; S146-Q151 CarbonylContact C-O 3.54Å; S146-Q151 VanDerWaalsContact CA-O 3.31Å; S146-Q151 WeakPolarHBondContact CA-O 3.49Å
147	D	78.9	Confident	85.4	Confident	43 Å²	43	54.4 Å²	54.4	23%	0.23	32%	0.319	C	S	.	.			trans	-99.1	169.4	178.4	86.7	-8.4	0	0	0	113	F149 G150 Q151	D147-F149 PolarHBondContact O-N 3.39Å; D147-F149 VanDerWaalsContact OD1-C 3.29Å; D147-F149 VanDerWaalsContact OD1-CA 3.31Å; D147-F149 WeakPolarHBondContact OD1-CA 3.45Å; D147-F149 WeakPolarHBondContact OD1-CB 3.26Å; D147-F149 PolarHBondContact OD1-N 3.02Å; D147-G150 PolarHBondContact O-N 3.25Å; D147-G150 PolarHBondContact OD1-N 3.4Å; D147-Q151 PolarHBondContact N-O 2.93Å; D147-Q151 WeakPolarHBondContact OD1-CB 3.1Å; D147-Q151 PolarHBondContact OD1-N 2.76Å
148	P	73.1	Confident	84.7	Confident	48 Å²	48	59.8 Å²	59.8	31%	0.312	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.4	6.8	176.4	-19.1	33.8	0	0	0	115.3	G124	G124-P148 WeakPolarHBondContact CA-O 2.88Å
149	F	80.4	Confident	84.2	Confident	123 Å²	123	61.1 Å²	61.1	54%	0.539	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	-118.6	9.4	179.4	-54.4	-69.8	0	0	0	112.2	D147	D147-F149 PolarHBondContact O-N 3.39Å; D147-F149 VanDerWaalsContact OD1-C 3.29Å; D147-F149 VanDerWaalsContact OD1-CA 3.31Å; D147-F149 WeakPolarHBondContact OD1-CA 3.45Å; D147-F149 WeakPolarHBondContact OD1-CB 3.26Å; D147-F149 PolarHBondContact OD1-N 3.02Å
150	G	77.4	Confident	84.1	Confident	24 Å²	24	58.9 Å²	58.9	25%	0.247	33%	0.334	C	S	.	.	S	Bend	trans	79.1	12.6	179.3	0	0	0	0	0	114.6	D147	D147-G150 PolarHBondContact O-N 3.25Å; D147-G150 PolarHBondContact OD1-N 3.4Å
151	Q	83.9	Confident	84.3	Confident	122 Å²	122	60.5 Å²	60.5	57%	0.57	34%	0.342	S	S	*	.			trans	-89.9	163.8	174.3	-47.5	-170.3	22.8	0	0	110.9	P132 S146 D147	P132-Q151 WeakPolarHBondContact CG-O 3.47Å; S146-Q151 CarbonylContact C-O 3.54Å; S146-Q151 VanDerWaalsContact CA-O 3.31Å; S146-Q151 WeakPolarHBondContact CA-O 3.49Å; D147-Q151 PolarHBondContact N-O 2.93Å; D147-Q151 WeakPolarHBondContact OD1-CB 3.1Å; D147-Q151 PolarHBondContact OD1-N 2.76Å
152	F	86.9	Confident	84.5	Confident	63 Å²	63	59.1 Å²	59.1	28%	0.276	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	147.6	171.3	71.6	-89.1	0	0	0	111	P132 P137 H145 V163 R164	P132-F152 HydrophobicContact CB-CB 4.17Å; P132-F152 HydrophobicContact CB-CD1 4.28Å; P132-F152 HydrophobicContact CG-CB 3.89Å; P137-F152 HydrophobicContact CB-CD1 4.28Å; P137-F152 HydrophobicContact CB-CD2 3.94Å; P137-F152 HydrophobicContact CB-CE1 4.11Å; P137-F152 HydrophobicContact CB-CE2 3.77Å; P137-F152 HydrophobicContact CB-CG 4.21Å; P137-F152 HydrophobicContact CB-CZ 3.86Å; P137-F152 HydrophobicContact CG-CB 4.25Å; P137-F152 HydrophobicContact CG-CD1 4.17Å; P137-F152 HydrophobicContact CG-CD2 3.66Å; P137-F152 HydrophobicContact CG-CE1 4.49Å; P137-F152 HydrophobicContact CG-CE2 4.04Å; P137-F152 HydrophobicContact CG-CG 3.76Å; P137-F152 HydrophobicContact CG-CZ 4.44Å; H145-F152 CarbonylContact O-C 3.55Å; H145-F152 WeakPolarHBondContact O-CA 3.13Å; F152-V163 HydrophobicContact CE2-CG1 4.42Å; F152-V163 HydrophobicContact CZ-CG1 4.46Å; F152-R164 HydrophobicContact CE2-CG 4.16Å; F152-R164 HydrophobicContact CZ-CG 4.12Å
153	T	89.9	Confident	84.6	Confident	91 Å²	91	63.5 Å²	63.5	56%	0.558	35%	0.352	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-121.3	128.9	167.7	-64.3	0	0	0	0	108.6	H145	H145-T153 PolarHBondContact N-O 3.28Å; H145-T153 PolarHBondContact O-N 3.19Å
154	C	91.3	Very high	84.6	Confident	16 Å²	16	65 Å²	65	11%	0.108	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	118.6	173.2	-66.4	0	0	0	0	110.8	C138 T143 C156 V163	C138-C154 WeakPolarHBondContact CA-SG 3.23Å; C138-C154 HydrophobicContact CB-CB 3.81Å; C138-C154 WeakPolarHBondContact CB-SG 3.22Å; C138-C154 WeakPolarHBondContact SG-CA 3.06Å; C138-C154 WeakPolarHBondContact SG-CB 3.27Å; C138-C154 CovalentContact SG-SG 2.03Å; C138-C154 PolarHBondContact SG-SG 3.07Å; T143-C154 CarbonylContact O-C 3.48Å; T143-C154 WeakPolarHBondContact O-CA 3.17Å; C154-C156 PolarHBondContact O-N 3.14Å; C154-V163 WeakPolarHBondContact CB-O 3.01Å
155	I	90.5	Very high	84.5	Confident	98 Å²	98	63.5 Å²	63.5	50%	0.503	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	105.1	167	-60.6	-178.5	0	0	0	107.4	G142 T143 H145	G142-I155 CarbonylContact C-O 3.49Å; G142-I155 VanDerWaalsContact CA-O 3.32Å; G142-I155 WeakPolarHBondContact CA-O 3.17Å; T143-I155 PolarHBondContact N-O 2.89Å; T143-I155 PolarHBondContact O-N 3.12Å; H145-I155 WeakPolarHBondContact NE2-CD1 3.39Å
156	C	86.7	Confident	84.4	Confident	34 Å²	34	62.9 Å²	62.9	23%	0.23	34%	0.336	C	S	.	.	P	Polyproline II helix	trans	-77	142.1	-177.6	-54.6	0	0	0	0	112.2	C154 Y160 C165	C154-C156 PolarHBondContact O-N 3.14Å; C156-Y160 WeakPolarHBondContact CB-O 3.07Å; C156-C165 WeakPolarHBondContact CA-SG 3.43Å; C156-C165 HydrophobicContact CB-CB 3.73Å; C156-C165 WeakPolarHBondContact CB-SG 3.33Å; C156-C165 WeakPolarHBondContact SG-CA 3.37Å; C156-C165 WeakPolarHBondContact SG-CB 3.15Å; C156-C165 CovalentContact SG-SG 2.04Å; C156-C165 PolarHBondContact SG-SG 2.85Å
157	P	78.7	Confident	84.2	Confident	49 Å²	49	65.3 Å²	65.3	32%	0.318	34%	0.342	S	S	.	.	P	Polyproline II helix	trans	-64.8	166.3	170.3	28.4	-33.4	0	0	0	110.6	N140 W159 Y160	N140-P157 VanDerWaalsContact O-CG 3.31Å; N140-P157 WeakPolarHBondContact O-CG 3.15Å; P157-W159 PolarHBondContact O-N 3.35Å; P157-Y160 HydrophobicContact CG-CD2 4Å; P157-Y160 HydrophobicContact CG-CG 4.4Å; P157-Y160 PolarHBondContact O-N 2.88Å; P157-Y160 VanDerWaalsContact O-N 3.13Å
158	Q	74.2	Confident	84.2	Confident	124 Å²	124	68.4 Å²	68.4	58%	0.579	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.8	140.4	172.6	-164.4	172.6	-23.6	0	0	109.8
159	W	81.4	Confident	84.5	Confident	41 Å²	41	68.5 Å²	68.5	16%	0.155	35%	0.353	C	S	.	.	T	Hydrogen-bonded Turn	trans	76.1	7.9	-173	-36.9	121.1	0	0	0	117	P157 I169 P171 I208 V209 F211	P157-W159 PolarHBondContact O-N 3.35Å; W159-I169 PolarHBondContact O-N 3.48Å; W159-P171 HydrophobicContact CD2-CB 4.33Å; W159-P171 HydrophobicContact CD2-CG 4.29Å; W159-P171 HydrophobicContact CE3-CB 3.88Å; W159-P171 HydrophobicContact CE3-CG 4.27Å; W159-P171 HydrophobicContact CH2-CB 3.86Å; W159-P171 HydrophobicContact CZ2-CB 4.29Å; W159-P171 HydrophobicContact CZ3-CB 3.66Å; W159-P171 HydrophobicContact CZ3-CG 4.48Å; W159-I208 HydrophobicContact CB-CB 4.17Å; W159-I208 HydrophobicContact CB-CG2 3.96Å; W159-I208 HydrophobicContact CG-CG2 3.89Å; W159-V209 PolarHBondContact NE1-O 2.66Å; W159-F211 HydrophobicContact CH2-CD1 4.02Å; W159-F211 AromaticContact CH2-CE1 3.83Å; W159-F211 HydrophobicContact CH2-CE1 3.83Å; W159-F211 AromaticContact CZ2-CD1 3.79Å; W159-F211 HydrophobicContact CZ2-CD1 3.79Å; W159-F211 AromaticContact CZ2-CE1 3.85Å; W159-F211 HydrophobicContact CZ2-CE1 3.85Å
160	Y	85.9	Confident	84.3	Confident	11 Å²	11	65.6 Å²	65.6	4%	0.043	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	148.5	175.4	-72.2	-89	0	0	0	113.6	N140 C156 P157 C165 Q167 E168 Y207 I208	N140-Y160 HydrophobicContact CB-CD1 3.51Å; N140-Y160 HydrophobicContact CB-CD2 4.4Å; N140-Y160 HydrophobicContact CB-CE1 3.48Å; N140-Y160 VanDerWaalsContact CB-CE1 3.48Å; N140-Y160 HydrophobicContact CB-CE2 4.4Å; N140-Y160 HydrophobicContact CB-CG 4.01Å; N140-Y160 VanDerWaalsContact CG-CE1 3.41Å; N140-Y160 WeakPolarHBondContact ND2-CD1 3.46Å; N140-Y160 VanDerWaalsContact ND2-CE1 3.27Å; N140-Y160 WeakPolarHBondContact ND2-CE1 3.47Å; C156-Y160 WeakPolarHBondContact CB-O 3.07Å; P157-Y160 HydrophobicContact CG-CD2 4Å; P157-Y160 HydrophobicContact CG-CG 4.4Å; P157-Y160 PolarHBondContact O-N 2.88Å; P157-Y160 VanDerWaalsContact O-N 3.13Å; Y160-C165 WeakPolarHBondContact CD1-O 3.4Å; Y160-Q167 WeakPolarHBondContact CA-O 3.27Å; Y160-Q167 WeakPolarHBondContact CD1-O 3.24Å; Y160-E168 HydrophobicContact CD1-CG 4.05Å; Y160-E168 HydrophobicContact CE1-CB 4.41Å; Y160-E168 HydrophobicContact CE1-CG 3.25Å; Y160-E168 PolarHBondContact OH-OE1 3.02Å; Y160-Y207 VanDerWaalsContact OH-CA 3.26Å; Y160-Y207 WeakPolarHBondContact OH-CA 3.21Å; Y160-Y207 VanDerWaalsContact OH-CB 3.29Å; Y160-Y207 WeakPolarHBondContact OH-CB 3.31Å; Y160-I208 PolarHBondContact OH-N 3.1Å
161	N	85.3	Confident	84.4	Confident	58 Å²	58	65.3 Å²	65.3	31%	0.31	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.5	-173.4	173.1	69.9	-67.7	0	0	0	111.7	C165 E166 Q167 I169	N161-C165 CarbonylContact O-C 3.59Å; N161-C165 VanDerWaalsContact O-C 3.23Å; N161-C165 VanDerWaalsContact O-CA 3.23Å; N161-C165 WeakPolarHBondContact O-CA 3.3Å; N161-E166 PolarHBondContact O-N 3.37Å; N161-Q167 PolarHBondContact N-O 3.18Å; N161-Q167 PolarHBondContact ND2-OE1 2.66Å; N161-Q167 WeakPolarHBondContact O-CB 3.14Å; N161-Q167 PolarHBondContact O-N 2.88Å; N161-Q167 WeakPolarHBondContact OD1-CB 3.36Å; N161-I169 HydrophobicContact CB-CD1 4.18Å; N161-I169 WeakPolarHBondContact OD1-CG1 3.34Å
162	G	85.9	Confident	84.4	Confident	30 Å²	30	60.7 Å²	60.7	31%	0.309	32%	0.318	S	S	.	.	S	Bend	trans	97.5	171.4	-169	0	0	0	0	0	111.9	R164 C165 E166	G162-R164 VanDerWaalsContact C-N 3.26Å; G162-R164 PolarHBondContact O-N 2.84Å; G162-C165 PolarHBondContact O-N 3.09Å; G162-E166 VanDerWaalsContact C-OE2 3.29Å; G162-E166 VanDerWaalsContact CA-OE1 3.26Å; G162-E166 WeakPolarHBondContact CA-OE1 2.92Å; G162-E166 WeakPolarHBondContact CA-OE2 3.39Å
163	V	86.7	Confident	84	Confident	106 Å²	106	66.1 Å²	66.1	64%	0.642	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.2	-26.7	-174.1	179.4	0	0	0	0	111.7	F152 C154 E166	F152-V163 HydrophobicContact CE2-CG1 4.42Å; F152-V163 HydrophobicContact CZ-CG1 4.46Å; C154-V163 WeakPolarHBondContact CB-O 3.01Å; V163-E166 PolarHBondContact N-OE1 2.93Å; V163-E166 PolarHBondContact N-OE2 3.4Å; V163-E166 VanDerWaalsContact N-OE2 3.11Å
164	R	90.1	Very high	83.3	Confident	109 Å²	109	66.9 Å²	66.9	41%	0.411	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-118.8	15	-179.5	-57.9	-177.5	61.7	-173.2	-3.9	111.8	P137 L139 F152 G162 E166	P137-R164 VanDerWaalsContact O-CZ 3.25Å; P137-R164 PolarHBondContact O-NE 2.96Å; P137-R164 PolarHBondContact O-NH2 3.3Å; L139-R164 WeakPolarHBondContact CB-O 3.46Å; L139-R164 HydrophobicContact CG-CB 4.47Å; L139-R164 PolarHBondContact N-O 3.11Å; F152-R164 HydrophobicContact CE2-CG 4.16Å; F152-R164 HydrophobicContact CZ-CG 4.12Å; G162-R164 VanDerWaalsContact C-N 3.26Å; G162-R164 PolarHBondContact O-N 2.84Å; R164-E166 VanDerWaalsContact C-OE2 3.24Å; R164-E166 VanDerWaalsContact CA-OE2 3.24Å; R164-E166 WeakPolarHBondContact CA-OE2 3.04Å; R164-E166 WeakPolarHBondContact CB-OE2 3.47Å; R164-E166 PolarHBondContact N-OE2 3.39Å; R164-E166 PolarHBondContact O-N 2.92Å
165	C	90.2	Very high	82.6	Confident	0 Å²	0	71.3 Å²	71.3	0%	0	37%	0.371	C	S	.	.	S	Bend	trans	60.4	29.9	-173.2	-46.3	0	0	0	0	113.8	N140 C156 Y160 N161 G162	N140-C165 PolarHBondContact ND2-O 3.26Å; C156-C165 WeakPolarHBondContact CA-SG 3.43Å; C156-C165 HydrophobicContact CB-CB 3.73Å; C156-C165 WeakPolarHBondContact CB-SG 3.33Å; C156-C165 WeakPolarHBondContact SG-CA 3.37Å; C156-C165 WeakPolarHBondContact SG-CB 3.15Å; C156-C165 CovalentContact SG-SG 2.04Å; C156-C165 PolarHBondContact SG-SG 2.85Å; Y160-C165 WeakPolarHBondContact CD1-O 3.4Å; N161-C165 CarbonylContact O-C 3.59Å; N161-C165 VanDerWaalsContact O-C 3.23Å; N161-C165 VanDerWaalsContact O-CA 3.23Å; N161-C165 WeakPolarHBondContact O-CA 3.3Å; G162-C165 PolarHBondContact O-N 3.09Å
166	E	88.2	Confident	82.2	Confident	83 Å²	83	69.5 Å²	69.5	39%	0.388	37%	0.367	S	S	.	.			trans	-79.3	-15.3	-176.4	73.1	-75.5	-179.7	0	0	114.6	L139 N161 G162 V163 R164	L139-E166 HydrophobicContact CD1-CB 3.96Å; N161-E166 PolarHBondContact O-N 3.37Å; G162-E166 VanDerWaalsContact C-OE2 3.29Å; G162-E166 VanDerWaalsContact CA-OE1 3.26Å; G162-E166 WeakPolarHBondContact CA-OE1 2.92Å; G162-E166 WeakPolarHBondContact CA-OE2 3.39Å; V163-E166 PolarHBondContact N-OE1 2.93Å; V163-E166 PolarHBondContact N-OE2 3.4Å; V163-E166 VanDerWaalsContact N-OE2 3.11Å; R164-E166 VanDerWaalsContact C-OE2 3.24Å; R164-E166 VanDerWaalsContact CA-OE2 3.24Å; R164-E166 WeakPolarHBondContact CA-OE2 3.04Å; R164-E166 WeakPolarHBondContact CB-OE2 3.47Å; R164-E166 PolarHBondContact N-OE2 3.39Å; R164-E166 PolarHBondContact O-N 2.92Å
167	Q	83.5	Confident	82.1	Confident	98 Å²	98	69.4 Å²	69.4	46%	0.458	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	133.6	-177.9	-55.1	-176.7	-4.8	0	0	110.7	Y160 N161	Y160-Q167 WeakPolarHBondContact CA-O 3.27Å; Y160-Q167 WeakPolarHBondContact CD1-O 3.24Å; N161-Q167 PolarHBondContact N-O 3.18Å; N161-Q167 PolarHBondContact ND2-OE1 2.66Å; N161-Q167 WeakPolarHBondContact O-CB 3.14Å; N161-Q167 PolarHBondContact O-N 2.88Å; N161-Q167 WeakPolarHBondContact OD1-CB 3.36Å
168	E	77.7	Confident	82.6	Confident	109 Å²	109	67.6 Å²	67.6	51%	0.509	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	132.8	175.7	-79.6	178.8	-178.7	0	0	111.6	Y160	Y160-E168 HydrophobicContact CD1-CG 4.05Å; Y160-E168 HydrophobicContact CE1-CB 4.41Å; Y160-E168 HydrophobicContact CE1-CG 3.25Å; Y160-E168 PolarHBondContact OH-OE1 3.02Å
169	I	78.8	Confident	83	Confident	50 Å²	50	66.3 Å²	66.3	26%	0.256	35%	0.351	S	S	.	.			trans	-101.9	106.6	169.8	-52.5	175.5	0	0	0	107.3	W159 N161 P171	W159-I169 PolarHBondContact O-N 3.48Å; N161-I169 HydrophobicContact CB-CD1 4.18Å; N161-I169 WeakPolarHBondContact OD1-CG1 3.34Å; I169-P171 WeakPolarHBondContact O-CD 3.48Å
170	N	77.6	Confident	82.6	Confident	61 Å²	61	65.9 Å²	65.9	33%	0.326	36%	0.359	S	S	.	.			trans	-71.6	109.9	170.9	179.7	-15	0	0	0	109.7	C172 Y173	N170-C172 PolarHBondContact O-N 3.16Å; N170-C172 WeakPolarHBondContact OD1-CA 3.41Å; N170-C172 WeakPolarHBondContact OD1-CB 3.34Å; N170-C172 PolarHBondContact OD1-N 3.42Å; N170-Y173 PolarHBondContact O-N 2.82Å
171	P	79.3	Confident	82	Confident	18 Å²	18	75 Å²	75	12%	0.117	40%	0.402	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-20.1	178.5	24.1	-35.9	0	0	0	114.9	W159 I169 P177 L187 I208 F211	W159-P171 HydrophobicContact CD2-CB 4.33Å; W159-P171 HydrophobicContact CD2-CG 4.29Å; W159-P171 HydrophobicContact CE3-CB 3.88Å; W159-P171 HydrophobicContact CE3-CG 4.27Å; W159-P171 HydrophobicContact CH2-CB 3.86Å; W159-P171 HydrophobicContact CZ2-CB 4.29Å; W159-P171 HydrophobicContact CZ3-CB 3.66Å; W159-P171 HydrophobicContact CZ3-CG 4.48Å; I169-P171 WeakPolarHBondContact O-CD 3.48Å; P171-P177 WeakPolarHBondContact O-CD 3.03Å; P171-L187 HydrophobicContact CG-CD2 3.52Å; P171-I208 HydrophobicContact CG-CG2 4.45Å; P171-F211 HydrophobicContact CB-CB 4.28Å; P171-F211 HydrophobicContact CB-CD1 3.69Å; P171-F211 HydrophobicContact CB-CE1 4.41Å; P171-F211 HydrophobicContact CB-CG 4.17Å; P171-F211 HydrophobicContact CG-CB 3.82Å; P171-F211 HydrophobicContact CG-CD1 3.99Å; P171-F211 HydrophobicContact CG-CG 4.24Å
172	C	84	Confident	81.9	Confident	25 Å²	25	79.2 Å²	79.2	17%	0.169	42%	0.418	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.6	-2.1	-178.7	-58	0	0	0	0	113.9	N170 C185	N170-C172 PolarHBondContact O-N 3.16Å; N170-C172 WeakPolarHBondContact OD1-CA 3.41Å; N170-C172 WeakPolarHBondContact OD1-CB 3.34Å; N170-C172 PolarHBondContact OD1-N 3.42Å; C172-C185 VanDerWaalsContact CA-SG 3.55Å; C172-C185 HydrophobicContact CB-CB 3.64Å; C172-C185 WeakPolarHBondContact CB-SG 3.3Å; C172-C185 VanDerWaalsContact SG-C 3.55Å; C172-C185 WeakPolarHBondContact SG-CB 3.36Å; C172-C185 PolarHBondContact SG-O 3.43Å; C172-C185 CovalentContact SG-SG 2.04Å; C172-C185 PolarHBondContact SG-SG 2.79Å
173	Y	79.1	Confident	81.9	Confident	177 Å²	177	78.8 Å²	78.8	69%	0.694	41%	0.41	S	S	*	.	S	Bend	trans	-141.4	140.3	-171.9	-174.5	-89.6	0	0	0	111.9	N170	N170-Y173 PolarHBondContact O-N 2.82Å
174	P	73.4	Confident	81.9	Confident	107 Å²	107	77 Å²	77	70%	0.695	40%	0.399	S	S	*	.	S	Bend	cis	-78.7	-13.2	4.2	32.4	-36.9	0	0	0	114.7
175	T	77	Confident	81.8	Confident	110 Å²	110	73 Å²	73	68%	0.675	39%	0.388	S	S	*	.	S	Bend	trans	-118.5	126.8	179.4	52	0	0	0	0	110.1
176	S	82.7	Confident	81.7	Confident	59 Å²	59	76.6 Å²	76.6	41%	0.413	40%	0.404	S	S	.	.			trans	-58.6	137.3	170.6	-177.7	0	0	0	0	110.5	C178	S176-C178 WeakPolarHBondContact OG-CB 3.46Å; S176-C178 PolarHBondContact OG-N 3.07Å; S176-C178 VanDerWaalsContact OG-N 3.14Å
177	P	84.8	Confident	81.3	Confident	33 Å²	33	75.2 Å²	75.2	21%	0.214	40%	0.399	C	S	.	.	S	Bend	trans	-78.3	-6.6	170.1	34.5	-35.1	0	0	0	112.3	P171 C185 F211 Y223	P171-P177 WeakPolarHBondContact O-CD 3.03Å; P177-C185 WeakPolarHBondContact CD-SG 3.46Å; P177-F211 HydrophobicContact CB-CE2 3.93Å; P177-F211 HydrophobicContact CB-CZ 4.07Å; P177-F211 HydrophobicContact CG-CD2 3.6Å; P177-F211 HydrophobicContact CG-CE1 4.5Å; P177-F211 HydrophobicContact CG-CE2 3.42Å; P177-F211 VanDerWaalsContact CG-CE2 3.42Å; P177-F211 HydrophobicContact CG-CG 4.23Å; P177-F211 HydrophobicContact CG-CZ 3.92Å; P177-Y223 HydrophobicContact CB-CD1 4.18Å; P177-Y223 HydrophobicContact CB-CE1 4.49Å; P177-Y223 WeakPolarHBondContact O-CD1 3.44Å
178	C	88.4	Confident	80.9	Confident	11 Å²	11	73.4 Å²	73.4	7%	0.074	39%	0.392	C	S	.	.			trans	-89.2	139.5	-179	-42.9	0	0	0	0	111.2	S176 S183 C185 C213 Y223	S176-C178 WeakPolarHBondContact OG-CB 3.46Å; S176-C178 PolarHBondContact OG-N 3.07Å; S176-C178 VanDerWaalsContact OG-N 3.14Å; C178-S183 VanDerWaalsContact CB-OG 3.29Å; C178-S183 WeakPolarHBondContact CB-OG 3.48Å; C178-S183 PolarHBondContact O-OG 3.37Å; C178-C185 VanDerWaalsContact SG-CB 3.57Å; C178-C213 WeakPolarHBondContact CA-SG 3.27Å; C178-C213 HydrophobicContact CB-CB 3.69Å; C178-C213 WeakPolarHBondContact CB-SG 3.29Å; C178-C213 WeakPolarHBondContact SG-CA 2.98Å; C178-C213 WeakPolarHBondContact SG-CB 3.42Å; C178-C213 CovalentContact SG-SG 2.03Å; C178-C213 PolarHBondContact SG-SG 3.09Å; C178-Y223 CarbonylContact C-O 3.48Å
179	L	82.6	Confident	80.6	Confident	97 Å²	97	69.1 Å²	69.1	51%	0.508	37%	0.374	S	S	.	.			trans	-105.5	151.6	-177.8	-62.9	172.6	0	0	0	112.1	S183 Y223 C224 D225	L179-S183 VanDerWaalsContact O-CB 3.31Å; L179-S183 WeakPolarHBondContact O-CB 3.29Å; L179-S183 PolarHBondContact O-OG 2.84Å; L179-S183 VanDerWaalsContact O-OG 3.08Å; L179-Y223 WeakPolarHBondContact CB-O 3.37Å; L179-Y223 PolarHBondContact N-O 2.94Å; L179-C224 WeakPolarHBondContact O-CB 3.41Å; L179-D225 HydrophobicContact CD1-CB 4.05Å
180	G	72.7	Confident	79.9	Confident	32 Å²	32	68.5 Å²	68.5	33%	0.33	37%	0.374	S	S	.	.	S	Bend	trans	90.6	139.6	-174.3	0	0	0	0	0	112.5	K182 S183	G180-K182 PolarHBondContact O-N 3.05Å; G180-S183 WeakPolarHBondContact O-CB 3.06Å; G180-S183 PolarHBondContact O-N 3.32Å; G180-S183 PolarHBondContact O-OG 2.03Å
181	E	74.6	Confident	78.9	Confident	201 Å²	201	72.5 Å²	72.5	94%	0.939	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-21.1	-163.9	-60.7	-179	140.5	0	0	115.4
182	K	82.9	Confident	77.7	Confident	148 Å²	148	77 Å²	77	64%	0.643	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.8	10.9	179.3	-53.6	-176.5	-163.5	151.4	0	113.6	G180 D216	G180-K182 PolarHBondContact O-N 3.05Å; K182-D216 HydrophobicContact CB-CB 4.2Å; K182-D216 WeakPolarHBondContact CD-OD2 3.46Å; K182-D216 IonicContact NZ-OD2 3.41Å
183	S	84.5	Confident	75.7	Confident	21 Å²	21	83 Å²	83	15%	0.147	43%	0.431	C	S	.	.			trans	-75.4	138.8	177.5	66.1	0	0	0	0	111.6	C178 L179 G180 E214	C178-S183 VanDerWaalsContact CB-OG 3.29Å; C178-S183 WeakPolarHBondContact CB-OG 3.48Å; C178-S183 PolarHBondContact O-OG 3.37Å; L179-S183 VanDerWaalsContact O-CB 3.31Å; L179-S183 WeakPolarHBondContact O-CB 3.29Å; L179-S183 PolarHBondContact O-OG 2.84Å; L179-S183 VanDerWaalsContact O-OG 3.08Å; G180-S183 WeakPolarHBondContact O-CB 3.06Å; G180-S183 PolarHBondContact O-N 3.32Å; G180-S183 PolarHBondContact O-OG 2.03Å; S183-E214 CarbonylContact C-O 3.23Å; S183-E214 WeakPolarHBondContact CA-O 3.02Å
184	V	88.2	Confident	73.6	Confident	67 Å²	67	81.6 Å²	81.6	41%	0.406	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	128.6	-175.7	-174.7	0	0	0	0	110.1	C213 E214	V184-C213 WeakPolarHBondContact O-CA 3.26Å; V184-E214 HydrophobicContact CB-CB 4.3Å; V184-E214 PolarHBondContact N-O 3.32Å; V184-E214 PolarHBondContact O-N 3.21Å
185	C	88.1	Confident	71.9	Confident	26 Å²	26	81.7 Å²	81.7	18%	0.176	44%	0.438	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	116	177.2	-171.1	0	0	0	0	110.7	C172 P177 C178	C172-C185 VanDerWaalsContact CA-SG 3.55Å; C172-C185 HydrophobicContact CB-CB 3.64Å; C172-C185 WeakPolarHBondContact CB-SG 3.3Å; C172-C185 VanDerWaalsContact SG-C 3.55Å; C172-C185 WeakPolarHBondContact SG-CB 3.36Å; C172-C185 PolarHBondContact SG-O 3.43Å; C172-C185 CovalentContact SG-SG 2.04Å; C172-C185 PolarHBondContact SG-SG 2.79Å; P177-C185 WeakPolarHBondContact CD-SG 3.46Å; C178-C185 VanDerWaalsContact SG-CB 3.57Å
186	H	86.5	Confident	69.7	Low	76 Å²	76	80.9 Å²	80.9	35%	0.352	44%	0.438	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	135.2	177.5	-62.7	-75.7	0	0	0	110.9	F211 L212 E214	H186-F211 CarbonylContact O-C 3.49Å; H186-F211 VanDerWaalsContact O-CA 3.24Å; H186-F211 WeakPolarHBondContact O-CA 3.45Å; H186-L212 HydrophobicContact CB-CB 4.47Å; H186-L212 PolarHBondContact N-O 3.49Å; H186-L212 PolarHBondContact O-N 3.2Å; H186-E214 IonicContact CD2-OE2 3.79Å; H186-E214 IonicContact CE1-OE2 3.36Å; H186-E214 IonicContact NE2-OE2 3.37Å; H186-E214 PolarHBondContact NE2-OE2 2.8Å
187	L	81.1	Confident	67.3	Low	54 Å²	54	80.3 Å²	80.3	28%	0.283	44%	0.441	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	126.5	173.6	-67.9	178.7	0	0	0	111.2	P171 T189 I208	P171-L187 HydrophobicContact CG-CD2 3.52Å; L187-T189 PolarHBondContact O-N 3.05Å; L187-I208 HydrophobicContact CD1-CD1 4.34Å; L187-I208 HydrophobicContact CD2-CD1 4.49Å; L187-I208 HydrophobicContact CD2-CG2 4.35Å
188	L	75	Confident	64.8	Low	59 Å²	59	84.8 Å²	84.8	31%	0.309	47%	0.47	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	90.3	173.1	-63.1	-179.5	0	0	0	109.2	V209 D210 L212	L188-V209 WeakPolarHBondContact O-CB 3.49Å; L188-V209 PolarHBondContact O-N 2.74Å; L188-D210 WeakPolarHBondContact CA-O 3.31Å; L188-D210 HydrophobicContact CB-CB 4.33Å; L188-D210 WeakPolarHBondContact CB-O 3.26Å; L188-D210 HydrophobicContact CD1-CB 4.23Å; L188-D210 PolarHBondContact N-O 3.07Å; L188-D210 PolarHBondContact O-N 3.23Å; L188-L212 HydrophobicContact CD1-CB 4.09Å; L188-L212 HydrophobicContact CD2-CB 4.27Å; L188-L212 HydrophobicContact CG-CB 4.15Å
189	T	70.6	Confident	62.1	Low	20 Å²	20	88.9 Å²	88.9	12%	0.123	50%	0.498	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	167.2	175.5	73.2	0	0	0	0	112.1	L187 K191 N192 E206 Y207	L187-T189 PolarHBondContact O-N 3.05Å; T189-K191 PolarHBondContact O-N 3.22Å; T189-K191 PolarHBondContact OG1-N 3.05Å; T189-N192 PolarHBondContact O-N 3.43Å; T189-N192 VanDerWaalsContact O-N 3.08Å; T189-E206 VanDerWaalsContact CB-CG 3.49Å; T189-E206 VanDerWaalsContact CB-OE1 3.3Å; T189-E206 WeakPolarHBondContact CB-OE1 3.08Å; T189-E206 HydrophobicContact CG2-CG 3.89Å; T189-E206 WeakPolarHBondContact CG2-OE1 3.39Å; T189-E206 PolarHBondContact OG1-OE1 2.94Å; T189-Y207 CarbonylContact C-O 3.38Å; T189-Y207 VanDerWaalsContact CA-O 3.27Å; T189-Y207 WeakPolarHBondContact CA-O 3.42Å
190	S	63.9	Low	59.8	Low	36 Å²	36	92.5 Å²	92.5	25%	0.252	51%	0.511	S	S	.	.	G	3₁₀ helix	trans	-61.7	-18.1	175.2	59.1	0	0	0	0	114.3	Y207	S190-Y207 PolarHBondContact N-O 3.4Å; S190-Y207 WeakPolarHBondContact OG-CD1 3.06Å; S190-Y207 PolarHBondContact OG-N 3.39Å; S190-Y207 VanDerWaalsContact OG-N 3.11Å
191	K	57.7	Low	57.8	Low	146 Å²	146	96 Å²	96	64%	0.635	53%	0.529	S	S	*	.	G	3₁₀ helix	trans	-77.1	-31.7	171.8	-69.6	-172.5	-171	151.4	0	113.3	T189 R193 E206	T189-K191 PolarHBondContact O-N 3.22Å; T189-K191 PolarHBondContact OG1-N 3.05Å; K191-R193 PolarHBondContact O-N 3.36Å; K191-E206 VanDerWaalsContact CD-CD 3.49Å; K191-E206 HydrophobicContact CD-CG 4.25Å; K191-E206 WeakPolarHBondContact CD-OE1 3.46Å; K191-E206 WeakPolarHBondContact CD-OE2 3.27Å; K191-E206 WeakPolarHBondContact CE-OE2 3.42Å; K191-E206 HydrophobicContact CG-CB 4.44Å; K191-E206 HydrophobicContact CG-CG 4.07Å; K191-E206 IonicContact NZ-OE2 3.62Å; K191-E206 PolarHBondContact NZ-OE2 2.88Å
192	N	53	Low	55.8	Low	113 Å²	113	92.3 Å²	92.3	60%	0.604	52%	0.515	S	S	*	.	G	3₁₀ helix	trans	-78.3	21.8	-177.9	-72.5	-7.2	0	0	0	113.3	T189	T189-N192 PolarHBondContact O-N 3.43Å; T189-N192 VanDerWaalsContact O-N 3.08Å
193	R	43.3	Very low	53.6	Low	151 Å²	151	90.2 Å²	90.2	57%	0.57	51%	0.508	S	S	*	.			trans	-120.2	112.7	170.2	-66.6	-174.2	175	-161.8	-2.4	109.9	K191 V195	K191-R193 PolarHBondContact O-N 3.36Å; R193-V195 VanDerWaalsContact C-N 3.25Å; R193-V195 HydrophobicContact CB-CG2 3.62Å; R193-V195 PolarHBondContact O-N 3.49Å
194	T	35.4	Very low	51.3	Low	147 Å²	147	99.9 Å²	99.9	90%	0.902	55%	0.547	S	S	*	.			trans	-70.3	82.2	162	48.2	0	0	0	0	109.4	S196	T194-S196 PolarHBondContact O-N 3.19Å
195	V	37.6	Very low	49.4	Very low	108 Å²	108	98.7 Å²	98.7	66%	0.655	54%	0.541	S	S	*	.			trans	-86.3	97.3	179.8	-174.3	0	0	0	0	110.5	R193 G197	R193-V195 VanDerWaalsContact C-N 3.25Å; R193-V195 HydrophobicContact CB-CG2 3.62Å; R193-V195 PolarHBondContact O-N 3.49Å; V195-G197 VanDerWaalsContact C-N 3.31Å; V195-G197 PolarHBondContact O-N 3.1Å; V195-G197 VanDerWaalsContact O-N 3.17Å
196	S	30.5	Very low	48	Very low	94 Å²	94	101.3 Å²	101.3	66%	0.657	55%	0.551	S	S	*	*			trans	-83.4	70.2	168.9	33.8	0	0	0	0	111	T194	T194-S196 PolarHBondContact O-N 3.19Å
197	G	31.4	Very low	46.8	Very low	46 Å²	46	102.6 Å²	102.6	47%	0.474	55%	0.554	S	S	.	*	S	Bend	trans	-171.1	144.6	176.7	0	0	0	0	0	112.2	V195	V195-G197 VanDerWaalsContact C-N 3.31Å; V195-G197 PolarHBondContact O-N 3.1Å; V195-G197 VanDerWaalsContact O-N 3.17Å
198	P	33.5	Very low	46.1	Very low	128 Å²	128	100.6 Å²	100.6	83%	0.831	54%	0.543	S	S	*	.			trans	-82.7	135.1	-157.6	30.1	-35.8	0	0	0	116.2
199	S	31.2	Very low	45.8	Very low	96 Å²	96	99.8 Å²	99.8	67%	0.671	54%	0.54	S	S	*	.			trans	48	102.9	145.5	-61.2	0	0	0	0	120.4
200	F	35	Very low	46	Very low	174 Å²	174	100.8 Å²	100.8	76%	0.763	55%	0.545	S	S	*	.				-127.5	90.9	126.3	-133.2	-90.4	0	0	0	110.2	I202	F200-I202 VanDerWaalsContact C-N 3.34Å; F200-I202 HydrophobicContact CE1-CD1 4.44Å; F200-I202 PolarHBondContact O-N 3.21Å; F200-I202 VanDerWaalsContact O-N 3.12Å
201	S	28.8	Very low	46.9	Very low	104 Å²	104	99.7 Å²	99.7	73%	0.727	54%	0.536	S	S	*	.			trans	-88.2	55	-167.7	40.5	0	0	0	0	114.1
202	I	32.6	Very low	48.1	Very low	125 Å²	125	97.2 Å²	97.2	64%	0.641	53%	0.529	S	S	*	.			trans	-133.1	92.8	158.6	-58.3	89	0	0	0	109.3	F200	F200-I202 VanDerWaalsContact C-N 3.34Å; F200-I202 HydrophobicContact CE1-CD1 4.44Å; F200-I202 PolarHBondContact O-N 3.21Å; F200-I202 VanDerWaalsContact O-N 3.12Å
203	H	36.9	Very low	49.8	Very low	104 Å²	104	92.4 Å²	92.4	48%	0.481	50%	0.504	S	S	.	.			trans	176.4	128.1	131.5	-100.5	-75.9	0	0	0	108.1
204	K	37.8	Very low	51.8	Low	223 Å²	223	90.5 Å²	90.5	97%	0.97	50%	0.502	S	S	*	.			trans	-92.4	4.6	-176	-127.1	177.4	-175.2	178.6	0	113.6
205	S	47.4	Very low	54.2	Low	42 Å²	42	85.3 Å²	85.3	29%	0.294	47%	0.471	S	S	.	.	S	Bend	trans	-83.2	135.5	173.6	35.8	0	0	0	0	110.8	Y207	S205-Y207 PolarHBondContact O-N 2.91Å
206	E	58.8	Low	56.1	Low	82 Å²	82	81 Å²	81	38%	0.383	44%	0.444	S	S	.	.			trans	-73.5	117.3	162.4	176.1	167.5	-157.1	0	0	107.6	T189 K191	T189-E206 VanDerWaalsContact CB-CG 3.49Å; T189-E206 VanDerWaalsContact CB-OE1 3.3Å; T189-E206 WeakPolarHBondContact CB-OE1 3.08Å; T189-E206 HydrophobicContact CG2-CG 3.89Å; T189-E206 WeakPolarHBondContact CG2-OE1 3.39Å; T189-E206 PolarHBondContact OG1-OE1 2.94Å; K191-E206 VanDerWaalsContact CD-CD 3.49Å; K191-E206 HydrophobicContact CD-CG 4.25Å; K191-E206 WeakPolarHBondContact CD-OE1 3.46Å; K191-E206 WeakPolarHBondContact CD-OE2 3.27Å; K191-E206 WeakPolarHBondContact CE-OE2 3.42Å; K191-E206 HydrophobicContact CG-CB 4.44Å; K191-E206 HydrophobicContact CG-CG 4.07Å; K191-E206 IonicContact NZ-OE2 3.62Å; K191-E206 PolarHBondContact NZ-OE2 2.88Å
207	Y	62.3	Low	58.3	Low	102 Å²	102	81 Å²	81	40%	0.4	44%	0.442	S	S	.	.			trans	-118.4	144.8	-172.9	64.6	-96.9	0	0	0	111.5	Y160 T189 S190 S205 V209	Y160-Y207 VanDerWaalsContact OH-CA 3.26Å; Y160-Y207 WeakPolarHBondContact OH-CA 3.21Å; Y160-Y207 VanDerWaalsContact OH-CB 3.29Å; Y160-Y207 WeakPolarHBondContact OH-CB 3.31Å; T189-Y207 CarbonylContact C-O 3.38Å; T189-Y207 VanDerWaalsContact CA-O 3.27Å; T189-Y207 WeakPolarHBondContact CA-O 3.42Å; S190-Y207 PolarHBondContact N-O 3.4Å; S190-Y207 WeakPolarHBondContact OG-CD1 3.06Å; S190-Y207 PolarHBondContact OG-N 3.39Å; S190-Y207 VanDerWaalsContact OG-N 3.11Å; S205-Y207 PolarHBondContact O-N 2.91Å; Y207-V209 HydrophobicContact CD2-CG2 3.92Å; Y207-V209 HydrophobicContact CE2-CG2 3.78Å; Y207-V209 PolarHBondContact O-N 2.94Å
208	I	65.4	Low	60.2	Low	13 Å²	13	82.8 Å²	82.8	7%	0.067	44%	0.441	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	127.4	179.3	-56.3	176.6	0	0	0	108.6	W159 Y160 P171 L187	W159-I208 HydrophobicContact CB-CB 4.17Å; W159-I208 HydrophobicContact CB-CG2 3.96Å; W159-I208 HydrophobicContact CG-CG2 3.89Å; Y160-I208 PolarHBondContact OH-N 3.1Å; P171-I208 HydrophobicContact CG-CG2 4.45Å; L187-I208 HydrophobicContact CD1-CD1 4.34Å; L187-I208 HydrophobicContact CD2-CD1 4.49Å; L187-I208 HydrophobicContact CD2-CG2 4.35Å
209	V	68.4	Low	62.3	Low	41 Å²	41	80.5 Å²	80.5	25%	0.248	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	-40.8	179.7	-163.3	0	0	0	0	111.1	W159 L188 Y207	W159-V209 PolarHBondContact NE1-O 2.66Å; L188-V209 WeakPolarHBondContact O-CB 3.49Å; L188-V209 PolarHBondContact O-N 2.74Å; Y207-V209 HydrophobicContact CD2-CG2 3.92Å; Y207-V209 HydrophobicContact CE2-CG2 3.78Å; Y207-V209 PolarHBondContact O-N 2.94Å
210	D	74.3	Confident	64.4	Low	42 Å²	42	77.8 Å²	77.8	23%	0.225	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.2	-171.6	175.5	-147.3	-24.9	0	0	0	110.4	L188 R222	L188-D210 WeakPolarHBondContact CA-O 3.31Å; L188-D210 HydrophobicContact CB-CB 4.33Å; L188-D210 WeakPolarHBondContact CB-O 3.26Å; L188-D210 HydrophobicContact CD1-CB 4.23Å; L188-D210 PolarHBondContact N-O 3.07Å; L188-D210 PolarHBondContact O-N 3.23Å; D210-R222 IonicContact OD1-CZ 2.79Å; D210-R222 IonicContact OD1-NH2 2.63Å; D210-R222 PolarHBondContact OD1-NH2 3.22Å; D210-R222 IonicContact OD2-CZ 2.76Å; D210-R222 IonicContact OD2-NH2 2.82Å; D210-R222 PolarHBondContact OD2-NH2 2.8Å
211	F	83.9	Confident	66.1	Low	12 Å²	12	71 Å²	71	5%	0.053	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	161.6	164.6	65.9	-81.9	0	0	0	110.5	W159 P171 P177 H186 Y223	W159-F211 HydrophobicContact CH2-CD1 4.02Å; W159-F211 AromaticContact CH2-CE1 3.83Å; W159-F211 HydrophobicContact CH2-CE1 3.83Å; W159-F211 AromaticContact CZ2-CD1 3.79Å; W159-F211 HydrophobicContact CZ2-CD1 3.79Å; W159-F211 AromaticContact CZ2-CE1 3.85Å; W159-F211 HydrophobicContact CZ2-CE1 3.85Å; P171-F211 HydrophobicContact CB-CB 4.28Å; P171-F211 HydrophobicContact CB-CD1 3.69Å; P171-F211 HydrophobicContact CB-CE1 4.41Å; P171-F211 HydrophobicContact CB-CG 4.17Å; P171-F211 HydrophobicContact CG-CB 3.82Å; P171-F211 HydrophobicContact CG-CD1 3.99Å; P171-F211 HydrophobicContact CG-CG 4.24Å; P177-F211 HydrophobicContact CB-CE2 3.93Å; P177-F211 HydrophobicContact CB-CZ 4.07Å; P177-F211 HydrophobicContact CG-CD2 3.6Å; P177-F211 HydrophobicContact CG-CE1 4.5Å; P177-F211 HydrophobicContact CG-CE2 3.42Å; P177-F211 VanDerWaalsContact CG-CE2 3.42Å; P177-F211 HydrophobicContact CG-CG 4.23Å; P177-F211 HydrophobicContact CG-CZ 3.92Å; H186-F211 CarbonylContact O-C 3.49Å; H186-F211 VanDerWaalsContact O-CA 3.24Å; H186-F211 WeakPolarHBondContact O-CA 3.45Å; F211-Y223 HydrophobicContact CE2-CD1 4.43Å; F211-Y223 HydrophobicContact CE2-CE1 4.38Å; F211-Y223 HydrophobicContact CZ-CD1 4.22Å; F211-Y223 AromaticContact CZ-CE1 3.74Å; F211-Y223 HydrophobicContact CZ-CE1 3.74Å
212	L	83.2	Confident	68.7	Low	94 Å²	94	71.8 Å²	71.8	49%	0.492	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	132.3	172.8	176.6	62.8	0	0	0	109	H186 L188	H186-L212 HydrophobicContact CB-CB 4.47Å; H186-L212 PolarHBondContact N-O 3.49Å; H186-L212 PolarHBondContact O-N 3.2Å; L188-L212 HydrophobicContact CD1-CB 4.09Å; L188-L212 HydrophobicContact CD2-CB 4.27Å; L188-L212 HydrophobicContact CG-CB 4.15Å
213	C	87.4	Confident	71.2	Confident	13 Å²	13	69.5 Å²	69.5	9%	0.088	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	116.9	167.7	-67.1	0	0	0	0	109.8	C178 V184 R222 C224	C178-C213 WeakPolarHBondContact CA-SG 3.27Å; C178-C213 HydrophobicContact CB-CB 3.69Å; C178-C213 WeakPolarHBondContact CB-SG 3.29Å; C178-C213 WeakPolarHBondContact SG-CA 2.98Å; C178-C213 WeakPolarHBondContact SG-CB 3.42Å; C178-C213 CovalentContact SG-SG 2.03Å; C178-C213 PolarHBondContact SG-SG 3.09Å; V184-C213 WeakPolarHBondContact O-CA 3.26Å; C213-R222 WeakPolarHBondContact CB-O 3.45Å; C213-R222 PolarHBondContact SG-O 3.02Å; C213-C224 VanDerWaalsContact CB-SG 3.56Å
214	E	86	Confident	73.6	Confident	111 Å²	111	64.5 Å²	64.5	52%	0.519	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	118.7	164	-178.8	177.2	-170	0	0	107.4	S183 V184 H186	S183-E214 CarbonylContact C-O 3.23Å; S183-E214 WeakPolarHBondContact CA-O 3.02Å; V184-E214 HydrophobicContact CB-CB 4.3Å; V184-E214 PolarHBondContact N-O 3.32Å; V184-E214 PolarHBondContact O-N 3.21Å; H186-E214 IonicContact CD2-OE2 3.79Å; H186-E214 IonicContact CE1-OE2 3.36Å; H186-E214 IonicContact NE2-OE2 3.37Å; H186-E214 PolarHBondContact NE2-OE2 2.8Å
215	C	85.3	Confident	75.7	Confident	38 Å²	38	57.5 Å²	57.5	26%	0.257	29%	0.292	S	S	.	.	P	Polyproline II helix	trans	-93.4	152.2	-170	-58.1	0	0	0	0	113.3	Y219 C224	C215-Y219 VanDerWaalsContact CB-O 3.3Å; C215-Y219 WeakPolarHBondContact CB-O 3.26Å; C215-C224 WeakPolarHBondContact CA-SG 3.08Å; C215-C224 HydrophobicContact CB-CB 3.81Å; C215-C224 WeakPolarHBondContact CB-SG 3.45Å; C215-C224 WeakPolarHBondContact SG-CA 3.49Å; C215-C224 WeakPolarHBondContact SG-CB 3.29Å; C215-C224 CovalentContact SG-SG 2.04Å; C215-C224 PolarHBondContact SG-SG 3.08Å
216	D	78.9	Confident	76.9	Confident	16 Å²	16	59 Å²	59	9%	0.086	29%	0.294	C	S	.	.	P	Polyproline II helix	trans	-54.3	143.8	160.9	176.9	-82.6	0	0	0	109.5	K182 N218 Y219	K182-D216 HydrophobicContact CB-CB 4.2Å; K182-D216 WeakPolarHBondContact CD-OD2 3.46Å; K182-D216 IonicContact NZ-OD2 3.41Å; D216-N218 PolarHBondContact O-N 3.21Å; D216-N218 WeakPolarHBondContact OD1-CB 3.44Å; D216-N218 PolarHBondContact OD1-N 3.27Å; D216-N218 PolarHBondContact OD1-ND2 2.79Å; D216-Y219 HydrophobicContact CB-CD2 4.16Å; D216-Y219 PolarHBondContact O-N 2.96Å
217	P	76.8	Confident	77.2	Confident	94 Å²	94	61.6 Å²	61.6	61%	0.61	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.3	-19.2	-176.5	-30.4	36.6	0	0	0	116.5	R228	P217-R228 PolarHBondContact O-NH1 3.46Å
218	N	70.2	Confident	77.2	Confident	84 Å²	84	62.9 Å²	62.9	45%	0.449	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.4	-1.6	177.5	-58	-85.7	0	0	0	114	D216 K227 R228	D216-N218 PolarHBondContact O-N 3.21Å; D216-N218 WeakPolarHBondContact OD1-CB 3.44Å; D216-N218 PolarHBondContact OD1-N 3.27Å; D216-N218 PolarHBondContact OD1-ND2 2.79Å; N218-K227 CarbonylContact O-C 3.58Å; N218-K227 WeakPolarHBondContact O-CA 3.22Å; N218-K227 WeakPolarHBondContact O-CG 3.46Å; N218-R228 PolarHBondContact O-N 2.85Å
219	Y	77.4	Confident	77	Confident	80 Å²	80	66 Å²	66	31%	0.314	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	155.6	-172.6	-71.7	-92.5	0	0	0	112.3	C215 D216 C224 K226 K227	C215-Y219 VanDerWaalsContact CB-O 3.3Å; C215-Y219 WeakPolarHBondContact CB-O 3.26Å; D216-Y219 HydrophobicContact CB-CD2 4.16Å; D216-Y219 PolarHBondContact O-N 2.96Å; Y219-C224 WeakPolarHBondContact CD1-O 3.42Å; Y219-K226 CarbonylContact C-O 3.26Å; Y219-K226 VanDerWaalsContact CA-O 3.3Å; Y219-K226 WeakPolarHBondContact CA-O 3.5Å; Y219-K227 HydrophobicContact CE1-CB 4.4Å
220	F	76.3	Confident	76.6	Confident	39 Å²	39	65.8 Å²	65.8	17%	0.171	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.7	-179.4	178.3	75.4	-75	0	0	0	111.1	C224 D225 K226 R228 E1096	F220-C224 CarbonylContact O-C 3.6Å; F220-C224 WeakPolarHBondContact O-CA 3.45Å; F220-D225 PolarHBondContact O-N 3.09Å; F220-K226 HydrophobicContact CD1-CB 3.71Å; F220-K226 WeakPolarHBondContact CD1-O 3.39Å; F220-K226 HydrophobicContact CD2-CB 4.25Å; F220-K226 HydrophobicContact CD2-CD 4.45Å; F220-K226 HydrophobicContact CE1-CB 3.43Å; F220-K226 VanDerWaalsContact CE1-CB 3.43Å; F220-K226 HydrophobicContact CE2-CB 4Å; F220-K226 HydrophobicContact CE2-CD 3.83Å; F220-K226 HydrophobicContact CG-CB 4.12Å; F220-K226 HydrophobicContact CZ-CB 3.6Å; F220-K226 HydrophobicContact CZ-CD 3.94Å; F220-K226 HydrophobicContact CZ-CG 4.39Å; F220-K226 PolarHBondContact N-O 3.05Å; F220-K226 PolarHBondContact O-N 3.38Å; F220-R228 HydrophobicContact CD1-CB 4.17Å; F220-E1096 HydrophobicContact CE2-CG 4Å; F220-E1096 HydrophobicContact CZ-CG 4.43Å; F220-E1096 WeakPolarHBondContact CZ-OE2 3.16Å
221	G	71.2	Confident	76.2	Confident	31 Å²	31	65 Å²	65	32%	0.32	32%	0.322	S	S	.	.	S	Bend	trans	92.4	164.2	-171.2	0	0	0	0	0	112	Y223 C224	G221-Y223 PolarHBondContact O-N 3.04Å; G221-Y223 VanDerWaalsContact O-N 3.12Å; G221-C224 PolarHBondContact O-N 3.46Å
222	R	81.5	Confident	75.1	Confident	122 Å²	122	68.8 Å²	68.8	46%	0.46	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.1	-28.1	-173.6	179.4	175.5	-177.3	154.8	6.1	113.2	D210 C213	D210-R222 IonicContact OD1-CZ 2.79Å; D210-R222 IonicContact OD1-NH2 2.63Å; D210-R222 PolarHBondContact OD1-NH2 3.22Å; D210-R222 IonicContact OD2-CZ 2.76Å; D210-R222 IonicContact OD2-NH2 2.82Å; D210-R222 PolarHBondContact OD2-NH2 2.8Å; C213-R222 WeakPolarHBondContact CB-O 3.45Å; C213-R222 PolarHBondContact SG-O 3.02Å
223	Y	86.7	Confident	73.9	Confident	76 Å²	76	71.5 Å²	71.5	30%	0.298	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112.4	12.6	-178.5	-54.6	-88.1	0	0	0	111.5	P177 C178 L179 F211 G221 D225	P177-Y223 HydrophobicContact CB-CD1 4.18Å; P177-Y223 HydrophobicContact CB-CE1 4.49Å; P177-Y223 WeakPolarHBondContact O-CD1 3.44Å; C178-Y223 CarbonylContact C-O 3.48Å; L179-Y223 WeakPolarHBondContact CB-O 3.37Å; L179-Y223 PolarHBondContact N-O 2.94Å; F211-Y223 HydrophobicContact CE2-CD1 4.43Å; F211-Y223 HydrophobicContact CE2-CE1 4.38Å; F211-Y223 HydrophobicContact CZ-CD1 4.22Å; F211-Y223 AromaticContact CZ-CE1 3.74Å; F211-Y223 HydrophobicContact CZ-CE1 3.74Å; G221-Y223 PolarHBondContact O-N 3.04Å; G221-Y223 VanDerWaalsContact O-N 3.12Å; Y223-D225 PolarHBondContact N-OD1 2.03Å; Y223-D225 PolarHBondContact O-N 2.03Å
224	C	86	Confident	72.6	Confident	0 Å²	0	75.2 Å²	75.2	0%	0	36%	0.363	C	S	.	.	S	Bend	trans	53.2	31.6	-169.4	-52.6	0	0	0	0	112.9	L179 C213 C215 Y219 F220 G221	L179-C224 WeakPolarHBondContact O-CB 3.41Å; C213-C224 VanDerWaalsContact CB-SG 3.56Å; C215-C224 WeakPolarHBondContact CA-SG 3.08Å; C215-C224 HydrophobicContact CB-CB 3.81Å; C215-C224 WeakPolarHBondContact CB-SG 3.45Å; C215-C224 WeakPolarHBondContact SG-CA 3.49Å; C215-C224 WeakPolarHBondContact SG-CB 3.29Å; C215-C224 CovalentContact SG-SG 2.04Å; C215-C224 PolarHBondContact SG-SG 3.08Å; Y219-C224 WeakPolarHBondContact CD1-O 3.42Å; F220-C224 CarbonylContact O-C 3.6Å; F220-C224 WeakPolarHBondContact O-CA 3.45Å; G221-C224 PolarHBondContact O-N 3.46Å
225	D	81.8	Confident	71.7	Confident	75 Å²	75	76 Å²	76	40%	0.401	37%	0.37	S	S	.	.			trans	-79.5	-28.5	-174.4	51.4	-67	0	0	0	113.4	L179 F220 Y223	L179-D225 HydrophobicContact CD1-CB 4.05Å; F220-D225 PolarHBondContact O-N 3.09Å; Y223-D225 PolarHBondContact N-OD1 2.03Å; Y223-D225 PolarHBondContact O-N 2.03Å
226	K	72.4	Confident	71.3	Confident	75 Å²	75	75.4 Å²	75.4	33%	0.326	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	130.5	-177.1	-55.8	-174.3	-179.6	-179.2	0	110	Y219 F220	Y219-K226 CarbonylContact C-O 3.26Å; Y219-K226 VanDerWaalsContact CA-O 3.3Å; Y219-K226 WeakPolarHBondContact CA-O 3.5Å; F220-K226 HydrophobicContact CD1-CB 3.71Å; F220-K226 WeakPolarHBondContact CD1-O 3.39Å; F220-K226 HydrophobicContact CD2-CB 4.25Å; F220-K226 HydrophobicContact CD2-CD 4.45Å; F220-K226 HydrophobicContact CE1-CB 3.43Å; F220-K226 VanDerWaalsContact CE1-CB 3.43Å; F220-K226 HydrophobicContact CE2-CB 4Å; F220-K226 HydrophobicContact CE2-CD 3.83Å; F220-K226 HydrophobicContact CG-CB 4.12Å; F220-K226 HydrophobicContact CZ-CB 3.6Å; F220-K226 HydrophobicContact CZ-CD 3.94Å; F220-K226 HydrophobicContact CZ-CG 4.39Å; F220-K226 PolarHBondContact N-O 3.05Å; F220-K226 PolarHBondContact O-N 3.38Å
227	K	66.5	Low	71.3	Confident	135 Å²	135	80 Å²	80	59%	0.587	39%	0.386	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.3	125.8	174.4	-167.6	179.7	-177.4	-179.1	0	110	N218 Y219 N229	N218-K227 CarbonylContact O-C 3.58Å; N218-K227 WeakPolarHBondContact O-CA 3.22Å; N218-K227 WeakPolarHBondContact O-CG 3.46Å; Y219-K227 HydrophobicContact CE1-CB 4.4Å; K227-N229 PolarHBondContact O-N 3.28Å
228	R	61.3	Low	71.4	Confident	129 Å²	129	79.2 Å²	79.2	49%	0.487	38%	0.376	S	S	.	.	P	Polyproline II helix	trans	-60.5	117.9	-178.6	179.6	178.6	-78.7	-175.9	-6.4	110.3	P217 N218 F220 Q244	P217-R228 PolarHBondContact O-NH1 3.46Å; N218-R228 PolarHBondContact O-N 2.85Å; F220-R228 HydrophobicContact CD1-CB 4.17Å; R228-Q244 PolarHBondContact O-NE2 2.84Å
229	N	60.9	Low	71.3	Confident	78 Å²	78	78.6 Å²	78.6	42%	0.417	39%	0.39	S	S	.	.			trans	-94.6	107.5	177.2	-175.8	-3.5	0	0	0	110.6	K227 C231 K232	K227-N229 PolarHBondContact O-N 3.28Å; N229-C231 PolarHBondContact O-N 2.82Å; N229-C231 VanDerWaalsContact O-N 3.09Å; N229-C231 WeakPolarHBondContact OD1-CB 3.3Å; N229-C231 PolarHBondContact OD1-N 3.3Å; N229-C231 VanDerWaalsContact OD1-N 3.08Å; N229-K232 WeakPolarHBondContact O-CB 3.31Å; N229-K232 PolarHBondContact O-N 3.14Å
230	S	59.7	Low	71.3	Confident	37 Å²	37	75.4 Å²	75.4	26%	0.259	38%	0.38	S	S	.	.	G	3₁₀ helix	trans	-59.9	-21.8	-178.5	-48.4	0	0	0	0	113.7	K232 Q244	S230-K232 VanDerWaalsContact C-N 3.29Å; S230-K232 PolarHBondContact O-N 2.03Å; S230-Q244 PolarHBondContact OG-NE2 2.84Å
231	C	66.8	Low	71.4	Confident	25 Å²	25	77.7 Å²	77.7	17%	0.169	40%	0.397	C	S	.	.	G	3₁₀ helix	trans	-75.1	-11.7	176.6	-75.8	0	0	0	0	114.8	N229 F233 C242 L243	N229-C231 PolarHBondContact O-N 2.82Å; N229-C231 VanDerWaalsContact O-N 3.09Å; N229-C231 WeakPolarHBondContact OD1-CB 3.3Å; N229-C231 PolarHBondContact OD1-N 3.3Å; N229-C231 VanDerWaalsContact OD1-N 3.08Å; C231-F233 VanDerWaalsContact C-N 3.33Å; C231-C242 WeakPolarHBondContact CA-SG 3.38Å; C231-C242 HydrophobicContact CB-CB 3.54Å; C231-C242 WeakPolarHBondContact CB-SG 3.38Å; C231-C242 WeakPolarHBondContact SG-CB 3.38Å; C231-C242 CovalentContact SG-SG 2.03Å; C231-C242 PolarHBondContact SG-SG 3.49Å; C231-L243 PolarHBondContact SG-N 2.88Å; C231-L243 VanDerWaalsContact SG-N 3.36Å
232	K	60.9	Low	71.7	Confident	93 Å²	93	78 Å²	78	40%	0.404	39%	0.394	S	S	.	.	G	3₁₀ helix	trans	-81.9	-12.3	-179.5	-168.4	158.5	175.6	170	0	113.8	N229 S230 M1095 E1096	N229-K232 WeakPolarHBondContact O-CB 3.31Å; N229-K232 PolarHBondContact O-N 3.14Å; S230-K232 VanDerWaalsContact C-N 3.29Å; S230-K232 PolarHBondContact O-N 2.03Å; K232-M1095 WeakPolarHBondContact CE-O 3.05Å; K232-M1095 PolarHBondContact NZ-O 3.39Å; K232-E1096 IonicContact NZ-OE1 2.69Å; K232-E1096 PolarHBondContact NZ-OE1 2.92Å; K232-E1096 IonicContact NZ-OE2 2.75Å
233	F	57.6	Low	71.2	Confident	151 Å²	151	73.7 Å²	73.7	66%	0.662	38%	0.38	S	S	*	.	S	Bend	trans	-112.1	-1.6	-178	-69.4	-83.6	0	0	0	114.2	C231	C231-F233 VanDerWaalsContact C-N 3.33Å
234	H	61.1	Low	70.2	Confident	91 Å²	91	74.1 Å²	74.1	42%	0.421	38%	0.384	S	S	.	.	S	Bend	trans	-132.7	107.2	-177.7	-70.2	91.5	0	0	0	111.2	C236 F249	H234-C236 PolarHBondContact O-N 3.3Å; H234-F249 HydrophobicContact CB-CD1 3.99Å; H234-F249 HydrophobicContact CB-CD2 3.95Å; H234-F249 HydrophobicContact CB-CE1 3.63Å; H234-F249 HydrophobicContact CB-CE2 3.58Å; H234-F249 HydrophobicContact CB-CG 4.16Å; H234-F249 HydrophobicContact CB-CZ 3.42Å; H234-F249 VanDerWaalsContact CB-CZ 3.42Å; H234-F249 AromaticContact CD2-CE1 3.36Å; H234-F249 WeakPolarHBondContact CD2-CE1 3.04Å; H234-F249 AromaticContact CD2-CZ 3.52Å; H234-F249 AromaticContact CE1-CE1 3.84Å; H234-F249 AromaticContact CG-CD1 3.74Å; H234-F249 AromaticContact CG-CE1 3.22Å; H234-F249 AromaticContact CG-CZ 3.46Å; H234-F249 VanDerWaalsContact CG-CZ 3.46Å; H234-F249 AromaticContact ND1-CD1 3.71Å; H234-F249 AromaticContact ND1-CE1 3.54Å; H234-F249 AromaticContact NE2-CE1 3.74Å
235	N	66.4	Low	68.9	Low	126 Å²	126	78.6 Å²	78.6	67%	0.674	41%	0.408	S	S	*	.			trans	-79.4	92.5	-172.6	-64.9	-8.7	0	0	0	111.3	K237	N235-K237 PolarHBondContact O-N 2.04Å
236	C	77	Confident	67.6	Low	26 Å²	26	84.8 Å²	84.8	18%	0.176	43%	0.432	C	S	.	.			trans	-55.5	120.9	161.2	-58.1	0	0	0	0	109.3	H234 A240 C242 C251	H234-C236 PolarHBondContact O-N 3.3Å; C236-A240 HydrophobicContact CB-CB 3.79Å; C236-A240 WeakPolarHBondContact CB-O 3.12Å; C236-C242 WeakPolarHBondContact SG-CB 3.2Å; C236-C251 WeakPolarHBondContact CA-SG 3.29Å; C236-C251 HydrophobicContact CB-CB 3.71Å; C236-C251 WeakPolarHBondContact CB-SG 3.22Å; C236-C251 VanDerWaalsContact SG-CA 3.54Å; C236-C251 WeakPolarHBondContact SG-CB 3.38Å; C236-C251 CovalentContact SG-SG 2.03Å; C236-C251 PolarHBondContact SG-SG 2.85Å
237	K	79.4	Confident	66.8	Low	114 Å²	114	89.2 Å²	89.2	50%	0.496	45%	0.453	S	S	.	.			trans	-89.5	169.6	-173.9	-63.9	-156.7	173	-167.5	0	112.5	N235 G239 A240 I261	N235-K237 PolarHBondContact O-N 2.04Å; K237-G239 VanDerWaalsContact C-N 3.31Å; K237-G239 PolarHBondContact O-N 3.2Å; K237-A240 WeakPolarHBondContact O-CB 3.03Å; K237-A240 PolarHBondContact O-N 2.84Å; K237-A240 VanDerWaalsContact O-N 3.09Å; K237-I261 WeakPolarHBondContact CB-O 3.42Å; K237-I261 PolarHBondContact N-O 3.05Å
238	N	77.4	Confident	66.6	Low	77 Å²	77	89.2 Å²	89.2	41%	0.412	46%	0.455	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.1	36.8	169.6	-53.2	-37.3	0	0	0	114.3	P254 F257 C262	N238-P254 WeakPolarHBondContact O-CG 3.45Å; N238-F257 HydrophobicContact CB-CD1 3.84Å; N238-F257 HydrophobicContact CB-CD2 3.93Å; N238-F257 HydrophobicContact CB-CE1 3.78Å; N238-F257 HydrophobicContact CB-CE2 3.86Å; N238-F257 HydrophobicContact CB-CG 3.9Å; N238-F257 HydrophobicContact CB-CZ 3.79Å; N238-F257 WeakPolarHBondContact ND2-CD1 3.39Å; N238-F257 VanDerWaalsContact ND2-CE1 3.27Å; N238-F257 WeakPolarHBondContact ND2-CE1 3.4Å; N238-C262 PolarHBondContact ND2-O 2.85Å
239	G	68.4	Low	67	Low	71 Å²	71	85.6 Å²	85.6	73%	0.732	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.1	11.5	-179.8	0	0	0	0	0	115.2	K237	K237-G239 VanDerWaalsContact C-N 3.31Å; K237-G239 PolarHBondContact O-N 3.2Å
240	A	78	Confident	67.6	Low	13 Å²	13	84.8 Å²	84.8	11%	0.107	44%	0.441	C	S	.	.	P	Polyproline II helix	trans	-69.2	134.6	-178.5	0	0	0	0	0	114	C236 K237 C251 L252 C262	C236-A240 HydrophobicContact CB-CB 3.79Å; C236-A240 WeakPolarHBondContact CB-O 3.12Å; K237-A240 WeakPolarHBondContact O-CB 3.03Å; K237-A240 PolarHBondContact O-N 2.84Å; K237-A240 VanDerWaalsContact O-N 3.09Å; A240-C251 HydrophobicContact CB-CB 4.46Å; A240-L252 CarbonylContact C-O 3.52Å; A240-L252 WeakPolarHBondContact CA-O 3.42Å; A240-L252 WeakPolarHBondContact CB-O 3.39Å; A240-C262 HydrophobicContact CB-CB 3.46Å; A240-C262 VanDerWaalsContact CB-CB 3.46Å; A240-C262 WeakPolarHBondContact CB-SG 3.48Å
241	T	77.9	Confident	68.6	Low	87 Å²	87	83.7 Å²	83.7	53%	0.534	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	121.1	-178.9	-64.1	0	0	0	0	110.6	L243 L252	T241-L243 HydrophobicContact CG2-CD2 4.42Å; T241-L252 HydrophobicContact CG2-CD1 4.45Å; T241-L252 PolarHBondContact N-O 2.04Å; T241-L252 WeakPolarHBondContact O-CB 3.35Å; T241-L252 PolarHBondContact O-N 3.33Å
242	C	78.8	Confident	69.1	Low	36 Å²	36	85.1 Å²	85.1	24%	0.243	44%	0.439	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	141.2	176.2	-169.7	0	0	0	0	112.7	C231 C236	C231-C242 WeakPolarHBondContact CA-SG 3.38Å; C231-C242 HydrophobicContact CB-CB 3.54Å; C231-C242 WeakPolarHBondContact CB-SG 3.38Å; C231-C242 WeakPolarHBondContact SG-CB 3.38Å; C231-C242 CovalentContact SG-SG 2.03Å; C231-C242 PolarHBondContact SG-SG 3.49Å; C236-C242 WeakPolarHBondContact SG-CB 3.2Å
243	L	70.8	Confident	70	Confident	32 Å²	32	82.6 Å²	82.6	17%	0.168	43%	0.432	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	133.8	177.7	-53	172.1	0	0	0	110.7	C231 T241 F249 V250 L252 Y306	C231-L243 PolarHBondContact SG-N 2.88Å; C231-L243 VanDerWaalsContact SG-N 3.36Å; T241-L243 HydrophobicContact CG2-CD2 4.42Å; L243-F249 CarbonylContact O-C 3.59Å; L243-F249 VanDerWaalsContact O-CA 3.22Å; L243-F249 WeakPolarHBondContact O-CA 3.07Å; L243-V250 HydrophobicContact CB-CB 4.38Å; L243-V250 WeakPolarHBondContact CB-O 3.37Å; L243-V250 HydrophobicContact CD1-CB 4.44Å; L243-V250 PolarHBondContact N-O 3.36Å; L243-V250 PolarHBondContact O-N 3.31Å; L243-L252 HydrophobicContact CD1-CD1 3.91Å; L243-L252 HydrophobicContact CD1-CD2 3.72Å; L243-L252 HydrophobicContact CD1-CG 3.58Å; L243-L252 HydrophobicContact CD2-CD1 4.06Å; L243-L252 HydrophobicContact CD2-CG 4.42Å; L243-L252 HydrophobicContact CG-CD1 4.18Å; L243-L252 HydrophobicContact CG-CG 3.99Å; L243-Y306 HydrophobicContact CD1-CE1 3.72Å; L243-Y306 WeakPolarHBondContact CD1-OH 3.38Å; L243-Y306 HydrophobicContact CD2-CE1 4.37Å; L243-Y306 VanDerWaalsContact CD2-OH 3.29Å; L243-Y306 WeakPolarHBondContact CD2-OH 3.26Å
244	Q	65.3	Low	70.7	Confident	85 Å²	85	77.6 Å²	77.6	40%	0.397	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	106.3	171.9	-169.5	177.4	28.8	0	0	110.4	R228 S230	R228-Q244 PolarHBondContact O-NE2 2.84Å; S230-Q244 PolarHBondContact OG-NE2 2.84Å
245	N	58.3	Low	70.8	Confident	94 Å²	94	79.3 Å²	79.3	50%	0.503	43%	0.427	S	S	.	.			trans	-81	170.7	162.6	-79.2	-38.8	0	0	0	109.9	E247 H248	N245-E247 PolarHBondContact O-N 2.82Å; N245-H248 CarbonylContact C-O 3.5Å; N245-H248 WeakPolarHBondContact CA-O 3.24Å; N245-H248 WeakPolarHBondContact CB-O 3.43Å; N245-H248 PolarHBondContact N-O 3.3Å
246	K	55	Low	70.9	Confident	206 Å²	206	74.2 Å²	74.2	90%	0.896	40%	0.404	S	S	*	.	S	Bend	trans	-59.1	-22.6	-173.1	-70.2	-173.3	176.5	-176.8	0	115.4
247	E	55.6	Low	71.1	Confident	167 Å²	167	76.2 Å²	76.2	78%	0.78	41%	0.41	S	S	*	.	S	Bend	trans	-134.5	-13.8	-175.6	-65	174.5	166.5	0	0	113.5	N245	N245-E247 PolarHBondContact O-N 2.82Å
248	H	61.4	Low	71.1	Confident	135 Å²	135	74.3 Å²	74.3	63%	0.625	41%	0.408	S	S	*	.			trans	-145.5	158.4	-170.5	-65.5	86.9	0	0	0	110.6	N245	N245-H248 CarbonylContact C-O 3.5Å; N245-H248 WeakPolarHBondContact CA-O 3.24Å; N245-H248 WeakPolarHBondContact CB-O 3.43Å; N245-H248 PolarHBondContact N-O 3.3Å
249	F	69.6	Low	71.1	Confident	53 Å²	53	71.8 Å²	71.8	23%	0.232	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	158.5	166.9	77.2	-81.6	0	0	0	110.9	H234 L243	H234-F249 HydrophobicContact CB-CD1 3.99Å; H234-F249 HydrophobicContact CB-CD2 3.95Å; H234-F249 HydrophobicContact CB-CE1 3.63Å; H234-F249 HydrophobicContact CB-CE2 3.58Å; H234-F249 HydrophobicContact CB-CG 4.16Å; H234-F249 HydrophobicContact CB-CZ 3.42Å; H234-F249 VanDerWaalsContact CB-CZ 3.42Å; H234-F249 AromaticContact CD2-CE1 3.36Å; H234-F249 WeakPolarHBondContact CD2-CE1 3.04Å; H234-F249 AromaticContact CD2-CZ 3.52Å; H234-F249 AromaticContact CE1-CE1 3.84Å; H234-F249 AromaticContact CG-CD1 3.74Å; H234-F249 AromaticContact CG-CE1 3.22Å; H234-F249 AromaticContact CG-CZ 3.46Å; H234-F249 VanDerWaalsContact CG-CZ 3.46Å; H234-F249 AromaticContact ND1-CD1 3.71Å; H234-F249 AromaticContact ND1-CE1 3.54Å; H234-F249 AromaticContact NE2-CE1 3.74Å; L243-F249 CarbonylContact O-C 3.59Å; L243-F249 VanDerWaalsContact O-CA 3.22Å; L243-F249 WeakPolarHBondContact O-CA 3.07Å
250	V	75.2	Confident	71.5	Confident	61 Å²	61	73.7 Å²	73.7	37%	0.37	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	128.8	174.6	178.2	0	0	0	0	109.2	L243	L243-V250 HydrophobicContact CB-CB 4.38Å; L243-V250 WeakPolarHBondContact CB-O 3.37Å; L243-V250 HydrophobicContact CD1-CB 4.44Å; L243-V250 PolarHBondContact N-O 3.36Å; L243-V250 PolarHBondContact O-N 3.31Å
251	C	79.1	Confident	71.7	Confident	14 Å²	14	75.9 Å²	75.9	10%	0.095	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	125.9	171.9	-59.8	0	0	0	0	111	C236 A240 P260 C262	C236-C251 WeakPolarHBondContact CA-SG 3.29Å; C236-C251 HydrophobicContact CB-CB 3.71Å; C236-C251 WeakPolarHBondContact CB-SG 3.22Å; C236-C251 VanDerWaalsContact SG-CA 3.54Å; C236-C251 WeakPolarHBondContact SG-CB 3.38Å; C236-C251 CovalentContact SG-SG 2.03Å; C236-C251 PolarHBondContact SG-SG 2.85Å; A240-C251 HydrophobicContact CB-CB 4.46Å; C251-P260 WeakPolarHBondContact CB-O 3.32Å; C251-P260 PolarHBondContact SG-O 3.35Å; C251-P260 VanDerWaalsContact SG-O 3.38Å; C251-C262 VanDerWaalsContact CB-SG 3.55Å
252	L	78.6	Confident	71.9	Confident	55 Å²	55	71.8 Å²	71.8	29%	0.288	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	109.8	166.9	-65.2	-179.8	0	0	0	109.7	A240 T241 L243 Y306	A240-L252 CarbonylContact C-O 3.52Å; A240-L252 WeakPolarHBondContact CA-O 3.42Å; A240-L252 WeakPolarHBondContact CB-O 3.39Å; T241-L252 HydrophobicContact CG2-CD1 4.45Å; T241-L252 PolarHBondContact N-O 2.04Å; T241-L252 WeakPolarHBondContact O-CB 3.35Å; T241-L252 PolarHBondContact O-N 3.33Å; L243-L252 HydrophobicContact CD1-CD1 3.91Å; L243-L252 HydrophobicContact CD1-CD2 3.72Å; L243-L252 HydrophobicContact CD1-CG 3.58Å; L243-L252 HydrophobicContact CD2-CD1 4.06Å; L243-L252 HydrophobicContact CD2-CG 4.42Å; L243-L252 HydrophobicContact CG-CD1 4.18Å; L243-L252 HydrophobicContact CG-CG 3.99Å; L252-Y306 HydrophobicContact CD1-CD1 3.83Å; L252-Y306 HydrophobicContact CD1-CE1 3.66Å; L252-Y306 HydrophobicContact CD2-CD1 4.42Å; L252-Y306 HydrophobicContact CD2-CE1 4.09Å; L252-Y306 HydrophobicContact CG-CE1 4.39Å
253	C	78.9	Confident	72.1	Confident	40 Å²	40	72.8 Å²	72.8	27%	0.27	39%	0.391	S	S	.	.	P	Polyproline II helix	trans	-76.4	134.8	179.6	-48.7	0	0	0	0	111.1	F257 G259 C262	C253-F257 HydrophobicContact CB-CB 4.2Å; C253-F257 WeakPolarHBondContact CB-O 3.39Å; C253-G259 PolarHBondContact SG-O 2.81Å; C253-C262 WeakPolarHBondContact CA-SG 3.4Å; C253-C262 HydrophobicContact CB-CB 3.64Å; C253-C262 WeakPolarHBondContact CB-SG 3.39Å; C253-C262 PolarHBondContact N-SG 2.84Å; C253-C262 WeakPolarHBondContact SG-CA 3.47Å; C253-C262 WeakPolarHBondContact SG-CB 3.48Å; C253-C262 CovalentContact SG-SG 2.04Å; C253-C262 PolarHBondContact SG-SG 3.17Å
254	P	72.1	Confident	72.4	Confident	47 Å²	47	74.7 Å²	74.7	31%	0.305	40%	0.404	S	S	.	.	P	Polyproline II helix	trans	-71	163	171.6	25.6	-24.3	0	0	0	110.4	N238 G256 F257	N238-P254 WeakPolarHBondContact O-CG 3.45Å; P254-G256 PolarHBondContact O-N 3.32Å; P254-F257 HydrophobicContact CG-CD2 4.09Å; P254-F257 PolarHBondContact O-N 2.87Å
255	L	64.3	Low	72.7	Confident	127 Å²	127	75.3 Å²	75.3	67%	0.665	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.2	123.8	176.5	-76.1	162	0	0	0	110.1	Y271	L255-Y271 HydrophobicContact CD2-CD1 4.45Å
256	G	67.9	Low	72.9	Confident	19 Å²	19	72.7 Å²	72.7	20%	0.196	40%	0.403	C	S	.	.	T	Hydrogen-bonded Turn	trans	107.2	-8	-172.7	0	0	0	0	0	114.8	P254 P265 T266	P254-G256 PolarHBondContact O-N 3.32Å; G256-P265 CarbonylContact O-C 3.48Å; G256-P265 WeakPolarHBondContact O-CA 3.1Å; G256-T266 VanDerWaalsContact CA-OG1 3.23Å; G256-T266 WeakPolarHBondContact CA-OG1 3.24Å; G256-T266 PolarHBondContact O-N 3.4Å; G256-T266 PolarHBondContact O-OG1 2.93Å
257	F	80.8	Confident	72.7	Confident	67 Å²	67	69.1 Å²	69.1	29%	0.294	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	156.1	-177.2	-63.3	-82.3	0	0	0	114.5	N238 C253 P254 T264 P265	N238-F257 HydrophobicContact CB-CD1 3.84Å; N238-F257 HydrophobicContact CB-CD2 3.93Å; N238-F257 HydrophobicContact CB-CE1 3.78Å; N238-F257 HydrophobicContact CB-CE2 3.86Å; N238-F257 HydrophobicContact CB-CG 3.9Å; N238-F257 HydrophobicContact CB-CZ 3.79Å; N238-F257 WeakPolarHBondContact ND2-CD1 3.39Å; N238-F257 VanDerWaalsContact ND2-CE1 3.27Å; N238-F257 WeakPolarHBondContact ND2-CE1 3.4Å; C253-F257 HydrophobicContact CB-CB 4.2Å; C253-F257 WeakPolarHBondContact CB-O 3.39Å; P254-F257 HydrophobicContact CG-CD2 4.09Å; P254-F257 PolarHBondContact O-N 2.87Å; F257-T264 CarbonylContact C-O 3.13Å; F257-T264 WeakPolarHBondContact CA-O 3.48Å; F257-P265 HydrophobicContact CE1-CB 4.48Å; F257-P265 HydrophobicContact CE1-CG 4.23Å
258	T	79.6	Confident	72.1	Confident	74 Å²	74	66.2 Å²	66.2	45%	0.454	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150	-179.3	179.2	-168.6	0	0	0	0	111.5	C262 S263 T264 T266	T258-C262 CarbonylContact O-C 3.6Å; T258-C262 VanDerWaalsContact O-C 3.26Å; T258-C262 WeakPolarHBondContact O-CA 3.46Å; T258-S263 PolarHBondContact O-N 2.89Å; T258-T264 PolarHBondContact N-O 3.26Å; T258-T264 PolarHBondContact O-N 3.39Å; T258-T264 VanDerWaalsContact O-N 3.1Å; T258-T264 PolarHBondContact O-OG1 2.87Å; T258-T266 HydrophobicContact CG2-CG2 3.64Å
259	G	78	Confident	70.9	Confident	24 Å²	24	65.3 Å²	65.3	25%	0.247	39%	0.392	C	S	.	.	S	Bend	trans	91.6	164	-176.9	0	0	0	0	0	113.7	C253 I261 C262	C253-G259 PolarHBondContact SG-O 2.81Å; G259-I261 PolarHBondContact O-N 3.36Å; G259-C262 PolarHBondContact O-N 2.93Å
260	P	76.5	Confident	69.4	Low	112 Å²	112	70.4 Å²	70.4	73%	0.727	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.6	-23.3	-169.5	26.2	-35.5	0	0	0	114.4	C251	C251-P260 WeakPolarHBondContact CB-O 3.32Å; C251-P260 PolarHBondContact SG-O 3.35Å; C251-P260 VanDerWaalsContact SG-O 3.38Å
261	I	82.8	Confident	67.5	Low	59 Å²	59	73.5 Å²	73.5	30%	0.303	42%	0.422	S	S	.	.	T	Hydrogen-bonded Turn	trans	-118.3	19.2	171.6	61.9	168.4	0	0	0	112.3	K237 G259 S263	K237-I261 WeakPolarHBondContact CB-O 3.42Å; K237-I261 PolarHBondContact N-O 3.05Å; G259-I261 PolarHBondContact O-N 3.36Å; I261-S263 PolarHBondContact O-N 3.35Å
262	C	82.4	Confident	65.3	Low	0 Å²	0	80 Å²	80	0%	0	46%	0.455	C	S	.	.	S	Bend	trans	58.6	28.4	176.6	-54	0	0	0	0	115.8	N238 A240 C251 C253 T258 G259	N238-C262 PolarHBondContact ND2-O 2.85Å; A240-C262 HydrophobicContact CB-CB 3.46Å; A240-C262 VanDerWaalsContact CB-CB 3.46Å; A240-C262 WeakPolarHBondContact CB-SG 3.48Å; C251-C262 VanDerWaalsContact CB-SG 3.55Å; C253-C262 WeakPolarHBondContact CA-SG 3.4Å; C253-C262 HydrophobicContact CB-CB 3.64Å; C253-C262 WeakPolarHBondContact CB-SG 3.39Å; C253-C262 PolarHBondContact N-SG 2.84Å; C253-C262 WeakPolarHBondContact SG-CA 3.47Å; C253-C262 WeakPolarHBondContact SG-CB 3.48Å; C253-C262 CovalentContact SG-SG 2.04Å; C253-C262 PolarHBondContact SG-SG 3.17Å; T258-C262 CarbonylContact O-C 3.6Å; T258-C262 VanDerWaalsContact O-C 3.26Å; T258-C262 WeakPolarHBondContact O-CA 3.46Å; G259-C262 PolarHBondContact O-N 2.93Å
263	S	82.6	Confident	63.3	Low	58 Å²	58	82.1 Å²	82.1	41%	0.406	46%	0.46	S	S	.	.			trans	-83.5	-19.2	-176.2	50.5	0	0	0	0	114.8	T258 I261	T258-S263 PolarHBondContact O-N 2.89Å; I261-S263 PolarHBondContact O-N 3.35Å
264	T	77.6	Confident	61.5	Low	71 Å²	71	84.1 Å²	84.1	44%	0.436	47%	0.472	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	123	-176.1	10.2	0	0	0	0	111.4	F257 T258	F257-T264 CarbonylContact C-O 3.13Å; F257-T264 WeakPolarHBondContact CA-O 3.48Å; T258-T264 PolarHBondContact N-O 3.26Å; T258-T264 PolarHBondContact O-N 3.39Å; T258-T264 VanDerWaalsContact O-N 3.1Å; T258-T264 PolarHBondContact O-OG1 2.87Å
265	P	71	Confident	60.2	Low	99 Å²	99	86.4 Å²	86.4	64%	0.643	48%	0.482	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-65.3	138.9	172.1	-21	33.4	0	0	0	112	G256 F257	G256-P265 CarbonylContact O-C 3.48Å; G256-P265 WeakPolarHBondContact O-CA 3.1Å; F257-P265 HydrophobicContact CE1-CB 4.48Å; F257-P265 HydrophobicContact CE1-CG 4.23Å
266	T	61.8	Low	59.1	Low	38 Å²	38	81.8 Å²	81.8	23%	0.233	46%	0.459	C	S	.	.	P	Polyproline II helix	trans	-94	133	169.7	58.6	0	0	0	0	110	G256 T258 T268	G256-T266 VanDerWaalsContact CA-OG1 3.23Å; G256-T266 WeakPolarHBondContact CA-OG1 3.24Å; G256-T266 PolarHBondContact O-N 3.4Å; G256-T266 PolarHBondContact O-OG1 2.93Å; T258-T266 HydrophobicContact CG2-CG2 3.64Å; T266-T268 PolarHBondContact O-N 3.45Å
267	N	51.8	Low	57.9	Low	132 Å²	132	83.6 Å²	83.6	71%	0.706	47%	0.465	S	S	*	.	P	Polyproline II helix	trans	-59.4	120.4	178.9	-158.5	-0.8	0	0	0	110.5	T269	N267-T269 PolarHBondContact O-N 3.18Å
268	T	41.6	Very low	56.3	Low	106 Å²	106	83.5 Å²	83.5	65%	0.65	47%	0.47	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.4	9.6	-158.2	43.6	0	0	0	0	115.2	T266	T266-T268 PolarHBondContact O-N 3.45Å
269	T	37.9	Very low	54.6	Low	115 Å²	115	81.3 Å²	81.3	71%	0.706	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.7	-13.5	-176	46	0	0	0	0	115.2	N267	N267-T269 PolarHBondContact O-N 3.18Å
270	E	38.1	Very low	53	Low	161 Å²	161	81.6 Å²	81.6	75%	0.752	45%	0.45	S	S	*	.	S	Bend	trans	-106.1	-8	-176	-68.2	-168.6	125.9	0	0	115.6
271	Y	34	Very low	51.6	Low	125 Å²	125	84.7 Å²	84.7	49%	0.49	45%	0.448	S	S	.	.			trans	-108.6	19.7	-174.4	-80.2	-83.9	0	0	0	115.6	L255 Y273	L255-Y271 HydrophobicContact CD2-CD1 4.45Å; Y271-Y273 HydrophobicContact CD1-CD2 4.25Å; Y271-Y273 AromaticContact CD1-CE2 3.61Å; Y271-Y273 HydrophobicContact CD1-CE2 3.61Å; Y271-Y273 AromaticContact CE1-CE2 3.85Å; Y271-Y273 HydrophobicContact CE1-CE2 3.85Å; Y271-Y273 AromaticContact CE1-CZ 3.94Å; Y271-Y273 PolarHBondContact O-N 3.18Å; Y271-Y273 VanDerWaalsContact O-N 3.14Å
272	L	32.4	Very low	49.6	Very low	151 Å²	151	84.9 Å²	84.9	79%	0.791	45%	0.449	S	S	*	.			trans	-66.7	107	156	-114.8	75.3	0	0	0	108.4	P274	L272-P274 WeakPolarHBondContact O-CD 3.5Å
273	Y	37.9	Very low	47.8	Very low	100 Å²	100	90.2 Å²	90.2	39%	0.392	47%	0.474	S	S	.	.			trans	-103.1	79.9	176.6	-84.8	-46.6	0	0	0	113.5	Y271 N275 V276 L300	Y271-Y273 HydrophobicContact CD1-CD2 4.25Å; Y271-Y273 AromaticContact CD1-CE2 3.61Å; Y271-Y273 HydrophobicContact CD1-CE2 3.61Å; Y271-Y273 AromaticContact CE1-CE2 3.85Å; Y271-Y273 HydrophobicContact CE1-CE2 3.85Å; Y271-Y273 AromaticContact CE1-CZ 3.94Å; Y271-Y273 PolarHBondContact O-N 3.18Å; Y271-Y273 VanDerWaalsContact O-N 3.14Å; Y273-N275 HydrophobicContact CD1-CB 4.4Å; Y273-N275 PolarHBondContact O-N 2.94Å; Y273-V276 HydrophobicContact CG-CG2 4.35Å; Y273-L300 HydrophobicContact CE2-CD1 4.08Å
274	P	41.6	Very low	45.9	Very low	81 Å²	81	91.4 Å²	91.4	53%	0.526	48%	0.482	S	S	.	.	H	α-helix	trans	-65.2	-16.1	160.4	31.3	-34.1	0	0	0	111.5	L272 N277 T278	L272-P274 WeakPolarHBondContact O-CD 3.5Å; P274-N277 WeakPolarHBondContact O-CB 3.17Å; P274-T278 PolarHBondContact O-N 2.97Å; P274-T278 PolarHBondContact O-OG1 3.37Å
275	N	43.2	Very low	43.9	Very low	95 Å²	95	94.2 Å²	94.2	51%	0.508	49%	0.492	S	S	.	.	H	α-helix	trans	-68.5	-32.6	-179.5	-71.7	-14.8	0	0	0	113.5	Y273 T278 L279	Y273-N275 HydrophobicContact CD1-CB 4.4Å; Y273-N275 PolarHBondContact O-N 2.94Å; N275-T278 CarbonylContact O-C 3.55Å; N275-T278 PolarHBondContact O-N 2.91Å; N275-L279 WeakPolarHBondContact O-CB 3.43Å; N275-L279 WeakPolarHBondContact O-CD1 3.45Å; N275-L279 VanDerWaalsContact O-CG 3.22Å; N275-L279 WeakPolarHBondContact O-CG 3.3Å; N275-L279 PolarHBondContact O-N 3.28Å
276	V	42.9	Very low	42	Very low	31 Å²	31	99.6 Å²	99.6	19%	0.188	51%	0.505	C	S	.	.	H	α-helix	trans	-62.8	-50.4	175.3	175.6	0	0	0	0	110.4	Y273 T278 L279 I280 L300	Y273-V276 HydrophobicContact CG-CG2 4.35Å; V276-T278 VanDerWaalsContact C-N 3.26Å; V276-T278 PolarHBondContact O-N 2.71Å; V276-L279 PolarHBondContact O-N 3.31Å; V276-L279 VanDerWaalsContact O-N 3.14Å; V276-I280 HydrophobicContact CG1-CD1 3.85Å; V276-I280 WeakPolarHBondContact O-CG1 3.42Å; V276-I280 PolarHBondContact O-N 3.29Å; V276-L300 HydrophobicContact CG2-CD2 3.62Å; V276-L300 HydrophobicContact CG2-CG 4.04Å
277	N	41.5	Very low	40.7	Very low	57 Å²	57	102.4 Å²	102.4	31%	0.305	52%	0.523	S	S	.	.	H	α-helix	trans	-52.3	-45	171.6	-106.2	-44.9	0	0	0	112	P274 R281 Y357	P274-N277 WeakPolarHBondContact O-CB 3.17Å; N277-R281 WeakPolarHBondContact O-CB 3.49Å; N277-R281 WeakPolarHBondContact O-CG 3.3Å; N277-R281 PolarHBondContact O-N 3.38Å; N277-Y357 VanDerWaalsContact ND2-CE2 3.29Å; N277-Y357 WeakPolarHBondContact ND2-CE2 3.45Å; N277-Y357 PolarHBondContact ND2-OH 2.84Å; N277-Y357 VanDerWaalsContact ND2-OH 3.07Å
278	T	47.7	Very low	39.8	Very low	65 Å²	65	104.4 Å²	104.4	40%	0.399	53%	0.533	S	S	.	.	H	α-helix	trans	-66.5	-38	-179.9	-54.5	0	0	0	0	111.8	P274 N275 V276 N282	P274-T278 PolarHBondContact O-N 2.97Å; P274-T278 PolarHBondContact O-OG1 3.37Å; N275-T278 CarbonylContact O-C 3.55Å; N275-T278 PolarHBondContact O-N 2.91Å; V276-T278 VanDerWaalsContact C-N 3.26Å; V276-T278 PolarHBondContact O-N 2.71Å; T278-N282 VanDerWaalsContact O-CB 3.24Å; T278-N282 WeakPolarHBondContact O-CB 3.38Å; T278-N282 PolarHBondContact O-N 2.75Å; T278-N282 PolarHBondContact O-ND2 2.94Å
279	L	42.5	Very low	39.5	Very low	27 Å²	27	104.5 Å²	104.5	14%	0.141	53%	0.534	C	S	.	.	H	α-helix	trans	-69.7	-44.5	177.2	-72.9	161.7	0	0	0	112.3	N275 V276 R281 N282 Q283 F290 N297 L300	N275-L279 WeakPolarHBondContact O-CB 3.43Å; N275-L279 WeakPolarHBondContact O-CD1 3.45Å; N275-L279 VanDerWaalsContact O-CG 3.22Å; N275-L279 WeakPolarHBondContact O-CG 3.3Å; N275-L279 PolarHBondContact O-N 3.28Å; V276-L279 PolarHBondContact O-N 3.31Å; V276-L279 VanDerWaalsContact O-N 3.14Å; L279-R281 VanDerWaalsContact C-N 3.33Å; L279-R281 PolarHBondContact O-N 3.46Å; L279-N282 PolarHBondContact O-N 3.3Å; L279-Q283 WeakPolarHBondContact O-CG 3.37Å; L279-Q283 PolarHBondContact O-N 3.31Å; L279-F290 HydrophobicContact CD2-CE1 3.75Å; L279-F290 HydrophobicContact CD2-CZ 4.13Å; L279-N297 WeakPolarHBondContact CD1-OD1 3.39Å; L279-N297 HydrophobicContact CD2-CB 4.2Å; L279-N297 WeakPolarHBondContact CD2-OD1 3.15Å; L279-L300 HydrophobicContact CD1-CD2 3.71Å
280	I	44.7	Very low	39.2	Very low	30 Å²	30	103.9 Å²	103.9	15%	0.154	52%	0.521	C	S	.	.	H	α-helix	trans	-64.3	-39.4	177.8	-65.4	171.1	0	0	0	110.6	V276 Y356	V276-I280 HydrophobicContact CG1-CD1 3.85Å; V276-I280 WeakPolarHBondContact O-CG1 3.42Å; V276-I280 PolarHBondContact O-N 3.29Å; I280-Y356 HydrophobicContact CD1-CD1 4.36Å; I280-Y356 HydrophobicContact CD1-CE1 3.97Å; I280-Y356 HydrophobicContact CG2-CE1 4.3Å; I280-Y356 HydrophobicContact CG2-CE2 4.26Å
281	R	46.8	Very low	39	Very low	178 Å²	178	107.6 Å²	107.6	67%	0.672	53%	0.528	S	S	*	.	H	α-helix	trans	-64.5	-44.2	171	-75.2	179.3	-178.7	177	1.5	112.4	N277 L279 Q283 S284	N277-R281 WeakPolarHBondContact O-CB 3.49Å; N277-R281 WeakPolarHBondContact O-CG 3.3Å; N277-R281 PolarHBondContact O-N 3.38Å; L279-R281 VanDerWaalsContact C-N 3.33Å; L279-R281 PolarHBondContact O-N 3.46Å; R281-Q283 VanDerWaalsContact C-N 3.32Å; R281-Q283 PolarHBondContact O-N 2.95Å; R281-S284 PolarHBondContact O-N 3.11Å; R281-S284 VanDerWaalsContact O-N 3.12Å; R281-S284 PolarHBondContact O-OG 3.39Å
282	N	41	Very low	39.3	Very low	63 Å²	63	110.9 Å²	110.9	34%	0.337	55%	0.545	S	S	.	.	H	α-helix	trans	-66.2	-31.4	179.8	-74.2	-16.7	0	0	0	113	T278 L279 S284 M285 F290	T278-N282 VanDerWaalsContact O-CB 3.24Å; T278-N282 WeakPolarHBondContact O-CB 3.38Å; T278-N282 PolarHBondContact O-N 2.75Å; T278-N282 PolarHBondContact O-ND2 2.94Å; L279-N282 PolarHBondContact O-N 3.3Å; N282-S284 VanDerWaalsContact C-N 3.26Å; N282-S284 PolarHBondContact O-N 3.45Å; N282-M285 PolarHBondContact O-N 2.85Å; N282-F290 HydrophobicContact CB-CE2 3.74Å; N282-F290 HydrophobicContact CB-CZ 3.97Å
283	Q	44.7	Very low	39.7	Very low	111 Å²	111	108.5 Å²	108.5	52%	0.519	53%	0.533	S	S	.	.	H	α-helix	trans	-68.4	-21.4	173.4	-75.7	-178.3	0.2	0	0	113.7	L279 R281 M285	L279-Q283 WeakPolarHBondContact O-CG 3.37Å; L279-Q283 PolarHBondContact O-N 3.31Å; R281-Q283 VanDerWaalsContact C-N 3.32Å; R281-Q283 PolarHBondContact O-N 2.95Å; Q283-M285 VanDerWaalsContact C-N 3.33Å
284	S	42.6	Very low	40.3	Very low	83 Å²	83	106.9 Å²	106.9	58%	0.58	54%	0.537	S	S	*	.	H	α-helix	trans	-79.6	-14.2	175.2	75.2	0	0	0	0	113.4	R281 N282	R281-S284 PolarHBondContact O-N 3.11Å; R281-S284 VanDerWaalsContact O-N 3.12Å; R281-S284 PolarHBondContact O-OG 3.39Å; N282-S284 VanDerWaalsContact C-N 3.26Å; N282-S284 PolarHBondContact O-N 3.45Å
285	M	36.4	Very low	40.8	Very low	131 Å²	131	108.4 Å²	108.4	65%	0.645	54%	0.544	S	S	*	.	S	Bend	trans	-90	105.8	175.1	-68.3	-159	175.8	0	0	111.7	N282 Q283 T287	N282-M285 PolarHBondContact O-N 2.85Å; Q283-M285 VanDerWaalsContact C-N 3.33Å; M285-T287 VanDerWaalsContact C-N 3.28Å; M285-T287 PolarHBondContact O-N 2.04Å
286	K	31.1	Very low	41	Very low	211 Å²	211	110.3 Å²	110.3	92%	0.917	55%	0.551	S	S	*	*			trans	-61.3	72.1	177.4	-66.4	177.7	177	172.8	0	113.6
287	T	34.6	Very low	41.3	Very low	98 Å²	98	110.4 Å²	110.4	60%	0.601	55%	0.55	S	S	*	.			trans	-142.1	147.6	177.8	59.4	0	0	0	0	113.5	M285 V289	M285-T287 VanDerWaalsContact C-N 3.28Å; M285-T287 PolarHBondContact O-N 2.04Å; T287-V289 PolarHBondContact O-N 2.93Å
288	N	33.7	Very low	42.3	Very low	173 Å²	173	113.2 Å²	113.2	93%	0.925	56%	0.564	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.7	33.4	-168	-72.9	-47.9	0	0	0	115.5
289	V	35.3	Very low	43.2	Very low	109 Å²	109	116.6 Å²	116.6	66%	0.661	57%	0.573	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.2	-30.8	-166	-174.7	0	0	0	0	113.9	T287 R291	T287-V289 PolarHBondContact O-N 2.93Å; V289-R291 PolarHBondContact O-N 2.73Å
290	F	31.4	Very low	44.2	Very low	101 Å²	101	117.4 Å²	117.4	44%	0.443	58%	0.577	S	S	.	*			trans	-76.6	18.1	-167.3	-96.7	-93.6	0	0	0	117.2	L279 N282 K292	L279-F290 HydrophobicContact CD2-CE1 3.75Å; L279-F290 HydrophobicContact CD2-CZ 4.13Å; N282-F290 HydrophobicContact CB-CE2 3.74Å; N282-F290 HydrophobicContact CB-CZ 3.97Å; F290-K292 VanDerWaalsContact C-N 3.29Å; F290-K292 PolarHBondContact O-N 3.05Å
291	R	32.9	Very low	45.2	Very low	239 Å²	239	118.4 Å²	118.4	90%	0.902	58%	0.583	S	S	*	*	S	Bend	trans	-82	15.5	-173.8	-111	-177.9	-174.2	176.5	2.8	116.3	V289	V289-R291 PolarHBondContact O-N 2.73Å
292	K	40.1	Very low	46.1	Very low	195 Å²	195	115.9 Å²	115.9	85%	0.848	57%	0.574	S	S	*	*	S	Bend	trans	-128.1	-24.8	-179.6	-75.2	-169.3	172.8	-175	0	117	F290	F290-K292 VanDerWaalsContact C-N 3.29Å; F290-K292 PolarHBondContact O-N 3.05Å
293	N	40.3	Very low	47.4	Very low	101 Å²	101	115.7 Å²	115.7	54%	0.54	57%	0.573	S	S	.	*	S	Bend	trans	-118.7	69.3	174.9	-69.4	37.2	0	0	0	109.4	N297	N293-N297 PolarHBondContact O-ND2 2.92Å
294	S	50.9	Low	48.5	Very low	66 Å²	66	112.7 Å²	112.7	46%	0.462	56%	0.559	S	S	.	*			trans	-89.2	-37.7	-174.1	49.8	0	0	0	0	114.2	I298	S294-I298 WeakPolarHBondContact O-CB 3.31Å; S294-I298 WeakPolarHBondContact O-CD1 3.46Å; S294-I298 VanDerWaalsContact O-CG1 3.23Å; S294-I298 WeakPolarHBondContact O-CG1 3.26Å; S294-I298 PolarHBondContact O-N 2.93Å; S294-I298 VanDerWaalsContact O-N 3.14Å
295	T	52	Low	50	Low	112 Å²	112	109.3 Å²	109.3	69%	0.687	54%	0.535	S	S	*	.	H	α-helix	trans	-68.7	-51.6	-169	29.9	0	0	0	0	114.2	N297 I298 K299	T295-N297 VanDerWaalsContact C-N 3.33Å; T295-N297 PolarHBondContact O-N 2.79Å; T295-I298 PolarHBondContact O-N 2.93Å; T295-K299 PolarHBondContact O-N 3.24Å
296	E	47.4	Very low	51.5	Low	136 Å²	136	106.3 Å²	106.3	64%	0.636	52%	0.517	S	S	*	.	H	α-helix	trans	-61	-43.4	179.5	-65.8	179.5	126	0	0	111.7	I298 K299 L300	E296-I298 PolarHBondContact O-N 3.33Å; E296-K299 PolarHBondContact O-N 3.28Å; E296-L300 WeakPolarHBondContact O-CB 3.46Å; E296-L300 PolarHBondContact O-N 3.4Å
297	N	49.2	Very low	53.3	Low	33 Å²	33	102.3 Å²	102.3	18%	0.176	50%	0.501	C	S	.	.	H	α-helix	trans	-69.6	-32.4	-176.3	-64.5	-34.4	0	0	0	112.8	L279 N293 T295 L301	L279-N297 WeakPolarHBondContact CD1-OD1 3.39Å; L279-N297 HydrophobicContact CD2-CB 4.2Å; L279-N297 WeakPolarHBondContact CD2-OD1 3.15Å; N293-N297 PolarHBondContact O-ND2 2.92Å; T295-N297 VanDerWaalsContact C-N 3.33Å; T295-N297 PolarHBondContact O-N 2.79Å; N297-L301 PolarHBondContact O-N 2.94Å
298	I	62.4	Low	54.9	Low	116 Å²	116	100.5 Å²	100.5	60%	0.595	49%	0.488	S	S	*	.	H	α-helix	trans	-70.1	-41.3	171.2	-71.3	167.9	0	0	0	110.6	S294 T295 E296 Y302	S294-I298 WeakPolarHBondContact O-CB 3.31Å; S294-I298 WeakPolarHBondContact O-CD1 3.46Å; S294-I298 VanDerWaalsContact O-CG1 3.23Å; S294-I298 WeakPolarHBondContact O-CG1 3.26Å; S294-I298 PolarHBondContact O-N 2.93Å; S294-I298 VanDerWaalsContact O-N 3.14Å; T295-I298 PolarHBondContact O-N 2.93Å; E296-I298 PolarHBondContact O-N 3.33Å; I298-Y302 WeakPolarHBondContact O-CB 3.44Å; I298-Y302 PolarHBondContact O-N 2.94Å
299	K	67.7	Low	56.6	Low	136 Å²	136	93.5 Å²	93.5	59%	0.591	46%	0.457	S	S	*	.	H	α-helix	trans	-63.5	-47.5	177.1	-168	-170	172.8	-168	0	111.4	T295 E296 L301 Y302 D303	T295-K299 PolarHBondContact O-N 3.24Å; E296-K299 PolarHBondContact O-N 3.28Å; K299-L301 VanDerWaalsContact C-N 3.3Å; K299-L301 PolarHBondContact O-N 3.06Å; K299-Y302 WeakPolarHBondContact O-CB 3.35Å; K299-Y302 PolarHBondContact O-N 2.03Å; K299-Y302 VanDerWaalsContact O-N 3.08Å; K299-D303 WeakPolarHBondContact CE-OD2 3.43Å; K299-D303 WeakPolarHBondContact O-CB 3.28Å; K299-D303 VanDerWaalsContact O-CG 3.25Å; K299-D303 PolarHBondContact O-N 2.97Å
300	L	63.6	Low	58.4	Low	43 Å²	43	88.7 Å²	88.7	23%	0.225	43%	0.428	C	S	.	.	H	α-helix	trans	-60.7	-37.6	-179.2	-159.5	70.8	0	0	0	112.5	Y273 V276 L279 E296 H304	Y273-L300 HydrophobicContact CE2-CD1 4.08Å; V276-L300 HydrophobicContact CG2-CD2 3.62Å; V276-L300 HydrophobicContact CG2-CG 4.04Å; L279-L300 HydrophobicContact CD1-CD2 3.71Å; E296-L300 WeakPolarHBondContact O-CB 3.46Å; E296-L300 PolarHBondContact O-N 3.4Å; L300-H304 WeakPolarHBondContact O-CB 3.33Å; L300-H304 PolarHBondContact O-N 2.95Å
301	L	65.2	Low	59.8	Low	52 Å²	52	87.5 Å²	87.5	27%	0.272	43%	0.426	S	S	.	.	H	α-helix	trans	-70.7	-41.7	172.8	-179.9	61.3	0	0	0	112	N297 K299 H304 C305	N297-L301 PolarHBondContact O-N 2.94Å; K299-L301 VanDerWaalsContact C-N 3.3Å; K299-L301 PolarHBondContact O-N 3.06Å; L301-H304 PolarHBondContact O-N 3.22Å; L301-C305 WeakPolarHBondContact O-CB 3.49Å; L301-C305 PolarHBondContact O-N 2.94Å; L301-C305 PolarHBondContact O-SG 3.2Å
302	Y	66.3	Low	60.8	Low	125 Å²	125	84.7 Å²	84.7	49%	0.49	42%	0.42	S	S	.	.	H	α-helix	trans	-59.8	-48.7	176.4	-175.7	-89.4	0	0	0	111.3	I298 K299 H304 C305 Y306	I298-Y302 WeakPolarHBondContact O-CB 3.44Å; I298-Y302 PolarHBondContact O-N 2.94Å; K299-Y302 WeakPolarHBondContact O-CB 3.35Å; K299-Y302 PolarHBondContact O-N 2.03Å; K299-Y302 VanDerWaalsContact O-N 3.08Å; Y302-H304 VanDerWaalsContact C-N 3.35Å; Y302-H304 PolarHBondContact O-N 2.76Å; Y302-C305 PolarHBondContact O-N 2.79Å; Y302-Y306 VanDerWaalsContact O-CB 3.28Å; Y302-Y306 WeakPolarHBondContact O-CB 3.45Å; Y302-Y306 PolarHBondContact O-N 2.65Å
303	D	67.8	Low	61.3	Low	59 Å²	59	79.8 Å²	79.8	32%	0.316	42%	0.416	S	S	.	.	H	α-helix	trans	-62.4	-40.2	-180	-64.3	-18.1	0	0	0	111.2	K299 Y306 Q307	K299-D303 WeakPolarHBondContact CE-OD2 3.43Å; K299-D303 WeakPolarHBondContact O-CB 3.28Å; K299-D303 VanDerWaalsContact O-CG 3.25Å; K299-D303 PolarHBondContact O-N 2.97Å; D303-Y306 PolarHBondContact O-N 3.18Å; D303-Q307 WeakPolarHBondContact O-CG 3.37Å; D303-Q307 PolarHBondContact O-N 2.91Å
304	H	68.7	Low	62.3	Low	47 Å²	47	79 Å²	79	22%	0.218	41%	0.408	C	S	.	.	H	α-helix	trans	-63.7	-47.8	173.9	176.8	54.8	0	0	0	112.9	L300 L301 Y302 Y306 Q307 L308	L300-H304 WeakPolarHBondContact O-CB 3.33Å; L300-H304 PolarHBondContact O-N 2.95Å; L301-H304 PolarHBondContact O-N 3.22Å; Y302-H304 VanDerWaalsContact C-N 3.35Å; Y302-H304 PolarHBondContact O-N 2.76Å; H304-Y306 PolarHBondContact O-N 3.37Å; H304-Q307 PolarHBondContact O-N 3.18Å; H304-L308 WeakPolarHBondContact O-CG 3.45Å; H304-L308 PolarHBondContact O-N 3.4Å; H304-L308 VanDerWaalsContact O-N 3.12Å
305	C	72.7	Confident	62.9	Low	13 Å²	13	79.1 Å²	79.1	9%	0.088	41%	0.406	C	S	.	.	H	α-helix	trans	-62.4	-32	176.8	-71.5	0	0	0	0	112.9	L301 Y302 L308 G309 C310 C329	L301-C305 WeakPolarHBondContact O-CB 3.49Å; L301-C305 PolarHBondContact O-N 2.94Å; L301-C305 PolarHBondContact O-SG 3.2Å; Y302-C305 PolarHBondContact O-N 2.79Å; C305-L308 PolarHBondContact O-N 3.09Å; C305-G309 PolarHBondContact O-N 2.91Å; C305-C310 HydrophobicContact CB-CB 4.48Å; C305-C310 VanDerWaalsContact O-CB 3.25Å; C305-C310 WeakPolarHBondContact O-CB 3.44Å; C305-C310 PolarHBondContact O-N 2.96Å; C305-C329 WeakPolarHBondContact CA-SG 3.15Å; C305-C329 HydrophobicContact CB-CB 3.55Å; C305-C329 WeakPolarHBondContact CB-SG 3.44Å; C305-C329 WeakPolarHBondContact SG-CA 3.48Å; C305-C329 WeakPolarHBondContact SG-CB 3.37Å; C305-C329 CovalentContact SG-SG 2.02Å; C305-C329 PolarHBondContact SG-SG 2.99Å
306	Y	69.3	Low	63.6	Low	67 Å²	67	76.1 Å²	76.1	26%	0.263	40%	0.397	S	S	.	.	H	α-helix	trans	-72.4	-41.4	177.1	-162.6	-140.8	0	0	0	112.1	L243 L252 Y302 D303 H304 L308 G309 N311	L243-Y306 HydrophobicContact CD1-CE1 3.72Å; L243-Y306 WeakPolarHBondContact CD1-OH 3.38Å; L243-Y306 HydrophobicContact CD2-CE1 4.37Å; L243-Y306 VanDerWaalsContact CD2-OH 3.29Å; L243-Y306 WeakPolarHBondContact CD2-OH 3.26Å; L252-Y306 HydrophobicContact CD1-CD1 3.83Å; L252-Y306 HydrophobicContact CD1-CE1 3.66Å; L252-Y306 HydrophobicContact CD2-CD1 4.42Å; L252-Y306 HydrophobicContact CD2-CE1 4.09Å; L252-Y306 HydrophobicContact CG-CE1 4.39Å; Y302-Y306 VanDerWaalsContact O-CB 3.28Å; Y302-Y306 WeakPolarHBondContact O-CB 3.45Å; Y302-Y306 PolarHBondContact O-N 2.65Å; D303-Y306 PolarHBondContact O-N 3.18Å; H304-Y306 PolarHBondContact O-N 3.37Å; Y306-L308 PolarHBondContact O-N 2.7Å; Y306-G309 PolarHBondContact O-N 3.05Å; Y306-N311 VanDerWaalsContact CD2-OD1 3.23Å; Y306-N311 WeakPolarHBondContact CD2-OD1 3.25Å; Y306-N311 WeakPolarHBondContact CE2-OD1 3.47Å
307	Q	68.3	Low	64.8	Low	127 Å²	127	71.9 Å²	71.9	59%	0.593	38%	0.379	S	S	*	.	H	α-helix	trans	-59.2	-32.5	170.9	-73.8	171.3	-10.4	0	0	112.9	D303 H304 G309	D303-Q307 WeakPolarHBondContact O-CG 3.37Å; D303-Q307 PolarHBondContact O-N 2.91Å; H304-Q307 PolarHBondContact O-N 3.18Å; Q307-G309 PolarHBondContact O-N 2.86Å
308	L	68	Low	66.2	Low	61 Å²	61	74.5 Å²	74.5	32%	0.319	39%	0.393	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.4	-0.5	174.7	-67.5	172.6	0	0	0	114.2	H304 C305 Y306 C310 K323 A327	H304-L308 WeakPolarHBondContact O-CG 3.45Å; H304-L308 PolarHBondContact O-N 3.4Å; H304-L308 VanDerWaalsContact O-N 3.12Å; C305-L308 PolarHBondContact O-N 3.09Å; Y306-L308 PolarHBondContact O-N 2.7Å; L308-C310 VanDerWaalsContact CB-SG 3.53Å; L308-C310 PolarHBondContact O-N 2.89Å; L308-K323 HydrophobicContact CD2-CD 4.25Å; L308-A327 HydrophobicContact CD1-CB 3.22Å
309	G	69.3	Low	67.3	Low	26 Å²	26	70 Å²	70	27%	0.268	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	71.1	16.8	-177.5	0	0	0	0	0	114.3	C305 Y306 Q307 N311 K314	C305-G309 PolarHBondContact O-N 2.91Å; Y306-G309 PolarHBondContact O-N 3.05Å; Q307-G309 PolarHBondContact O-N 2.86Å; G309-N311 PolarHBondContact O-N 3.13Å; G309-K314 PolarHBondContact O-NZ 2.82Å
310	C	72.1	Confident	68.2	Low	7 Å²	7	63.8 Å²	63.8	5%	0.047	34%	0.343	C	S	.	.			trans	-81.3	55.5	-178.9	-53.8	0	0	0	0	111.7	C305 L308 C324 C329	C305-C310 HydrophobicContact CB-CB 4.48Å; C305-C310 VanDerWaalsContact O-CB 3.25Å; C305-C310 WeakPolarHBondContact O-CB 3.44Å; C305-C310 PolarHBondContact O-N 2.96Å; L308-C310 VanDerWaalsContact CB-SG 3.53Å; L308-C310 PolarHBondContact O-N 2.89Å; C310-C324 VanDerWaalsContact CA-SG 3.53Å; C310-C324 HydrophobicContact CB-CB 3.76Å; C310-C324 WeakPolarHBondContact CB-SG 3.39Å; C310-C324 WeakPolarHBondContact SG-CA 3.5Å; C310-C324 WeakPolarHBondContact SG-CB 3.28Å; C310-C324 CovalentContact SG-SG 2.03Å; C310-C324 PolarHBondContact SG-SG 2.86Å; C310-C329 HydrophobicContact CB-CB 3.59Å
311	N	61.3	Low	69.1	Low	77 Å²	77	62.7 Å²	62.7	41%	0.412	34%	0.337	S	S	.	.			trans	-64	140.5	177.3	-72	-27.7	0	0	0	110.9	Y306 G309 A313	Y306-N311 VanDerWaalsContact CD2-OD1 3.23Å; Y306-N311 WeakPolarHBondContact CD2-OD1 3.25Å; Y306-N311 WeakPolarHBondContact CE2-OD1 3.47Å; G309-N311 PolarHBondContact O-N 3.13Å; N311-A313 PolarHBondContact O-N 3.11Å
312	K	54.6	Low	69.9	Low	180 Å²	180	60.3 Å²	60.3	78%	0.783	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68	37.3	-174.7	-68	-173.9	169.7	-176.1	0	115.6
313	A	50.4	Low	70.5	Confident	92 Å²	92	57.2 Å²	57.2	76%	0.76	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-152.9	19.7	-171.2	0	0	0	0	0	115	N311	N311-A313 PolarHBondContact O-N 3.11Å
314	K	61.5	Low	71	Confident	85 Å²	85	54.6 Å²	54.6	37%	0.37	30%	0.3	S	S	.	.			trans	-111.6	-15.5	-179.4	-59.7	175.7	168.2	170.8	0	116.1	G309 G316 D317	G309-K314 PolarHBondContact O-NZ 2.82Å; K314-G316 PolarHBondContact O-N 3Å; K314-D317 WeakPolarHBondContact O-CB 3.41Å; K314-D317 PolarHBondContact O-N 3Å
315	T	62.4	Low	71.4	Confident	68 Å²	68	53.1 Å²	53.1	42%	0.417	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.8	131.5	178	47.1	0	0	0	0	111.1	L330 E335 D339	T315-L330 HydrophobicContact CG2-CD1 4.22Å; T315-L330 HydrophobicContact CG2-CD2 4.43Å; T315-E335 HydrophobicContact CG2-CB 4.1Å; T315-E335 HydrophobicContact CG2-CG 4.3Å; T315-D339 WeakPolarHBondContact CA-OD2 3.42Å
316	G	67.9	Low	71.5	Confident	48 Å²	48	54.2 Å²	54.2	50%	0.495	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	91.6	6.8	-173.3	0	0	0	0	0	115	K314 N318 D339	K314-G316 PolarHBondContact O-N 3Å; G316-N318 VanDerWaalsContact C-N 3.32Å; G316-D339 VanDerWaalsContact CA-OD1 3.26Å; G316-D339 WeakPolarHBondContact CA-OD1 3.45Å; G316-D339 PolarHBondContact N-OD1 3.49Å; G316-D339 VanDerWaalsContact N-OD1 3.14Å; G316-D339 PolarHBondContact N-OD2 2.56Å
317	D	72.5	Confident	71.6	Confident	47 Å²	47	51.4 Å²	51.4	25%	0.251	29%	0.287	S	S	.	.	S	Bend	trans	-87.2	-0.2	173.7	96	-35.5	0	0	0	114.1	K314 I319 D339 K540	K314-D317 WeakPolarHBondContact O-CB 3.41Å; K314-D317 PolarHBondContact O-N 3Å; D317-I319 VanDerWaalsContact C-N 3.3Å; D317-I319 WeakPolarHBondContact OD1-CB 3.27Å; D317-I319 WeakPolarHBondContact OD1-CG1 3.3Å; D317-I319 PolarHBondContact OD1-N 3.38Å; D317-I319 WeakPolarHBondContact OD2-CD1 3.36Å; D317-I319 WeakPolarHBondContact OD2-CG1 3.24Å; D317-D339 PolarHBondContact N-OD1 3.31Å; D317-K540 VanDerWaalsContact CG-NZ 3.35Å; D317-K540 VanDerWaalsContact O-CE 3.22Å; D317-K540 WeakPolarHBondContact O-CE 3.03Å; D317-K540 PolarHBondContact O-NZ 2.89Å; D317-K540 IonicContact OD2-NZ 3.77Å; D317-K540 PolarHBondContact OD2-NZ 3Å
318	N	77.8	Confident	71.9	Confident	89 Å²	89	50.2 Å²	50.2	48%	0.476	28%	0.28	S	S	.	.	S	Bend	trans	66.7	15	-176.8	-48.5	-94.7	0	0	0	115.3	G316 D339 S535	G316-N318 VanDerWaalsContact C-N 3.32Å; N318-D339 WeakPolarHBondContact CA-OD1 3.44Å; N318-D339 PolarHBondContact N-OD1 2.88Å; N318-S535 VanDerWaalsContact O-CA 3.27Å; N318-S535 WeakPolarHBondContact O-CA 3.46Å; N318-S535 VanDerWaalsContact O-CB 3.26Å; N318-S535 WeakPolarHBondContact O-CB 3.29Å
319	I	85.7	Confident	72.2	Confident	22 Å²	22	48.3 Å²	48.3	11%	0.113	27%	0.271	C	S	.	.			trans	-96.5	125	168.1	-51.3	176	0	0	0	109.8	D317 Q321 D339 I537 K540	D317-I319 VanDerWaalsContact C-N 3.3Å; D317-I319 WeakPolarHBondContact OD1-CB 3.27Å; D317-I319 WeakPolarHBondContact OD1-CG1 3.3Å; D317-I319 PolarHBondContact OD1-N 3.38Å; D317-I319 WeakPolarHBondContact OD2-CD1 3.36Å; D317-I319 WeakPolarHBondContact OD2-CG1 3.24Å; I319-Q321 VanDerWaalsContact O-CG 3.23Å; I319-Q321 WeakPolarHBondContact O-CG 3.07Å; I319-Q321 PolarHBondContact O-N 3.22Å; I319-D339 WeakPolarHBondContact O-CB 3.48Å; I319-I537 HydrophobicContact CG2-CG1 3.55Å; I319-K540 HydrophobicContact CD1-CD 3.71Å; I319-K540 HydrophobicContact CG1-CD 3.71Å; I319-K540 HydrophobicContact CG1-CG 4.18Å
320	C	87.3	Confident	72.3	Confident	4 Å²	4	48.1 Å²	48.1	3%	0.027	26%	0.264	C	S	.	.			trans	-74.8	114.9	173.9	175.9	0	0	0	0	112.1	A322 D339 C340 W343 V363 S535	C320-A322 PolarHBondContact O-N 2.73Å; C320-D339 WeakPolarHBondContact CB-O 3.27Å; C320-C340 VanDerWaalsContact C-SG 3.58Å; C320-C340 WeakPolarHBondContact CA-SG 3.26Å; C320-C340 HydrophobicContact CB-CB 3.89Å; C320-C340 WeakPolarHBondContact CB-SG 3.27Å; C320-C340 WeakPolarHBondContact SG-CA 3.48Å; C320-C340 WeakPolarHBondContact SG-CB 3.29Å; C320-C340 CovalentContact SG-SG 2.03Å; C320-C340 PolarHBondContact SG-SG 3.1Å; C320-W343 HydrophobicContact CB-CG 4.45Å; C320-V363 HydrophobicContact CB-CG1 3.84Å; C320-S535 PolarHBondContact N-O 3.16Å
321	Q	81.6	Confident	72.1	Confident	21 Å²	21	53 Å²	53	10%	0.098	29%	0.29	C	S	.	.			trans	-105.6	58.5	-172.5	-34.9	-177.7	18.9	0	0	110.3	I319 K323 C324 I325 E335	I319-Q321 VanDerWaalsContact O-CG 3.23Å; I319-Q321 WeakPolarHBondContact O-CG 3.07Å; I319-Q321 PolarHBondContact O-N 3.22Å; Q321-K323 PolarHBondContact O-N 2.63Å; Q321-C324 HydrophobicContact CB-CB 4.18Å; Q321-C324 WeakPolarHBondContact O-CA 3.39Å; Q321-C324 VanDerWaalsContact O-CB 3.26Å; Q321-C324 WeakPolarHBondContact O-CB 3.49Å; Q321-C324 PolarHBondContact O-N 3.24Å; Q321-I325 PolarHBondContact O-N 3.2Å; Q321-E335 WeakPolarHBondContact CA-OE1 3.12Å; Q321-E335 WeakPolarHBondContact CB-OE1 3.16Å; Q321-E335 VanDerWaalsContact CG-OE1 3.28Å; Q321-E335 WeakPolarHBondContact CG-OE1 3.38Å; Q321-E335 PolarHBondContact N-OE1 3.33Å
322	A	82.2	Confident	72.2	Confident	1 Å²	1	52.4 Å²	52.4	1%	0.008	29%	0.289	C	S	.	.	H	α-helix	trans	-50.2	-34.3	-173.1	0	0	0	0	0	115.1	C320 C324 I325 Y326 L347 T361 V363	C320-A322 PolarHBondContact O-N 2.73Å; A322-C324 VanDerWaalsContact C-N 3.32Å; A322-C324 PolarHBondContact O-N 2.89Å; A322-I325 PolarHBondContact O-N 3.4Å; A322-Y326 HydrophobicContact CB-CE2 4.44Å; A322-Y326 WeakPolarHBondContact O-CD2 3.42Å; A322-Y326 PolarHBondContact O-N 2.64Å; A322-L347 HydrophobicContact CB-CD1 4.39Å; A322-L347 HydrophobicContact CB-CD2 3.49Å; A322-L347 VanDerWaalsContact CB-CD2 3.49Å; A322-T361 HydrophobicContact CB-CG2 3.87Å; A322-V363 HydrophobicContact CB-CB 4.22Å; A322-V363 HydrophobicContact CB-CG2 3.66Å
323	K	78.8	Confident	72.8	Confident	60 Å²	60	52 Å²	52	26%	0.261	29%	0.29	S	S	.	.	H	α-helix	trans	-56.2	-43.9	170.6	-80.9	-162.6	176	88.7	0	112.7	L308 Q321 I325 Y326 A327 T361 E364	L308-K323 HydrophobicContact CD2-CD 4.25Å; Q321-K323 PolarHBondContact O-N 2.63Å; K323-I325 VanDerWaalsContact C-N 3.34Å; K323-Y326 PolarHBondContact O-N 3.39Å; K323-A327 VanDerWaalsContact O-CB 3.25Å; K323-A327 WeakPolarHBondContact O-CB 3.21Å; K323-A327 PolarHBondContact O-N 3.2Å; K323-T361 HydrophobicContact CG-CG2 4.13Å; K323-E364 WeakPolarHBondContact CG-OE2 3.19Å; K323-E364 IonicContact NZ-OE1 3.9Å; K323-E364 PolarHBondContact NZ-OE1 3.19Å; K323-E364 IonicContact NZ-OE2 3.19Å; K323-E364 PolarHBondContact NZ-OE2 3.03Å
324	C	78.6	Confident	73.5	Confident	5 Å²	5	51.3 Å²	51.3	3%	0.034	27%	0.273	C	S	.	.	H	α-helix	trans	-68.4	-33.2	179.7	-58.9	0	0	0	0	112.5	C310 Q321 A322 K328 C329 L330	C310-C324 VanDerWaalsContact CA-SG 3.53Å; C310-C324 HydrophobicContact CB-CB 3.76Å; C310-C324 WeakPolarHBondContact CB-SG 3.39Å; C310-C324 WeakPolarHBondContact SG-CA 3.5Å; C310-C324 WeakPolarHBondContact SG-CB 3.28Å; C310-C324 CovalentContact SG-SG 2.03Å; C310-C324 PolarHBondContact SG-SG 2.86Å; Q321-C324 HydrophobicContact CB-CB 4.18Å; Q321-C324 WeakPolarHBondContact O-CA 3.39Å; Q321-C324 VanDerWaalsContact O-CB 3.26Å; Q321-C324 WeakPolarHBondContact O-CB 3.49Å; Q321-C324 PolarHBondContact O-N 3.24Å; A322-C324 VanDerWaalsContact C-N 3.32Å; A322-C324 PolarHBondContact O-N 2.89Å; C324-K328 PolarHBondContact O-N 3.36Å; C324-K328 VanDerWaalsContact O-N 3.16Å; C324-C329 HydrophobicContact CB-CB 4.28Å; C324-C329 WeakPolarHBondContact O-CB 3.35Å; C324-C329 PolarHBondContact O-N 3.12Å; C324-L330 HydrophobicContact CB-CD1 3.75Å; C324-L330 HydrophobicContact CB-CG 4.06Å
325	I	77.3	Confident	73.9	Confident	16 Å²	16	47.2 Å²	47.2	8%	0.082	26%	0.255	C	S	.	.	H	α-helix	trans	-65.6	-53.1	172	-62.2	-176.7	0	0	0	110.4	Q321 A322 K323 A327 K328 V332 E335 L336 C340 L347	Q321-I325 PolarHBondContact O-N 3.2Å; A322-I325 PolarHBondContact O-N 3.4Å; K323-I325 VanDerWaalsContact C-N 3.34Å; I325-A327 VanDerWaalsContact C-N 3.34Å; I325-A327 PolarHBondContact O-N 2.64Å; I325-K328 PolarHBondContact O-N 3.19Å; I325-V332 HydrophobicContact CG2-CG1 4.08Å; I325-V332 HydrophobicContact CG2-CG2 4.16Å; I325-E335 HydrophobicContact CD1-CB 4.49Å; I325-E335 HydrophobicContact CD1-CG 4.2Å; I325-E335 HydrophobicContact CG1-CG 4.49Å; I325-E335 VanDerWaalsContact CG1-OE2 3.22Å; I325-E335 WeakPolarHBondContact CG1-OE2 3.46Å; I325-L336 HydrophobicContact CD1-CD1 4.2Å; I325-C340 HydrophobicContact CD1-CB 4.01Å; I325-C340 WeakPolarHBondContact CD1-SG 3.43Å; I325-L347 HydrophobicContact CD1-CD1 4.48Å
326	Y	75.4	Confident	74.2	Confident	35 Å²	35	46 Å²	46	14%	0.137	25%	0.246	C	C	.	.	H	α-helix	trans	-63.7	-35.8	179.6	-70.8	-56.8	0	0	0	113.4	A322 K323 K328 L347 T350 E351 V354 Y356 T361	A322-Y326 HydrophobicContact CB-CE2 4.44Å; A322-Y326 WeakPolarHBondContact O-CD2 3.42Å; A322-Y326 PolarHBondContact O-N 2.64Å; K323-Y326 PolarHBondContact O-N 3.39Å; Y326-K328 PolarHBondContact O-N 3.48Å; Y326-L347 HydrophobicContact CE2-CD2 3.84Å; Y326-L347 VanDerWaalsContact OH-CA 3.25Å; Y326-L347 WeakPolarHBondContact OH-CA 3.22Å; Y326-L347 WeakPolarHBondContact OH-CD2 3.32Å; Y326-L347 PolarHBondContact OH-O 2.97Å; Y326-T350 PolarHBondContact OH-OG1 2.93Å; Y326-E351 HydrophobicContact CE1-CB 3.98Å; Y326-E351 HydrophobicContact CE1-CG 4.05Å; Y326-V354 HydrophobicContact CD2-CG2 4.45Å; Y326-V354 HydrophobicContact CE2-CG2 4.01Å; Y326-Y356 PolarHBondContact O-OH 2.93Å; Y326-T361 HydrophobicContact CD2-CG2 3.71Å; Y326-T361 HydrophobicContact CE2-CG2 3.71Å
327	A	71.4	Confident	74.2	Confident	9 Å²	9	50.1 Å²	50.1	7%	0.074	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.1	-3.5	174.4	0	0	0	0	0	113.9	L308 K323 I325 C329	L308-A327 HydrophobicContact CD1-CB 3.22Å; K323-A327 VanDerWaalsContact O-CB 3.25Å; K323-A327 WeakPolarHBondContact O-CB 3.21Å; K323-A327 PolarHBondContact O-N 3.2Å; I325-A327 VanDerWaalsContact C-N 3.34Å; I325-A327 PolarHBondContact O-N 2.64Å; A327-C329 VanDerWaalsContact C-N 3.27Å; A327-C329 WeakPolarHBondContact CB-SG 3.5Å; A327-C329 PolarHBondContact O-N 3.38Å
328	K	73.9	Confident	74.3	Confident	101 Å²	101	52 Å²	52	44%	0.439	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	60.2	35.4	179.1	-54.9	173.1	-174.6	171.2	0	113.1	C324 I325 Y326	C324-K328 PolarHBondContact O-N 3.36Å; C324-K328 VanDerWaalsContact O-N 3.16Å; I325-K328 PolarHBondContact O-N 3.19Å; Y326-K328 PolarHBondContact O-N 3.48Å
329	C	74.2	Confident	74.5	Confident	22 Å²	22	47.8 Å²	47.8	15%	0.149	24%	0.236	C	C	.	.			trans	-88.7	-27.1	-176.5	-61.6	0	0	0	0	113.6	C305 C310 C324 A327	C305-C329 WeakPolarHBondContact CA-SG 3.15Å; C305-C329 HydrophobicContact CB-CB 3.55Å; C305-C329 WeakPolarHBondContact CB-SG 3.44Å; C305-C329 WeakPolarHBondContact SG-CA 3.48Å; C305-C329 WeakPolarHBondContact SG-CB 3.37Å; C305-C329 CovalentContact SG-SG 2.02Å; C305-C329 PolarHBondContact SG-SG 2.99Å; C310-C329 HydrophobicContact CB-CB 3.59Å; C324-C329 HydrophobicContact CB-CB 4.28Å; C324-C329 WeakPolarHBondContact O-CB 3.35Å; C324-C329 PolarHBondContact O-N 3.12Å; A327-C329 VanDerWaalsContact C-N 3.27Å; A327-C329 WeakPolarHBondContact CB-SG 3.5Å; A327-C329 PolarHBondContact O-N 3.38Å
330	L	70.8	Confident	74.5	Confident	21 Å²	21	46.8 Å²	46.8	11%	0.11	23%	0.231	C	C	.	.	S	Bend	trans	-118.5	155.7	175.7	-64.5	174.9	0	0	0	108.9	T315 C324 V332 E335	T315-L330 HydrophobicContact CG2-CD1 4.22Å; T315-L330 HydrophobicContact CG2-CD2 4.43Å; C324-L330 HydrophobicContact CB-CD1 3.75Å; C324-L330 HydrophobicContact CB-CG 4.06Å; L330-V332 PolarHBondContact O-N 3.32Å; L330-V332 VanDerWaalsContact O-N 3.12Å; L330-E335 VanDerWaalsContact CB-OE2 3.29Å; L330-E335 WeakPolarHBondContact CB-OE2 3.26Å; L330-E335 WeakPolarHBondContact CD1-OE2 3.33Å
331	N	67.8	Low	74.6	Confident	111 Å²	111	50.9 Å²	50.9	59%	0.594	25%	0.25	S	C	*	.			trans	-64.9	113.5	173.9	-83	-5.4	0	0	0	108.5	E333 D334 E335	N331-E333 PolarHBondContact O-N 3.15Å; N331-D334 HydrophobicContact CB-CB 4.02Å; N331-D334 VanDerWaalsContact CB-OD2 3.29Å; N331-D334 WeakPolarHBondContact CB-OD2 3.35Å; N331-D334 PolarHBondContact ND2-OD2 2.85Å; N331-D334 PolarHBondContact O-N 3.04Å; N331-E335 PolarHBondContact O-N 3.41Å
332	V	63.9	Low	75	Confident	64 Å²	64	53 Å²	53	39%	0.388	26%	0.257	S	S	.	.	H	α-helix	trans	-53	-44.2	-179.3	-176.4	0	0	0	0	110.8	I325 L330 D334 L336	I325-V332 HydrophobicContact CG2-CG1 4.08Å; I325-V332 HydrophobicContact CG2-CG2 4.16Å; L330-V332 PolarHBondContact O-N 3.32Å; L330-V332 VanDerWaalsContact O-N 3.12Å; V332-D334 PolarHBondContact O-N 3.35Å; V332-L336 HydrophobicContact CG1-CB 4.23Å; V332-L336 HydrophobicContact CG1-CD2 3.93Å; V332-L336 WeakPolarHBondContact O-CA 3.37Å; V332-L336 WeakPolarHBondContact O-CB 3.49Å; V332-L336 PolarHBondContact O-N 2.88Å
333	E	67.2	Low	75.3	Confident	172 Å²	172	52.9 Å²	52.9	80%	0.804	26%	0.256	S	S	*	.	H	α-helix	trans	-60.8	-47.1	-178.9	-64.1	173.4	179	0	0	112.5	N331 E335 E337	N331-E333 PolarHBondContact O-N 3.15Å; E333-E335 PolarHBondContact O-N 2.84Å; E333-E337 VanDerWaalsContact O-CB 3.24Å; E333-E337 WeakPolarHBondContact O-CB 3.37Å; E333-E337 PolarHBondContact O-N 3.31Å
334	D	66.3	Low	75.7	Confident	76 Å²	76	51.6 Å²	51.6	41%	0.406	25%	0.253	S	S	.	.	H	α-helix	trans	-65.7	-39.7	-176.8	-78.2	-62.1	0	0	0	113.8	N331 V332 K338	N331-D334 HydrophobicContact CB-CB 4.02Å; N331-D334 VanDerWaalsContact CB-OD2 3.29Å; N331-D334 WeakPolarHBondContact CB-OD2 3.35Å; N331-D334 PolarHBondContact ND2-OD2 2.85Å; N331-D334 PolarHBondContact O-N 3.04Å; V332-D334 PolarHBondContact O-N 3.35Å; D334-K338 WeakPolarHBondContact O-CD 3.37Å; D334-K338 WeakPolarHBondContact O-CG 3.14Å; D334-K338 PolarHBondContact O-NZ 2.85Å; D334-K338 IonicContact OD1-NZ 3.79Å
335	E	68.6	Low	76.1	Confident	0 Å²	0	58.2 Å²	58.2	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-89.5	-38.9	-174.5	-171.5	-178.3	-171.4	0	0	112.5	T315 Q321 I325 L330 N331 E333 E337 K338 D339 C340	T315-E335 HydrophobicContact CG2-CB 4.1Å; T315-E335 HydrophobicContact CG2-CG 4.3Å; Q321-E335 WeakPolarHBondContact CA-OE1 3.12Å; Q321-E335 WeakPolarHBondContact CB-OE1 3.16Å; Q321-E335 VanDerWaalsContact CG-OE1 3.28Å; Q321-E335 WeakPolarHBondContact CG-OE1 3.38Å; Q321-E335 PolarHBondContact N-OE1 3.33Å; I325-E335 HydrophobicContact CD1-CB 4.49Å; I325-E335 HydrophobicContact CD1-CG 4.2Å; I325-E335 HydrophobicContact CG1-CG 4.49Å; I325-E335 VanDerWaalsContact CG1-OE2 3.22Å; I325-E335 WeakPolarHBondContact CG1-OE2 3.46Å; L330-E335 VanDerWaalsContact CB-OE2 3.29Å; L330-E335 WeakPolarHBondContact CB-OE2 3.26Å; L330-E335 WeakPolarHBondContact CD1-OE2 3.33Å; N331-E335 PolarHBondContact O-N 3.41Å; E333-E335 PolarHBondContact O-N 2.84Å; E335-E337 VanDerWaalsContact C-N 3.3Å; E335-E337 PolarHBondContact O-N 3.46Å; E335-K338 PolarHBondContact O-N 2.8Å; E335-D339 HydrophobicContact CG-CB 4.29Å; E335-D339 PolarHBondContact O-N 3.42Å; E335-C340 PolarHBondContact O-N 3.11Å
336	L	68.2	Low	76.7	Confident	41 Å²	41	57.4 Å²	57.4	22%	0.215	28%	0.278	C	S	.	.	H	α-helix	trans	-68.5	-30.4	179.2	-165	71.2	0	0	0	112	I325 V332 C340 Q341 V344 L347	I325-L336 HydrophobicContact CD1-CD1 4.2Å; V332-L336 HydrophobicContact CG1-CB 4.23Å; V332-L336 HydrophobicContact CG1-CD2 3.93Å; V332-L336 WeakPolarHBondContact O-CA 3.37Å; V332-L336 WeakPolarHBondContact O-CB 3.49Å; V332-L336 PolarHBondContact O-N 2.88Å; L336-C340 HydrophobicContact CD1-CB 3.96Å; L336-Q341 VanDerWaalsContact O-CA 3.32Å; L336-Q341 WeakPolarHBondContact O-CA 3.43Å; L336-Q341 PolarHBondContact O-N 3.32Å; L336-V344 HydrophobicContact CD1-CB 4.36Å; L336-V344 HydrophobicContact CD1-CG1 4.39Å; L336-V344 HydrophobicContact CD1-CG2 3.77Å; L336-V344 HydrophobicContact CD2-CG1 4.22Å; L336-V344 HydrophobicContact CG-CG1 4.35Å; L336-V344 HydrophobicContact CG-CG2 3.82Å; L336-L347 HydrophobicContact CD1-CD1 3.92Å
337	E	68.2	Low	77.2	Confident	136 Å²	136	56.2 Å²	56.2	64%	0.636	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.4	-29.4	173.9	-175.3	-176.3	-132	0	0	113.1	E333 E335	E333-E337 VanDerWaalsContact O-CB 3.24Å; E333-E337 WeakPolarHBondContact O-CB 3.37Å; E333-E337 PolarHBondContact O-N 3.31Å; E335-E337 VanDerWaalsContact C-N 3.3Å; E335-E337 PolarHBondContact O-N 3.46Å
338	K	74.5	Confident	77.7	Confident	85 Å²	85	61.6 Å²	61.6	37%	0.37	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.9	-68.2	-168.6	-60.9	177.4	-168.2	72.4	0	112.4	D334 E335 Q341	D334-K338 WeakPolarHBondContact O-CD 3.37Å; D334-K338 WeakPolarHBondContact O-CG 3.14Å; D334-K338 PolarHBondContact O-NZ 2.85Å; D334-K338 IonicContact OD1-NZ 3.79Å; E335-K338 PolarHBondContact O-N 2.8Å; K338-Q341 PolarHBondContact O-NE2 2.96Å
339	D	82	Confident	77.9	Confident	2 Å²	2	59.8 Å²	59.8	1%	0.011	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.5	-35.1	-169.2	-51.7	-65	0	0	0	111.9	T315 G316 D317 N318 I319 C320 E335	T315-D339 WeakPolarHBondContact CA-OD2 3.42Å; G316-D339 VanDerWaalsContact CA-OD1 3.26Å; G316-D339 WeakPolarHBondContact CA-OD1 3.45Å; G316-D339 PolarHBondContact N-OD1 3.49Å; G316-D339 VanDerWaalsContact N-OD1 3.14Å; G316-D339 PolarHBondContact N-OD2 2.56Å; D317-D339 PolarHBondContact N-OD1 3.31Å; N318-D339 WeakPolarHBondContact CA-OD1 3.44Å; N318-D339 PolarHBondContact N-OD1 2.88Å; I319-D339 WeakPolarHBondContact O-CB 3.48Å; C320-D339 WeakPolarHBondContact CB-O 3.27Å; E335-D339 HydrophobicContact CG-CB 4.29Å; E335-D339 PolarHBondContact O-N 3.42Å
340	C	87	Confident	77.9	Confident	0 Å²	0	58.9 Å²	58.9	0%	0	29%	0.289	C	S	.	.	S	Bend	trans	-96.7	13.1	176.8	-75.4	0	0	0	0	114.9	C320 I325 E335 L336 Y342 W343 V344 L347	C320-C340 VanDerWaalsContact C-SG 3.58Å; C320-C340 WeakPolarHBondContact CA-SG 3.26Å; C320-C340 HydrophobicContact CB-CB 3.89Å; C320-C340 WeakPolarHBondContact CB-SG 3.27Å; C320-C340 WeakPolarHBondContact SG-CA 3.48Å; C320-C340 WeakPolarHBondContact SG-CB 3.29Å; C320-C340 CovalentContact SG-SG 2.03Å; C320-C340 PolarHBondContact SG-SG 3.1Å; I325-C340 HydrophobicContact CD1-CB 4.01Å; I325-C340 WeakPolarHBondContact CD1-SG 3.43Å; E335-C340 PolarHBondContact O-N 3.11Å; L336-C340 HydrophobicContact CD1-CB 3.96Å; C340-Y342 PolarHBondContact O-N 2.98Å; C340-Y342 VanDerWaalsContact O-N 3.09Å; C340-W343 PolarHBondContact O-N 3.14Å; C340-V344 WeakPolarHBondContact O-CG2 3.42Å; C340-V344 PolarHBondContact O-N 2.87Å; C340-L347 HydrophobicContact CB-CD1 4.21Å
341	Q	88	Confident	77.6	Confident	91 Å²	91	63.6 Å²	63.6	43%	0.425	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.3	-29.8	-170.7	73.3	-178.4	-87.4	0	0	115.2	L336 K338 V344	L336-Q341 VanDerWaalsContact O-CA 3.32Å; L336-Q341 WeakPolarHBondContact O-CA 3.43Å; L336-Q341 PolarHBondContact O-N 3.32Å; K338-Q341 PolarHBondContact O-NE2 2.96Å; Q341-V344 WeakPolarHBondContact O-CG2 3.41Å
342	Y	90.1	Very high	77.1	Confident	64 Å²	64	66.9 Å²	66.9	25%	0.251	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.3	-26.8	176.3	-53	-69.3	0	0	0	112	C340 Y381 I528 L531	C340-Y342 PolarHBondContact O-N 2.98Å; C340-Y342 VanDerWaalsContact O-N 3.09Å; Y342-Y381 PolarHBondContact O-OH 3.34Å; Y342-I528 HydrophobicContact CD1-CG2 4.28Å; Y342-L531 HydrophobicContact CD1-CB 4.16Å; Y342-L531 HydrophobicContact CD2-CB 3.94Å; Y342-L531 HydrophobicContact CE1-CB 3.9Å; Y342-L531 HydrophobicContact CE1-CD1 3.95Å; Y342-L531 HydrophobicContact CE2-CB 3.7Å; Y342-L531 HydrophobicContact CG-CB 4.19Å
343	W	90	Very high	76.7	Confident	0 Å²	0	66.7 Å²	66.7	0%	0	32%	0.317	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.2	-11.1	-174.7	-71.8	98.9	0	0	0	114.5	C320 C340 K345 C346 L347 V363 F366 Y381 A532 S535 T536	C320-W343 HydrophobicContact CB-CG 4.45Å; C340-W343 PolarHBondContact O-N 3.14Å; W343-K345 VanDerWaalsContact C-N 3.31Å; W343-K345 PolarHBondContact O-N 2.9Å; W343-K345 VanDerWaalsContact O-N 3.11Å; W343-C346 HydrophobicContact CE3-CB 3.92Å; W343-C346 HydrophobicContact CZ3-CB 4.42Å; W343-C346 WeakPolarHBondContact O-CA 3.36Å; W343-C346 WeakPolarHBondContact O-CB 3.47Å; W343-C346 PolarHBondContact O-N 3.12Å; W343-L347 HydrophobicContact CB-CD1 4.14Å; W343-L347 HydrophobicContact CB-CG 4.26Å; W343-L347 WeakPolarHBondContact O-CG 3.35Å; W343-L347 PolarHBondContact O-N 3.34Å; W343-V363 HydrophobicContact CB-CG2 4.1Å; W343-V363 HydrophobicContact CD2-CB 4.27Å; W343-V363 HydrophobicContact CD2-CG1 4.09Å; W343-V363 HydrophobicContact CD2-CG2 3.69Å; W343-V363 HydrophobicContact CE3-CB 4.43Å; W343-V363 HydrophobicContact CE3-CG2 3.74Å; W343-V363 HydrophobicContact CG-CG1 4.22Å; W343-V363 HydrophobicContact CG-CG2 3.85Å; W343-V363 HydrophobicContact CZ2-CG1 4.41Å; W343-V363 HydrophobicContact CZ3-CG2 4.41Å; W343-F366 HydrophobicContact CH2-CB 3.73Å; W343-F366 AromaticContact CH2-CD2 3.61Å; W343-F366 HydrophobicContact CH2-CD2 3.61Å; W343-F366 HydrophobicContact CH2-CE2 4.42Å; W343-F366 AromaticContact CH2-CG 3.79Å; W343-F366 HydrophobicContact CH2-CG 3.79Å; W343-F366 HydrophobicContact CZ2-CB 4.23Å; W343-F366 HydrophobicContact CZ2-CD2 4.19Å; W343-F366 HydrophobicContact CZ2-CG 4.13Å; W343-Y381 HydrophobicContact CD2-CE2 4.41Å; W343-Y381 HydrophobicContact CE3-CD2 4.17Å; W343-Y381 HydrophobicContact CE3-CE2 4.23Å; W343-Y381 AromaticContact CH2-CD2 3.8Å; W343-Y381 HydrophobicContact CH2-CD2 3.8Å; W343-Y381 HydrophobicContact CZ2-CD2 4.23Å; W343-Y381 AromaticContact CZ3-CD2 3.78Å; W343-Y381 HydrophobicContact CZ3-CD2 3.78Å; W343-Y381 HydrophobicContact CZ3-CE2 4.3Å; W343-A532 HydrophobicContact CZ2-CB 4Å; W343-A532 PolarHBondContact NE1-O 3.26Å; W343-S535 VanDerWaalsContact CD1-OG 3.26Å; W343-S535 PolarHBondContact NE1-OG 2.96Å; W343-T536 HydrophobicContact CZ2-CG2 4.03Å
344	V	86.9	Confident	76	Confident	33 Å²	33	60 Å²	60	20%	0.2	29%	0.289	C	S	.	.	H	α-helix	trans	-45.5	-47.7	-174.7	-173.9	0	0	0	0	113.9	L336 C340 Q341 L347 Q348	L336-V344 HydrophobicContact CD1-CB 4.36Å; L336-V344 HydrophobicContact CD1-CG1 4.39Å; L336-V344 HydrophobicContact CD1-CG2 3.77Å; L336-V344 HydrophobicContact CD2-CG1 4.22Å; L336-V344 HydrophobicContact CG-CG1 4.35Å; L336-V344 HydrophobicContact CG-CG2 3.82Å; C340-V344 WeakPolarHBondContact O-CG2 3.42Å; C340-V344 PolarHBondContact O-N 2.87Å; Q341-V344 WeakPolarHBondContact O-CG2 3.41Å; V344-L347 PolarHBondContact O-N 2.95Å; V344-Q348 HydrophobicContact CG1-CG 4.43Å; V344-Q348 WeakPolarHBondContact O-CB 3.37Å; V344-Q348 VanDerWaalsContact O-CG 3.28Å; V344-Q348 WeakPolarHBondContact O-CG 3.46Å; V344-Q348 PolarHBondContact O-N 2.62Å
345	K	87.2	Confident	75.1	Confident	143 Å²	143	62 Å²	62	62%	0.622	30%	0.299	S	S	*	.	H	α-helix	trans	-67.3	-37.7	-179.5	-66.3	-176.1	179.2	-179.4	0	112.8	W343 T349 E379	W343-K345 VanDerWaalsContact C-N 3.31Å; W343-K345 PolarHBondContact O-N 2.9Å; W343-K345 VanDerWaalsContact O-N 3.11Å; K345-T349 WeakPolarHBondContact O-CG2 3.26Å; K345-T349 PolarHBondContact O-N 3.43Å; K345-T349 PolarHBondContact O-OG1 2.81Å; K345-E379 HydrophobicContact CB-CB 4.12Å; K345-E379 HydrophobicContact CB-CG 4.42Å
346	C	89.7	Confident	74.3	Confident	0 Å²	0	66.3 Å²	66.3	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-64.4	-47.4	173.1	-173.6	0	0	0	0	110.4	W343 Q348 T349 T350 C362 E379 C380	W343-C346 HydrophobicContact CE3-CB 3.92Å; W343-C346 HydrophobicContact CZ3-CB 4.42Å; W343-C346 WeakPolarHBondContact O-CA 3.36Å; W343-C346 WeakPolarHBondContact O-CB 3.47Å; W343-C346 PolarHBondContact O-N 3.12Å; C346-Q348 PolarHBondContact O-N 3.27Å; C346-T349 PolarHBondContact O-N 3.06Å; C346-T349 VanDerWaalsContact O-N 3.16Å; C346-T349 PolarHBondContact O-OG1 2.87Å; C346-T349 VanDerWaalsContact O-OG1 3.1Å; C346-T350 WeakPolarHBondContact O-CB 3.42Å; C346-T350 VanDerWaalsContact O-CG2 3.3Å; C346-T350 WeakPolarHBondContact O-CG2 3.28Å; C346-T350 PolarHBondContact O-N 2.9Å; C346-T350 PolarHBondContact O-OG1 3.13Å; C346-C362 WeakPolarHBondContact SG-CB 3.46Å; C346-E379 VanDerWaalsContact CB-O 3.31Å; C346-E379 WeakPolarHBondContact CB-O 3.24Å; C346-E379 PolarHBondContact N-O 2.83Å; C346-C380 WeakPolarHBondContact CA-SG 3.46Å; C346-C380 HydrophobicContact CB-CB 3.92Å; C346-C380 WeakPolarHBondContact CB-SG 3.36Å; C346-C380 VanDerWaalsContact SG-CA 3.56Å; C346-C380 WeakPolarHBondContact SG-CB 3.21Å; C346-C380 CovalentContact SG-SG 2.04Å; C346-C380 PolarHBondContact SG-SG 3.44Å
347	L	84.7	Confident	73.3	Confident	10 Å²	10	70.2 Å²	70.2	5%	0.052	33%	0.329	C	S	.	.	H	α-helix	trans	-62.7	-42.7	-176.9	-63.4	174.9	0	0	0	112.1	A322 I325 Y326 L336 C340 W343 V344 T349 T350 E351 V363	A322-L347 HydrophobicContact CB-CD1 4.39Å; A322-L347 HydrophobicContact CB-CD2 3.49Å; A322-L347 VanDerWaalsContact CB-CD2 3.49Å; I325-L347 HydrophobicContact CD1-CD1 4.48Å; Y326-L347 HydrophobicContact CE2-CD2 3.84Å; Y326-L347 VanDerWaalsContact OH-CA 3.25Å; Y326-L347 WeakPolarHBondContact OH-CA 3.22Å; Y326-L347 WeakPolarHBondContact OH-CD2 3.32Å; Y326-L347 PolarHBondContact OH-O 2.97Å; L336-L347 HydrophobicContact CD1-CD1 3.92Å; C340-L347 HydrophobicContact CB-CD1 4.21Å; W343-L347 HydrophobicContact CB-CD1 4.14Å; W343-L347 HydrophobicContact CB-CG 4.26Å; W343-L347 WeakPolarHBondContact O-CG 3.35Å; W343-L347 PolarHBondContact O-N 3.34Å; V344-L347 PolarHBondContact O-N 2.95Å; L347-T349 PolarHBondContact O-N 3.11Å; L347-T350 PolarHBondContact O-N 3.29Å; L347-T350 PolarHBondContact O-OG1 3.03Å; L347-E351 PolarHBondContact O-N 2.62Å; L347-V363 HydrophobicContact CD2-CG2 3.95Å
348	Q	81.6	Confident	72.5	Confident	121 Å²	121	71.5 Å²	71.5	57%	0.565	34%	0.34	S	S	*	.	H	α-helix	trans	-64.3	-35.5	175	-72.9	171	-15.9	0	0	113.2	V344 C346	V344-Q348 HydrophobicContact CG1-CG 4.43Å; V344-Q348 WeakPolarHBondContact O-CB 3.37Å; V344-Q348 VanDerWaalsContact O-CG 3.28Å; V344-Q348 WeakPolarHBondContact O-CG 3.46Å; V344-Q348 PolarHBondContact O-N 2.62Å; C346-Q348 PolarHBondContact O-N 3.27Å
349	T	78.6	Confident	71.7	Confident	63 Å²	63	71.2 Å²	71.2	39%	0.387	34%	0.339	S	S	.	.	H	α-helix	trans	-85.2	-13.2	178.9	55.8	0	0	0	0	113.9	K345 C346 L347 E379	K345-T349 WeakPolarHBondContact O-CG2 3.26Å; K345-T349 PolarHBondContact O-N 3.43Å; K345-T349 PolarHBondContact O-OG1 2.81Å; C346-T349 PolarHBondContact O-N 3.06Å; C346-T349 VanDerWaalsContact O-N 3.16Å; C346-T349 PolarHBondContact O-OG1 2.87Å; C346-T349 VanDerWaalsContact O-OG1 3.1Å; L347-T349 PolarHBondContact O-N 3.11Å; T349-E379 HydrophobicContact CG2-CG 4.49Å
350	T	75.5	Confident	71.1	Confident	4 Å²	4	74.1 Å²	74.1	3%	0.025	36%	0.357	C	S	.	.	H	α-helix	trans	-107.3	-10	-178.4	53.2	0	0	0	0	114.1	Y326 C346 L347 H352 I353 V354 C362	Y326-T350 PolarHBondContact OH-OG1 2.93Å; C346-T350 WeakPolarHBondContact O-CB 3.42Å; C346-T350 VanDerWaalsContact O-CG2 3.3Å; C346-T350 WeakPolarHBondContact O-CG2 3.28Å; C346-T350 PolarHBondContact O-N 2.9Å; C346-T350 PolarHBondContact O-OG1 3.13Å; L347-T350 PolarHBondContact O-N 3.29Å; L347-T350 PolarHBondContact O-OG1 3.03Å; T350-H352 PolarHBondContact O-N 2.78Å; T350-I353 PolarHBondContact O-N 3.46Å; T350-V354 PolarHBondContact O-N 2.87Å; T350-C362 VanDerWaalsContact CG2-SG 3.54Å
351	E	63.4	Low	70.9	Confident	120 Å²	120	74.3 Å²	74.3	56%	0.561	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.2	-31	179.7	-173.8	172.6	-175.2	0	0	113.7	Y326 L347	Y326-E351 HydrophobicContact CE1-CB 3.98Å; Y326-E351 HydrophobicContact CE1-CG 4.05Å; L347-E351 PolarHBondContact O-N 2.62Å
352	H	56.8	Low	71	Confident	179 Å²	179	70.3 Å²	70.3	83%	0.829	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.7	-8.2	177.2	-59.6	-37.8	0	0	0	115.1	T350	T350-H352 PolarHBondContact O-N 2.78Å
353	I	56.4	Low	71	Confident	60 Å²	60	67.5 Å²	67.5	31%	0.308	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.5	-28.7	-172.8	-50.2	178.2	0	0	0	111.5	T350 N355 E374	T350-I353 PolarHBondContact O-N 3.46Å; I353-N355 PolarHBondContact O-N 3.37Å; I353-E374 HydrophobicContact CG2-CB 4.18Å; I353-E374 HydrophobicContact CG2-CG 3.89Å; I353-E374 WeakPolarHBondContact CG2-OE2 3.45Å
354	V	51.8	Low	70.8	Confident	33 Å²	33	70.6 Å²	70.6	20%	0.2	34%	0.344	C	S	.	.			trans	-68.8	94.4	179	-176.7	0	0	0	0	110.2	Y326 T350 Y356	Y326-V354 HydrophobicContact CD2-CG2 4.45Å; Y326-V354 HydrophobicContact CE2-CG2 4.01Å; T350-V354 PolarHBondContact O-N 2.87Å; V354-Y356 PolarHBondContact O-N 3.08Å
355	N	48.5	Very low	70.7	Confident	116 Å²	116	69.8 Å²	69.8	62%	0.62	34%	0.338	S	S	*	.			trans	-67	117	174.7	-164.7	7.7	0	0	0	109.3	I353 Y357 K359	I353-N355 PolarHBondContact O-N 3.37Å; N355-Y357 PolarHBondContact O-N 2.81Å; N355-K359 HydrophobicContact CB-CD 4.28Å
356	Y	51.6	Low	70.9	Confident	91 Å²	91	63.1 Å²	63.1	36%	0.357	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-1.7	-157.3	-127	-75.2	0	0	0	117.4	I280 Y326 V354	I280-Y356 HydrophobicContact CD1-CD1 4.36Å; I280-Y356 HydrophobicContact CD1-CE1 3.97Å; I280-Y356 HydrophobicContact CG2-CE1 4.3Å; I280-Y356 HydrophobicContact CG2-CE2 4.26Å; Y326-Y356 PolarHBondContact O-OH 2.93Å; V354-Y356 PolarHBondContact O-N 3.08Å
357	Y	47.8	Very low	70.8	Confident	123 Å²	123	63.7 Å²	63.7	48%	0.482	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-115.7	-25.8	-163.8	-84	-86.2	0	0	0	116.2	N277 N355	N277-Y357 VanDerWaalsContact ND2-CE2 3.29Å; N277-Y357 WeakPolarHBondContact ND2-CE2 3.45Å; N277-Y357 PolarHBondContact ND2-OH 2.84Å; N277-Y357 VanDerWaalsContact ND2-OH 3.07Å; N355-Y357 PolarHBondContact O-N 2.81Å
358	N	49.5	Very low	70.7	Confident	164 Å²	164	64.4 Å²	64.4	88%	0.877	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-164.7	31.8	-179.4	-137.6	3.2	0	0	0	116.5
359	K	59.1	Low	70.6	Confident	78 Å²	78	59.4 Å²	59.4	34%	0.339	30%	0.296	S	S	.	.			trans	-109.2	133.3	-179.7	-81.6	-166.8	160.8	-164	0	113	N355 E374	N355-K359 HydrophobicContact CB-CD 4.28Å; K359-E374 IonicContact NZ-OE1 3.67Å; K359-E374 PolarHBondContact NZ-OE1 2.97Å; K359-E374 IonicContact NZ-OE2 3.06Å; K359-E374 PolarHBondContact NZ-OE2 2.85Å
360	T	69.9	Low	70.9	Confident	64 Å²	64	63.1 Å²	63.1	39%	0.393	31%	0.307	S	S	.	.			trans	-63.5	151.5	162	35.8	0	0	0	0	110.5	E364 Q365	T360-E364 WeakPolarHBondContact CA-OE2 3.48Å; T360-E364 HydrophobicContact CG2-CB 4.31Å; T360-Q365 PolarHBondContact O-NE2 2.93Å; T360-Q365 VanDerWaalsContact O-NE2 3.13Å; T360-Q365 PolarHBondContact OG1-NE2 3.37Å
361	T	82.6	Confident	71.5	Confident	3 Å²	3	65.5 Å²	65.5	2%	0.018	32%	0.323	C	S	.	.			trans	-90.3	161	176.9	62.8	0	0	0	0	110.9	A322 K323 Y326 V363 E364 Q365	A322-T361 HydrophobicContact CB-CG2 3.87Å; K323-T361 HydrophobicContact CG-CG2 4.13Å; Y326-T361 HydrophobicContact CD2-CG2 3.71Å; Y326-T361 HydrophobicContact CE2-CG2 3.71Å; T361-V363 PolarHBondContact O-N 3.24Å; T361-E364 PolarHBondContact N-OE2 3.48Å; T361-E364 CarbonylContact O-C 3.49Å; T361-E364 PolarHBondContact O-N 3.43Å; T361-E364 WeakPolarHBondContact OG1-CG 3.5Å; T361-E364 PolarHBondContact OG1-OE2 2.88Å; T361-E364 VanDerWaalsContact OG1-OE2 3.05Å; T361-Q365 PolarHBondContact O-N 3.08Å
362	C	89.1	Confident	72.6	Confident	8 Å²	8	61.6 Å²	61.6	5%	0.054	31%	0.305	C	S	.	.	H	α-helix	trans	-58.1	-22.9	176.6	-63.8	0	0	0	0	114.1	C346 T350 E364 F366 C375 C380	C346-C362 WeakPolarHBondContact SG-CB 3.46Å; T350-C362 VanDerWaalsContact CG2-SG 3.54Å; C362-E364 VanDerWaalsContact C-N 3.33Å; C362-F366 WeakPolarHBondContact O-CB 3.26Å; C362-F366 PolarHBondContact O-N 3.23Å; C362-C375 WeakPolarHBondContact CA-SG 3.25Å; C362-C375 HydrophobicContact CB-CB 3.76Å; C362-C375 WeakPolarHBondContact CB-SG 3.37Å; C362-C375 VanDerWaalsContact SG-CA 3.55Å; C362-C375 WeakPolarHBondContact SG-CB 3.38Å; C362-C375 CovalentContact SG-SG 2.03Å; C362-C375 PolarHBondContact SG-SG 3.16Å; C362-C380 HydrophobicContact CB-CB 4.49Å
363	V	89.7	Confident	74	Confident	4 Å²	4	58 Å²	58	2%	0.024	30%	0.298	C	S	.	.	H	α-helix	trans	-69.5	-31.1	174.6	-169.3	0	0	0	0	112.2	C320 A322 W343 L347 T361 T536	C320-V363 HydrophobicContact CB-CG1 3.84Å; A322-V363 HydrophobicContact CB-CB 4.22Å; A322-V363 HydrophobicContact CB-CG2 3.66Å; W343-V363 HydrophobicContact CB-CG2 4.1Å; W343-V363 HydrophobicContact CD2-CB 4.27Å; W343-V363 HydrophobicContact CD2-CG1 4.09Å; W343-V363 HydrophobicContact CD2-CG2 3.69Å; W343-V363 HydrophobicContact CE3-CB 4.43Å; W343-V363 HydrophobicContact CE3-CG2 3.74Å; W343-V363 HydrophobicContact CG-CG1 4.22Å; W343-V363 HydrophobicContact CG-CG2 3.85Å; W343-V363 HydrophobicContact CZ2-CG1 4.41Å; W343-V363 HydrophobicContact CZ3-CG2 4.41Å; L347-V363 HydrophobicContact CD2-CG2 3.95Å; T361-V363 PolarHBondContact O-N 3.24Å; V363-T536 HydrophobicContact CG1-CG2 4.48Å; V363-T536 WeakPolarHBondContact O-CG2 3.38Å
364	E	85.6	Confident	75.4	Confident	65 Å²	65	58.9 Å²	58.9	30%	0.304	30%	0.301	S	S	.	.	H	α-helix	trans	-96.7	-13.6	179.4	-56.8	167.1	121.2	0	0	112.3	K323 T360 T361 C362	K323-E364 WeakPolarHBondContact CG-OE2 3.19Å; K323-E364 IonicContact NZ-OE1 3.9Å; K323-E364 PolarHBondContact NZ-OE1 3.19Å; K323-E364 IonicContact NZ-OE2 3.19Å; K323-E364 PolarHBondContact NZ-OE2 3.03Å; T360-E364 WeakPolarHBondContact CA-OE2 3.48Å; T360-E364 HydrophobicContact CG2-CB 4.31Å; T361-E364 PolarHBondContact N-OE2 3.48Å; T361-E364 CarbonylContact O-C 3.49Å; T361-E364 PolarHBondContact O-N 3.43Å; T361-E364 WeakPolarHBondContact OG1-CG 3.5Å; T361-E364 PolarHBondContact OG1-OE2 2.88Å; T361-E364 VanDerWaalsContact OG1-OE2 3.05Å; C362-E364 VanDerWaalsContact C-N 3.33Å
365	Q	86.4	Confident	77.2	Confident	17 Å²	17	57.4 Å²	57.4	8%	0.079	29%	0.291	C	S	.	.	H	α-helix	trans	-91.3	-29.1	175.1	-79.1	174.9	10.1	0	0	111.8	T360 T361 K367 N368 Q372 C375	T360-Q365 PolarHBondContact O-NE2 2.93Å; T360-Q365 VanDerWaalsContact O-NE2 3.13Å; T360-Q365 PolarHBondContact OG1-NE2 3.37Å; T361-Q365 PolarHBondContact O-N 3.08Å; Q365-K367 PolarHBondContact O-N 2.91Å; Q365-K367 VanDerWaalsContact O-N 3.09Å; Q365-N368 WeakPolarHBondContact CA-ND2 3.2Å; Q365-N368 PolarHBondContact O-N 3.02Å; Q365-N368 PolarHBondContact O-ND2 3.03Å; Q365-Q372 HydrophobicContact CG-CG 4.33Å; Q365-Q372 VanDerWaalsContact CG-OE1 3.28Å; Q365-C375 PolarHBondContact OE1-SG 3.03Å
366	F	90.1	Very high	79	Confident	2 Å²	2	55 Å²	55	1%	0.009	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	-44.8	116.5	177.3	179.4	-91.5	0	0	0	113.4	W343 C362 N368 Y529 A533 T536	W343-F366 HydrophobicContact CH2-CB 3.73Å; W343-F366 AromaticContact CH2-CD2 3.61Å; W343-F366 HydrophobicContact CH2-CD2 3.61Å; W343-F366 HydrophobicContact CH2-CE2 4.42Å; W343-F366 AromaticContact CH2-CG 3.79Å; W343-F366 HydrophobicContact CH2-CG 3.79Å; W343-F366 HydrophobicContact CZ2-CB 4.23Å; W343-F366 HydrophobicContact CZ2-CD2 4.19Å; W343-F366 HydrophobicContact CZ2-CG 4.13Å; C362-F366 WeakPolarHBondContact O-CB 3.26Å; C362-F366 PolarHBondContact O-N 3.23Å; F366-N368 PolarHBondContact O-N 2.97Å; F366-Y529 HydrophobicContact CE2-CD2 4.27Å; F366-Y529 AromaticContact CE2-CE2 3.66Å; F366-Y529 HydrophobicContact CE2-CE2 3.66Å; F366-Y529 HydrophobicContact CZ-CD2 4.31Å; F366-Y529 AromaticContact CZ-CE2 3.59Å; F366-Y529 HydrophobicContact CZ-CE2 3.59Å; F366-Y529 AromaticContact CZ-CZ 3.83Å; F366-A533 HydrophobicContact CD1-CB 4.49Å; F366-A533 HydrophobicContact CE1-CB 3.45Å; F366-A533 VanDerWaalsContact CE1-CB 3.45Å; F366-A533 HydrophobicContact CZ-CB 3.66Å; F366-T536 HydrophobicContact CB-CG2 4.44Å; F366-T536 HydrophobicContact CD1-CG2 4.02Å; F366-T536 HydrophobicContact CG-CG2 4.49Å
367	K	87.6	Confident	80.8	Confident	12 Å²	12	54 Å²	54	5%	0.052	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	60.3	36.7	174.9	-152.9	154.1	-161.9	58.9	0	115.4	Q365 G369 D383 G384 D386 I463 Y539	Q365-K367 PolarHBondContact O-N 2.91Å; Q365-K367 VanDerWaalsContact O-N 3.09Å; K367-G369 VanDerWaalsContact C-N 3.32Å; K367-D383 PolarHBondContact N-O 2.99Å; K367-G384 PolarHBondContact NZ-O 3.34Å; K367-D386 WeakPolarHBondContact CA-OD2 3.38Å; K367-D386 IonicContact NZ-OD1 2.73Å; K367-I463 WeakPolarHBondContact CE-O 3.4Å; K367-Y539 HydrophobicContact CB-CE2 3.99Å; K367-Y539 HydrophobicContact CG-CE2 4.43Å; K367-Y539 PolarHBondContact O-OH 3.16Å
368	N	83	Confident	82.6	Confident	25 Å²	25	53.7 Å²	53.7	13%	0.134	28%	0.281	C	S	.	.	S	Bend	trans	-82.6	2.5	172.6	80.7	67.2	0	0	0	114.8	Q365 F366 K370 Q372 D386 Q393	Q365-N368 WeakPolarHBondContact CA-ND2 3.2Å; Q365-N368 PolarHBondContact O-N 3.02Å; Q365-N368 PolarHBondContact O-ND2 3.03Å; F366-N368 PolarHBondContact O-N 2.97Å; N368-K370 VanDerWaalsContact C-N 3.35Å; N368-K370 VanDerWaalsContact OD1-CB 3.23Å; N368-K370 WeakPolarHBondContact OD1-CB 3.45Å; N368-K370 WeakPolarHBondContact OD1-CG 3.47Å; N368-K370 PolarHBondContact OD1-N 3.44Å; N368-Q372 PolarHBondContact ND2-OE1 3.44Å; N368-D386 PolarHBondContact N-OD2 2.87Å; N368-Q393 VanDerWaalsContact O-CG 3.27Å; N368-Q393 WeakPolarHBondContact O-CG 3.49Å; N368-Q393 PolarHBondContact O-NE2 3.09Å
369	G	80.7	Confident	84.5	Confident	17 Å²	17	49.7 Å²	49.7	18%	0.175	26%	0.257	C	S	.	.	S	Bend	trans	74.5	21.1	-178.9	0	0	0	0	0	114.2	K367 D386 I391	K367-G369 VanDerWaalsContact C-N 3.32Å; G369-D386 PolarHBondContact N-OD2 2.85Å; G369-I391 WeakPolarHBondContact CA-O 3.06Å
370	K	84.6	Confident	86	Confident	141 Å²	141	46 Å²	46	61%	0.613	24%	0.241	S	C	*	.	S	Bend	trans	-139.9	123.8	173.8	-52.4	172.4	-176.4	175.4	0	107.9	N368 Q372 D386	N368-K370 VanDerWaalsContact C-N 3.35Å; N368-K370 VanDerWaalsContact OD1-CB 3.23Å; N368-K370 WeakPolarHBondContact OD1-CB 3.45Å; N368-K370 WeakPolarHBondContact OD1-CG 3.47Å; N368-K370 PolarHBondContact OD1-N 3.44Å; K370-Q372 VanDerWaalsContact O-CD 3.27Å; K370-Q372 PolarHBondContact O-N 2.76Å; K370-Q372 PolarHBondContact O-NE2 3.28Å; K370-Q372 PolarHBondContact O-OE1 2.7Å; K370-D386 PolarHBondContact N-OD2 3.47Å
371	C	87.5	Confident	87	Confident	54 Å²	54	44.5 Å²	44.5	37%	0.365	23%	0.228	S	C	.	.			trans	-63.2	123.6	176.9	176.6	0	0	0	0	112.5	C387	C371-C387 WeakPolarHBondContact CA-SG 3.03Å; C371-C387 HydrophobicContact CB-CB 3.9Å; C371-C387 WeakPolarHBondContact CB-SG 3.2Å; C371-C387 WeakPolarHBondContact SG-CB 3.36Å; C371-C387 CovalentContact SG-SG 2.03Å; C371-C387 PolarHBondContact SG-SG 3.11Å
372	Q	87	Confident	87.3	Confident	38 Å²	38	46.4 Å²	46.4	18%	0.178	24%	0.238	C	C	.	.			trans	-107.3	104.1	164.2	-77.4	88.9	68.3	0	0	110.5	Q365 N368 K370 E374 C375 N376 D383	Q365-Q372 HydrophobicContact CG-CG 4.33Å; Q365-Q372 VanDerWaalsContact CG-OE1 3.28Å; N368-Q372 PolarHBondContact ND2-OE1 3.44Å; K370-Q372 VanDerWaalsContact O-CD 3.27Å; K370-Q372 PolarHBondContact O-N 2.76Å; K370-Q372 PolarHBondContact O-NE2 3.28Å; K370-Q372 PolarHBondContact O-OE1 2.7Å; Q372-E374 PolarHBondContact O-N 3.17Å; Q372-C375 HydrophobicContact CB-CB 4.29Å; Q372-C375 PolarHBondContact O-N 3.46Å; Q372-N376 PolarHBondContact O-N 3.34Å; Q372-D383 WeakPolarHBondContact CA-OD2 3.23Å; Q372-D383 PolarHBondContact N-OD2 3.08Å
373	P	85.7	Confident	87.3	Confident	104 Å²	104	46 Å²	46	68%	0.675	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.4	-20.7	176	-25.9	35.2	0	0	0	114.4	C375	P373-C375 VanDerWaalsContact C-N 3.26Å; P373-C375 PolarHBondContact O-N 3.44Å
374	E	85.3	Confident	87.2	Confident	78 Å²	78	45.9 Å²	45.9	36%	0.364	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-22.3	173.9	-65.5	178.7	-172.9	0	0	112.8	I353 K359 Q372 R377	I353-E374 HydrophobicContact CG2-CB 4.18Å; I353-E374 HydrophobicContact CG2-CG 3.89Å; I353-E374 WeakPolarHBondContact CG2-OE2 3.45Å; K359-E374 IonicContact NZ-OE1 3.67Å; K359-E374 PolarHBondContact NZ-OE1 2.97Å; K359-E374 IonicContact NZ-OE2 3.06Å; K359-E374 PolarHBondContact NZ-OE2 2.85Å; Q372-E374 PolarHBondContact O-N 3.17Å; E374-R377 PolarHBondContact O-NH1 3.19Å; E374-R377 PolarHBondContact O-NH2 3.3Å
375	C	89.1	Confident	87.3	Confident	1 Å²	1	42.8 Å²	42.8	1%	0.007	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-116.9	-12	-176.9	-60.4	0	0	0	0	113.7	C362 Q365 Q372 P373 R377 C380 D383	C362-C375 WeakPolarHBondContact CA-SG 3.25Å; C362-C375 HydrophobicContact CB-CB 3.76Å; C362-C375 WeakPolarHBondContact CB-SG 3.37Å; C362-C375 VanDerWaalsContact SG-CA 3.55Å; C362-C375 WeakPolarHBondContact SG-CB 3.38Å; C362-C375 CovalentContact SG-SG 2.03Å; C362-C375 PolarHBondContact SG-SG 3.16Å; Q365-C375 PolarHBondContact OE1-SG 3.03Å; Q372-C375 HydrophobicContact CB-CB 4.29Å; Q372-C375 PolarHBondContact O-N 3.46Å; P373-C375 VanDerWaalsContact C-N 3.26Å; P373-C375 PolarHBondContact O-N 3.44Å; C375-R377 PolarHBondContact O-N 3.49Å; C375-C380 WeakPolarHBondContact O-CB 3.32Å; C375-D383 HydrophobicContact CB-CB 4.3Å; C375-D383 WeakPolarHBondContact CB-OD1 3.25Å; C375-D383 PolarHBondContact O-N 2.67Å
376	N	88.1	Confident	87.3	Confident	65 Å²	65	42.2 Å²	42.2	35%	0.348	22%	0.217	S	C	.	.			trans	-72	69.2	172.9	-170.9	13.6	0	0	0	112.8	Q372 D383 C387	Q372-N376 PolarHBondContact O-N 3.34Å; N376-D383 HydrophobicContact CB-CB 4.3Å; N376-C387 HydrophobicContact CB-CB 4.25Å; N376-C387 WeakPolarHBondContact ND2-CB 3.43Å
377	R	87.6	Confident	87	Confident	70 Å²	70	43.6 Å²	43.6	26%	0.264	23%	0.227	S	C	.	.	S	Bend	trans	-138.7	157.3	173.7	-70	-167.9	-65.4	-70.4	-8.2	110.3	E374 C375 E379 C380 Y381 M382	E374-R377 PolarHBondContact O-NH1 3.19Å; E374-R377 PolarHBondContact O-NH2 3.3Å; C375-R377 PolarHBondContact O-N 3.49Å; R377-E379 VanDerWaalsContact C-N 3.26Å; R377-E379 PolarHBondContact O-N 3.13Å; R377-C380 CarbonylContact O-C 3.53Å; R377-C380 VanDerWaalsContact O-C 3.25Å; R377-C380 WeakPolarHBondContact O-CA 3.46Å; R377-C380 PolarHBondContact O-N 2.87Å; R377-Y381 PolarHBondContact O-N 3.36Å; R377-Y381 VanDerWaalsContact O-N 3.13Å; R377-M382 PolarHBondContact O-N 3.17Å
378	N	86.8	Confident	86.4	Confident	118 Å²	118	47.2 Å²	47.2	63%	0.631	25%	0.246	S	C	*	.	G	3₁₀ helix	trans	-61.6	-34.8	-177.9	-67.3	-8.2	0	0	0	112.5	C380 Y381	N378-C380 PolarHBondContact O-N 2.74Å; N378-Y381 PolarHBondContact O-N 2.8Å
379	E	89	Confident	85.4	Confident	80 Å²	80	49.9 Å²	49.9	37%	0.374	26%	0.258	S	S	.	.	G	3₁₀ helix	trans	-68.3	-23.5	177.5	-59.7	70.3	-151.8	0	0	112.7	K345 C346 T349 R377	K345-E379 HydrophobicContact CB-CB 4.12Å; K345-E379 HydrophobicContact CB-CG 4.42Å; C346-E379 VanDerWaalsContact CB-O 3.31Å; C346-E379 WeakPolarHBondContact CB-O 3.24Å; C346-E379 PolarHBondContact N-O 2.83Å; T349-E379 HydrophobicContact CG2-CG 4.49Å; R377-E379 VanDerWaalsContact C-N 3.26Å; R377-E379 PolarHBondContact O-N 3.13Å
380	C	90.5	Very high	84.4	Confident	1 Å²	1	56.8 Å²	56.8	1%	0.007	29%	0.291	C	S	.	.	G	3₁₀ helix	trans	-111.5	25.6	178.2	-66	0	0	0	0	111.6	C346 C362 C375 R377 N378 M382 D383	C346-C380 WeakPolarHBondContact CA-SG 3.46Å; C346-C380 HydrophobicContact CB-CB 3.92Å; C346-C380 WeakPolarHBondContact CB-SG 3.36Å; C346-C380 VanDerWaalsContact SG-CA 3.56Å; C346-C380 WeakPolarHBondContact SG-CB 3.21Å; C346-C380 CovalentContact SG-SG 2.04Å; C346-C380 PolarHBondContact SG-SG 3.44Å; C362-C380 HydrophobicContact CB-CB 4.49Å; C375-C380 WeakPolarHBondContact O-CB 3.32Å; R377-C380 CarbonylContact O-C 3.53Å; R377-C380 VanDerWaalsContact O-C 3.25Å; R377-C380 WeakPolarHBondContact O-CA 3.46Å; R377-C380 PolarHBondContact O-N 2.87Å; N378-C380 PolarHBondContact O-N 2.74Å; C380-M382 VanDerWaalsContact C-N 3.27Å; C380-M382 PolarHBondContact O-N 2.75Å; C380-D383 PolarHBondContact O-N 2.95Å
381	Y	91.1	Very high	83.3	Confident	31 Å²	31	50.8 Å²	50.8	12%	0.122	27%	0.265	C	S	.	.	G	3₁₀ helix	trans	57.6	34	172	-55.6	-65	0	0	0	115.2	Y342 W343 R377 N378 D383 G384 I528 Y529 A532	Y342-Y381 PolarHBondContact O-OH 3.34Å; W343-Y381 HydrophobicContact CD2-CE2 4.41Å; W343-Y381 HydrophobicContact CE3-CD2 4.17Å; W343-Y381 HydrophobicContact CE3-CE2 4.23Å; W343-Y381 AromaticContact CH2-CD2 3.8Å; W343-Y381 HydrophobicContact CH2-CD2 3.8Å; W343-Y381 HydrophobicContact CZ2-CD2 4.23Å; W343-Y381 AromaticContact CZ3-CD2 3.78Å; W343-Y381 HydrophobicContact CZ3-CD2 3.78Å; W343-Y381 HydrophobicContact CZ3-CE2 4.3Å; R377-Y381 PolarHBondContact O-N 3.36Å; R377-Y381 VanDerWaalsContact O-N 3.13Å; N378-Y381 PolarHBondContact O-N 2.8Å; Y381-D383 PolarHBondContact O-N 3.05Å; Y381-D383 VanDerWaalsContact O-N 3.16Å; Y381-G384 PolarHBondContact O-N 2.82Å; Y381-G384 VanDerWaalsContact O-N 3.08Å; Y381-I528 HydrophobicContact CE1-CG2 3.69Å; Y381-I528 WeakPolarHBondContact OH-CG2 3.27Å; Y381-Y529 HydrophobicContact CD1-CD2 4.36Å; Y381-Y529 HydrophobicContact CG-CD2 4.45Å; Y381-A532 HydrophobicContact CD2-CB 3.79Å; Y381-A532 HydrophobicContact CE2-CB 3.51Å; Y381-A532 HydrophobicContact CG-CB 4.42Å
382	M	89.2	Confident	82.3	Confident	43 Å²	43	51.4 Å²	51.4	21%	0.212	27%	0.27	C	S	.	.	G	3₁₀ helix	trans	50.4	37.4	-179.4	-68.6	175.1	-80.6	0	0	112.8	R377 C380 G384 F385 L521	R377-M382 PolarHBondContact O-N 3.17Å; C380-M382 VanDerWaalsContact C-N 3.27Å; C380-M382 PolarHBondContact O-N 2.75Å; M382-G384 PolarHBondContact O-N 2.86Å; M382-F385 HydrophobicContact CB-CD1 4.21Å; M382-F385 HydrophobicContact CB-CE1 4.25Å; M382-F385 HydrophobicContact CE-CD1 4.43Å; M382-F385 HydrophobicContact CE-CE1 3.41Å; M382-F385 VanDerWaalsContact CE-CE1 3.41Å; M382-F385 HydrophobicContact CE-CZ 3.73Å; M382-F385 WeakPolarHBondContact O-CA 3.47Å; M382-F385 PolarHBondContact O-N 3.25Å; M382-F385 HydrophobicContact SD-CE1 3.97Å; M382-L521 HydrophobicContact CE-CD2 3.92Å
383	D	88.8	Confident	81.7	Confident	1 Å²	1	55 Å²	55	1%	0.005	29%	0.287	C	S	.	.	G	3₁₀ helix	trans	59.8	27.9	178.8	-153.6	34.6	0	0	0	114.1	K367 Q372 C375 N376 C380 Y381 F385 D386	K367-D383 PolarHBondContact N-O 2.99Å; Q372-D383 WeakPolarHBondContact CA-OD2 3.23Å; Q372-D383 PolarHBondContact N-OD2 3.08Å; C375-D383 HydrophobicContact CB-CB 4.3Å; C375-D383 WeakPolarHBondContact CB-OD1 3.25Å; C375-D383 PolarHBondContact O-N 2.67Å; N376-D383 HydrophobicContact CB-CB 4.3Å; C380-D383 PolarHBondContact O-N 2.95Å; Y381-D383 PolarHBondContact O-N 3.05Å; Y381-D383 VanDerWaalsContact O-N 3.16Å; D383-F385 PolarHBondContact O-N 3.19Å; D383-D386 PolarHBondContact O-N 3.48Å
384	G	88.1	Confident	81.5	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	26%	0.258	C	S	.	.	G	3₁₀ helix	trans	69.1	18	-172.5	0	0	0	0	0	113.6	K367 Y381 M382 D386	K367-G384 PolarHBondContact NZ-O 3.34Å; Y381-G384 PolarHBondContact O-N 2.82Å; Y381-G384 VanDerWaalsContact O-N 3.08Å; M382-G384 PolarHBondContact O-N 2.86Å; G384-D386 VanDerWaalsContact C-N 3.34Å
385	F	87.3	Confident	81	Confident	1 Å²	1	52.8 Å²	52.8	0%	0.004	28%	0.277	C	S	.	.	G	3₁₀ helix	trans	72	12.2	-175	-55.2	-79.1	0	0	0	116.4	M382 D383 C387 L388 L520 L521 Y529	M382-F385 HydrophobicContact CB-CD1 4.21Å; M382-F385 HydrophobicContact CB-CE1 4.25Å; M382-F385 HydrophobicContact CE-CD1 4.43Å; M382-F385 HydrophobicContact CE-CE1 3.41Å; M382-F385 VanDerWaalsContact CE-CE1 3.41Å; M382-F385 HydrophobicContact CE-CZ 3.73Å; M382-F385 WeakPolarHBondContact O-CA 3.47Å; M382-F385 PolarHBondContact O-N 3.25Å; M382-F385 HydrophobicContact SD-CE1 3.97Å; D383-F385 PolarHBondContact O-N 3.19Å; F385-C387 PolarHBondContact O-N 2.99Å; F385-L388 HydrophobicContact CB-CD1 4.32Å; F385-L388 HydrophobicContact CB-CG 4.43Å; F385-L388 HydrophobicContact CD1-CD1 3.48Å; F385-L388 VanDerWaalsContact CD1-CD1 3.48Å; F385-L388 HydrophobicContact CD1-CG 4.04Å; F385-L388 HydrophobicContact CE1-CD1 4.19Å; F385-L388 HydrophobicContact CG-CD1 4.3Å; F385-L388 PolarHBondContact O-N 3.02Å; F385-L520 HydrophobicContact CD1-CD1 4.31Å; F385-L520 HydrophobicContact CE1-CD1 3.88Å; F385-L521 HydrophobicContact CE2-CD1 4.35Å; F385-L521 HydrophobicContact CZ-CD1 4.09Å; F385-L521 HydrophobicContact CZ-CD2 4.35Å; F385-L521 HydrophobicContact CZ-CG 4.17Å; F385-Y529 AromaticContact CD2-CE2 3.93Å; F385-Y529 HydrophobicContact CD2-CE2 3.93Å; F385-Y529 AromaticContact CD2-CZ 3.85Å; F385-Y529 WeakPolarHBondContact CD2-OH 3.38Å; F385-Y529 HydrophobicContact CE2-CD2 4.17Å; F385-Y529 HydrophobicContact CE2-CE1 4.29Å; F385-Y529 AromaticContact CE2-CE2 3.49Å; F385-Y529 HydrophobicContact CE2-CE2 3.49Å; F385-Y529 VanDerWaalsContact CE2-CE2 3.49Å; F385-Y529 AromaticContact CE2-CZ 3.59Å
386	D	85.7	Confident	80.6	Confident	5 Å²	5	54.7 Å²	54.7	3%	0.027	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-11.7	177.7	-70.8	-5.5	0	0	0	114.3	K367 N368 G369 K370 D383 G384	K367-D386 WeakPolarHBondContact CA-OD2 3.38Å; K367-D386 IonicContact NZ-OD1 2.73Å; N368-D386 PolarHBondContact N-OD2 2.87Å; G369-D386 PolarHBondContact N-OD2 2.85Å; K370-D386 PolarHBondContact N-OD2 3.47Å; D383-D386 PolarHBondContact O-N 3.48Å; G384-D386 VanDerWaalsContact C-N 3.34Å
387	C	84.4	Confident	80.5	Confident	31 Å²	31	54.3 Å²	54.3	21%	0.209	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.1	-4.4	175.7	-63.5	0	0	0	0	115.1	C371 N376 F385	C371-C387 WeakPolarHBondContact CA-SG 3.03Å; C371-C387 HydrophobicContact CB-CB 3.9Å; C371-C387 WeakPolarHBondContact CB-SG 3.2Å; C371-C387 WeakPolarHBondContact SG-CB 3.36Å; C371-C387 CovalentContact SG-SG 2.03Å; C371-C387 PolarHBondContact SG-SG 3.11Å; N376-C387 HydrophobicContact CB-CB 4.25Å; N376-C387 WeakPolarHBondContact ND2-CB 3.43Å; F385-C387 PolarHBondContact O-N 2.99Å
388	L	74.2	Confident	80.4	Confident	87 Å²	87	55 Å²	55	46%	0.455	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.2	-32	179.4	-73.9	-168.7	0	0	0	113.4	F385 L520	F385-L388 HydrophobicContact CB-CD1 4.32Å; F385-L388 HydrophobicContact CB-CG 4.43Å; F385-L388 HydrophobicContact CD1-CD1 3.48Å; F385-L388 VanDerWaalsContact CD1-CD1 3.48Å; F385-L388 HydrophobicContact CD1-CG 4.04Å; F385-L388 HydrophobicContact CE1-CD1 4.19Å; F385-L388 HydrophobicContact CG-CD1 4.3Å; F385-L388 PolarHBondContact O-N 3.02Å; L388-L520 HydrophobicContact CD1-CD1 3.61Å
389	Q	62.6	Low	80.5	Confident	81 Å²	81	53.3 Å²	53.3	38%	0.379	28%	0.279	S	S	.	.	S	Bend	trans	-145.5	156.2	173.7	-75.3	174.8	5.7	0	0	107	I391	Q389-I391 HydrophobicContact CB-CD1 3.93Å; Q389-I391 HydrophobicContact CB-CG1 3.59Å; Q389-I391 PolarHBondContact O-N 3Å
390	N	58.8	Low	80.5	Confident	162 Å²	162	49.6 Å²	49.6	87%	0.866	26%	0.262	S	S	*	.			trans	-79.5	64.5	179.3	-154.8	36.7	0	0	0	110.2	S392	N390-S392 PolarHBondContact O-N 3.08Å
391	I	62.1	Low	80.6	Confident	16 Å²	16	49.5 Å²	49.5	8%	0.082	26%	0.261	C	S	.	.			trans	-79.7	115.2	-169.3	-64.2	175.9	0	0	0	109.3	G369 Q389 I416 Q417	G369-I391 WeakPolarHBondContact CA-O 3.06Å; Q389-I391 HydrophobicContact CB-CD1 3.93Å; Q389-I391 HydrophobicContact CB-CG1 3.59Å; Q389-I391 PolarHBondContact O-N 3Å; I391-I416 HydrophobicContact CD1-CG2 4.36Å; I391-Q417 HydrophobicContact CG2-CB 3.64Å
392	S	65.9	Low	80.4	Confident	66 Å²	66	53.9 Å²	53.9	46%	0.462	28%	0.283	S	S	.	.			trans	-64.9	150.6	169.5	51.1	0	0	0	0	111.1	N390 Q417	N390-S392 PolarHBondContact O-N 3.08Å; S392-Q417 WeakPolarHBondContact O-CB 3.41Å; S392-Q417 WeakPolarHBondContact O-CG 3.24Å; S392-Q417 PolarHBondContact OG-NE2 3.43Å; S392-Q417 VanDerWaalsContact OG-NE2 3.13Å
393	Q	75.9	Confident	80.4	Confident	114 Å²	114	52.4 Å²	52.4	53%	0.533	28%	0.277	S	S	.	.			trans	-55.3	155.6	168.6	-66.3	-175.7	-9.9	0	0	110.9	N368 V395	N368-Q393 VanDerWaalsContact O-CG 3.27Å; N368-Q393 WeakPolarHBondContact O-CG 3.49Å; N368-Q393 PolarHBondContact O-NE2 3.09Å; Q393-V395 PolarHBondContact O-N 3.38Å
394	C	81.6	Confident	80.6	Confident	11 Å²	11	52.5 Å²	52.5	7%	0.074	28%	0.277	C	S	.	.			trans	-61.1	110.5	172.6	-175.3	0	0	0	0	110	S396 F397 Q417 C418	C394-S396 PolarHBondContact O-N 3.17Å; C394-F397 HydrophobicContact CB-CB 4.38Å; C394-F397 HydrophobicContact CB-CD2 4.22Å; C394-F397 PolarHBondContact O-N 3.42Å; C394-Q417 HydrophobicContact CB-CG 4.45Å; C394-C418 WeakPolarHBondContact CA-SG 3.49Å; C394-C418 HydrophobicContact CB-CB 4.08Å; C394-C418 WeakPolarHBondContact CB-SG 3.16Å; C394-C418 VanDerWaalsContact SG-CA 3.59Å; C394-C418 WeakPolarHBondContact SG-CB 3.39Å; C394-C418 CovalentContact SG-SG 2.04Å; C394-C418 PolarHBondContact SG-SG 3.38Å
395	V	74.7	Confident	80.6	Confident	124 Å²	124	53.8 Å²	53.8	75%	0.752	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.4	-32.1	-166.9	179.2	0	0	0	0	113	Q393	Q393-V395 PolarHBondContact O-N 3.38Å
396	S	80.9	Confident	80.6	Confident	42 Å²	42	57.2 Å²	57.2	29%	0.294	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-128.8	52.1	176.5	-50.7	0	0	0	0	110.6	C394 E398 F399 C400	C394-S396 PolarHBondContact O-N 3.17Å; S396-E398 PolarHBondContact O-N 3.11Å; S396-E398 VanDerWaalsContact O-N 3.16Å; S396-F399 WeakPolarHBondContact O-CA 2.99Å; S396-F399 WeakPolarHBondContact O-CB 3.43Å; S396-F399 PolarHBondContact O-N 3.23Å; S396-C400 PolarHBondContact O-N 3.41Å
397	F	85.2	Confident	80.6	Confident	57 Å²	57	58.7 Å²	58.7	25%	0.25	33%	0.325	C	S	.	.	H	α-helix	trans	-34	-60.7	-174.7	-176.1	-98.9	0	0	0	114.5	C394 F399 C400 L401 I463 Y539	C394-F397 HydrophobicContact CB-CB 4.38Å; C394-F397 HydrophobicContact CB-CD2 4.22Å; C394-F397 PolarHBondContact O-N 3.42Å; F397-F399 PolarHBondContact O-N 3.34Å; F397-C400 PolarHBondContact O-N 3.32Å; F397-L401 HydrophobicContact CD1-CD1 3.93Å; F397-L401 HydrophobicContact CE1-CD1 3.43Å; F397-L401 VanDerWaalsContact CE1-CD1 3.43Å; F397-L401 HydrophobicContact CE1-CG 4.39Å; F397-L401 HydrophobicContact CE2-CD1 4.36Å; F397-L401 HydrophobicContact CZ-CD1 3.68Å; F397-L401 HydrophobicContact CZ-CG 4.48Å; F397-L401 WeakPolarHBondContact O-CG 3.48Å; F397-L401 PolarHBondContact O-N 3.4Å; F397-I463 HydrophobicContact CD2-CD1 3.85Å; F397-I463 HydrophobicContact CE2-CD1 3.62Å; F397-Y539 HydrophobicContact CE2-CE1 4.05Å; F397-Y539 HydrophobicContact CZ-CE1 4.23Å
398	E	86.5	Confident	80.7	Confident	85 Å²	85	60.8 Å²	60.8	40%	0.397	34%	0.337	S	S	.	.	H	α-helix	trans	-66.7	-36.7	-177.2	-175.9	56.3	-148.2	0	0	113.2	S396 L401 Q402 H456	S396-E398 PolarHBondContact O-N 3.11Å; S396-E398 VanDerWaalsContact O-N 3.16Å; E398-L401 PolarHBondContact O-N 3.41Å; E398-Q402 VanDerWaalsContact O-CG 3.29Å; E398-Q402 WeakPolarHBondContact O-CG 3.33Å; E398-Q402 PolarHBondContact O-N 3.18Å; E398-Q402 PolarHBondContact OE1-NE2 2.9Å; E398-H456 IonicContact OE1-ND1 2.95Å; E398-H456 IonicContact OE2-CE1 2.62Å; E398-H456 PolarHBondContact OE2-CE1 3.44Å; E398-H456 IonicContact OE2-ND1 2.64Å
399	F	87.7	Confident	81.4	Confident	81 Å²	81	59.2 Å²	59.2	36%	0.355	33%	0.332	S	S	.	.	H	α-helix	trans	-63.3	-46.1	173.2	169.8	-87.2	0	0	0	110.9	S396 F397 L401 Q402 S403 Q410 Q412	S396-F399 WeakPolarHBondContact O-CA 2.99Å; S396-F399 WeakPolarHBondContact O-CB 3.43Å; S396-F399 PolarHBondContact O-N 3.23Å; F397-F399 PolarHBondContact O-N 3.34Å; F399-L401 VanDerWaalsContact C-N 3.32Å; F399-L401 PolarHBondContact O-N 3.16Å; F399-Q402 PolarHBondContact O-N 3.23Å; F399-Q402 VanDerWaalsContact O-N 3.11Å; F399-S403 PolarHBondContact O-N 3.13Å; F399-Q410 HydrophobicContact CE1-CB 4.19Å; F399-Q410 HydrophobicContact CE1-CG 3.93Å; F399-Q410 HydrophobicContact CZ-CG 4.12Å; F399-Q412 HydrophobicContact CE1-CG 4.34Å
400	C	90.4	Very high	82.7	Confident	2 Å²	2	57.5 Å²	57.5	1%	0.014	33%	0.325	C	S	.	.	H	α-helix	trans	-66.9	-32.2	178.7	-63	0	0	0	0	112.4	S396 F397 Y404 C413 C418	S396-C400 PolarHBondContact O-N 3.41Å; F397-C400 PolarHBondContact O-N 3.32Å; C400-Y404 WeakPolarHBondContact O-CB 3.49Å; C400-Y404 PolarHBondContact O-N 2.96Å; C400-C413 WeakPolarHBondContact CA-SG 3.18Å; C400-C413 HydrophobicContact CB-CB 3.68Å; C400-C413 WeakPolarHBondContact CB-SG 3.27Å; C400-C413 VanDerWaalsContact SG-CA 3.54Å; C400-C413 WeakPolarHBondContact SG-CB 3.23Å; C400-C413 CovalentContact SG-SG 2.04Å; C400-C413 PolarHBondContact SG-SG 2.89Å; C400-C418 HydrophobicContact CB-CB 4.35Å
401	L	90.8	Very high	83.9	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-68.4	-31.2	170.8	-73.4	-174.1	0	0	0	113.1	F397 E398 F399 N455 H456 N460 I463	F397-L401 HydrophobicContact CD1-CD1 3.93Å; F397-L401 HydrophobicContact CE1-CD1 3.43Å; F397-L401 VanDerWaalsContact CE1-CD1 3.43Å; F397-L401 HydrophobicContact CE1-CG 4.39Å; F397-L401 HydrophobicContact CE2-CD1 4.36Å; F397-L401 HydrophobicContact CZ-CD1 3.68Å; F397-L401 HydrophobicContact CZ-CG 4.48Å; F397-L401 WeakPolarHBondContact O-CG 3.48Å; F397-L401 PolarHBondContact O-N 3.4Å; E398-L401 PolarHBondContact O-N 3.41Å; F399-L401 VanDerWaalsContact C-N 3.32Å; F399-L401 PolarHBondContact O-N 3.16Å; L401-N455 CarbonylContact O-C 3.59Å; L401-N455 VanDerWaalsContact O-CB 3.29Å; L401-N455 WeakPolarHBondContact O-CB 3.45Å; L401-H456 VanDerWaalsContact CD1-CE1 3.46Å; L401-H456 WeakPolarHBondContact CD1-CE1 3.38Å; L401-H456 PolarHBondContact O-N 3.01Å; L401-N460 WeakPolarHBondContact CD1-OD1 3.32Å; L401-N460 VanDerWaalsContact CD2-N 3.34Å; L401-I463 HydrophobicContact CD2-CD1 3.91Å
402	Q	87.8	Confident	85	Confident	122 Å²	122	58.3 Å²	58.3	57%	0.57	33%	0.334	S	S	*	.	H	α-helix	trans	-76.2	-42	176.9	-72	174.8	18.9	0	0	112	E398 F399 N455	E398-Q402 VanDerWaalsContact O-CG 3.29Å; E398-Q402 WeakPolarHBondContact O-CG 3.33Å; E398-Q402 PolarHBondContact O-N 3.18Å; E398-Q402 PolarHBondContact OE1-NE2 2.9Å; F399-Q402 PolarHBondContact O-N 3.23Å; F399-Q402 VanDerWaalsContact O-N 3.11Å; Q402-N455 WeakPolarHBondContact O-CB 3.21Å; Q402-N455 PolarHBondContact O-ND2 3.38Å
403	S	89.3	Confident	86.1	Confident	13 Å²	13	55.2 Å²	55.2	9%	0.091	31%	0.312	C	S	.	.	H	α-helix	trans	-78.3	-14.4	176.5	-75.2	0	0	0	0	115.2	F399 G405 D406	F399-S403 PolarHBondContact O-N 3.13Å; S403-G405 PolarHBondContact O-N 3.37Å; S403-D406 WeakPolarHBondContact CA-OD2 3.48Å; S403-D406 WeakPolarHBondContact O-CB 3.43Å; S403-D406 VanDerWaalsContact O-CG 3.24Å; S403-D406 PolarHBondContact O-N 3.45Å; S403-D406 PolarHBondContact OG-OD2 3.33Å
404	Y	92	Very high	86.6	Confident	3 Å²	3	52.8 Å²	52.8	1%	0.012	30%	0.303	C	S	.	.	T	Hydrogen-bonded Turn	trans	-52	107.4	-173.2	-160.7	-90.3	0	0	0	114.2	C400 G419 G422 N455 L458 G459 V469	C400-Y404 WeakPolarHBondContact O-CB 3.49Å; C400-Y404 PolarHBondContact O-N 2.96Å; Y404-G419 VanDerWaalsContact CE2-O 3.22Å; Y404-G419 WeakPolarHBondContact CE2-O 3.43Å; Y404-G419 PolarHBondContact OH-O 3.25Å; Y404-G422 VanDerWaalsContact CE1-CA 3.5Å; Y404-G422 VanDerWaalsContact CZ-CA 3.4Å; Y404-N455 WeakPolarHBondContact O-CB 3.36Å; Y404-N455 VanDerWaalsContact O-CG 3.24Å; Y404-L458 HydrophobicContact CD1-CB 3.99Å; Y404-L458 HydrophobicContact CE1-CB 4.03Å; Y404-G459 VanDerWaalsContact CG-CA 3.45Å; Y404-V469 WeakPolarHBondContact CE1-O 3.29Å; Y404-V469 PolarHBondContact OH-N 2.82Å
405	G	88.8	Confident	86.6	Confident	26 Å²	26	54.1 Å²	54.1	27%	0.268	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.7	33.1	178.2	0	0	0	0	0	113.8	S403 D424 R454	S403-G405 PolarHBondContact O-N 3.37Å; G405-D424 WeakPolarHBondContact CA-OD2 2.99Å; G405-D424 PolarHBondContact N-OD2 3.27Å; G405-R454 PolarHBondContact O-NH2 2.75Å
406	D	88	Confident	86.9	Confident	73 Å²	73	49.1 Å²	49.1	39%	0.39	28%	0.28	S	S	.	.	S	Bend	trans	-85.3	-18.1	173	79.4	19.4	0	0	0	113.7	S403 V408 D424	S403-D406 WeakPolarHBondContact CA-OD2 3.48Å; S403-D406 WeakPolarHBondContact O-CB 3.43Å; S403-D406 VanDerWaalsContact O-CG 3.24Å; S403-D406 PolarHBondContact O-N 3.45Å; S403-D406 PolarHBondContact OG-OD2 3.33Å; D406-V408 WeakPolarHBondContact OD1-CA 3.31Å; D406-V408 VanDerWaalsContact OD1-CB 3.29Å; D406-V408 WeakPolarHBondContact OD1-CB 3.46Å; D406-V408 PolarHBondContact OD1-N 2.87Å; D406-D424 PolarHBondContact N-OD2 3.08Å
407	G	85.8	Confident	86.9	Confident	37 Å²	37	48.9 Å²	48.9	38%	0.381	27%	0.274	S	S	.	.	S	Bend	trans	98.1	9.6	-179	0	0	0	0	0	115.1	D424	G407-D424 PolarHBondContact N-OD2 2.81Å
408	V	86.4	Confident	87	Confident	75 Å²	75	46.2 Å²	46.2	46%	0.455	26%	0.263	S	S	.	.	S	Bend	trans	-125.6	92.8	-178	-172.5	0	0	0	0	110.9	D406 Q410	D406-V408 WeakPolarHBondContact OD1-CA 3.31Å; D406-V408 VanDerWaalsContact OD1-CB 3.29Å; D406-V408 WeakPolarHBondContact OD1-CB 3.46Å; D406-V408 PolarHBondContact OD1-N 2.87Å; V408-Q410 WeakPolarHBondContact O-CG 3.38Å; V408-Q410 PolarHBondContact O-N 3.34Å; V408-Q410 PolarHBondContact O-NE2 2.9Å
409	C	88.4	Confident	87.1	Confident	53 Å²	53	42.2 Å²	42.2	36%	0.358	24%	0.244	S	C	.	.			trans	-40.2	105.8	177.3	174.4	0	0	0	0	114.6	D421 C425	C409-D421 WeakPolarHBondContact CA-OD2 3.02Å; C409-C425 WeakPolarHBondContact CA-SG 3.41Å; C409-C425 HydrophobicContact CB-CB 3.92Å; C409-C425 WeakPolarHBondContact CB-SG 3.22Å; C409-C425 VanDerWaalsContact SG-CA 3.51Å; C409-C425 WeakPolarHBondContact SG-CB 3.3Å; C409-C425 CovalentContact SG-SG 2.03Å; C409-C425 PolarHBondContact SG-SG 2.92Å
410	Q	89.4	Confident	87.1	Confident	46 Å²	46	40.1 Å²	40.1	22%	0.215	23%	0.234	C	C	.	.			trans	-93.1	100.1	168.7	-52.7	-57.9	-31.5	0	0	108.6	F399 V408 Q412 C413 N414 D421	F399-Q410 HydrophobicContact CE1-CB 4.19Å; F399-Q410 HydrophobicContact CE1-CG 3.93Å; F399-Q410 HydrophobicContact CZ-CG 4.12Å; V408-Q410 WeakPolarHBondContact O-CG 3.38Å; V408-Q410 PolarHBondContact O-N 3.34Å; V408-Q410 PolarHBondContact O-NE2 2.9Å; Q410-Q412 PolarHBondContact O-N 2.88Å; Q410-C413 HydrophobicContact CB-CB 3.97Å; Q410-C413 PolarHBondContact O-N 3.35Å; Q410-N414 PolarHBondContact O-N 3.33Å; Q410-N414 VanDerWaalsContact O-N 3.08Å; Q410-D421 PolarHBondContact N-OD2 2.67Å
411	S	84.4	Confident	87.1	Confident	101 Å²	101	40 Å²	40	71%	0.706	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56	-29	-176.8	56.4	0	0	0	0	114.2
412	Q	84.4	Confident	87	Confident	94 Å²	94	40 Å²	40	44%	0.439	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.7	-24.9	175	66.6	-166.6	19.9	0	0	114.2	F399 Q410	F399-Q412 HydrophobicContact CE1-CG 4.34Å; Q410-Q412 PolarHBondContact O-N 2.88Å
413	C	89.1	Confident	87	Confident	0 Å²	0	34.3 Å²	34.3	0%	0	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.1	-11.1	176.9	-57.2	0	0	0	0	112.7	C400 Q410 T415 C418 D421	C400-C413 WeakPolarHBondContact CA-SG 3.18Å; C400-C413 HydrophobicContact CB-CB 3.68Å; C400-C413 WeakPolarHBondContact CB-SG 3.27Å; C400-C413 VanDerWaalsContact SG-CA 3.54Å; C400-C413 WeakPolarHBondContact SG-CB 3.23Å; C400-C413 CovalentContact SG-SG 2.04Å; C400-C413 PolarHBondContact SG-SG 2.89Å; Q410-C413 HydrophobicContact CB-CB 3.97Å; Q410-C413 PolarHBondContact O-N 3.35Å; C413-T415 PolarHBondContact O-N 2.88Å; C413-C418 HydrophobicContact CB-CB 4.39Å; C413-C418 WeakPolarHBondContact O-CB 3.3Å; C413-D421 HydrophobicContact CB-CB 3.95Å; C413-D421 VanDerWaalsContact CB-OD1 3.23Å; C413-D421 WeakPolarHBondContact CB-OD1 3.23Å; C413-D421 PolarHBondContact O-N 3.18Å
414	N	86.8	Confident	87	Confident	63 Å²	63	35.3 Å²	35.3	34%	0.337	21%	0.211	S	C	.	.			trans	-76.8	59.8	176	-172.8	21.7	0	0	0	112.1	Q410 D421 C425	Q410-N414 PolarHBondContact O-N 3.33Å; Q410-N414 VanDerWaalsContact O-N 3.08Å; N414-D421 HydrophobicContact CB-CB 4.32Å; N414-C425 HydrophobicContact CB-CB 4.18Å; N414-C425 VanDerWaalsContact ND2-CB 3.26Å; N414-C425 WeakPolarHBondContact ND2-CB 3.25Å
415	T	82.5	Confident	86.6	Confident	40 Å²	40	36 Å²	36	25%	0.245	22%	0.216	C	C	.	.	S	Bend	trans	-139.6	155	-178.4	64.9	0	0	0	0	110.3	C413 Q417 C418 G419 Y420	C413-T415 PolarHBondContact O-N 2.88Å; T415-Q417 VanDerWaalsContact C-N 3.26Å; T415-Q417 VanDerWaalsContact CB-OE1 3.32Å; T415-Q417 PolarHBondContact O-N 2.86Å; T415-Q417 VanDerWaalsContact OG1-CD 3.31Å; T415-Q417 WeakPolarHBondContact OG1-CG 3.46Å; T415-Q417 PolarHBondContact OG1-OE1 2.89Å; T415-C418 CarbonylContact O-C 3.52Å; T415-C418 PolarHBondContact O-N 3.36Å; T415-C418 WeakPolarHBondContact OG1-CB 3.43Å; T415-C418 PolarHBondContact OG1-SG 2.84Å; T415-C418 VanDerWaalsContact OG1-SG 3.36Å; T415-G419 PolarHBondContact O-N 2.92Å; T415-Y420 PolarHBondContact O-N 3.14Å
416	I	81.1	Confident	85.9	Confident	19 Å²	19	37.9 Å²	37.9	10%	0.097	22%	0.218	C	C	.	.	G	3₁₀ helix	trans	-61.1	-34.2	-176.3	-171	169.1	0	0	0	112.6	I391 C418 G419 Y420 Q466 S515	I391-I416 HydrophobicContact CD1-CG2 4.36Å; I416-C418 VanDerWaalsContact C-N 3.3Å; I416-C418 PolarHBondContact O-N 3.4Å; I416-G419 PolarHBondContact O-N 3.37Å; I416-Y420 HydrophobicContact CB-CE1 4.5Å; I416-Y420 HydrophobicContact CB-CE2 4.07Å; I416-Y420 HydrophobicContact CG1-CE2 3.95Å; I416-Q466 HydrophobicContact CD1-CB 4.07Å; I416-Q466 HydrophobicContact CG1-CB 3.7Å; I416-Q466 HydrophobicContact CG1-CG 4.19Å; I416-S515 VanDerWaalsContact CD1-OG 3.29Å; I416-S515 WeakPolarHBondContact CD1-OG 3.23Å
417	Q	81.1	Confident	84.6	Confident	36 Å²	36	43.7 Å²	43.7	17%	0.168	24%	0.236	C	C	.	.	G	3₁₀ helix	trans	-71.3	-20	175.3	59.5	-91.8	45.5	0	0	114.6	I391 S392 C394 T415 I463	I391-Q417 HydrophobicContact CG2-CB 3.64Å; S392-Q417 WeakPolarHBondContact O-CB 3.41Å; S392-Q417 WeakPolarHBondContact O-CG 3.24Å; S392-Q417 PolarHBondContact OG-NE2 3.43Å; S392-Q417 VanDerWaalsContact OG-NE2 3.13Å; C394-Q417 HydrophobicContact CB-CG 4.45Å; T415-Q417 VanDerWaalsContact C-N 3.26Å; T415-Q417 VanDerWaalsContact CB-OE1 3.32Å; T415-Q417 PolarHBondContact O-N 2.86Å; T415-Q417 VanDerWaalsContact OG1-CD 3.31Å; T415-Q417 WeakPolarHBondContact OG1-CG 3.46Å; T415-Q417 PolarHBondContact OG1-OE1 2.89Å; Q417-I463 WeakPolarHBondContact O-CG1 3.49Å; Q417-I463 WeakPolarHBondContact O-CG2 3.34Å
418	C	87	Confident	83	Confident	2 Å²	2	48.6 Å²	48.6	1%	0.014	25%	0.249	C	C	.	.	G	3₁₀ helix	trans	-105.1	9.8	177.4	-63.8	0	0	0	0	112.1	C394 C400 C413 T415 I416 Y420	C394-C418 WeakPolarHBondContact CA-SG 3.49Å; C394-C418 HydrophobicContact CB-CB 4.08Å; C394-C418 WeakPolarHBondContact CB-SG 3.16Å; C394-C418 VanDerWaalsContact SG-CA 3.59Å; C394-C418 WeakPolarHBondContact SG-CB 3.39Å; C394-C418 CovalentContact SG-SG 2.04Å; C394-C418 PolarHBondContact SG-SG 3.38Å; C400-C418 HydrophobicContact CB-CB 4.35Å; C413-C418 HydrophobicContact CB-CB 4.39Å; C413-C418 WeakPolarHBondContact O-CB 3.3Å; T415-C418 CarbonylContact O-C 3.52Å; T415-C418 PolarHBondContact O-N 3.36Å; T415-C418 WeakPolarHBondContact OG1-CB 3.43Å; T415-C418 PolarHBondContact OG1-SG 2.84Å; T415-C418 VanDerWaalsContact OG1-SG 3.36Å; I416-C418 VanDerWaalsContact C-N 3.3Å; I416-C418 PolarHBondContact O-N 3.4Å; C418-Y420 VanDerWaalsContact C-N 3.32Å; C418-Y420 PolarHBondContact O-N 2.99Å
419	G	87.4	Confident	81.2	Confident	0 Å²	0	53.1 Å²	53.1	0%	0	27%	0.265	C	S	.	.	G	3₁₀ helix	trans	67.8	28	-179.4	0	0	0	0	0	114.4	Y404 T415 I416 D421	Y404-G419 VanDerWaalsContact CE2-O 3.22Å; Y404-G419 WeakPolarHBondContact CE2-O 3.43Å; Y404-G419 PolarHBondContact OH-O 3.25Å; T415-G419 PolarHBondContact O-N 2.92Å; I416-G419 PolarHBondContact O-N 3.37Å; G419-D421 PolarHBondContact O-N 3.31Å
420	Y	88.9	Confident	79.4	Confident	38 Å²	38	60.6 Å²	60.6	15%	0.149	29%	0.286	C	S	.	.	G	3₁₀ helix	trans	57.9	36.3	178.2	-59.3	-89.4	0	0	0	115.2	T415 I416 C418 G422 G423 I468	T415-Y420 PolarHBondContact O-N 3.14Å; I416-Y420 HydrophobicContact CB-CE1 4.5Å; I416-Y420 HydrophobicContact CB-CE2 4.07Å; I416-Y420 HydrophobicContact CG1-CE2 3.95Å; C418-Y420 VanDerWaalsContact C-N 3.32Å; C418-Y420 PolarHBondContact O-N 2.99Å; Y420-G422 PolarHBondContact O-N 3.22Å; Y420-G423 WeakPolarHBondContact O-CA 3.36Å; Y420-G423 PolarHBondContact O-N 2.84Å; Y420-I468 HydrophobicContact CD2-CG1 4.39Å; Y420-I468 HydrophobicContact CG-CG1 4.34Å
421	D	89.6	Confident	77.2	Confident	0 Å²	0	65.1 Å²	65.1	0%	0	31%	0.311	C	S	.	.	G	3₁₀ helix	trans	55.1	36.1	175.3	-161.2	44.3	0	0	0	114.1	C409 Q410 C413 N414 G419 G423 D424	C409-D421 WeakPolarHBondContact CA-OD2 3.02Å; Q410-D421 PolarHBondContact N-OD2 2.67Å; C413-D421 HydrophobicContact CB-CB 3.95Å; C413-D421 VanDerWaalsContact CB-OD1 3.23Å; C413-D421 WeakPolarHBondContact CB-OD1 3.23Å; C413-D421 PolarHBondContact O-N 3.18Å; N414-D421 HydrophobicContact CB-CB 4.32Å; G419-D421 PolarHBondContact O-N 3.31Å; D421-G423 PolarHBondContact O-N 2.79Å; D421-D424 WeakPolarHBondContact O-CB 3.26Å; D421-D424 PolarHBondContact O-N 2.84Å
422	G	89.2	Confident	75.5	Confident	0 Å²	0	65.6 Å²	65.6	0%	0	31%	0.306	C	S	.	.	G	3₁₀ helix	trans	62.4	11.1	-173.4	0	0	0	0	0	114.7	Y404 Y420 R470	Y404-G422 VanDerWaalsContact CE1-CA 3.5Å; Y404-G422 VanDerWaalsContact CZ-CA 3.4Å; Y420-G422 PolarHBondContact O-N 3.22Å; G422-R470 PolarHBondContact O-NE 2.7Å; G422-R470 PolarHBondContact O-NH2 2.71Å
423	G	87.5	Confident	73.9	Confident	2 Å²	2	66.2 Å²	66.2	2%	0.021	32%	0.321	C	S	.	.	G	3₁₀ helix	trans	79.9	16.6	-174	0	0	0	0	0	114.5	Y420 D421 C425 E426 R470	Y420-G423 WeakPolarHBondContact O-CA 3.36Å; Y420-G423 PolarHBondContact O-N 2.84Å; D421-G423 PolarHBondContact O-N 2.79Å; G423-C425 PolarHBondContact O-N 3.15Å; G423-E426 WeakPolarHBondContact O-CB 3.34Å; G423-E426 PolarHBondContact O-N 3.43Å; G423-E426 VanDerWaalsContact O-N 3.1Å; G423-R470 PolarHBondContact O-NH2 2.97Å
424	D	88.3	Confident	72.5	Confident	33 Å²	33	69.1 Å²	69.1	18%	0.176	34%	0.336	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.2	-12.9	-172.2	-67	-18.2	0	0	0	113.7	G405 D406 G407 D421 R470	G405-D424 WeakPolarHBondContact CA-OD2 2.99Å; G405-D424 PolarHBondContact N-OD2 3.27Å; D406-D424 PolarHBondContact N-OD2 3.08Å; G407-D424 PolarHBondContact N-OD2 2.81Å; D421-D424 WeakPolarHBondContact O-CB 3.26Å; D421-D424 PolarHBondContact O-N 2.84Å; D424-R470 IonicContact OD1-NH2 3.62Å; D424-R470 PolarHBondContact OD1-NH2 2.85Å
425	C	83.7	Confident	71.6	Confident	17 Å²	17	68.3 Å²	68.3	12%	0.115	34%	0.335	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.5	-3.1	167.7	-62.2	0	0	0	0	114.4	C409 N414 G423 Y427	C409-C425 WeakPolarHBondContact CA-SG 3.41Å; C409-C425 HydrophobicContact CB-CB 3.92Å; C409-C425 WeakPolarHBondContact CB-SG 3.22Å; C409-C425 VanDerWaalsContact SG-CA 3.51Å; C409-C425 WeakPolarHBondContact SG-CB 3.3Å; C409-C425 CovalentContact SG-SG 2.03Å; C409-C425 PolarHBondContact SG-SG 2.92Å; N414-C425 HydrophobicContact CB-CB 4.18Å; N414-C425 VanDerWaalsContact ND2-CB 3.26Å; N414-C425 WeakPolarHBondContact ND2-CB 3.25Å; G423-C425 PolarHBondContact O-N 3.15Å; C425-Y427 PolarHBondContact O-N 2.78Å; C425-Y427 VanDerWaalsContact O-N 3.17Å
426	E	75.7	Confident	71.3	Confident	67 Å²	67	70 Å²	70	31%	0.313	34%	0.342	S	S	.	.			trans	-84.6	85.8	177.8	-63.8	-160.8	142.5	0	0	111.6	G423 I468 Q500	G423-E426 WeakPolarHBondContact O-CB 3.34Å; G423-E426 PolarHBondContact O-N 3.43Å; G423-E426 VanDerWaalsContact O-N 3.1Å; E426-I468 VanDerWaalsContact CD-CD1 3.49Å; E426-I468 HydrophobicContact CG-CD1 4.26Å; E426-I468 WeakPolarHBondContact OE2-CD1 3.49Å; E426-Q500 PolarHBondContact OE1-NE2 2.7Å
427	Y	59.2	Low	71.5	Confident	194 Å²	194	72.1 Å²	72.1	76%	0.761	35%	0.35	S	S	*	.			trans	-55.6	145	168.5	-70	-89.3	0	0	0	111.5	C425 Q429	C425-Y427 PolarHBondContact O-N 2.78Å; C425-Y427 VanDerWaalsContact O-N 3.17Å; Y427-Q429 PolarHBondContact O-N 2.87Å
428	E	53.2	Low	71.9	Confident	141 Å²	141	72 Å²	72	66%	0.659	35%	0.349	S	S	*	.	S	Bend	trans	-59.1	82	-163.2	-63.8	-171.1	123.8	0	0	116
429	Q	47.8	Very low	72.1	Confident	169 Å²	169	72.4 Å²	72.4	79%	0.79	35%	0.35	S	S	*	.			trans	-122.9	64.7	167.8	-64.9	-164.1	9.1	0	0	111.1	Y427 N431	Y427-Q429 PolarHBondContact O-N 2.87Å; Q429-N431 PolarHBondContact O-N 3.32Å
430	R	50.5	Low	72.4	Confident	211 Å²	211	73.8 Å²	73.8	80%	0.796	36%	0.358	S	S	*	.			trans	-69.4	27.8	172.5	-57	-162.4	-158.3	-177	10.7	114.1
431	N	42.8	Very low	72.6	Confident	140 Å²	140	72.1 Å²	72.1	75%	0.749	35%	0.352	S	S	*	.			trans	-123.6	65.7	-173.9	-74.3	-26.3	0	0	0	110.7	Q429	Q429-N431 PolarHBondContact O-N 3.32Å
432	N	49.5	Very low	72.7	Confident	111 Å²	111	74.9 Å²	74.9	59%	0.594	36%	0.364	S	S	*	.	S	Bend	trans	171.9	112	140.6	-89.3	-39.1	0	0	0	113.7	L434 S501	N432-L434 PolarHBondContact O-N 2.03Å; N432-L434 VanDerWaalsContact O-N 3.12Å; N432-S501 PolarHBondContact O-OG 3.42Å
433	S	50.5	Low	72.9	Confident	108 Å²	108	74.9 Å²	74.9	76%	0.755	36%	0.364	S	S	*	.			trans	53.4	34.5	153.7	-164	0	0	0	0	118.2	S501	S433-S501 VanDerWaalsContact O-CB 3.23Å; S433-S501 WeakPolarHBondContact O-CB 3.26Å
434	L	59.6	Low	73	Confident	61 Å²	61	80.8 Å²	80.8	32%	0.319	39%	0.389	S	S	.	.			trans	-71.7	136.3	165.9	-65.9	165.5	0	0	0	109.7	N432 T498 S499	N432-L434 PolarHBondContact O-N 2.03Å; N432-L434 VanDerWaalsContact O-N 3.12Å; L434-T498 HydrophobicContact CB-CG2 4.18Å; L434-T498 HydrophobicContact CD1-CG2 4.18Å; L434-T498 HydrophobicContact CD2-CG2 4.31Å; L434-T498 HydrophobicContact CG-CG2 4.46Å; L434-S499 WeakPolarHBondContact CD2-O 3.39Å
435	S	67.7	Low	73.1	Confident	45 Å²	45	79.2 Å²	79.2	32%	0.315	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	122.9	171.9	105.8	0	0	0	0	109.2	S499	S435-S499 WeakPolarHBondContact CB-OG 3.36Å; S435-S499 PolarHBondContact O-N 3.01Å; S435-S499 PolarHBondContact O-OG 3.4Å; S435-S499 VanDerWaalsContact O-OG 3.11Å; S435-S499 PolarHBondContact OG-OG 2.84Å
436	I	76.2	Confident	73.3	Confident	75 Å²	75	80.5 Å²	80.5	39%	0.385	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	135.3	-178.7	-56.9	176.3	0	0	0	108.1	Y438 E496 V497 T498	I436-Y438 HydrophobicContact CG2-CE1 4.09Å; I436-Y438 HydrophobicContact CG2-CE2 3.95Å; I436-E496 HydrophobicContact CG2-CG 3.64Å; I436-V497 WeakPolarHBondContact CA-O 3.42Å; I436-T498 HydrophobicContact CG1-CG2 4.35Å
437	K	85.2	Confident	74	Confident	65 Å²	65	79 Å²	79	28%	0.283	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	148.2	170.1	-58.8	-166.7	-170.1	176.5	0	109.7	V497 V518	K437-V497 PolarHBondContact N-O 2.88Å; K437-V497 PolarHBondContact O-N 2.88Å; K437-V518 HydrophobicContact CB-CG1 4.48Å; K437-V518 HydrophobicContact CD-CG1 3.63Å; K437-V518 HydrophobicContact CG-CG1 4.21Å; K437-V518 PolarHBondContact NZ-O 2.82Å
438	Y	89.8	Confident	75.2	Confident	34 Å²	34	74.2 Å²	74.2	13%	0.133	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	133.9	179	-56.7	-85.7	0	0	0	112.2	I436 A472 L494 L495 E496 F550 V551 P554	I436-Y438 HydrophobicContact CG2-CE1 4.09Å; I436-Y438 HydrophobicContact CG2-CE2 3.95Å; Y438-A472 HydrophobicContact CD1-CB 4.1Å; Y438-A472 HydrophobicContact CE1-CB 4.16Å; Y438-L494 HydrophobicContact CD1-CD2 4.2Å; Y438-L494 HydrophobicContact CD1-CG 4.44Å; Y438-L495 CarbonylContact C-O 3.58Å; Y438-L495 WeakPolarHBondContact CA-O 3.24Å; Y438-E496 HydrophobicContact CD1-CB 4.18Å; Y438-E496 HydrophobicContact CD1-CG 4.41Å; Y438-E496 HydrophobicContact CE1-CB 4Å; Y438-E496 HydrophobicContact CE1-CG 3.84Å; Y438-F550 WeakPolarHBondContact O-CA 3.4Å; Y438-V551 WeakPolarHBondContact CB-O 3.38Å; Y438-V551 PolarHBondContact O-N 3.47Å; Y438-V551 VanDerWaalsContact O-N 3.11Å; Y438-P554 HydrophobicContact CE1-CG 3.95Å
439	I	92.1	Very high	76.8	Confident	9 Å²	9	71.4 Å²	71.4	5%	0.046	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	114.2	177.8	-48.2	-172.8	0	0	0	108.8	L441 L465 L495 V497 I530 L548 N549 F550	I439-L441 HydrophobicContact CG2-CD2 4.29Å; I439-L441 HydrophobicContact CG2-CG 4.28Å; I439-L465 HydrophobicContact CD1-CD1 4.28Å; I439-L495 HydrophobicContact CB-CB 4.32Å; I439-L495 PolarHBondContact N-O 3.26Å; I439-L495 PolarHBondContact O-N 3.13Å; I439-V497 HydrophobicContact CD1-CG2 3.83Å; I439-V497 HydrophobicContact CG1-CG2 3.97Å; I439-I530 HydrophobicContact CD1-CD1 3.91Å; I439-L548 HydrophobicContact CG2-CD1 4.43Å; I439-L548 HydrophobicContact CG2-CD2 3.76Å; I439-L548 HydrophobicContact CG2-CG 3.77Å; I439-N549 CarbonylContact C-O 3.21Å; I439-N549 WeakPolarHBondContact CA-O 3.33Å; I439-F550 HydrophobicContact CD1-CE1 3.78Å; I439-F550 HydrophobicContact CD1-CZ 4.4Å; I439-F550 HydrophobicContact CG1-CD1 3.92Å; I439-F550 HydrophobicContact CG1-CE1 3.64Å
440	L	92.6	Very high	78.9	Confident	29 Å²	29	63.4 Å²	63.4	15%	0.152	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	109.9	174.4	178.8	61.9	0	0	0	109.3	L494 N549 F559	L440-L494 HydrophobicContact CB-CD1 3.96Å; L440-L494 HydrophobicContact CD1-CD1 4.26Å; L440-N549 HydrophobicContact CB-CB 4.37Å; L440-N549 PolarHBondContact N-O 3.47Å; L440-N549 PolarHBondContact O-N 2.83Å; L440-F559 HydrophobicContact CD1-CE2 3.77Å
441	L	93.7	Very high	80.8	Confident	4 Å²	4	58.7 Å²	58.7	2%	0.021	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	138.3	175.4	-68.6	174.4	0	0	0	111	I439 L443 Y457 L461 K492 V493 L495 I545 L548	I439-L441 HydrophobicContact CG2-CD2 4.29Å; I439-L441 HydrophobicContact CG2-CG 4.28Å; L441-L443 HydrophobicContact CB-CD2 4.1Å; L441-L443 HydrophobicContact CB-CG 4.21Å; L441-L443 HydrophobicContact CD1-CD2 4.49Å; L441-Y457 HydrophobicContact CD1-CE1 4.06Å; L441-L461 HydrophobicContact CD1-CD1 4.32Å; L441-K492 WeakPolarHBondContact O-CA 3.5Å; L441-V493 HydrophobicContact CB-CG1 3.82Å; L441-V493 HydrophobicContact CD1-CG1 4.36Å; L441-V493 PolarHBondContact N-O 2.89Å; L441-V493 PolarHBondContact O-N 3.45Å; L441-L495 HydrophobicContact CD1-CD1 3.57Å; L441-L495 HydrophobicContact CD1-CG 4.19Å; L441-L495 HydrophobicContact CG-CD1 4.44Å; L441-I545 HydrophobicContact CD2-CD1 4.39Å; L441-I545 HydrophobicContact CD2-CG2 4.5Å; L441-L548 HydrophobicContact CD2-CB 3.85Å; L441-L548 HydrophobicContact CD2-CD1 3.95Å; L441-L548 HydrophobicContact CD2-CG 3.66Å
442	H	91.9	Very high	82.9	Confident	58 Å²	58	59 Å²	59	27%	0.269	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	113.7	167.2	178.8	-172.6	0	0	0	107.5	I485 Q490 I491 I546 N547	H442-I485 WeakPolarHBondContact NE2-CD1 3.48Å; H442-Q490 PolarHBondContact CE1-OE1 3.43Å; H442-Q490 WeakPolarHBondContact NE2-CB 3.4Å; H442-Q490 WeakPolarHBondContact NE2-CG 3.31Å; H442-Q490 PolarHBondContact NE2-OE1 2.93Å; H442-I491 WeakPolarHBondContact CA-O 3.22Å; H442-I491 PolarHBondContact CD2-O 3.43Å; H442-I546 HydrophobicContact CB-CB 4.36Å; H442-I546 WeakPolarHBondContact NE2-CD1 3.37Å; H442-I546 WeakPolarHBondContact O-CB 3.05Å; H442-I546 PolarHBondContact O-N 2.71Å; H442-N547 HydrophobicContact CB-CB 4.48Å; H442-N547 PolarHBondContact N-O 3.41Å; H442-N547 PolarHBondContact O-N 3.13Å
443	L	92.6	Very high	84.8	Confident	0 Å²	0	56.4 Å²	56.4	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	148.7	-171.5	-53.4	-179.7	0	0	0	111.5	L441 T445 F450 Y457 Q490 I491 V493 F543 I545	L441-L443 HydrophobicContact CB-CD2 4.1Å; L441-L443 HydrophobicContact CB-CG 4.21Å; L441-L443 HydrophobicContact CD1-CD2 4.49Å; L443-T445 VanDerWaalsContact C-N 3.34Å; L443-T445 HydrophobicContact CB-CG2 3.99Å; L443-T445 PolarHBondContact O-N 2.94Å; L443-F450 HydrophobicContact CD1-CD2 3.89Å; L443-F450 HydrophobicContact CD1-CE2 3.61Å; L443-Y457 HydrophobicContact CD1-CE1 4.08Å; L443-Q490 CarbonylContact O-C 3.55Å; L443-Q490 WeakPolarHBondContact O-CA 3.2Å; L443-I491 HydrophobicContact CB-CD1 4.32Å; L443-I491 HydrophobicContact CB-CG1 3.87Å; L443-I491 HydrophobicContact CD1-CD1 4.17Å; L443-I491 PolarHBondContact N-O 2.89Å; L443-I491 PolarHBondContact O-N 3.25Å; L443-V493 HydrophobicContact CD1-CG1 4.23Å; L443-F543 HydrophobicContact CB-CB 4.24Å; L443-F543 HydrophobicContact CD1-CB 4.35Å; L443-F543 HydrophobicContact CD1-CD2 4.23Å; L443-I545 HydrophobicContact CD2-CB 4.3Å; L443-I545 HydrophobicContact CD2-CG1 3.64Å
444	K	90.2	Very high	86.7	Confident	126 Å²	126	54.8 Å²	54.8	55%	0.548	27%	0.274	S	S	.	.	S	Bend	trans	-88.3	64.3	176.4	-165.1	-170.4	172.5	-171.7	0	112.1	N489 S544 I546	K444-N489 CarbonylContact C-O 3.58Å; K444-S544 PolarHBondContact N-O 3.02Å; K444-I546 HydrophobicContact CB-CD1 3.98Å; K444-I546 HydrophobicContact CB-CG1 4.3Å
445	T	91.1	Very high	88.2	Confident	0 Å²	0	53.5 Å²	53.5	0%	0	27%	0.267	C	S	.	.	S	Bend	trans	-150.3	174.1	176.8	179.7	0	0	0	0	109.1	L443 E449 F450 N489 Q490 I491 F543	L443-T445 VanDerWaalsContact C-N 3.34Å; L443-T445 HydrophobicContact CB-CG2 3.99Å; L443-T445 PolarHBondContact O-N 2.94Å; T445-E449 WeakPolarHBondContact CB-OE2 3.4Å; T445-E449 WeakPolarHBondContact OG1-CB 3.44Å; T445-E449 VanDerWaalsContact OG1-CD 3.29Å; T445-E449 WeakPolarHBondContact OG1-CG 3.44Å; T445-E449 PolarHBondContact OG1-OE2 3.29Å; T445-F450 HydrophobicContact CG2-CB 4.03Å; T445-F450 HydrophobicContact CG2-CD2 4.36Å; T445-N489 PolarHBondContact N-O 3.27Å; T445-N489 CarbonylContact O-C 3.53Å; T445-Q490 CarbonylContact O-C 3.59Å; T445-Q490 WeakPolarHBondContact O-CA 3.32Å; T445-Q490 PolarHBondContact O-N 3.39Å; T445-Q490 VanDerWaalsContact O-N 3.1Å; T445-I491 HydrophobicContact CG2-CD1 3.66Å; T445-I491 HydrophobicContact CG2-CG1 3.79Å; T445-I491 PolarHBondContact O-N 3.44Å; T445-F543 HydrophobicContact CG2-CB 4.15Å; T445-F543 HydrophobicContact CG2-CD1 3.69Å; T445-F543 HydrophobicContact CG2-CD2 4.15Å; T445-F543 HydrophobicContact CG2-CE1 4.11Å; T445-F543 HydrophobicContact CG2-CG 3.71Å; T445-F543 HydrophobicContact CG2-CZ 4.49Å
446	N	88.6	Confident	89.3	Confident	43 Å²	43	53.8 Å²	53.8	23%	0.23	26%	0.263	C	S	.	.			trans	-105.2	165.8	170.7	58.9	76.5	0	0	0	110.9	S448 E449 F450 D484 N489	N446-S448 VanDerWaalsContact C-N 3.28Å; N446-S448 PolarHBondContact O-N 3.5Å; N446-S448 WeakPolarHBondContact OD1-CB 3.03Å; N446-S448 PolarHBondContact OD1-N 2.83Å; N446-S448 VanDerWaalsContact OD1-N 3.11Å; N446-E449 PolarHBondContact O-N 2.7Å; N446-E449 PolarHBondContact OD1-N 3.47Å; N446-F450 WeakPolarHBondContact O-CB 3.3Å; N446-F450 PolarHBondContact O-N 2.71Å; N446-D484 WeakPolarHBondContact CA-OD1 3.44Å; N446-N489 PolarHBondContact ND2-OD1 3.21Å
447	Q	88.9	Confident	90	Very high	37 Å²	37	50.5 Å²	50.5	17%	0.173	25%	0.246	C	C	.	.	H	α-helix	trans	-57.3	-34.8	-179.8	-77.3	-167.2	33.6	0	0	114.9	K451 L482 D484 I491	Q447-K451 HydrophobicContact CB-CD 4.44Å; Q447-K451 WeakPolarHBondContact O-CB 3.3Å; Q447-K451 WeakPolarHBondContact O-CD 3.49Å; Q447-K451 WeakPolarHBondContact O-CG 3.44Å; Q447-K451 PolarHBondContact O-N 3.43Å; Q447-L482 HydrophobicContact CG-CD1 4.11Å; Q447-L482 HydrophobicContact CG-CD2 4.14Å; Q447-L482 HydrophobicContact CG-CG 3.8Å; Q447-L482 PolarHBondContact NE2-O 3.17Å; Q447-D484 WeakPolarHBondContact CB-OD2 3.46Å; Q447-D484 HydrophobicContact CG-CB 4.5Å; Q447-D484 WeakPolarHBondContact CG-OD2 3.01Å; Q447-D484 PolarHBondContact N-OD1 2.83Å; Q447-I491 HydrophobicContact CG-CG2 3.87Å
448	S	85.2	Confident	90.5	Very high	93 Å²	93	47.9 Å²	47.9	65%	0.65	24%	0.235	S	C	*	.	H	α-helix	trans	-68.5	-45.9	-177.1	-56.9	0	0	0	0	111.6	N446 K451 L452	N446-S448 VanDerWaalsContact C-N 3.28Å; N446-S448 PolarHBondContact O-N 3.5Å; N446-S448 WeakPolarHBondContact OD1-CB 3.03Å; N446-S448 PolarHBondContact OD1-N 2.83Å; N446-S448 VanDerWaalsContact OD1-N 3.11Å; S448-K451 PolarHBondContact O-N 3.39Å; S448-L452 WeakPolarHBondContact O-CB 3.44Å; S448-L452 PolarHBondContact O-N 3.09Å
449	E	87.4	Confident	90.6	Very high	82 Å²	82	46.2 Å²	46.2	38%	0.383	23%	0.229	S	C	.	.	H	α-helix	trans	-68.3	-39.7	177.8	-177.6	-175.2	-143.4	0	0	111.6	T445 N446 L452 N453 F543	T445-E449 WeakPolarHBondContact CB-OE2 3.4Å; T445-E449 WeakPolarHBondContact OG1-CB 3.44Å; T445-E449 VanDerWaalsContact OG1-CD 3.29Å; T445-E449 WeakPolarHBondContact OG1-CG 3.44Å; T445-E449 PolarHBondContact OG1-OE2 3.29Å; N446-E449 PolarHBondContact O-N 2.7Å; N446-E449 PolarHBondContact OD1-N 3.47Å; E449-L452 PolarHBondContact O-N 2.71Å; E449-N453 PolarHBondContact O-N 2.72Å; E449-N453 PolarHBondContact O-ND2 3.31Å; E449-F543 HydrophobicContact CG-CE1 3.92Å
450	F	91.5	Very high	90.6	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-65.2	-43.7	172.6	-176.7	-100.9	0	0	0	112.7	L443 T445 N446 L452 N453 R454 Y457 I471 L482 I491 V493 F543	L443-F450 HydrophobicContact CD1-CD2 3.89Å; L443-F450 HydrophobicContact CD1-CE2 3.61Å; T445-F450 HydrophobicContact CG2-CB 4.03Å; T445-F450 HydrophobicContact CG2-CD2 4.36Å; N446-F450 WeakPolarHBondContact O-CB 3.3Å; N446-F450 PolarHBondContact O-N 2.71Å; F450-L452 VanDerWaalsContact C-N 3.32Å; F450-L452 PolarHBondContact O-N 2.91Å; F450-N453 PolarHBondContact O-N 3.19Å; F450-R454 WeakPolarHBondContact O-CA 3.29Å; F450-R454 PolarHBondContact O-N 3.37Å; F450-Y457 AromaticContact CE2-CD1 3.72Å; F450-Y457 HydrophobicContact CE2-CD1 3.72Å; F450-Y457 HydrophobicContact CE2-CE1 4.01Å; F450-Y457 HydrophobicContact CE2-CG 4.25Å; F450-Y457 HydrophobicContact CZ-CD1 4.24Å; F450-I471 HydrophobicContact CE1-CD1 3.86Å; F450-L482 HydrophobicContact CD1-CD1 3.89Å; F450-L482 HydrophobicContact CD1-CD2 3.94Å; F450-L482 HydrophobicContact CE1-CD1 4.12Å; F450-L482 HydrophobicContact CE1-CD2 4.27Å; F450-I491 HydrophobicContact CB-CD1 3.58Å; F450-I491 HydrophobicContact CD1-CD1 3.86Å; F450-I491 HydrophobicContact CD2-CD1 3.57Å; F450-I491 HydrophobicContact CE1-CD1 4.45Å; F450-I491 HydrophobicContact CE2-CD1 4.21Å; F450-I491 HydrophobicContact CG-CD1 3.37Å; F450-V493 HydrophobicContact CE1-CB 4.48Å; F450-V493 HydrophobicContact CE1-CG2 4.06Å; F450-V493 HydrophobicContact CE2-CG1 4.46Å; F450-V493 HydrophobicContact CZ-CB 4.38Å; F450-V493 HydrophobicContact CZ-CG1 4.04Å; F450-V493 HydrophobicContact CZ-CG2 4.13Å; F450-F543 HydrophobicContact CB-CE2 4.44Å; F450-F543 AromaticContact CD2-CD2 3.77Å; F450-F543 HydrophobicContact CD2-CD2 3.77Å; F450-F543 AromaticContact CD2-CE2 3.51Å; F450-F543 HydrophobicContact CD2-CE2 3.51Å; F450-F543 HydrophobicContact CD2-CZ 4.36Å; F450-F543 HydrophobicContact CE2-CD2 4.28Å; F450-F543 HydrophobicContact CE2-CE2 4.2Å; F450-F543 HydrophobicContact CG-CE2 4.38Å
451	K	89.7	Confident	90.6	Very high	112 Å²	112	45.1 Å²	45.1	49%	0.487	22%	0.223	S	C	.	.	H	α-helix	trans	-64.2	-35.6	177.9	-78	165.8	176.9	167.4	0	112.1	Q447 S448 R454 L482	Q447-K451 HydrophobicContact CB-CD 4.44Å; Q447-K451 WeakPolarHBondContact O-CB 3.3Å; Q447-K451 WeakPolarHBondContact O-CD 3.49Å; Q447-K451 WeakPolarHBondContact O-CG 3.44Å; Q447-K451 PolarHBondContact O-N 3.43Å; S448-K451 PolarHBondContact O-N 3.39Å; K451-R454 WeakPolarHBondContact O-CB 3.49Å; K451-L482 HydrophobicContact CD-CD2 4.47Å; K451-L482 HydrophobicContact CG-CD2 4.2Å
452	L	86.7	Confident	90.5	Very high	146 Å²	146	45 Å²	45	76%	0.764	22%	0.222	S	C	*	.	H	α-helix	trans	-63.8	-39.7	176.8	-176.9	64.8	0	0	0	112.7	S448 E449 F450	S448-L452 WeakPolarHBondContact O-CB 3.44Å; S448-L452 PolarHBondContact O-N 3.09Å; E449-L452 PolarHBondContact O-N 2.71Å; F450-L452 VanDerWaalsContact C-N 3.32Å; F450-L452 PolarHBondContact O-N 2.91Å
453	N	88.8	Confident	90.3	Very high	57 Å²	57	42.4 Å²	42.4	31%	0.305	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102.3	13.8	-177.1	-58.4	-87	0	0	0	113.2	E449 F450 N455 H456 Y457 L542 F543	E449-N453 PolarHBondContact O-N 2.72Å; E449-N453 PolarHBondContact O-ND2 3.31Å; F450-N453 PolarHBondContact O-N 3.19Å; N453-N455 PolarHBondContact O-N 3.04Å; N453-H456 PolarHBondContact O-N 2.78Å; N453-Y457 WeakPolarHBondContact O-CB 3.08Å; N453-Y457 PolarHBondContact O-N 3.41Å; N453-L542 HydrophobicContact CB-CD1 3.84Å; N453-F543 HydrophobicContact CB-CE2 4.41Å; N453-F543 HydrophobicContact CB-CZ 3.96Å
454	R	91.8	Very high	90.2	Very high	75 Å²	75	42.4 Å²	42.4	28%	0.283	21%	0.21	S	C	.	.	H	α-helix	trans	-55.4	-51.5	-168.4	-178.6	-162.7	68.8	168	8.5	112.7	G405 F450 K451 Y457 L458 I471	G405-R454 PolarHBondContact O-NH2 2.75Å; F450-R454 WeakPolarHBondContact O-CA 3.29Å; F450-R454 PolarHBondContact O-N 3.37Å; K451-R454 WeakPolarHBondContact O-CB 3.49Å; R454-Y457 PolarHBondContact O-N 3.42Å; R454-L458 HydrophobicContact CG-CD1 3.74Å; R454-L458 HydrophobicContact CG-CG 4.3Å; R454-L458 WeakPolarHBondContact O-CB 3.45Å; R454-L458 WeakPolarHBondContact O-CG 3.41Å; R454-L458 PolarHBondContact O-N 3.28Å; R454-I471 HydrophobicContact CG-CD1 4.18Å
455	N	91.1	Very high	90.1	Very high	33 Å²	33	36.4 Å²	36.4	18%	0.176	18%	0.184	C	C	.	.	H	α-helix	trans	-63.2	-47.6	-173.2	-63.6	14.9	0	0	0	110.4	L401 Q402 Y404 N453 Y457 L458 G459	L401-N455 CarbonylContact O-C 3.59Å; L401-N455 VanDerWaalsContact O-CB 3.29Å; L401-N455 WeakPolarHBondContact O-CB 3.45Å; Q402-N455 WeakPolarHBondContact O-CB 3.21Å; Q402-N455 PolarHBondContact O-ND2 3.38Å; Y404-N455 WeakPolarHBondContact O-CB 3.36Å; Y404-N455 VanDerWaalsContact O-CG 3.24Å; N453-N455 PolarHBondContact O-N 3.04Å; N455-Y457 PolarHBondContact O-N 3.41Å; N455-L458 PolarHBondContact O-N 3.21Å; N455-G459 WeakPolarHBondContact O-CA 3.24Å; N455-G459 PolarHBondContact O-N 3.4Å
456	H	89.8	Confident	89.8	Confident	51 Å²	51	36.5 Å²	36.5	24%	0.236	19%	0.185	C	C	.	.	H	α-helix	trans	-63.3	-38.7	177.2	-168.8	111.9	0	0	0	112.3	E398 L401 N453 N460	E398-H456 IonicContact OE1-ND1 2.95Å; E398-H456 IonicContact OE2-CE1 2.62Å; E398-H456 PolarHBondContact OE2-CE1 3.44Å; E398-H456 IonicContact OE2-ND1 2.64Å; L401-H456 VanDerWaalsContact CD1-CE1 3.46Å; L401-H456 WeakPolarHBondContact CD1-CE1 3.38Å; L401-H456 PolarHBondContact O-N 3.01Å; N453-H456 PolarHBondContact O-N 2.78Å; H456-N460 PolarHBondContact CD2-ND2 3.09Å; H456-N460 PolarHBondContact NE2-ND2 2.95Å; H456-N460 VanDerWaalsContact NE2-ND2 3.17Å; H456-N460 WeakPolarHBondContact O-CB 3.36Å; H456-N460 PolarHBondContact O-N 2.78Å; H456-N460 VanDerWaalsContact O-N 3.09Å; H456-N460 PolarHBondContact O-ND2 3.27Å
457	Y	92.5	Very high	89.7	Confident	6 Å²	6	34.5 Å²	34.5	2%	0.024	17%	0.174	C	C	.	.	H	α-helix	trans	-68.4	-45.5	177.1	-171.5	-93.5	0	0	0	113	L441 L443 F450 N453 R454 N455 L461 L542 F543	L441-Y457 HydrophobicContact CD1-CE1 4.06Å; L443-Y457 HydrophobicContact CD1-CE1 4.08Å; F450-Y457 AromaticContact CE2-CD1 3.72Å; F450-Y457 HydrophobicContact CE2-CD1 3.72Å; F450-Y457 HydrophobicContact CE2-CE1 4.01Å; F450-Y457 HydrophobicContact CE2-CG 4.25Å; F450-Y457 HydrophobicContact CZ-CD1 4.24Å; N453-Y457 WeakPolarHBondContact O-CB 3.08Å; N453-Y457 PolarHBondContact O-N 3.41Å; R454-Y457 PolarHBondContact O-N 3.42Å; N455-Y457 PolarHBondContact O-N 3.41Å; Y457-L461 HydrophobicContact CD1-CD1 4.16Å; Y457-L461 HydrophobicContact CE1-CD1 3.69Å; Y457-L461 PolarHBondContact O-N 3.43Å; Y457-L542 HydrophobicContact CD2-CB 4.42Å; Y457-F543 AromaticContact CD2-CD2 3.64Å; Y457-F543 HydrophobicContact CD2-CD2 3.64Å; Y457-F543 HydrophobicContact CD2-CE2 4.03Å; Y457-F543 AromaticContact CE2-CD2 3.82Å; Y457-F543 HydrophobicContact CE2-CD2 3.82Å; Y457-F543 HydrophobicContact CG-CD2 4.22Å; Y457-F543 HydrophobicContact CG-CE2 4.28Å
458	L	94	Very high	89.7	Confident	10 Å²	10	32.9 Å²	32.9	5%	0.052	17%	0.167	C	C	.	.	H	α-helix	trans	-70.8	-39.4	178.2	-63.8	178.4	0	0	0	111.7	Y404 R454 N455 L461 G462 V469 I471 L495	Y404-L458 HydrophobicContact CD1-CB 3.99Å; Y404-L458 HydrophobicContact CE1-CB 4.03Å; R454-L458 HydrophobicContact CG-CD1 3.74Å; R454-L458 HydrophobicContact CG-CG 4.3Å; R454-L458 WeakPolarHBondContact O-CB 3.45Å; R454-L458 WeakPolarHBondContact O-CG 3.41Å; R454-L458 PolarHBondContact O-N 3.28Å; N455-L458 PolarHBondContact O-N 3.21Å; L458-L461 CarbonylContact O-C 3.58Å; L458-L461 WeakPolarHBondContact O-CB 3.39Å; L458-L461 PolarHBondContact O-N 3.06Å; L458-G462 PolarHBondContact O-N 3.05Å; L458-V469 HydrophobicContact CD2-CG1 4.24Å; L458-I471 HydrophobicContact CD1-CD1 4.36Å; L458-I471 HydrophobicContact CD1-CG1 4.06Å; L458-I471 HydrophobicContact CD2-CG1 4.34Å; L458-L495 HydrophobicContact CD2-CD1 4.36Å; L458-L495 HydrophobicContact CD2-CD2 3.55Å
459	G	92.2	Very high	90.1	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-63.5	-42.3	178	0	0	0	0	0	112.5	Y404 N455 L461 G462 I463	Y404-G459 VanDerWaalsContact CG-CA 3.45Å; N455-G459 WeakPolarHBondContact O-CA 3.24Å; N455-G459 PolarHBondContact O-N 3.4Å; G459-L461 VanDerWaalsContact C-N 3.31Å; G459-L461 PolarHBondContact O-N 2.94Å; G459-G462 PolarHBondContact O-N 3.38Å; G459-G462 VanDerWaalsContact O-N 3.13Å; G459-I463 VanDerWaalsContact O-CG1 3.31Å; G459-I463 WeakPolarHBondContact O-CG1 3.22Å; G459-I463 PolarHBondContact O-N 2.97Å
460	N	91.9	Very high	90.3	Very high	9 Å²	9	28.9 Å²	28.9	5%	0.048	13%	0.134	C	C	.	.	H	α-helix	trans	-59.5	-42.2	172.6	-84.2	-33.3	0	0	0	111.6	L401 H456 I463 I464	L401-N460 WeakPolarHBondContact CD1-OD1 3.32Å; L401-N460 VanDerWaalsContact CD2-N 3.34Å; H456-N460 PolarHBondContact CD2-ND2 3.09Å; H456-N460 PolarHBondContact NE2-ND2 2.95Å; H456-N460 VanDerWaalsContact NE2-ND2 3.17Å; H456-N460 WeakPolarHBondContact O-CB 3.36Å; H456-N460 PolarHBondContact O-N 2.78Å; H456-N460 VanDerWaalsContact O-N 3.09Å; H456-N460 PolarHBondContact O-ND2 3.27Å; N460-I463 PolarHBondContact O-N 2.84Å; N460-I464 WeakPolarHBondContact O-CB 3.36Å; N460-I464 WeakPolarHBondContact O-CD1 3.45Å; N460-I464 WeakPolarHBondContact O-CG1 3.49Å; N460-I464 PolarHBondContact O-N 3.11Å
461	L	92.9	Very high	90.4	Very high	6 Å²	6	29.6 Å²	29.6	3%	0.031	14%	0.137	C	C	.	.	H	α-helix	trans	-65.1	-39.7	173.7	-69.9	174	0	0	0	112.4	L441 Y457 L458 G459 I464 L465 V469 L495 I530 L534	L441-L461 HydrophobicContact CD1-CD1 4.32Å; Y457-L461 HydrophobicContact CD1-CD1 4.16Å; Y457-L461 HydrophobicContact CE1-CD1 3.69Å; Y457-L461 PolarHBondContact O-N 3.43Å; L458-L461 CarbonylContact O-C 3.58Å; L458-L461 WeakPolarHBondContact O-CB 3.39Å; L458-L461 PolarHBondContact O-N 3.06Å; G459-L461 VanDerWaalsContact C-N 3.31Å; G459-L461 PolarHBondContact O-N 2.94Å; L461-I464 HydrophobicContact CD2-CD1 4.46Å; L461-I464 PolarHBondContact O-N 3.21Å; L461-L465 VanDerWaalsContact O-CB 3.23Å; L461-L465 WeakPolarHBondContact O-CB 3.11Å; L461-L465 VanDerWaalsContact O-CG 3.25Å; L461-L465 WeakPolarHBondContact O-CG 3.21Å; L461-L465 PolarHBondContact O-N 3.48Å; L461-V469 HydrophobicContact CB-CG1 4.15Å; L461-V469 HydrophobicContact CB-CG2 4.33Å; L461-L495 HydrophobicContact CD1-CD1 3.55Å; L461-I530 HydrophobicContact CD2-CG2 4.05Å; L461-L534 HydrophobicContact CD2-CD1 4.28Å; L461-L534 HydrophobicContact CD2-CD2 4.41Å
462	G	91	Very high	90.5	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-62.8	-39.5	175.7	0	0	0	0	0	113.4	L458 G459 Q466 S467	L458-G462 PolarHBondContact O-N 3.05Å; G459-G462 PolarHBondContact O-N 3.38Å; G459-G462 VanDerWaalsContact O-N 3.13Å; G462-Q466 WeakPolarHBondContact O-CA 3.46Å; G462-Q466 PolarHBondContact O-N 3.2Å; G462-S467 WeakPolarHBondContact CA-O 3.47Å; G462-S467 PolarHBondContact O-N 2.87Å
463	I	89.1	Confident	90.5	Very high	4 Å²	4	21.6 Å²	21.6	2%	0.021	10%	0.097	C	C	.	.	H	α-helix	trans	-70.2	-45	175.4	-65.8	174.4	0	0	0	111.2	K367 F397 L401 Q417 G459 N460 L465 Q466 Y539	K367-I463 WeakPolarHBondContact CE-O 3.4Å; F397-I463 HydrophobicContact CD2-CD1 3.85Å; F397-I463 HydrophobicContact CE2-CD1 3.62Å; L401-I463 HydrophobicContact CD2-CD1 3.91Å; Q417-I463 WeakPolarHBondContact O-CG1 3.49Å; Q417-I463 WeakPolarHBondContact O-CG2 3.34Å; G459-I463 VanDerWaalsContact O-CG1 3.31Å; G459-I463 WeakPolarHBondContact O-CG1 3.22Å; G459-I463 PolarHBondContact O-N 2.97Å; N460-I463 PolarHBondContact O-N 2.84Å; I463-L465 VanDerWaalsContact C-N 3.32Å; I463-L465 PolarHBondContact O-N 3.41Å; I463-Q466 PolarHBondContact O-N 3.27Å; I463-Y539 HydrophobicContact CB-CE1 4.32Å; I463-Y539 HydrophobicContact CG2-CE1 3.69Å
464	I	89.9	Confident	90.1	Very high	0 Å²	0	20.4 Å²	20.4	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-58.1	-46.3	175.2	-71.3	162.9	0	0	0	110.7	N460 L461 Y529 A533 L534 Y539	N460-I464 WeakPolarHBondContact O-CB 3.36Å; N460-I464 WeakPolarHBondContact O-CD1 3.45Å; N460-I464 WeakPolarHBondContact O-CG1 3.49Å; N460-I464 PolarHBondContact O-N 3.11Å; L461-I464 HydrophobicContact CD2-CD1 4.46Å; L461-I464 PolarHBondContact O-N 3.21Å; I464-Y529 HydrophobicContact CG2-CD1 4.21Å; I464-Y529 HydrophobicContact CG2-CE1 3.54Å; I464-Y529 WeakPolarHBondContact O-CE1 3.38Å; I464-Y529 PolarHBondContact O-OH 3.03Å; I464-A533 HydrophobicContact CD1-CB 3.9Å; I464-A533 HydrophobicContact CG1-CB 3.98Å; I464-A533 HydrophobicContact CG2-CB 3.7Å; I464-L534 HydrophobicContact CD1-CD2 3.76Å; I464-L534 HydrophobicContact CD1-CG 4.25Å; I464-Y539 HydrophobicContact CD1-CD1 4.29Å; I464-Y539 HydrophobicContact CD1-CG 4.22Å; I464-Y539 HydrophobicContact CG1-CD1 3.92Å; I464-Y539 HydrophobicContact CG1-CE1 4.34Å; I464-Y539 HydrophobicContact CG1-CG 4.02Å
465	L	89.3	Confident	89.4	Confident	1 Å²	1	22.5 Å²	22.5	1%	0.005	11%	0.107	C	C	.	.	H	α-helix	trans	-83.7	-18.6	-173.9	-67.2	-178.1	0	0	0	113.9	I439 L461 I463 S467 V469 V497 S517 V518 L526 Y529 I530	I439-L465 HydrophobicContact CD1-CD1 4.28Å; L461-L465 VanDerWaalsContact O-CB 3.23Å; L461-L465 WeakPolarHBondContact O-CB 3.11Å; L461-L465 VanDerWaalsContact O-CG 3.25Å; L461-L465 WeakPolarHBondContact O-CG 3.21Å; L461-L465 PolarHBondContact O-N 3.48Å; I463-L465 VanDerWaalsContact C-N 3.32Å; I463-L465 PolarHBondContact O-N 3.41Å; L465-S467 VanDerWaalsContact C-N 3.3Å; L465-V469 HydrophobicContact CD1-CG2 3.97Å; L465-V497 HydrophobicContact CD1-CG1 4.11Å; L465-V497 HydrophobicContact CD1-CG2 4.29Å; L465-S517 WeakPolarHBondContact CA-OG 3.05Å; L465-S517 PolarHBondContact O-OG 3.44Å; L465-V518 HydrophobicContact CB-CG2 3.95Å; L465-V518 HydrophobicContact CD1-CG2 4.2Å; L465-V518 HydrophobicContact CD2-CG2 4Å; L465-V518 HydrophobicContact CG-CG2 4.28Å; L465-L526 HydrophobicContact CD2-CD1 3.75Å; L465-Y529 HydrophobicContact CD2-CD1 4.41Å; L465-Y529 HydrophobicContact CD2-CE1 4.31Å; L465-I530 HydrophobicContact CD2-CD1 4.09Å; L465-I530 HydrophobicContact CD2-CG1 3.85Å
466	Q	84.5	Confident	88.6	Confident	2 Å²	2	27 Å²	27	1%	0.009	13%	0.13	C	C	.	.	T	Hydrogen-bonded Turn	trans	59.4	41.6	-173.8	-63.6	176.6	-64.3	0	0	112.1	I416 G462 I463	I416-Q466 HydrophobicContact CD1-CB 4.07Å; I416-Q466 HydrophobicContact CG1-CB 3.7Å; I416-Q466 HydrophobicContact CG1-CG 4.19Å; G462-Q466 WeakPolarHBondContact O-CA 3.46Å; G462-Q466 PolarHBondContact O-N 3.2Å; I463-Q466 PolarHBondContact O-N 3.27Å
467	S	86.6	Confident	88	Confident	1 Å²	1	26.9 Å²	26.9	1%	0.007	13%	0.133	C	C	.	.	S	Bend	trans	-153.6	163.6	-168.4	-152	0	0	0	0	110.6	G462 L465 T498 D516	G462-S467 WeakPolarHBondContact CA-O 3.47Å; G462-S467 PolarHBondContact O-N 2.87Å; L465-S467 VanDerWaalsContact C-N 3.3Å; S467-T498 PolarHBondContact OG-O 2.04Å; S467-D516 VanDerWaalsContact CB-OD2 3.32Å; S467-D516 WeakPolarHBondContact CB-OD2 3.48Å; S467-D516 PolarHBondContact OG-OD2 2.94Å
468	I	89	Confident	87.4	Confident	3 Å²	3	31.6 Å²	31.6	2%	0.015	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80	122	177.6	-67.1	164.8	0	0	0	109.1	Y420 E426 R470 V497 T498	Y420-I468 HydrophobicContact CD2-CG1 4.39Å; Y420-I468 HydrophobicContact CG-CG1 4.34Å; E426-I468 VanDerWaalsContact CD-CD1 3.49Å; E426-I468 HydrophobicContact CG-CD1 4.26Å; E426-I468 WeakPolarHBondContact OE2-CD1 3.49Å; I468-R470 HydrophobicContact CG2-CG 4.08Å; I468-V497 WeakPolarHBondContact O-CA 3.47Å; I468-T498 PolarHBondContact N-O 3.05Å; I468-T498 PolarHBondContact O-N 3.49Å
469	V	92.4	Very high	86.8	Confident	1 Å²	1	36.2 Å²	36.2	1%	0.006	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	113.9	-179.4	-177.9	0	0	0	0	110.6	Y404 L458 L461 L465 L495 V497	Y404-V469 WeakPolarHBondContact CE1-O 3.29Å; Y404-V469 PolarHBondContact OH-N 2.82Å; L458-V469 HydrophobicContact CD2-CG1 4.24Å; L461-V469 HydrophobicContact CB-CG1 4.15Å; L461-V469 HydrophobicContact CB-CG2 4.33Å; L465-V469 HydrophobicContact CD1-CG2 3.97Å; V469-L495 HydrophobicContact CG1-CB 4.4Å; V469-L495 HydrophobicContact CG1-CD1 3.93Å; V469-V497 HydrophobicContact CG1-CG2 4.47Å; V469-V497 HydrophobicContact CG2-CG1 4.23Å; V469-V497 HydrophobicContact CG2-CG2 4.25Å
470	R	91.7	Very high	86.5	Confident	90 Å²	90	39.9 Å²	39.9	34%	0.34	20%	0.196	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	162.8	-178.9	-73	172.8	163.3	163.8	-8.7	110.4	G422 G423 D424 I468 L495 E496	G422-R470 PolarHBondContact O-NE 2.7Å; G422-R470 PolarHBondContact O-NH2 2.71Å; G423-R470 PolarHBondContact O-NH2 2.97Å; D424-R470 IonicContact OD1-NH2 3.62Å; D424-R470 PolarHBondContact OD1-NH2 2.85Å; I468-R470 HydrophobicContact CG2-CG 4.08Å; R470-L495 CarbonylContact O-C 3.5Å; R470-L495 VanDerWaalsContact O-CA 3.24Å; R470-L495 WeakPolarHBondContact O-CA 3.2Å; R470-E496 PolarHBondContact N-O 3.49Å; R470-E496 PolarHBondContact O-N 2.96Å
471	I	93.4	Very high	86.4	Confident	15 Å²	15	40.2 Å²	40.2	8%	0.077	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	124.1	165.1	-59.8	166.8	0	0	0	106.8	F450 R454 L458 L480 V493 L495	F450-I471 HydrophobicContact CE1-CD1 3.86Å; R454-I471 HydrophobicContact CG-CD1 4.18Å; L458-I471 HydrophobicContact CD1-CD1 4.36Å; L458-I471 HydrophobicContact CD1-CG1 4.06Å; L458-I471 HydrophobicContact CD2-CG1 4.34Å; I471-L480 HydrophobicContact CB-CD2 4.26Å; I471-L480 HydrophobicContact CG2-CB 3.96Å; I471-L480 HydrophobicContact CG2-CD2 4.29Å; I471-V493 HydrophobicContact CB-CG2 4.49Å; I471-V493 HydrophobicContact CD1-CG2 4.33Å; I471-V493 HydrophobicContact CG1-CG2 3.97Å; I471-V493 HydrophobicContact CG2-CG2 3.83Å; I471-L495 HydrophobicContact CG1-CD2 4.08Å
472	A	91.2	Very high	86.3	Confident	1 Å²	1	40.7 Å²	40.7	1%	0.008	20%	0.2	C	C	.	.	P	Polyproline II helix	trans	-61.3	150.1	179.1	0	0	0	0	0	110.9	Y438 L481 L494 E496	Y438-A472 HydrophobicContact CD1-CB 4.1Å; Y438-A472 HydrophobicContact CE1-CB 4.16Å; A472-L481 HydrophobicContact CB-CD1 4.14Å; A472-L481 WeakPolarHBondContact O-CB 3.4Å; A472-L481 PolarHBondContact O-N 2.78Å; A472-L494 HydrophobicContact CB-CB 4.16Å; A472-L494 HydrophobicContact CB-CD2 3.81Å; A472-L494 HydrophobicContact CB-CG 3.93Å; A472-L494 PolarHBondContact N-O 3.17Å; A472-E496 HydrophobicContact CB-CB 4.07Å
473	K	87.4	Confident	86.1	Confident	89 Å²	89	43.1 Å²	43.1	39%	0.387	21%	0.211	S	C	.	.	B	Isolated β-bridge	trans	-102.9	154.3	175.7	-71.9	175.3	-178.4	178.1	0	111.5	E479 L480 L481	K473-E479 CarbonylContact C-O 3.59Å; K473-E479 WeakPolarHBondContact CA-O 3.33Å; K473-L480 HydrophobicContact CG-CD2 3.97Å; K473-L481 WeakPolarHBondContact O-CD1 3.38Å
474	D	80.7	Confident	86	Confident	32 Å²	32	46 Å²	46	17%	0.171	23%	0.227	C	C	.	.	P	Polyproline II helix	trans	-67.1	129.7	160.7	-173.4	-85.9	0	0	0	109.1	I476 T477 Q478 E479 L481	D474-I476 PolarHBondContact O-N 3.39Å; D474-I476 WeakPolarHBondContact OD1-CA 3.04Å; D474-I476 WeakPolarHBondContact OD1-CB 3.44Å; D474-I476 PolarHBondContact OD1-N 3.35Å; D474-T477 PolarHBondContact OD1-N 3.03Å; D474-Q478 VanDerWaalsContact O-CA 3.24Å; D474-Q478 WeakPolarHBondContact O-CA 3.37Å; D474-Q478 PolarHBondContact O-N 3.36Å; D474-Q478 PolarHBondContact O-NE2 2.88Å; D474-E479 PolarHBondContact N-O 2.71Å; D474-L481 HydrophobicContact CB-CD2 4.12Å
475	D	76.7	Confident	85.7	Confident	119 Å²	119	47.9 Å²	47.9	64%	0.636	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-30	-176.2	-67.4	-58.3	0	0	0	112.3	Q478	D475-Q478 PolarHBondContact O-NE2 2.77Å
476	I	75.1	Confident	84.9	Confident	128 Å²	128	54.7 Å²	54.7	66%	0.656	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.8	-53	-174.4	-50.2	171	0	0	0	111.1	D474 W563	D474-I476 PolarHBondContact O-N 3.39Å; D474-I476 WeakPolarHBondContact OD1-CA 3.04Å; D474-I476 WeakPolarHBondContact OD1-CB 3.44Å; D474-I476 PolarHBondContact OD1-N 3.35Å; I476-W563 HydrophobicContact CD1-CZ2 4.3Å; I476-W563 HydrophobicContact CG2-CZ2 4.14Å
477	T	76.5	Confident	84	Confident	48 Å²	48	61.1 Å²	61.1	29%	0.294	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.3	-15.1	-175.9	77.5	0	0	0	0	113.4	D474 E479 P562	D474-T477 PolarHBondContact OD1-N 3.03Å; T477-E479 PolarHBondContact O-N 2.57Å; T477-E479 VanDerWaalsContact O-N 3.13Å; T477-E479 WeakPolarHBondContact OG1-CB 3.29Å; T477-E479 WeakPolarHBondContact OG1-CG 3.47Å; T477-E479 PolarHBondContact OG1-N 3.15Å; T477-E479 PolarHBondContact OG1-OE2 2.87Å; T477-P562 HydrophobicContact CG2-CG 4.11Å
478	Q	79.9	Confident	83.3	Confident	104 Å²	104	67.3 Å²	67.3	49%	0.486	33%	0.333	S	S	.	.			trans	59.8	12.1	-174.3	-62.1	-68.3	-55	0	0	114.4	D474 D475	D474-Q478 VanDerWaalsContact O-CA 3.24Å; D474-Q478 WeakPolarHBondContact O-CA 3.37Å; D474-Q478 PolarHBondContact O-N 3.36Å; D474-Q478 PolarHBondContact O-NE2 2.88Å; D475-Q478 PolarHBondContact O-NE2 2.77Å
479	E	81.3	Confident	83.1	Confident	108 Å²	108	71.2 Å²	71.2	51%	0.505	35%	0.354	S	S	.	.			trans	-75.1	155.9	173.5	-65	178.1	122.9	0	0	111.4	K473 D474 T477 P562	K473-E479 CarbonylContact C-O 3.59Å; K473-E479 WeakPolarHBondContact CA-O 3.33Å; D474-E479 PolarHBondContact N-O 2.71Å; T477-E479 PolarHBondContact O-N 2.57Å; T477-E479 VanDerWaalsContact O-N 3.13Å; T477-E479 WeakPolarHBondContact OG1-CB 3.29Å; T477-E479 WeakPolarHBondContact OG1-CG 3.47Å; T477-E479 PolarHBondContact OG1-N 3.15Å; T477-E479 PolarHBondContact OG1-OE2 2.87Å; E479-P562 VanDerWaalsContact OE2-CG 3.24Å; E479-P562 WeakPolarHBondContact OE2-CG 3.47Å
480	L	85.8	Confident	83	Confident	77 Å²	77	72.8 Å²	72.8	40%	0.403	36%	0.361	S	S	.	.	B	Isolated β-bridge	trans	-76.5	130.9	178.7	-61.6	177.4	0	0	0	110.7	I471 K473 L482	I471-L480 HydrophobicContact CB-CD2 4.26Å; I471-L480 HydrophobicContact CG2-CB 3.96Å; I471-L480 HydrophobicContact CG2-CD2 4.29Å; K473-L480 HydrophobicContact CG-CD2 3.97Å; L480-L482 VanDerWaalsContact C-N 3.27Å; L480-L482 PolarHBondContact O-N 3.33Å
481	L	89.6	Confident	83.1	Confident	15 Å²	15	68.5 Å²	68.5	8%	0.079	35%	0.345	C	S	.	.			trans	-75.7	79.3	179.1	-66.2	172	0	0	0	111	A472 K473 D474 V493 L494 P554 F559	A472-L481 HydrophobicContact CB-CD1 4.14Å; A472-L481 WeakPolarHBondContact O-CB 3.4Å; A472-L481 PolarHBondContact O-N 2.78Å; K473-L481 WeakPolarHBondContact O-CD1 3.38Å; D474-L481 HydrophobicContact CB-CD2 4.12Å; L481-V493 WeakPolarHBondContact O-CA 3.39Å; L481-L494 HydrophobicContact CB-CB 3.94Å; L481-L494 HydrophobicContact CD1-CB 4.46Å; L481-L494 HydrophobicContact CD1-CD2 3.75Å; L481-L494 PolarHBondContact O-N 3.34Å; L481-P554 HydrophobicContact CD1-CB 3.86Å; L481-F559 HydrophobicContact CB-CD1 4.22Å; L481-F559 HydrophobicContact CB-CE1 4.16Å; L481-F559 HydrophobicContact CB-CE2 4.48Å; L481-F559 HydrophobicContact CB-CG 4.43Å; L481-F559 HydrophobicContact CB-CZ 4.27Å; L481-F559 HydrophobicContact CD2-CB 4.12Å; L481-F559 HydrophobicContact CD2-CD1 4.2Å; L481-F559 HydrophobicContact CD2-CG 4.13Å; L481-F559 WeakPolarHBondContact O-CE1 3.06Å; L481-F559 WeakPolarHBondContact O-CZ 3.38Å
482	L	91	Very high	83	Confident	17 Å²	17	70.2 Å²	70.2	9%	0.089	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	115.7	-177.8	172.3	62.6	0	0	0	109.6	Q447 F450 K451 L480 I491 K492 V493 F559	Q447-L482 HydrophobicContact CG-CD1 4.11Å; Q447-L482 HydrophobicContact CG-CD2 4.14Å; Q447-L482 HydrophobicContact CG-CG 3.8Å; Q447-L482 PolarHBondContact NE2-O 3.17Å; F450-L482 HydrophobicContact CD1-CD1 3.89Å; F450-L482 HydrophobicContact CD1-CD2 3.94Å; F450-L482 HydrophobicContact CE1-CD1 4.12Å; F450-L482 HydrophobicContact CE1-CD2 4.27Å; K451-L482 HydrophobicContact CD-CD2 4.47Å; K451-L482 HydrophobicContact CG-CD2 4.2Å; L480-L482 VanDerWaalsContact C-N 3.27Å; L480-L482 PolarHBondContact O-N 3.33Å; L482-I491 HydrophobicContact CD1-CB 4.15Å; L482-I491 HydrophobicContact CD1-CD1 3.71Å; L482-I491 HydrophobicContact CD1-CG1 4.49Å; L482-I491 HydrophobicContact CD1-CG2 4.32Å; L482-K492 WeakPolarHBondContact CA-O 3.48Å; L482-V493 HydrophobicContact CB-CG2 4.46Å; L482-V493 HydrophobicContact CD1-CB 3.93Å; L482-V493 HydrophobicContact CD1-CG2 4.13Å; L482-F559 VanDerWaalsContact N-CE1 3.31Å
483	E	88	Confident	83.1	Confident	51 Å²	51	70.2 Å²	70.2	24%	0.238	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	128.3	-170.5	-177.8	-173.1	-161.2	0	0	110	I491 K492 F559	E483-I491 CarbonylContact O-C 3.51Å; E483-I491 WeakPolarHBondContact O-CA 3.39Å; E483-K492 PolarHBondContact N-O 3.3Å; E483-K492 PolarHBondContact O-N 2.79Å; E483-K492 WeakPolarHBondContact OE2-CE 3.04Å; E483-K492 IonicContact OE2-NZ 2.75Å; E483-K492 PolarHBondContact OE2-NZ 2.92Å; E483-F559 HydrophobicContact CB-CD1 3.92Å; E483-F559 HydrophobicContact CB-CE1 3.62Å
484	D	86.3	Confident	83.5	Confident	65 Å²	65	66 Å²	66	35%	0.348	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	122.1	168.8	-86.7	-52.7	0	0	0	110.1	N446 Q447 L486 I491	N446-D484 WeakPolarHBondContact CA-OD1 3.44Å; Q447-D484 WeakPolarHBondContact CB-OD2 3.46Å; Q447-D484 HydrophobicContact CG-CB 4.5Å; Q447-D484 WeakPolarHBondContact CG-OD2 3.01Å; Q447-D484 PolarHBondContact N-OD1 2.83Å; D484-L486 PolarHBondContact O-N 3.46Å; D484-I491 VanDerWaalsContact OD1-CG2 3.29Å; D484-I491 WeakPolarHBondContact OD1-CG2 3.28Å
485	I	84.4	Confident	84.1	Confident	38 Å²	38	64.5 Å²	64.5	20%	0.195	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	97.6	171.5	-58.5	172.5	0	0	0	108	H442 N487 K488 Q490 K492	H442-I485 WeakPolarHBondContact NE2-CD1 3.48Å; I485-N487 PolarHBondContact O-N 3.38Å; I485-K488 HydrophobicContact CG2-CB 4.32Å; I485-K488 HydrophobicContact CG2-CD 3.99Å; I485-K488 HydrophobicContact CG2-CG 4.32Å; I485-K488 PolarHBondContact O-N 3.46Å; I485-Q490 HydrophobicContact CB-CB 4.11Å; I485-Q490 WeakPolarHBondContact CB-O 3.43Å; I485-Q490 HydrophobicContact CD1-CB 4.15Å; I485-Q490 PolarHBondContact N-O 3.1Å; I485-K492 HydrophobicContact CD1-CG 4.03Å; I485-K492 HydrophobicContact CG1-CG 4.3Å
486	L	71.5	Confident	84.8	Confident	144 Å²	144	61.1 Å²	61.1	75%	0.754	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-41.6	132.3	-178.7	-69.6	168.9	0	0	0	113	D484 K488	D484-L486 PolarHBondContact O-N 3.46Å; L486-K488 VanDerWaalsContact C-N 3.31Å; L486-K488 PolarHBondContact O-N 2.94Å
487	N	65.1	Low	85.5	Confident	138 Å²	138	55.1 Å²	55.1	74%	0.738	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.2	18.2	177.8	-49.3	-49.5	0	0	0	116.4	I485	I485-N487 PolarHBondContact O-N 3.38Å
488	K	72.6	Confident	85.9	Confident	130 Å²	130	53.4 Å²	53.4	57%	0.565	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-123.6	-8.8	178.6	-64.6	-167.5	178.9	-178.9	0	117.2	I485 L486 Q490	I485-K488 HydrophobicContact CG2-CB 4.32Å; I485-K488 HydrophobicContact CG2-CD 3.99Å; I485-K488 HydrophobicContact CG2-CG 4.32Å; I485-K488 PolarHBondContact O-N 3.46Å; L486-K488 VanDerWaalsContact C-N 3.31Å; L486-K488 PolarHBondContact O-N 2.94Å; K488-Q490 VanDerWaalsContact C-N 3.28Å; K488-Q490 HydrophobicContact CB-CB 4.09Å; K488-Q490 HydrophobicContact CB-CG 3.91Å; K488-Q490 PolarHBondContact O-N 2.83Å
489	N	84.2	Confident	85.4	Confident	86 Å²	86	48.5 Å²	48.5	46%	0.46	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	48.3	54.1	-166.1	-164.1	77.8	0	0	0	110.8	K444 T445 N446	K444-N489 CarbonylContact C-O 3.58Å; T445-N489 PolarHBondContact N-O 3.27Å; T445-N489 CarbonylContact O-C 3.53Å; N446-N489 PolarHBondContact ND2-OD1 3.21Å
490	Q	90.9	Very high	84.3	Confident	34 Å²	34	46.8 Å²	46.8	16%	0.159	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	147.1	-178.9	-70.2	172.4	4.3	0	0	108.6	H442 L443 T445 I485 K488 I546	H442-Q490 PolarHBondContact CE1-OE1 3.43Å; H442-Q490 WeakPolarHBondContact NE2-CB 3.4Å; H442-Q490 WeakPolarHBondContact NE2-CG 3.31Å; H442-Q490 PolarHBondContact NE2-OE1 2.93Å; L443-Q490 CarbonylContact O-C 3.55Å; L443-Q490 WeakPolarHBondContact O-CA 3.2Å; T445-Q490 CarbonylContact O-C 3.59Å; T445-Q490 WeakPolarHBondContact O-CA 3.32Å; T445-Q490 PolarHBondContact O-N 3.39Å; T445-Q490 VanDerWaalsContact O-N 3.1Å; I485-Q490 HydrophobicContact CB-CB 4.11Å; I485-Q490 WeakPolarHBondContact CB-O 3.43Å; I485-Q490 HydrophobicContact CD1-CB 4.15Å; I485-Q490 PolarHBondContact N-O 3.1Å; K488-Q490 VanDerWaalsContact C-N 3.28Å; K488-Q490 HydrophobicContact CB-CB 4.09Å; K488-Q490 HydrophobicContact CB-CG 3.91Å; K488-Q490 PolarHBondContact O-N 2.83Å; Q490-I546 HydrophobicContact CB-CD1 4.42Å; Q490-I546 VanDerWaalsContact CD-CD1 3.41Å; Q490-I546 HydrophobicContact CG-CD1 3.57Å
491	I	92.9	Very high	82.6	Confident	0 Å²	0	44.3 Å²	44.3	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	153	172.8	53.3	169.2	0	0	0	111.1	H442 L443 T445 Q447 F450 L482 E483 D484	H442-I491 WeakPolarHBondContact CA-O 3.22Å; H442-I491 PolarHBondContact CD2-O 3.43Å; L443-I491 HydrophobicContact CB-CD1 4.32Å; L443-I491 HydrophobicContact CB-CG1 3.87Å; L443-I491 HydrophobicContact CD1-CD1 4.17Å; L443-I491 PolarHBondContact N-O 2.89Å; L443-I491 PolarHBondContact O-N 3.25Å; T445-I491 HydrophobicContact CG2-CD1 3.66Å; T445-I491 HydrophobicContact CG2-CG1 3.79Å; T445-I491 PolarHBondContact O-N 3.44Å; Q447-I491 HydrophobicContact CG-CG2 3.87Å; F450-I491 HydrophobicContact CB-CD1 3.58Å; F450-I491 HydrophobicContact CD1-CD1 3.86Å; F450-I491 HydrophobicContact CD2-CD1 3.57Å; F450-I491 HydrophobicContact CE1-CD1 4.45Å; F450-I491 HydrophobicContact CE2-CD1 4.21Å; F450-I491 HydrophobicContact CG-CD1 3.37Å; L482-I491 HydrophobicContact CD1-CB 4.15Å; L482-I491 HydrophobicContact CD1-CD1 3.71Å; L482-I491 HydrophobicContact CD1-CG1 4.49Å; L482-I491 HydrophobicContact CD1-CG2 4.32Å; E483-I491 CarbonylContact O-C 3.51Å; E483-I491 WeakPolarHBondContact O-CA 3.39Å; D484-I491 VanDerWaalsContact OD1-CG2 3.29Å; D484-I491 WeakPolarHBondContact OD1-CG2 3.28Å
492	K	92.2	Very high	80.5	Confident	51 Å²	51	47.5 Å²	47.5	22%	0.222	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	141.2	150.9	-58	-177.4	-162.4	144.4	0	108.7	L441 L482 E483 I485 H558 F559	L441-K492 WeakPolarHBondContact O-CA 3.5Å; L482-K492 WeakPolarHBondContact CA-O 3.48Å; E483-K492 PolarHBondContact N-O 3.3Å; E483-K492 PolarHBondContact O-N 2.79Å; E483-K492 WeakPolarHBondContact OE2-CE 3.04Å; E483-K492 IonicContact OE2-NZ 2.75Å; E483-K492 PolarHBondContact OE2-NZ 2.92Å; I485-K492 HydrophobicContact CD1-CG 4.03Å; I485-K492 HydrophobicContact CG1-CG 4.3Å; K492-H558 PolarHBondContact NZ-O 3.45Å; K492-F559 HydrophobicContact CB-CE1 4.23Å; K492-F559 HydrophobicContact CB-CE2 4.02Å; K492-F559 HydrophobicContact CB-CZ 3.58Å; K492-F559 HydrophobicContact CD-CE2 4.38Å
493	V	94.2	Very high	78.2	Confident	0 Å²	0	52.3 Å²	52.3	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	133.1	165	64.9	0	0	0	0	109.2	L441 L443 F450 I471 L481 L482 L495	L441-V493 HydrophobicContact CB-CG1 3.82Å; L441-V493 HydrophobicContact CD1-CG1 4.36Å; L441-V493 PolarHBondContact N-O 2.89Å; L441-V493 PolarHBondContact O-N 3.45Å; L443-V493 HydrophobicContact CD1-CG1 4.23Å; F450-V493 HydrophobicContact CE1-CB 4.48Å; F450-V493 HydrophobicContact CE1-CG2 4.06Å; F450-V493 HydrophobicContact CE2-CG1 4.46Å; F450-V493 HydrophobicContact CZ-CB 4.38Å; F450-V493 HydrophobicContact CZ-CG1 4.04Å; F450-V493 HydrophobicContact CZ-CG2 4.13Å; I471-V493 HydrophobicContact CB-CG2 4.49Å; I471-V493 HydrophobicContact CD1-CG2 4.33Å; I471-V493 HydrophobicContact CG1-CG2 3.97Å; I471-V493 HydrophobicContact CG2-CG2 3.83Å; L481-V493 WeakPolarHBondContact O-CA 3.39Å; L482-V493 HydrophobicContact CB-CG2 4.46Å; L482-V493 HydrophobicContact CD1-CB 3.93Å; L482-V493 HydrophobicContact CD1-CG2 4.13Å; V493-L495 HydrophobicContact CG1-CD2 4.39Å; V493-L495 HydrophobicContact CG2-CD2 4.01Å
494	L	94.3	Very high	75.9	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	121.3	169.7	-169.3	70.2	0	0	0	108.9	Y438 L440 A472 L481 V551 P554 F559	Y438-L494 HydrophobicContact CD1-CD2 4.2Å; Y438-L494 HydrophobicContact CD1-CG 4.44Å; L440-L494 HydrophobicContact CB-CD1 3.96Å; L440-L494 HydrophobicContact CD1-CD1 4.26Å; A472-L494 HydrophobicContact CB-CB 4.16Å; A472-L494 HydrophobicContact CB-CD2 3.81Å; A472-L494 HydrophobicContact CB-CG 3.93Å; A472-L494 PolarHBondContact N-O 3.17Å; L481-L494 HydrophobicContact CB-CB 3.94Å; L481-L494 HydrophobicContact CD1-CB 4.46Å; L481-L494 HydrophobicContact CD1-CD2 3.75Å; L481-L494 PolarHBondContact O-N 3.34Å; L494-V551 HydrophobicContact CD1-CG2 3.73Å; L494-P554 HydrophobicContact CD2-CB 4.13Å; L494-P554 HydrophobicContact CD2-CG 4.44Å; L494-F559 HydrophobicContact CB-CE2 3.99Å; L494-F559 HydrophobicContact CB-CZ 4.45Å
495	L	94.2	Very high	73.9	Confident	1 Å²	1	54.2 Å²	54.2	1%	0.005	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	139.3	173	-55.9	-175.2	0	0	0	110.4	Y438 I439 L441 L458 L461 V469 R470 I471 V493	Y438-L495 CarbonylContact C-O 3.58Å; Y438-L495 WeakPolarHBondContact CA-O 3.24Å; I439-L495 HydrophobicContact CB-CB 4.32Å; I439-L495 PolarHBondContact N-O 3.26Å; I439-L495 PolarHBondContact O-N 3.13Å; L441-L495 HydrophobicContact CD1-CD1 3.57Å; L441-L495 HydrophobicContact CD1-CG 4.19Å; L441-L495 HydrophobicContact CG-CD1 4.44Å; L458-L495 HydrophobicContact CD2-CD1 4.36Å; L458-L495 HydrophobicContact CD2-CD2 3.55Å; L461-L495 HydrophobicContact CD1-CD1 3.55Å; V469-L495 HydrophobicContact CG1-CB 4.4Å; V469-L495 HydrophobicContact CG1-CD1 3.93Å; R470-L495 CarbonylContact O-C 3.5Å; R470-L495 VanDerWaalsContact O-CA 3.24Å; R470-L495 WeakPolarHBondContact O-CA 3.2Å; I471-L495 HydrophobicContact CG1-CD2 4.08Å; V493-L495 HydrophobicContact CG1-CD2 4.39Å; V493-L495 HydrophobicContact CG2-CD2 4.01Å
496	E	91.6	Very high	71.8	Confident	48 Å²	48	61.9 Å²	61.9	22%	0.224	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	127.1	166.7	-175.7	-176.8	155.1	0	0	107.6	I436 Y438 R470 A472	I436-E496 HydrophobicContact CG2-CG 3.64Å; Y438-E496 HydrophobicContact CD1-CB 4.18Å; Y438-E496 HydrophobicContact CD1-CG 4.41Å; Y438-E496 HydrophobicContact CE1-CB 4Å; Y438-E496 HydrophobicContact CE1-CG 3.84Å; R470-E496 PolarHBondContact N-O 3.49Å; R470-E496 PolarHBondContact O-N 2.96Å; A472-E496 HydrophobicContact CB-CB 4.07Å
497	V	89.9	Confident	70.1	Confident	2 Å²	2	59.1 Å²	59.1	1%	0.012	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	117.5	178.2	-172.5	0	0	0	0	108.8	I436 K437 I439 L465 I468 V469 V518	I436-V497 WeakPolarHBondContact CA-O 3.42Å; K437-V497 PolarHBondContact N-O 2.88Å; K437-V497 PolarHBondContact O-N 2.88Å; I439-V497 HydrophobicContact CD1-CG2 3.83Å; I439-V497 HydrophobicContact CG1-CG2 3.97Å; L465-V497 HydrophobicContact CD1-CG1 4.11Å; L465-V497 HydrophobicContact CD1-CG2 4.29Å; I468-V497 WeakPolarHBondContact O-CA 3.47Å; V469-V497 HydrophobicContact CG1-CG2 4.47Å; V469-V497 HydrophobicContact CG2-CG1 4.23Å; V469-V497 HydrophobicContact CG2-CG2 4.25Å; V497-V518 HydrophobicContact CG1-CG1 4.37Å; V497-V518 HydrophobicContact CG1-CG2 3.85Å
498	T	83.6	Confident	68.7	Low	12 Å²	12	58.9 Å²	58.9	7%	0.074	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	106.1	-167.7	-62.5	0	0	0	0	110.5	L434 I436 S467 I468	L434-T498 HydrophobicContact CB-CG2 4.18Å; L434-T498 HydrophobicContact CD1-CG2 4.18Å; L434-T498 HydrophobicContact CD2-CG2 4.31Å; L434-T498 HydrophobicContact CG-CG2 4.46Å; I436-T498 HydrophobicContact CG1-CG2 4.35Å; S467-T498 PolarHBondContact OG-O 2.04Å; I468-T498 PolarHBondContact N-O 3.05Å; I468-T498 PolarHBondContact O-N 3.49Å
499	S	68.9	Low	67	Low	2 Å²	2	61.2 Å²	61.2	1%	0.014	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79	124.8	176.7	71.9	0	0	0	0	110.3	L434 S435 D516 Q519	L434-S499 WeakPolarHBondContact CD2-O 3.39Å; S435-S499 WeakPolarHBondContact CB-OG 3.36Å; S435-S499 PolarHBondContact O-N 3.01Å; S435-S499 PolarHBondContact O-OG 3.4Å; S435-S499 VanDerWaalsContact O-OG 3.11Å; S435-S499 PolarHBondContact OG-OG 2.84Å; S499-D516 VanDerWaalsContact CA-OD2 3.27Å; S499-D516 WeakPolarHBondContact CA-OD2 3.35Å; S499-D516 WeakPolarHBondContact CB-OD2 3.46Å; S499-Q519 PolarHBondContact OG-NE2 2.93Å
500	Q	60.2	Low	64.5	Low	71 Å²	71	60.8 Å²	60.8	33%	0.332	34%	0.343	S	S	.	.	P	Polyproline II helix	trans	-60.9	143.1	179.3	-162.6	166.7	75.4	0	0	111.6	E426	E426-Q500 PolarHBondContact OE1-NE2 2.7Å
501	S	49.3	Very low	62	Low	26 Å²	26	65.9 Å²	65.9	18%	0.182	37%	0.371	C	S	.	.	P	Polyproline II helix	trans	-89.3	145.3	-173.1	71.9	0	0	0	0	112.2	N432 S433 N503	N432-S501 PolarHBondContact O-OG 3.42Å; S433-S501 VanDerWaalsContact O-CB 3.23Å; S433-S501 WeakPolarHBondContact O-CB 3.26Å; S501-N503 PolarHBondContact O-N 3.48Å
502	N	45.2	Very low	59.3	Low	82 Å²	82	72.5 Å²	72.5	44%	0.439	40%	0.404	S	S	.	.	G	3₁₀ helix	trans	-60.3	-8.4	-169.2	-67.4	-3.3	0	0	0	115.6	S504 C505 C513	N502-S504 PolarHBondContact O-N 3.34Å; N502-C505 WeakPolarHBondContact O-CB 3.3Å; N502-C505 PolarHBondContact O-N 2.68Å; N502-C513 PolarHBondContact OD1-O 2.72Å
503	N	42.5	Very low	56.8	Low	117 Å²	117	71.8 Å²	71.8	63%	0.626	41%	0.405	S	S	*	.	G	3₁₀ helix	trans	-64.9	-21	-173.2	-69.9	-11.8	0	0	0	114.3	S501	S501-N503 PolarHBondContact O-N 3.48Å
504	S	40.8	Very low	54.7	Low	97 Å²	97	73.8 Å²	73.8	68%	0.678	42%	0.417	S	S	*	.	G	3₁₀ helix	trans	-86.7	-13.2	173.6	-62.1	0	0	0	0	113.6	N502 K506	N502-S504 PolarHBondContact O-N 3.34Å; S504-K506 PolarHBondContact O-N 2.9Å
505	C	43.3	Very low	52.7	Low	59 Å²	59	74.8 Å²	74.8	40%	0.399	42%	0.424	S	S	.	.			trans	-82.8	83	-173.6	-169.1	0	0	0	0	111.6	N502 T507 C513	N502-C505 WeakPolarHBondContact O-CB 3.3Å; N502-C505 PolarHBondContact O-N 2.68Å; C505-T507 PolarHBondContact O-N 3.17Å; C505-C513 HydrophobicContact CB-CB 3.66Å; C505-C513 WeakPolarHBondContact CB-SG 3.47Å; C505-C513 WeakPolarHBondContact SG-CB 3.23Å; C505-C513 CovalentContact SG-SG 2.03Å; C505-C513 PolarHBondContact SG-SG 3.02Å
506	K	39.4	Very low	51.1	Low	199 Å²	199	75.4 Å²	75.4	87%	0.865	43%	0.427	S	S	*	.			trans	-73.5	87.6	175.7	-73.1	-176.9	177.8	175.7	0	111.5	S504 T508	S504-K506 PolarHBondContact O-N 2.9Å; K506-T508 PolarHBondContact O-N 3.42Å
507	T	36.1	Very low	50	Low	87 Å²	87	73.1 Å²	73.1	53%	0.534	42%	0.417	S	S	.	.			trans	-71.1	92	175.8	56.6	0	0	0	0	112.5	C505 C513	C505-T507 PolarHBondContact O-N 3.17Å; T507-C513 WeakPolarHBondContact CG2-SG 3.49Å
508	T	36.7	Very low	49.1	Very low	132 Å²	132	73.1 Å²	73.1	81%	0.81	42%	0.417	S	S	*	.	S	Bend	trans	-81.8	123.6	141.8	48.7	0	0	0	0	107.4	K506	K506-T508 PolarHBondContact O-N 3.42Å
509	E	35.6	Very low	48.6	Very low	180 Å²	180	76.3 Å²	76.3	84%	0.841	43%	0.431	S	S	*	.	S	Bend	trans	69.2	68.1	-179.8	-52.5	-167.2	163	0	0	117.2	N511	E509-N511 VanDerWaalsContact C-N 3.29Å; E509-N511 PolarHBondContact O-N 3.15Å
510	G	32.1	Very low	48.9	Very low	76 Å²	76	79.7 Å²	79.7	78%	0.784	45%	0.448	S	S	*	.	S	Bend	trans	70.9	-17.6	131.8	0	0	0	0	0	121.3
511	N	37.9	Very low	49.9	Very low	141 Å²	141	77.3 Å²	77.3	75%	0.754	44%	0.438	S	S	*	.			trans	-88.4	149.2	-174.6	-72.3	-37.6	0	0	0	113.3	E509 C513	E509-N511 VanDerWaalsContact C-N 3.29Å; E509-N511 PolarHBondContact O-N 3.15Å; N511-C513 PolarHBondContact O-N 2.91Å
512	M	36.9	Very low	51.6	Low	139 Å²	139	82.2 Å²	82.2	69%	0.685	46%	0.456	S	S	*	.			trans	-69.1	124.7	-167.3	-73.5	159.5	46.7	0	0	114	T514	M512-T514 PolarHBondContact O-N 3.31Å; M512-T514 VanDerWaalsContact O-N 3.1Å
513	C	41.1	Very low	53.4	Low	36 Å²	36	81.5 Å²	81.5	24%	0.243	46%	0.456	C	S	.	.	S	Bend	trans	-74.5	16.2	173.9	-62.5	0	0	0	0	115.3	N502 C505 T507 N511	N502-C513 PolarHBondContact OD1-O 2.72Å; C505-C513 HydrophobicContact CB-CB 3.66Å; C505-C513 WeakPolarHBondContact CB-SG 3.47Å; C505-C513 WeakPolarHBondContact SG-CB 3.23Å; C505-C513 CovalentContact SG-SG 2.03Å; C505-C513 PolarHBondContact SG-SG 3.02Å; T507-C513 WeakPolarHBondContact CG2-SG 3.49Å; N511-C513 PolarHBondContact O-N 2.91Å
514	T	49	Very low	55.5	Low	43 Å²	43	82.1 Å²	82.1	26%	0.264	46%	0.459	S	S	.	.			trans	-121.6	72.7	-174.4	58.4	0	0	0	0	110.3	M512	M512-T514 PolarHBondContact O-N 3.31Å; M512-T514 VanDerWaalsContact O-N 3.1Å
515	S	53.1	Low	57.7	Low	21 Å²	21	81.2 Å²	81.2	15%	0.147	44%	0.444	C	S	.	.			trans	-98.4	2.9	179.2	48.7	0	0	0	0	114.1	I416 S517	I416-S515 VanDerWaalsContact CD1-OG 3.29Å; I416-S515 WeakPolarHBondContact CD1-OG 3.23Å; S515-S517 PolarHBondContact O-N 2.83Å
516	D	60.6	Low	59.9	Low	13 Å²	13	78.4 Å²	78.4	7%	0.07	43%	0.425	C	S	.	.			trans	-78.8	117.1	176.7	-170.6	-27.6	0	0	0	110.6	S467 S499 V518 Q519 L520	S467-D516 VanDerWaalsContact CB-OD2 3.32Å; S467-D516 WeakPolarHBondContact CB-OD2 3.48Å; S467-D516 PolarHBondContact OG-OD2 2.94Å; S499-D516 VanDerWaalsContact CA-OD2 3.27Å; S499-D516 WeakPolarHBondContact CA-OD2 3.35Å; S499-D516 WeakPolarHBondContact CB-OD2 3.46Å; D516-V518 PolarHBondContact O-N 2.89Å; D516-V518 VanDerWaalsContact O-N 3.15Å; D516-V518 WeakPolarHBondContact OD1-CA 3.17Å; D516-V518 WeakPolarHBondContact OD1-CB 3.43Å; D516-V518 WeakPolarHBondContact OD1-CG2 3.34Å; D516-V518 PolarHBondContact OD1-N 2.87Å; D516-Q519 HydrophobicContact CB-CG 4.31Å; D516-Q519 PolarHBondContact O-N 2.95Å; D516-L520 PolarHBondContact O-N 3.27Å
517	S	67	Low	62.4	Low	0 Å²	0	71.6 Å²	71.6	0%	0	40%	0.396	C	S	.	.	H	α-helix	trans	-55.6	-30.4	177.4	71.1	0	0	0	0	113.3	L465 S515 Q519 L520 L521	L465-S517 WeakPolarHBondContact CA-OG 3.05Å; L465-S517 PolarHBondContact O-OG 3.44Å; S515-S517 PolarHBondContact O-N 2.83Å; S517-Q519 VanDerWaalsContact C-N 3.29Å; S517-Q519 PolarHBondContact O-N 2.88Å; S517-L520 PolarHBondContact O-N 3.25Å; S517-L521 WeakPolarHBondContact O-CG 3.49Å; S517-L521 PolarHBondContact O-N 2.98Å; S517-L521 VanDerWaalsContact O-N 3.08Å
518	V	71.8	Confident	65	Low	3 Å²	3	70.9 Å²	70.9	2%	0.018	39%	0.388	C	S	.	.	H	α-helix	trans	-68.3	-29.6	-179.7	-177.2	0	0	0	0	110.8	K437 L465 V497 D516 L526	K437-V518 HydrophobicContact CB-CG1 4.48Å; K437-V518 HydrophobicContact CD-CG1 3.63Å; K437-V518 HydrophobicContact CG-CG1 4.21Å; K437-V518 PolarHBondContact NZ-O 2.82Å; L465-V518 HydrophobicContact CB-CG2 3.95Å; L465-V518 HydrophobicContact CD1-CG2 4.2Å; L465-V518 HydrophobicContact CD2-CG2 4Å; L465-V518 HydrophobicContact CG-CG2 4.28Å; V497-V518 HydrophobicContact CG1-CG1 4.37Å; V497-V518 HydrophobicContact CG1-CG2 3.85Å; D516-V518 PolarHBondContact O-N 2.89Å; D516-V518 VanDerWaalsContact O-N 3.15Å; D516-V518 WeakPolarHBondContact OD1-CA 3.17Å; D516-V518 WeakPolarHBondContact OD1-CB 3.43Å; D516-V518 WeakPolarHBondContact OD1-CG2 3.34Å; D516-V518 PolarHBondContact OD1-N 2.87Å; V518-L526 HydrophobicContact CB-CD2 4.46Å; V518-L526 HydrophobicContact CG1-CD2 4.08Å
519	Q	72.3	Confident	67.7	Low	78 Å²	78	64.7 Å²	64.7	36%	0.364	35%	0.35	S	S	.	.	H	α-helix	trans	-81.7	-33.8	173.7	-65.2	-172.1	8.3	0	0	112.4	S499 D516 S517	S499-Q519 PolarHBondContact OG-NE2 2.93Å; D516-Q519 HydrophobicContact CB-CG 4.31Å; D516-Q519 PolarHBondContact O-N 2.95Å; S517-Q519 VanDerWaalsContact C-N 3.29Å; S517-Q519 PolarHBondContact O-N 2.88Å
520	L	75.9	Confident	70.4	Confident	73 Å²	73	56.2 Å²	56.2	38%	0.382	31%	0.31	S	S	.	.	H	α-helix	trans	-76.6	-29.7	-176	-65.2	172.3	0	0	0	114	F385 L388 D516 S517	F385-L520 HydrophobicContact CD1-CD1 4.31Å; F385-L520 HydrophobicContact CE1-CD1 3.88Å; L388-L520 HydrophobicContact CD1-CD1 3.61Å; D516-L520 PolarHBondContact O-N 3.27Å; S517-L520 PolarHBondContact O-N 3.25Å
521	L	81.9	Confident	73.2	Confident	21 Å²	21	53.7 Å²	53.7	11%	0.11	28%	0.278	C	S	.	.	S	Bend	trans	-103.8	139.5	-174.8	-60	178.5	0	0	0	113	M382 F385 S517 E525 L526 Y529	M382-L521 HydrophobicContact CE-CD2 3.92Å; F385-L521 HydrophobicContact CE2-CD1 4.35Å; F385-L521 HydrophobicContact CZ-CD1 4.09Å; F385-L521 HydrophobicContact CZ-CD2 4.35Å; F385-L521 HydrophobicContact CZ-CG 4.17Å; S517-L521 WeakPolarHBondContact O-CG 3.49Å; S517-L521 PolarHBondContact O-N 2.98Å; S517-L521 VanDerWaalsContact O-N 3.08Å; L521-E525 HydrophobicContact CB-CB 4.18Å; L521-E525 HydrophobicContact CD2-CB 4.31Å; L521-L526 HydrophobicContact CB-CB 3.98Å; L521-L526 HydrophobicContact CB-CD1 4.28Å; L521-L526 HydrophobicContact CD1-CD1 3.99Å; L521-Y529 HydrophobicContact CD1-CD1 4.09Å; L521-Y529 HydrophobicContact CD1-CD2 4.05Å; L521-Y529 HydrophobicContact CD1-CG 3.67Å
522	K	83.5	Confident	75.8	Confident	129 Å²	129	47 Å²	47	56%	0.561	24%	0.242	S	C	*	.			trans	-70	157.8	169.2	-59.9	177.5	-149.2	70.1	0	110.3	N524 E525 L526	K522-N524 VanDerWaalsContact C-N 3.32Å; K522-N524 PolarHBondContact O-N 2.91Å; K522-N524 VanDerWaalsContact O-N 3.12Å; K522-E525 HydrophobicContact CB-CG 4.38Å; K522-E525 VanDerWaalsContact CB-OE2 3.27Å; K522-E525 WeakPolarHBondContact CB-OE2 3.46Å; K522-E525 VanDerWaalsContact CG-OE2 3.26Å; K522-E525 WeakPolarHBondContact CG-OE2 3.43Å; K522-E525 PolarHBondContact N-OE2 2.65Å; K522-E525 IonicContact NZ-OE1 2.66Å; K522-E525 PolarHBondContact NZ-OE1 3.01Å; K522-E525 IonicContact NZ-OE2 3.73Å; K522-E525 PolarHBondContact NZ-OE2 3.41Å; K522-E525 CarbonylContact O-C 3.39Å; K522-E525 WeakPolarHBondContact O-CA 3.16Å; K522-E525 WeakPolarHBondContact O-CB 3.43Å; K522-E525 PolarHBondContact O-N 3.46Å; K522-L526 WeakPolarHBondContact O-CB 3.24Å; K522-L526 PolarHBondContact O-N 3.04Å
523	P	84.2	Confident	78.5	Confident	68 Å²	68	40.3 Å²	40.3	44%	0.442	21%	0.21	S	C	.	.	H	α-helix	trans	-50.5	-42.7	-176.4	-30.7	36.6	0	0	0	115.4	L526 K527 F550	P523-L526 PolarHBondContact O-N 3.13Å; P523-K527 WeakPolarHBondContact O-CB 3.42Å; P523-K527 PolarHBondContact O-N 3.21Å; P523-F550 HydrophobicContact CB-CD2 3.78Å; P523-F550 HydrophobicContact CB-CE2 4.19Å; P523-F550 HydrophobicContact CB-CG 4.17Å; P523-F550 WeakPolarHBondContact O-CE2 3.48Å
524	N	86.3	Confident	81	Confident	129 Å²	129	39.3 Å²	39.3	69%	0.69	20%	0.202	S	C	*	.	H	α-helix	trans	-70.9	-33.6	177.1	-71.5	-8.8	0	0	0	113.2	K522 I528	K522-N524 VanDerWaalsContact C-N 3.32Å; K522-N524 PolarHBondContact O-N 2.91Å; K522-N524 VanDerWaalsContact O-N 3.12Å; N524-I528 WeakPolarHBondContact O-CD1 2.92Å; N524-I528 VanDerWaalsContact O-CG1 3.29Å; N524-I528 WeakPolarHBondContact O-CG1 3.4Å; N524-I528 PolarHBondContact O-N 3.44Å
525	E	88	Confident	82.9	Confident	78 Å²	78	37.5 Å²	37.5	36%	0.364	19%	0.191	S	C	.	.	H	α-helix	trans	-69.8	-41.5	175.7	-66.5	155.3	-174.2	0	0	109.8	L521 K522 I528 Y529	L521-E525 HydrophobicContact CB-CB 4.18Å; L521-E525 HydrophobicContact CD2-CB 4.31Å; K522-E525 HydrophobicContact CB-CG 4.38Å; K522-E525 VanDerWaalsContact CB-OE2 3.27Å; K522-E525 WeakPolarHBondContact CB-OE2 3.46Å; K522-E525 VanDerWaalsContact CG-OE2 3.26Å; K522-E525 WeakPolarHBondContact CG-OE2 3.43Å; K522-E525 PolarHBondContact N-OE2 2.65Å; K522-E525 IonicContact NZ-OE1 2.66Å; K522-E525 PolarHBondContact NZ-OE1 3.01Å; K522-E525 IonicContact NZ-OE2 3.73Å; K522-E525 PolarHBondContact NZ-OE2 3.41Å; K522-E525 CarbonylContact O-C 3.39Å; K522-E525 WeakPolarHBondContact O-CA 3.16Å; K522-E525 WeakPolarHBondContact O-CB 3.43Å; K522-E525 PolarHBondContact O-N 3.46Å; E525-I528 PolarHBondContact O-N 2.87Å; E525-Y529 WeakPolarHBondContact O-CB 3.41Å; E525-Y529 PolarHBondContact O-N 3.24Å
526	L	88.8	Confident	84.7	Confident	1 Å²	1	36.8 Å²	36.8	1%	0.005	19%	0.186	C	C	.	.	H	α-helix	trans	-66.9	-38.9	176.3	-170.5	60.6	0	0	0	112.5	L465 V518 L521 K522 P523 I528 Y529 I530 F550	L465-L526 HydrophobicContact CD2-CD1 3.75Å; V518-L526 HydrophobicContact CB-CD2 4.46Å; V518-L526 HydrophobicContact CG1-CD2 4.08Å; L521-L526 HydrophobicContact CB-CB 3.98Å; L521-L526 HydrophobicContact CB-CD1 4.28Å; L521-L526 HydrophobicContact CD1-CD1 3.99Å; K522-L526 WeakPolarHBondContact O-CB 3.24Å; K522-L526 PolarHBondContact O-N 3.04Å; P523-L526 PolarHBondContact O-N 3.13Å; L526-I528 VanDerWaalsContact C-N 3.33Å; L526-I528 PolarHBondContact O-N 3.46Å; L526-Y529 HydrophobicContact CD1-CD1 4.23Å; L526-Y529 PolarHBondContact O-N 2.83Å; L526-I530 HydrophobicContact CD1-CD1 4.47Å; L526-I530 HydrophobicContact CG-CD1 4.16Å; L526-I530 WeakPolarHBondContact O-CD1 3.47Å; L526-I530 VanDerWaalsContact O-CG1 3.28Å; L526-I530 WeakPolarHBondContact O-CG1 3.03Å; L526-I530 PolarHBondContact O-N 2.82Å; L526-F550 HydrophobicContact CB-CZ 3.98Å; L526-F550 HydrophobicContact CD2-CE1 3.67Å; L526-F550 HydrophobicContact CD2-CZ 3.76Å; L526-F550 HydrophobicContact CG-CE1 4.23Å; L526-F550 HydrophobicContact CG-CZ 3.82Å
527	K	91.6	Very high	85.8	Confident	56 Å²	56	41.9 Å²	41.9	24%	0.243	21%	0.212	C	C	.	.	H	α-helix	trans	-55.8	-48.9	170.7	177.5	162	-176.5	163.6	0	111.1	P523 L531 N547 L548 F550	P523-K527 WeakPolarHBondContact O-CB 3.42Å; P523-K527 PolarHBondContact O-N 3.21Å; K527-L531 HydrophobicContact CG-CD1 3.72Å; K527-L531 WeakPolarHBondContact O-CB 3.12Å; K527-L531 WeakPolarHBondContact O-CD1 3.49Å; K527-L531 WeakPolarHBondContact O-CG 3.08Å; K527-L531 PolarHBondContact O-N 2.89Å; K527-L531 VanDerWaalsContact O-N 3.11Å; K527-N547 PolarHBondContact NZ-OD1 2.86Å; K527-L548 HydrophobicContact CB-CD2 4.21Å; K527-L548 HydrophobicContact CD-CD2 4.37Å; K527-L548 WeakPolarHBondContact CD-O 3.27Å; K527-L548 WeakPolarHBondContact CE-O 3.36Å; K527-L548 HydrophobicContact CG-CD2 4.09Å; K527-L548 PolarHBondContact NZ-O 2.92Å; K527-F550 HydrophobicContact CB-CE2 4.09Å
528	I	90.6	Very high	86.5	Confident	72 Å²	72	45.7 Å²	45.7	37%	0.369	23%	0.23	S	C	.	.	H	α-helix	trans	-69.1	-41	-178.1	-64.3	167.4	0	0	0	110.4	Y342 Y381 N524 E525 L526 L531 A532	Y342-I528 HydrophobicContact CD1-CG2 4.28Å; Y381-I528 HydrophobicContact CE1-CG2 3.69Å; Y381-I528 WeakPolarHBondContact OH-CG2 3.27Å; N524-I528 WeakPolarHBondContact O-CD1 2.92Å; N524-I528 VanDerWaalsContact O-CG1 3.29Å; N524-I528 WeakPolarHBondContact O-CG1 3.4Å; N524-I528 PolarHBondContact O-N 3.44Å; E525-I528 PolarHBondContact O-N 2.87Å; L526-I528 VanDerWaalsContact C-N 3.33Å; L526-I528 PolarHBondContact O-N 3.46Å; I528-L531 PolarHBondContact O-N 3.41Å; I528-A532 VanDerWaalsContact O-CB 3.3Å; I528-A532 WeakPolarHBondContact O-CB 3.35Å; I528-A532 PolarHBondContact O-N 3.39Å
529	Y	92.6	Very high	87.3	Confident	1 Å²	1	45.8 Å²	45.8	0%	0.004	23%	0.23	C	C	.	.	H	α-helix	trans	-57	-49.9	174.8	174.9	-98.8	0	0	0	112.3	F366 Y381 F385 I464 L465 L521 E525 L526 L531 A532 A533	F366-Y529 HydrophobicContact CE2-CD2 4.27Å; F366-Y529 AromaticContact CE2-CE2 3.66Å; F366-Y529 HydrophobicContact CE2-CE2 3.66Å; F366-Y529 HydrophobicContact CZ-CD2 4.31Å; F366-Y529 AromaticContact CZ-CE2 3.59Å; F366-Y529 HydrophobicContact CZ-CE2 3.59Å; F366-Y529 AromaticContact CZ-CZ 3.83Å; Y381-Y529 HydrophobicContact CD1-CD2 4.36Å; Y381-Y529 HydrophobicContact CG-CD2 4.45Å; F385-Y529 AromaticContact CD2-CE2 3.93Å; F385-Y529 HydrophobicContact CD2-CE2 3.93Å; F385-Y529 AromaticContact CD2-CZ 3.85Å; F385-Y529 WeakPolarHBondContact CD2-OH 3.38Å; F385-Y529 HydrophobicContact CE2-CD2 4.17Å; F385-Y529 HydrophobicContact CE2-CE1 4.29Å; F385-Y529 AromaticContact CE2-CE2 3.49Å; F385-Y529 HydrophobicContact CE2-CE2 3.49Å; F385-Y529 VanDerWaalsContact CE2-CE2 3.49Å; F385-Y529 AromaticContact CE2-CZ 3.59Å; I464-Y529 HydrophobicContact CG2-CD1 4.21Å; I464-Y529 HydrophobicContact CG2-CE1 3.54Å; I464-Y529 WeakPolarHBondContact O-CE1 3.38Å; I464-Y529 PolarHBondContact O-OH 3.03Å; L465-Y529 HydrophobicContact CD2-CD1 4.41Å; L465-Y529 HydrophobicContact CD2-CE1 4.31Å; L521-Y529 HydrophobicContact CD1-CD1 4.09Å; L521-Y529 HydrophobicContact CD1-CD2 4.05Å; L521-Y529 HydrophobicContact CD1-CG 3.67Å; E525-Y529 WeakPolarHBondContact O-CB 3.41Å; E525-Y529 PolarHBondContact O-N 3.24Å; L526-Y529 HydrophobicContact CD1-CD1 4.23Å; L526-Y529 PolarHBondContact O-N 2.83Å; Y529-L531 PolarHBondContact O-N 3.43Å; Y529-A532 PolarHBondContact O-N 3.2Å; Y529-A533 WeakPolarHBondContact O-CB 3.29Å; Y529-A533 PolarHBondContact O-N 3.45Å
530	I	92.9	Very high	87.9	Confident	3 Å²	3	45.9 Å²	45.9	2%	0.015	23%	0.229	C	C	.	.	H	α-helix	trans	-60.8	-44.9	177.4	-65.9	162.9	0	0	0	110.7	I439 L461 L465 L526 A533 L534 L548 F550	I439-I530 HydrophobicContact CD1-CD1 3.91Å; L461-I530 HydrophobicContact CD2-CG2 4.05Å; L465-I530 HydrophobicContact CD2-CD1 4.09Å; L465-I530 HydrophobicContact CD2-CG1 3.85Å; L526-I530 HydrophobicContact CD1-CD1 4.47Å; L526-I530 HydrophobicContact CG-CD1 4.16Å; L526-I530 WeakPolarHBondContact O-CD1 3.47Å; L526-I530 VanDerWaalsContact O-CG1 3.28Å; L526-I530 WeakPolarHBondContact O-CG1 3.03Å; L526-I530 PolarHBondContact O-N 2.82Å; I530-A533 PolarHBondContact O-N 3.04Å; I530-L534 HydrophobicContact CG2-CD1 3.74Å; I530-L534 HydrophobicContact CG2-CG 4.3Å; I530-L534 WeakPolarHBondContact O-CB 3.44Å; I530-L534 VanDerWaalsContact O-CG 3.24Å; I530-L534 WeakPolarHBondContact O-CG 3.22Å; I530-L534 PolarHBondContact O-N 3.46Å; I530-L548 HydrophobicContact CB-CD1 4.06Å; I530-L548 HydrophobicContact CD1-CD1 4.06Å; I530-L548 HydrophobicContact CG2-CD1 3.72Å; I530-F550 HydrophobicContact CD1-CZ 4.49Å
531	L	92.2	Very high	88.2	Confident	22 Å²	22	43.7 Å²	43.7	12%	0.115	22%	0.22	C	C	.	.	H	α-helix	trans	-69.9	-32.4	-178.3	-67.9	166.6	0	0	0	112.9	Y342 K527 I528 Y529 S535 I545	Y342-L531 HydrophobicContact CD1-CB 4.16Å; Y342-L531 HydrophobicContact CD2-CB 3.94Å; Y342-L531 HydrophobicContact CE1-CB 3.9Å; Y342-L531 HydrophobicContact CE1-CD1 3.95Å; Y342-L531 HydrophobicContact CE2-CB 3.7Å; Y342-L531 HydrophobicContact CG-CB 4.19Å; K527-L531 HydrophobicContact CG-CD1 3.72Å; K527-L531 WeakPolarHBondContact O-CB 3.12Å; K527-L531 WeakPolarHBondContact O-CD1 3.49Å; K527-L531 WeakPolarHBondContact O-CG 3.08Å; K527-L531 PolarHBondContact O-N 2.89Å; K527-L531 VanDerWaalsContact O-N 3.11Å; I528-L531 PolarHBondContact O-N 3.41Å; Y529-L531 PolarHBondContact O-N 3.43Å; L531-S535 PolarHBondContact O-N 3.04Å; L531-I545 HydrophobicContact CD2-CD1 4.14Å; L531-I545 HydrophobicContact CD2-CG2 4.44Å
532	A	92.3	Very high	88.3	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-70.2	-42.4	172.4	0	0	0	0	0	112.2	W343 Y381 I528 Y529 S535	W343-A532 HydrophobicContact CZ2-CB 4Å; W343-A532 PolarHBondContact NE1-O 3.26Å; Y381-A532 HydrophobicContact CD2-CB 3.79Å; Y381-A532 HydrophobicContact CE2-CB 3.51Å; Y381-A532 HydrophobicContact CG-CB 4.42Å; I528-A532 VanDerWaalsContact O-CB 3.3Å; I528-A532 WeakPolarHBondContact O-CB 3.35Å; I528-A532 PolarHBondContact O-N 3.39Å; Y529-A532 PolarHBondContact O-N 3.2Å; A532-S535 PolarHBondContact O-N 2.04Å; A532-S535 PolarHBondContact O-OG 3.11Å; A532-S535 VanDerWaalsContact O-OG 3.05Å
533	A	93.4	Very high	88.6	Confident	0 Å²	0	40.9 Å²	40.9	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-61.8	-46.2	176.2	0	0	0	0	0	111.7	F366 I464 Y529 I530 S535 T536	F366-A533 HydrophobicContact CD1-CB 4.49Å; F366-A533 HydrophobicContact CE1-CB 3.45Å; F366-A533 VanDerWaalsContact CE1-CB 3.45Å; F366-A533 HydrophobicContact CZ-CB 3.66Å; I464-A533 HydrophobicContact CD1-CB 3.9Å; I464-A533 HydrophobicContact CG1-CB 3.98Å; I464-A533 HydrophobicContact CG2-CB 3.7Å; Y529-A533 WeakPolarHBondContact O-CB 3.29Å; Y529-A533 PolarHBondContact O-N 3.45Å; I530-A533 PolarHBondContact O-N 3.04Å; A533-S535 PolarHBondContact O-N 3.04Å; A533-T536 WeakPolarHBondContact O-CB 3.47Å; A533-T536 WeakPolarHBondContact O-CG2 3.23Å; A533-T536 PolarHBondContact O-N 3.03Å; A533-T536 VanDerWaalsContact O-N 3.09Å; A533-T536 PolarHBondContact O-OG1 2.91Å
534	L	92.2	Very high	88.7	Confident	14 Å²	14	40.5 Å²	40.5	7%	0.073	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-9.7	179.4	-68.8	177.9	0	0	0	114.3	L461 I464 I530 Y539 S541 I545	L461-L534 HydrophobicContact CD2-CD1 4.28Å; L461-L534 HydrophobicContact CD2-CD2 4.41Å; I464-L534 HydrophobicContact CD1-CD2 3.76Å; I464-L534 HydrophobicContact CD1-CG 4.25Å; I530-L534 HydrophobicContact CG2-CD1 3.74Å; I530-L534 HydrophobicContact CG2-CG 4.3Å; I530-L534 WeakPolarHBondContact O-CB 3.44Å; I530-L534 VanDerWaalsContact O-CG 3.24Å; I530-L534 WeakPolarHBondContact O-CG 3.22Å; I530-L534 PolarHBondContact O-N 3.46Å; L534-Y539 VanDerWaalsContact CD2-O 3.26Å; L534-Y539 WeakPolarHBondContact CD2-O 3.46Å; L534-S541 PolarHBondContact O-N 2.9Å; L534-I545 HydrophobicContact CD1-CD1 3.43Å; L534-I545 VanDerWaalsContact CD1-CD1 3.43Å
535	S	90	Very high	88.8	Confident	6 Å²	6	36.4 Å²	36.4	4%	0.042	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97	11.4	170.7	85.3	0	0	0	0	113.5	N318 C320 W343 L531 A532 A533	N318-S535 VanDerWaalsContact O-CA 3.27Å; N318-S535 WeakPolarHBondContact O-CA 3.46Å; N318-S535 VanDerWaalsContact O-CB 3.26Å; N318-S535 WeakPolarHBondContact O-CB 3.29Å; C320-S535 PolarHBondContact N-O 3.16Å; W343-S535 VanDerWaalsContact CD1-OG 3.26Å; W343-S535 PolarHBondContact NE1-OG 2.96Å; L531-S535 PolarHBondContact O-N 3.04Å; A532-S535 PolarHBondContact O-N 2.04Å; A532-S535 PolarHBondContact O-OG 3.11Å; A532-S535 VanDerWaalsContact O-OG 3.05Å; A533-S535 PolarHBondContact O-N 3.04Å
536	T	90	Very high	88.8	Confident	5 Å²	5	36.1 Å²	36.1	3%	0.031	19%	0.187	C	C	.	.	S	Bend	trans	-86.8	165.1	168.9	67.2	0	0	0	0	111.1	W343 V363 F366 A533 Y539 K540	W343-T536 HydrophobicContact CZ2-CG2 4.03Å; V363-T536 HydrophobicContact CG1-CG2 4.48Å; V363-T536 WeakPolarHBondContact O-CG2 3.38Å; F366-T536 HydrophobicContact CB-CG2 4.44Å; F366-T536 HydrophobicContact CD1-CG2 4.02Å; F366-T536 HydrophobicContact CG-CG2 4.49Å; A533-T536 WeakPolarHBondContact O-CB 3.47Å; A533-T536 WeakPolarHBondContact O-CG2 3.23Å; A533-T536 PolarHBondContact O-N 3.03Å; A533-T536 VanDerWaalsContact O-N 3.09Å; A533-T536 PolarHBondContact O-OG1 2.91Å; T536-Y539 PolarHBondContact OG1-N 2.95Å; T536-K540 PolarHBondContact O-N 3.09Å
537	I	83.7	Confident	88.8	Confident	121 Å²	121	38.9 Å²	38.9	62%	0.621	20%	0.202	S	C	*	.	S	Bend	trans	-67.3	-42.2	174.1	-65.8	169	0	0	0	110.8	I319	I319-I537 HydrophobicContact CG2-CG1 3.55Å
538	Q	83	Confident	88.8	Confident	79 Å²	79	36.3 Å²	36.3	37%	0.369	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.5	-38.3	-172.5	-178.2	176.3	-16.7	0	0	113
539	Y	87.5	Confident	88.7	Confident	6 Å²	6	36.3 Å²	36.3	2%	0.024	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-114.4	28.4	-175.3	-57	-80.7	0	0	0	113.1	K367 F397 I463 I464 L534 T536 S541	K367-Y539 HydrophobicContact CB-CE2 3.99Å; K367-Y539 HydrophobicContact CG-CE2 4.43Å; K367-Y539 PolarHBondContact O-OH 3.16Å; F397-Y539 HydrophobicContact CE2-CE1 4.05Å; F397-Y539 HydrophobicContact CZ-CE1 4.23Å; I463-Y539 HydrophobicContact CB-CE1 4.32Å; I463-Y539 HydrophobicContact CG2-CE1 3.69Å; I464-Y539 HydrophobicContact CD1-CD1 4.29Å; I464-Y539 HydrophobicContact CD1-CG 4.22Å; I464-Y539 HydrophobicContact CG1-CD1 3.92Å; I464-Y539 HydrophobicContact CG1-CE1 4.34Å; I464-Y539 HydrophobicContact CG1-CG 4.02Å; L534-Y539 VanDerWaalsContact CD2-O 3.26Å; L534-Y539 WeakPolarHBondContact CD2-O 3.46Å; T536-Y539 PolarHBondContact OG1-N 2.95Å; Y539-S541 PolarHBondContact O-N 3.17Å
540	K	85.8	Confident	88.5	Confident	79 Å²	79	38.8 Å²	38.8	34%	0.343	20%	0.202	S	C	.	.			trans	-51.2	124.4	-176.1	-174.8	179.1	-168.2	166.8	0	111.5	D317 I319 T536 L542	D317-K540 VanDerWaalsContact CG-NZ 3.35Å; D317-K540 VanDerWaalsContact O-CE 3.22Å; D317-K540 WeakPolarHBondContact O-CE 3.03Å; D317-K540 PolarHBondContact O-NZ 2.89Å; D317-K540 IonicContact OD2-NZ 3.77Å; D317-K540 PolarHBondContact OD2-NZ 3Å; I319-K540 HydrophobicContact CD1-CD 3.71Å; I319-K540 HydrophobicContact CG1-CD 3.71Å; I319-K540 HydrophobicContact CG1-CG 4.18Å; T536-K540 PolarHBondContact O-N 3.09Å; K540-L542 PolarHBondContact O-N 3.21Å; K540-L542 VanDerWaalsContact O-N 3.16Å
541	S	82.8	Confident	88.2	Confident	27 Å²	27	39.6 Å²	39.6	19%	0.189	21%	0.207	C	C	.	.			trans	-61.6	119.8	176.9	-170.7	0	0	0	0	111.5	L534 Y539 F543	L534-S541 PolarHBondContact O-N 2.9Å; Y539-S541 PolarHBondContact O-N 3.17Å; S541-F543 PolarHBondContact O-N 3Å; S541-F543 PolarHBondContact OG-O 3.03Å
542	L	84	Confident	87.6	Confident	82 Å²	82	45 Å²	45	43%	0.429	24%	0.236	S	C	.	.	S	Bend	trans	-59.5	-24.6	174.3	-63.8	177.3	0	0	0	112.8	N453 Y457 K540	N453-L542 HydrophobicContact CB-CD1 3.84Å; Y457-L542 HydrophobicContact CD2-CB 4.42Å; K540-L542 PolarHBondContact O-N 3.21Å; K540-L542 VanDerWaalsContact O-N 3.16Å
543	F	89.3	Confident	86.9	Confident	9 Å²	9	46.6 Å²	46.6	4%	0.039	25%	0.248	C	C	.	.	S	Bend	trans	-125.7	136.4	-177.7	-51.8	-56.4	0	0	0	110.9	L443 T445 E449 F450 N453 Y457 S541 I545	L443-F543 HydrophobicContact CB-CB 4.24Å; L443-F543 HydrophobicContact CD1-CB 4.35Å; L443-F543 HydrophobicContact CD1-CD2 4.23Å; T445-F543 HydrophobicContact CG2-CB 4.15Å; T445-F543 HydrophobicContact CG2-CD1 3.69Å; T445-F543 HydrophobicContact CG2-CD2 4.15Å; T445-F543 HydrophobicContact CG2-CE1 4.11Å; T445-F543 HydrophobicContact CG2-CG 3.71Å; T445-F543 HydrophobicContact CG2-CZ 4.49Å; E449-F543 HydrophobicContact CG-CE1 3.92Å; F450-F543 HydrophobicContact CB-CE2 4.44Å; F450-F543 AromaticContact CD2-CD2 3.77Å; F450-F543 HydrophobicContact CD2-CD2 3.77Å; F450-F543 AromaticContact CD2-CE2 3.51Å; F450-F543 HydrophobicContact CD2-CE2 3.51Å; F450-F543 HydrophobicContact CD2-CZ 4.36Å; F450-F543 HydrophobicContact CE2-CD2 4.28Å; F450-F543 HydrophobicContact CE2-CE2 4.2Å; F450-F543 HydrophobicContact CG-CE2 4.38Å; N453-F543 HydrophobicContact CB-CE2 4.41Å; N453-F543 HydrophobicContact CB-CZ 3.96Å; Y457-F543 AromaticContact CD2-CD2 3.64Å; Y457-F543 HydrophobicContact CD2-CD2 3.64Å; Y457-F543 HydrophobicContact CD2-CE2 4.03Å; Y457-F543 AromaticContact CE2-CD2 3.82Å; Y457-F543 HydrophobicContact CE2-CD2 3.82Å; Y457-F543 HydrophobicContact CG-CD2 4.22Å; Y457-F543 HydrophobicContact CG-CE2 4.28Å; S541-F543 PolarHBondContact O-N 3Å; S541-F543 PolarHBondContact OG-O 3.03Å; F543-I545 PolarHBondContact O-N 3.34Å
544	S	85.4	Confident	86.3	Confident	61 Å²	61	47.3 Å²	47.3	43%	0.427	25%	0.252	S	S	.	.			trans	-66.2	119.3	175.1	-42.4	0	0	0	0	110.1	K444 I546	K444-S544 PolarHBondContact N-O 3.02Å; S544-I546 PolarHBondContact O-N 3.13Å
545	I	88.7	Confident	85.4	Confident	42 Å²	42	51.7 Å²	51.7	22%	0.215	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	122.9	174.1	-62	177.1	0	0	0	108.5	L441 L443 L531 L534 F543 N547 L548	L441-I545 HydrophobicContact CD2-CD1 4.39Å; L441-I545 HydrophobicContact CD2-CG2 4.5Å; L443-I545 HydrophobicContact CD2-CB 4.3Å; L443-I545 HydrophobicContact CD2-CG1 3.64Å; L531-I545 HydrophobicContact CD2-CD1 4.14Å; L531-I545 HydrophobicContact CD2-CG2 4.44Å; L534-I545 HydrophobicContact CD1-CD1 3.43Å; L534-I545 VanDerWaalsContact CD1-CD1 3.43Å; F543-I545 PolarHBondContact O-N 3.34Å; I545-N547 WeakPolarHBondContact CG2-O 3.34Å; I545-L548 HydrophobicContact CG2-CB 4.35Å
546	I	87.4	Confident	84.4	Confident	72 Å²	72	55.4 Å²	55.4	37%	0.369	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	-39	174.4	-62.7	164.8	0	0	0	109.7	H442 K444 Q490 S544	H442-I546 HydrophobicContact CB-CB 4.36Å; H442-I546 WeakPolarHBondContact NE2-CD1 3.37Å; H442-I546 WeakPolarHBondContact O-CB 3.05Å; H442-I546 PolarHBondContact O-N 2.71Å; K444-I546 HydrophobicContact CB-CD1 3.98Å; K444-I546 HydrophobicContact CB-CG1 4.3Å; Q490-I546 HydrophobicContact CB-CD1 4.42Å; Q490-I546 VanDerWaalsContact CD-CD1 3.41Å; Q490-I546 HydrophobicContact CG-CD1 3.57Å; S544-I546 PolarHBondContact O-N 3.13Å
547	N	88.9	Confident	83.4	Confident	59 Å²	59	55.4 Å²	55.4	32%	0.316	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.9	155.8	167.1	-169.3	27.4	0	0	0	111.8	H442 K527 I545 N549	H442-N547 HydrophobicContact CB-CB 4.48Å; H442-N547 PolarHBondContact N-O 3.41Å; H442-N547 PolarHBondContact O-N 3.13Å; K527-N547 PolarHBondContact NZ-OD1 2.86Å; I545-N547 WeakPolarHBondContact CG2-O 3.34Å; N547-N549 VanDerWaalsContact ND2-CG 3.27Å; N547-N549 PolarHBondContact ND2-ND2 2.83Å; N547-N549 PolarHBondContact ND2-OD1 3.39Å
548	L	91.4	Very high	82.7	Confident	2 Å²	2	57.1 Å²	57.1	1%	0.01	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	116.9	172	-175.8	168.4	0	0	0	107.6	I439 L441 K527 I530 I545 F550	I439-L548 HydrophobicContact CG2-CD1 4.43Å; I439-L548 HydrophobicContact CG2-CD2 3.76Å; I439-L548 HydrophobicContact CG2-CG 3.77Å; L441-L548 HydrophobicContact CD2-CB 3.85Å; L441-L548 HydrophobicContact CD2-CD1 3.95Å; L441-L548 HydrophobicContact CD2-CG 3.66Å; K527-L548 HydrophobicContact CB-CD2 4.21Å; K527-L548 HydrophobicContact CD-CD2 4.37Å; K527-L548 WeakPolarHBondContact CD-O 3.27Å; K527-L548 WeakPolarHBondContact CE-O 3.36Å; K527-L548 HydrophobicContact CG-CD2 4.09Å; K527-L548 PolarHBondContact NZ-O 2.92Å; I530-L548 HydrophobicContact CB-CD1 4.06Å; I530-L548 HydrophobicContact CD1-CD1 4.06Å; I530-L548 HydrophobicContact CG2-CD1 3.72Å; I545-L548 HydrophobicContact CG2-CB 4.35Å; L548-F550 HydrophobicContact CD2-CD2 4.32Å; L548-F550 HydrophobicContact CD2-CE2 3.7Å; L548-F550 HydrophobicContact CD2-CZ 3.96Å
549	N	89.8	Confident	82.1	Confident	73 Å²	73	55 Å²	55	39%	0.39	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	162.6	173.7	-76.6	-4.7	0	0	0	110.1	I439 L440 N547	I439-N549 CarbonylContact C-O 3.21Å; I439-N549 WeakPolarHBondContact CA-O 3.33Å; L440-N549 HydrophobicContact CB-CB 4.37Å; L440-N549 PolarHBondContact N-O 3.47Å; L440-N549 PolarHBondContact O-N 2.83Å; N547-N549 VanDerWaalsContact ND2-CG 3.27Å; N547-N549 PolarHBondContact ND2-ND2 2.83Å; N547-N549 PolarHBondContact ND2-OD1 3.39Å
550	F	88.1	Confident	80.6	Confident	53 Å²	53	60.3 Å²	60.3	23%	0.232	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	149.9	166.3	-63.4	-90.2	0	0	0	109.5	Y438 I439 P523 L526 K527 I530 L548	Y438-F550 WeakPolarHBondContact O-CA 3.4Å; I439-F550 HydrophobicContact CD1-CE1 3.78Å; I439-F550 HydrophobicContact CD1-CZ 4.4Å; I439-F550 HydrophobicContact CG1-CD1 3.92Å; I439-F550 HydrophobicContact CG1-CE1 3.64Å; P523-F550 HydrophobicContact CB-CD2 3.78Å; P523-F550 HydrophobicContact CB-CE2 4.19Å; P523-F550 HydrophobicContact CB-CG 4.17Å; P523-F550 WeakPolarHBondContact O-CE2 3.48Å; L526-F550 HydrophobicContact CB-CZ 3.98Å; L526-F550 HydrophobicContact CD2-CE1 3.67Å; L526-F550 HydrophobicContact CD2-CZ 3.76Å; L526-F550 HydrophobicContact CG-CE1 4.23Å; L526-F550 HydrophobicContact CG-CZ 3.82Å; K527-F550 HydrophobicContact CB-CE2 4.09Å; I530-F550 HydrophobicContact CD1-CZ 4.49Å; L548-F550 HydrophobicContact CD2-CD2 4.32Å; L548-F550 HydrophobicContact CD2-CE2 3.7Å; L548-F550 HydrophobicContact CD2-CZ 3.96Å
551	V	85.8	Confident	78.3	Confident	20 Å²	20	58.3 Å²	58.3	12%	0.121	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	153.8	171	-60	0	0	0	0	109.7	Y438 L494 S553 Q556	Y438-V551 WeakPolarHBondContact CB-O 3.38Å; Y438-V551 PolarHBondContact O-N 3.47Å; Y438-V551 VanDerWaalsContact O-N 3.11Å; L494-V551 HydrophobicContact CD1-CG2 3.73Å; V551-S553 WeakPolarHBondContact CG2-O 3.32Å; V551-Q556 HydrophobicContact CB-CB 4.02Å; V551-Q556 HydrophobicContact CG1-CB 4.32Å
552	D	81	Confident	76.1	Confident	134 Å²	134	60.1 Å²	60.1	72%	0.717	33%	0.328	S	S	*	.	S	Bend	trans	-80.7	-21.6	-175.6	-50.3	-48.5	0	0	0	112.6	Q556	D552-Q556 PolarHBondContact OD2-NE2 3.06Å; D552-Q556 PolarHBondContact OD2-OE1 3.39Å
553	S	77.9	Confident	73.8	Confident	35 Å²	35	64.2 Å²	64.2	25%	0.245	34%	0.338	C	S	.	.	S	Bend	trans	-158.7	163.3	-179.2	63	0	0	0	0	112.1	V551 S555 Q556	V551-S553 WeakPolarHBondContact CG2-O 3.32Å; S553-S555 PolarHBondContact O-N 2.74Å; S553-S555 PolarHBondContact OG-OG 2.03Å; S553-Q556 PolarHBondContact O-N 3.26Å
554	P	79.4	Confident	71.3	Confident	15 Å²	15	69.4 Å²	69.4	10%	0.097	36%	0.362	C	S	.	.	G	3₁₀ helix	trans	-54	-36.8	174.2	-27.5	37.2	0	0	0	113.5	Y438 L481 L494 Q556 S557	Y438-P554 HydrophobicContact CE1-CG 3.95Å; L481-P554 HydrophobicContact CD1-CB 3.86Å; L494-P554 HydrophobicContact CD2-CB 4.13Å; L494-P554 HydrophobicContact CD2-CG 4.44Å; P554-Q556 PolarHBondContact O-N 2.92Å; P554-Q556 VanDerWaalsContact O-N 3.14Å; P554-S557 VanDerWaalsContact O-CB 3.24Å; P554-S557 WeakPolarHBondContact O-CB 3.05Å; P554-S557 PolarHBondContact O-N 3.07Å; P554-S557 PolarHBondContact O-OG 3.27Å
555	S	72.9	Confident	68.9	Low	106 Å²	106	70.6 Å²	70.6	74%	0.741	37%	0.367	S	S	*	.	G	3₁₀ helix	trans	-57.9	-27.9	-179.8	73.8	0	0	0	0	114.9	S553	S553-S555 PolarHBondContact O-N 2.74Å; S553-S555 PolarHBondContact OG-OG 2.03Å
556	Q	70	Confident	66.1	Low	83 Å²	83	78.1 Å²	78.1	39%	0.388	40%	0.401	S	S	.	.	G	3₁₀ helix	trans	-84.9	-7.4	-179.4	-69	179.1	-4.6	0	0	113.5	V551 D552 S553 P554 H558	V551-Q556 HydrophobicContact CB-CB 4.02Å; V551-Q556 HydrophobicContact CG1-CB 4.32Å; D552-Q556 PolarHBondContact OD2-NE2 3.06Å; D552-Q556 PolarHBondContact OD2-OE1 3.39Å; S553-Q556 PolarHBondContact O-N 3.26Å; P554-Q556 PolarHBondContact O-N 2.92Å; P554-Q556 VanDerWaalsContact O-N 3.14Å; Q556-H558 VanDerWaalsContact C-N 3.3Å; Q556-H558 PolarHBondContact O-N 3.3Å
557	S	69	Low	63.2	Low	5 Å²	5	79.2 Å²	79.2	4%	0.035	42%	0.415	C	S	.	.	S	Bend	trans	-75.4	-10.8	-168.4	66.3	0	0	0	0	115.6	P554 F559	P554-S557 VanDerWaalsContact O-CB 3.24Å; P554-S557 WeakPolarHBondContact O-CB 3.05Å; P554-S557 PolarHBondContact O-N 3.07Å; P554-S557 PolarHBondContact O-OG 3.27Å; S557-F559 PolarHBondContact O-N 3.45Å; S557-F559 VanDerWaalsContact OG-CD2 3.3Å; S557-F559 WeakPolarHBondContact OG-CD2 3.39Å
558	H	69.4	Low	60.5	Low	158 Å²	158	81.3 Å²	81.3	73%	0.731	44%	0.435	S	S	*	.			trans	52.3	35.5	-172.8	-59	-62.7	0	0	0	114.1	K492 Q556	K492-H558 PolarHBondContact NZ-O 3.45Å; Q556-H558 VanDerWaalsContact C-N 3.3Å; Q556-H558 PolarHBondContact O-N 3.3Å
559	F	70.5	Confident	57.6	Low	34 Å²	34	88.6 Å²	88.6	15%	0.149	47%	0.474	C	S	.	.	P	Polyproline II helix	trans	-71	142.7	153.8	-81.1	-104.7	0	0	0	108.8	L440 L481 L482 E483 K492 L494 S557	L440-F559 HydrophobicContact CD1-CE2 3.77Å; L481-F559 HydrophobicContact CB-CD1 4.22Å; L481-F559 HydrophobicContact CB-CE1 4.16Å; L481-F559 HydrophobicContact CB-CE2 4.48Å; L481-F559 HydrophobicContact CB-CG 4.43Å; L481-F559 HydrophobicContact CB-CZ 4.27Å; L481-F559 HydrophobicContact CD2-CB 4.12Å; L481-F559 HydrophobicContact CD2-CD1 4.2Å; L481-F559 HydrophobicContact CD2-CG 4.13Å; L481-F559 WeakPolarHBondContact O-CE1 3.06Å; L481-F559 WeakPolarHBondContact O-CZ 3.38Å; L482-F559 VanDerWaalsContact N-CE1 3.31Å; E483-F559 HydrophobicContact CB-CD1 3.92Å; E483-F559 HydrophobicContact CB-CE1 3.62Å; K492-F559 HydrophobicContact CB-CE1 4.23Å; K492-F559 HydrophobicContact CB-CE2 4.02Å; K492-F559 HydrophobicContact CB-CZ 3.58Å; K492-F559 HydrophobicContact CD-CE2 4.38Å; L494-F559 HydrophobicContact CB-CE2 3.99Å; L494-F559 HydrophobicContact CB-CZ 4.45Å; S557-F559 PolarHBondContact O-N 3.45Å; S557-F559 VanDerWaalsContact OG-CD2 3.3Å; S557-F559 WeakPolarHBondContact OG-CD2 3.39Å
560	K	54.2	Low	54.7	Low	117 Å²	117	92.4 Å²	92.4	51%	0.509	49%	0.494	S	S	.	.	P	Polyproline II helix	trans	-73.6	137.3	168.9	-69.5	-173.6	169.6	-165	0	109.1	V565	K560-V565 HydrophobicContact CD-CG2 4.47Å
561	A	39.2	Very low	52.1	Low	37 Å²	37	94.8 Å²	94.8	31%	0.306	51%	0.513	S	S	.	.	P	Polyproline II helix	trans	-58.5	141.9	162.3	0	0	0	0	0	108.6	W563 E564	A561-W563 HydrophobicContact CB-CB 4.4Å; A561-W563 HydrophobicContact CB-CG 4.18Å; A561-W563 PolarHBondContact O-N 3.26Å; A561-E564 PolarHBondContact O-N 3.05Å; A561-E564 VanDerWaalsContact O-N 3.08Å
562	P	36	Very low	49.6	Very low	66 Å²	66	106 Å²	106	43%	0.429	55%	0.553	S	S	.	*	G	3₁₀ helix	trans	-54.1	-11.2	175.8	-28.9	35.8	0	0	0	115.2	T477 E479	T477-P562 HydrophobicContact CG2-CG 4.11Å; E479-P562 VanDerWaalsContact OE2-CG 3.24Å; E479-P562 WeakPolarHBondContact OE2-CG 3.47Å
563	W	34.6	Very low	47.6	Very low	168 Å²	168	104.4 Å²	104.4	64%	0.636	54%	0.544	S	S	*	.	G	3₁₀ helix	trans	-84.2	-15.1	-174.4	-40.5	26.2	0	0	0	111.6	I476 A561	I476-W563 HydrophobicContact CD1-CZ2 4.3Å; I476-W563 HydrophobicContact CG2-CZ2 4.14Å; A561-W563 HydrophobicContact CB-CB 4.4Å; A561-W563 HydrophobicContact CB-CG 4.18Å; A561-W563 PolarHBondContact O-N 3.26Å
564	E	38.7	Very low	45.8	Very low	117 Å²	117	105 Å²	105	55%	0.547	55%	0.547	S	S	.	.	G	3₁₀ helix	trans	-94.8	11.9	-174.6	-65.1	-162.7	140	0	0	115.3	A561	A561-E564 PolarHBondContact O-N 3.05Å; A561-E564 VanDerWaalsContact O-N 3.08Å
565	V	34.3	Very low	44.3	Very low	86 Å²	86	113.4 Å²	113.4	52%	0.521	58%	0.582	S	S	.	*	S	Bend	trans	-112.1	-24.9	-169.5	-173.8	0	0	0	0	114.4	K560 S567	K560-V565 HydrophobicContact CD-CG2 4.47Å; V565-S567 PolarHBondContact O-N 3.07Å
566	E	29	Very low	43.5	Very low	201 Å²	201	115.7 Å²	115.7	94%	0.939	58%	0.582	S	S	*	*	S	Bend	trans	-94.3	40	175.1	-65.8	-153.4	141.3	0	0	114.4
567	S	27.3	Very low	43.1	Very low	94 Å²	94	113.3 Å²	113.3	66%	0.657	58%	0.576	S	S	*	*			trans	-146.8	44.5	170.4	56	0	0	0	0	113.3	V565	V565-S567 PolarHBondContact O-N 3.07Å
568	S	32.7	Very low	43.1	Very low	104 Å²	104	117.8 Å²	117.8	73%	0.727	60%	0.598	S	S	*	*			trans	-119.3	31.5	179.9	61.8	0	0	0	0	116.1
569	N	30.4	Very low	43.3	Very low	155 Å²	155	112.1 Å²	112.1	83%	0.829	58%	0.583	S	S	*	*	S	Bend	trans	-96.4	126	139.8	-89.5	-8.5	0	0	0	107.2
570	D	29.2	Very low	43.5	Very low	152 Å²	152	115.8 Å²	115.8	81%	0.813	60%	0.603	S	S	*	*	S	Bend	trans	35.1	100.2	168.5	-64	-38.7	0	0	0	117.1
571	T	33	Very low	44.5	Very low	103 Å²	103	116.8 Å²	116.8	63%	0.632	61%	0.605	S	S	*	*			cis	-160.8	149	48.2	39.3	0	0	0	0	113.1	I573	T571-I573 PolarHBondContact O-N 2.92Å; T571-I573 WeakPolarHBondContact OG1-CD1 3.41Å; T571-I573 WeakPolarHBondContact OG1-CG1 3.36Å
572	R	32.4	Very low	46.5	Very low	256 Å²	256	118.6 Å²	118.6	97%	0.966	61%	0.612	S	S	*	*			trans	-78.2	60.3	175.7	-164.6	-178.3	-175.2	-172.3	1	111.5	S574	R572-S574 PolarHBondContact O-N 3.01Å; R572-S574 VanDerWaalsContact O-N 3.12Å
573	I	39.3	Very low	48.6	Very low	101 Å²	101	118.8 Å²	118.8	52%	0.518	61%	0.614	S	S	.	*			trans	-64.5	108	174.2	-68.2	175.4	0	0	0	107.8	T571 A577 I578	T571-I573 PolarHBondContact O-N 2.92Å; T571-I573 WeakPolarHBondContact OG1-CD1 3.41Å; T571-I573 WeakPolarHBondContact OG1-CG1 3.36Å; I573-A577 HydrophobicContact CB-CB 4.27Å; I573-A577 HydrophobicContact CG2-CB 3.55Å; I573-I578 HydrophobicContact CG2-CG1 3.83Å
574	S	40.7	Very low	50.9	Low	46 Å²	46	115.3 Å²	115.3	32%	0.322	61%	0.607	S	S	.	*			trans	-67.4	167.6	175.4	72.7	0	0	0	0	111.1	R572 E576 A577 I578	R572-S574 PolarHBondContact O-N 3.01Å; R572-S574 VanDerWaalsContact O-N 3.12Å; S574-E576 WeakPolarHBondContact CB-OE2 3.13Å; S574-E576 PolarHBondContact O-N 3.03Å; S574-E576 VanDerWaalsContact O-N 3.14Å; S574-E576 WeakPolarHBondContact OG-CB 3.11Å; S574-E576 PolarHBondContact OG-N 2.86Å; S574-E576 PolarHBondContact OG-OE2 2.97Å; S574-A577 WeakPolarHBondContact O-CA 3.27Å; S574-A577 WeakPolarHBondContact O-CB 3.48Å; S574-A577 PolarHBondContact O-N 3.11Å; S574-A577 PolarHBondContact OG-N 2.89Å; S574-I578 PolarHBondContact O-N 3.05Å
575	K	48.4	Very low	52.9	Low	192 Å²	192	112.5 Å²	112.5	84%	0.835	60%	0.6	S	S	*	*	H	α-helix	trans	-58.3	-26.3	171.6	-69.2	-172.2	176.7	-175.7	0	112.1	G579	K575-G579 PolarHBondContact O-N 3.32Å; K575-G579 VanDerWaalsContact O-N 3.07Å
576	E	54.7	Low	55.4	Low	155 Å²	155	113 Å²	113	72%	0.724	60%	0.598	S	S	*	*	H	α-helix	trans	-70.6	-37.4	173.1	-48.8	139.7	129.6	0	0	111.4	S574 G579 L580	S574-E576 WeakPolarHBondContact CB-OE2 3.13Å; S574-E576 PolarHBondContact O-N 3.03Å; S574-E576 VanDerWaalsContact O-N 3.14Å; S574-E576 WeakPolarHBondContact OG-CB 3.11Å; S574-E576 PolarHBondContact OG-N 2.86Å; S574-E576 PolarHBondContact OG-OE2 2.97Å; E576-G579 CarbonylContact O-C 3.6Å; E576-G579 WeakPolarHBondContact O-CA 3.15Å; E576-G579 PolarHBondContact O-N 2.88Å; E576-L580 WeakPolarHBondContact O-CB 3.31Å; E576-L580 PolarHBondContact O-N 2.95Å
577	A	61.1	Low	58.1	Low	32 Å²	32	108.1 Å²	108.1	26%	0.264	58%	0.578	S	S	.	*	H	α-helix	trans	-73.2	-29.3	176.9	0	0	0	0	0	112.8	I573 S574 L580 Y581	I573-A577 HydrophobicContact CB-CB 4.27Å; I573-A577 HydrophobicContact CG2-CB 3.55Å; S574-A577 WeakPolarHBondContact O-CA 3.27Å; S574-A577 WeakPolarHBondContact O-CB 3.48Å; S574-A577 PolarHBondContact O-N 3.11Å; S574-A577 PolarHBondContact OG-N 2.89Å; A577-L580 PolarHBondContact O-N 3.32Å; A577-Y581 WeakPolarHBondContact O-CB 3.39Å; A577-Y581 PolarHBondContact O-N 3.12Å
578	I	70.3	Confident	60.8	Low	99 Å²	99	105.7 Å²	105.7	51%	0.508	56%	0.564	S	S	.	*	H	α-helix	trans	-63.2	-45.9	164	-62.4	172.7	0	0	0	109.8	I573 S574 L580 Y581 V582	I573-I578 HydrophobicContact CG2-CG1 3.83Å; S574-I578 PolarHBondContact O-N 3.05Å; I578-L580 VanDerWaalsContact C-N 3.3Å; I578-L580 PolarHBondContact O-N 3.01Å; I578-Y581 PolarHBondContact O-N 2.69Å; I578-V582 WeakPolarHBondContact O-CG2 3.5Å; I578-V582 PolarHBondContact O-N 3.29Å
579	G	72.7	Confident	63.3	Low	40 Å²	40	102.1 Å²	102.1	41%	0.412	54%	0.543	S	S	.	.	H	α-helix	trans	-57.3	-41.5	173.4	0	0	0	0	0	112.8	K575 E576 V582 C583	K575-G579 PolarHBondContact O-N 3.32Å; K575-G579 VanDerWaalsContact O-N 3.07Å; E576-G579 CarbonylContact O-C 3.6Å; E576-G579 WeakPolarHBondContact O-CA 3.15Å; E576-G579 PolarHBondContact O-N 2.88Å; G579-V582 PolarHBondContact O-N 2.88Å; G579-C583 WeakPolarHBondContact O-CB 3.49Å; G579-C583 PolarHBondContact O-N 2.89Å
580	L	76.2	Confident	66	Low	110 Å²	110	98.7 Å²	98.7	58%	0.576	52%	0.524	S	S	*	.	H	α-helix	trans	-64.5	-43.3	175.9	-161.9	78.5	0	0	0	111.4	E576 A577 I578 C583 I584	E576-L580 WeakPolarHBondContact O-CB 3.31Å; E576-L580 PolarHBondContact O-N 2.95Å; A577-L580 PolarHBondContact O-N 3.32Å; I578-L580 VanDerWaalsContact C-N 3.3Å; I578-L580 PolarHBondContact O-N 3.01Å; L580-C583 WeakPolarHBondContact O-CB 3.38Å; L580-C583 PolarHBondContact O-N 3.32Å; L580-I584 HydrophobicContact CD2-CD1 4.38Å; L580-I584 HydrophobicContact CG-CD1 4.13Å; L580-I584 VanDerWaalsContact O-CG1 3.26Å; L580-I584 WeakPolarHBondContact O-CG1 3.19Å; L580-I584 PolarHBondContact O-N 2.99Å
581	Y	73.5	Confident	68.7	Low	139 Å²	139	95.9 Å²	95.9	55%	0.545	51%	0.508	S	S	.	.	H	α-helix	trans	-61.9	-45.8	175.9	-175.3	-100.6	0	0	0	111.7	A577 I578 C583 I584 C585	A577-Y581 WeakPolarHBondContact O-CB 3.39Å; A577-Y581 PolarHBondContact O-N 3.12Å; I578-Y581 PolarHBondContact O-N 2.69Å; Y581-C583 VanDerWaalsContact C-N 3.3Å; Y581-C583 PolarHBondContact O-N 2.95Å; Y581-I584 PolarHBondContact O-N 3.25Å; Y581-I584 VanDerWaalsContact O-N 3.17Å; Y581-C585 VanDerWaalsContact CE1-SG 3.58Å; Y581-C585 PolarHBondContact O-N 3.13Å; Y581-C585 PolarHBondContact O-SG 3.42Å; Y581-C585 VanDerWaalsContact O-SG 3.37Å
582	V	81.1	Confident	71	Confident	75 Å²	75	94.7 Å²	94.7	46%	0.455	50%	0.497	S	S	.	.	H	α-helix	trans	-59.4	-42	173.6	172.6	0	0	0	0	111	I578 G579 C585 I586	I578-V582 WeakPolarHBondContact O-CG2 3.5Å; I578-V582 PolarHBondContact O-N 3.29Å; G579-V582 PolarHBondContact O-N 2.88Å; V582-C585 PolarHBondContact O-N 3.39Å; V582-I586 HydrophobicContact CG1-CD1 3.82Å; V582-I586 VanDerWaalsContact O-CG1 3.29Å; V582-I586 WeakPolarHBondContact O-CG1 3.34Å; V582-I586 PolarHBondContact O-N 3Å
583	C	80.5	Confident	73.5	Confident	70 Å²	70	87.8 Å²	87.8	47%	0.473	48%	0.478	S	S	.	.	H	α-helix	trans	-61.7	-43.6	175	-131.1	0	0	0	0	112.1	G579 L580 Y581 I586 L587	G579-C583 WeakPolarHBondContact O-CB 3.49Å; G579-C583 PolarHBondContact O-N 2.89Å; L580-C583 WeakPolarHBondContact O-CB 3.38Å; L580-C583 PolarHBondContact O-N 3.32Å; Y581-C583 VanDerWaalsContact C-N 3.3Å; Y581-C583 PolarHBondContact O-N 2.95Å; C583-I586 PolarHBondContact O-N 3.39Å; C583-L587 WeakPolarHBondContact O-CB 3.28Å; C583-L587 VanDerWaalsContact O-CG 3.28Å; C583-L587 WeakPolarHBondContact O-CG 3.23Å; C583-L587 PolarHBondContact O-N 3.13Å
584	I	83.3	Confident	75.7	Confident	94 Å²	94	87.7 Å²	87.7	48%	0.482	48%	0.478	S	S	.	.	H	α-helix	trans	-64.1	-42.5	176.5	-70.1	162.4	0	0	0	110.9	L580 Y581 L587 A588	L580-I584 HydrophobicContact CD2-CD1 4.38Å; L580-I584 HydrophobicContact CG-CD1 4.13Å; L580-I584 VanDerWaalsContact O-CG1 3.26Å; L580-I584 WeakPolarHBondContact O-CG1 3.19Å; L580-I584 PolarHBondContact O-N 2.99Å; Y581-I584 PolarHBondContact O-N 3.25Å; Y581-I584 VanDerWaalsContact O-N 3.17Å; I584-L587 PolarHBondContact O-N 3.18Å; I584-A588 VanDerWaalsContact O-CB 3.26Å; I584-A588 WeakPolarHBondContact O-CB 3Å; I584-A588 PolarHBondContact O-N 2.99Å
585	C	80.4	Confident	77.7	Confident	58 Å²	58	90 Å²	90	39%	0.392	49%	0.486	S	S	.	.	H	α-helix	trans	-64	-40.6	175.3	-70	0	0	0	0	112.4	Y581 V582 G589	Y581-C585 VanDerWaalsContact CE1-SG 3.58Å; Y581-C585 PolarHBondContact O-N 3.13Å; Y581-C585 PolarHBondContact O-SG 3.42Å; Y581-C585 VanDerWaalsContact O-SG 3.37Å; V582-C585 PolarHBondContact O-N 3.39Å; C585-G589 PolarHBondContact O-N 2.95Å
586	I	86	Confident	79.2	Confident	97 Å²	97	85.1 Å²	85.1	50%	0.497	47%	0.469	S	S	.	.	H	α-helix	trans	-65.2	-45.9	175	-70.2	166.9	0	0	0	110.5	V582 C583 G589 I590	V582-I586 HydrophobicContact CG1-CD1 3.82Å; V582-I586 VanDerWaalsContact O-CG1 3.29Å; V582-I586 WeakPolarHBondContact O-CG1 3.34Å; V582-I586 PolarHBondContact O-N 3Å; C583-I586 PolarHBondContact O-N 3.39Å; I586-G589 PolarHBondContact O-N 3.46Å; I586-I590 HydrophobicContact CG2-CD1 3.81Å; I586-I590 VanDerWaalsContact O-CG1 3.31Å; I586-I590 WeakPolarHBondContact O-CG1 3.36Å; I586-I590 PolarHBondContact O-N 3.12Å
587	L	86.4	Confident	80.4	Confident	98 Å²	98	83.9 Å²	83.9	51%	0.513	46%	0.461	S	S	.	.	H	α-helix	trans	-62.6	-42.5	176.6	-73.5	168.7	0	0	0	112	C583 I584 I590 I591	C583-L587 WeakPolarHBondContact O-CB 3.28Å; C583-L587 VanDerWaalsContact O-CG 3.28Å; C583-L587 WeakPolarHBondContact O-CG 3.23Å; C583-L587 PolarHBondContact O-N 3.13Å; I584-L587 PolarHBondContact O-N 3.18Å; L587-I590 PolarHBondContact O-N 3.11Å; L587-I591 WeakPolarHBondContact O-CB 3.47Å; L587-I591 WeakPolarHBondContact O-CD1 3.44Å; L587-I591 VanDerWaalsContact O-CG1 3.26Å; L587-I591 WeakPolarHBondContact O-CG1 3.05Å; L587-I591 PolarHBondContact O-N 3.1Å
588	A	84.4	Confident	81.2	Confident	43 Å²	43	88 Å²	88	36%	0.355	48%	0.478	S	S	.	.	H	α-helix	trans	-62.9	-41.7	174.3	0	0	0	0	0	111.7	I584 I591 I592	I584-A588 VanDerWaalsContact O-CB 3.26Å; I584-A588 WeakPolarHBondContact O-CB 3Å; I584-A588 PolarHBondContact O-N 2.99Å; A588-I591 PolarHBondContact O-N 3.42Å; A588-I592 WeakPolarHBondContact O-CB 3.33Å; A588-I592 VanDerWaalsContact O-CG1 3.27Å; A588-I592 WeakPolarHBondContact O-CG1 3.02Å; A588-I592 PolarHBondContact O-N 2.95Å
589	G	86	Confident	81.4	Confident	29 Å²	29	87.6 Å²	87.6	30%	0.299	48%	0.48	S	S	.	.	H	α-helix	trans	-60.4	-44.9	173	0	0	0	0	0	112.6	C585 I586 I592 I593	C585-G589 PolarHBondContact O-N 2.95Å; I586-G589 PolarHBondContact O-N 3.46Å; G589-I592 PolarHBondContact O-N 3.47Å; G589-I593 WeakPolarHBondContact O-CB 3.05Å; G589-I593 VanDerWaalsContact O-CG1 3.26Å; G589-I593 WeakPolarHBondContact O-CG1 3.26Å; G589-I593 PolarHBondContact O-N 2.86Å
590	I	87.1	Confident	81.1	Confident	84 Å²	84	93.3 Å²	93.3	43%	0.431	49%	0.494	S	S	.	.	H	α-helix	trans	-63.7	-42.4	175.5	-68.8	165.4	0	0	0	110.9	I586 L587 I593 L594	I586-I590 HydrophobicContact CG2-CD1 3.81Å; I586-I590 VanDerWaalsContact O-CG1 3.31Å; I586-I590 WeakPolarHBondContact O-CG1 3.36Å; I586-I590 PolarHBondContact O-N 3.12Å; L587-I590 PolarHBondContact O-N 3.11Å; I590-I593 PolarHBondContact O-N 2.96Å; I590-L594 HydrophobicContact CG2-CD1 3.94Å; I590-L594 HydrophobicContact CG2-CG 4.4Å; I590-L594 WeakPolarHBondContact O-CB 3.39Å; I590-L594 VanDerWaalsContact O-CG 3.31Å; I590-L594 WeakPolarHBondContact O-CG 3.47Å; I590-L594 PolarHBondContact O-N 2.94Å
591	I	85.5	Confident	80.5	Confident	93 Å²	93	94 Å²	94	48%	0.477	49%	0.494	S	S	.	.	H	α-helix	trans	-63.7	-42.5	176.1	-72.5	161.6	0	0	0	111.1	L587 A588 L594 I595	L587-I591 WeakPolarHBondContact O-CB 3.47Å; L587-I591 WeakPolarHBondContact O-CD1 3.44Å; L587-I591 VanDerWaalsContact O-CG1 3.26Å; L587-I591 WeakPolarHBondContact O-CG1 3.05Å; L587-I591 PolarHBondContact O-N 3.1Å; A588-I591 PolarHBondContact O-N 3.42Å; I591-L594 PolarHBondContact O-N 3.37Å; I591-I595 HydrophobicContact CG2-CD1 3.74Å; I591-I595 HydrophobicContact CG2-CG1 4.43Å; I591-I595 WeakPolarHBondContact O-CB 3.47Å; I591-I595 VanDerWaalsContact O-CG1 3.26Å; I591-I595 WeakPolarHBondContact O-CG1 3.49Å; I591-I595 PolarHBondContact O-N 3.28Å
592	I	81.7	Confident	79.7	Confident	77 Å²	77	97.5 Å²	97.5	40%	0.395	51%	0.508	S	S	.	.	H	α-helix	trans	-63.4	-43.3	174.8	-71.2	165.1	0	0	0	110.6	F13 A588 G589 L594 I595 L596	F13-I592 HydrophobicContact CZ-CD1 4.48Å; A588-I592 WeakPolarHBondContact O-CB 3.33Å; A588-I592 VanDerWaalsContact O-CG1 3.27Å; A588-I592 WeakPolarHBondContact O-CG1 3.02Å; A588-I592 PolarHBondContact O-N 2.95Å; G589-I592 PolarHBondContact O-N 3.47Å; I592-L594 PolarHBondContact O-N 2.92Å; I592-I595 PolarHBondContact O-N 3.46Å; I592-L596 HydrophobicContact CG2-CD1 3.92Å; I592-L596 HydrophobicContact CG2-CG 4.41Å; I592-L596 WeakPolarHBondContact O-CB 3.25Å; I592-L596 VanDerWaalsContact O-CG 3.28Å; I592-L596 WeakPolarHBondContact O-CG 3.47Å; I592-L596 PolarHBondContact O-N 3.22Å
593	I	84.4	Confident	78.1	Confident	111 Å²	111	97.8 Å²	97.8	57%	0.569	51%	0.507	S	S	*	.	H	α-helix	trans	-62.2	-42.6	175.3	-71	165	0	0	0	110.8	G589 I590 L596 F597	G589-I593 WeakPolarHBondContact O-CB 3.05Å; G589-I593 VanDerWaalsContact O-CG1 3.26Å; G589-I593 WeakPolarHBondContact O-CG1 3.26Å; G589-I593 PolarHBondContact O-N 2.86Å; I590-I593 PolarHBondContact O-N 2.96Å; I593-L596 PolarHBondContact O-N 2.78Å; I593-F597 VanDerWaalsContact O-CB 3.3Å; I593-F597 WeakPolarHBondContact O-CB 3.28Å; I593-F597 PolarHBondContact O-N 2.89Å
594	L	84.4	Confident	76.5	Confident	99 Å²	99	101 Å²	101	52%	0.518	52%	0.519	S	S	.	.	H	α-helix	trans	-66	-41.2	176.5	-74.4	169.5	0	0	0	112.3	I590 I591 I592 F597 L598	I590-L594 HydrophobicContact CG2-CD1 3.94Å; I590-L594 HydrophobicContact CG2-CG 4.4Å; I590-L594 WeakPolarHBondContact O-CB 3.39Å; I590-L594 VanDerWaalsContact O-CG 3.31Å; I590-L594 WeakPolarHBondContact O-CG 3.47Å; I590-L594 PolarHBondContact O-N 2.94Å; I591-L594 PolarHBondContact O-N 3.37Å; I592-L594 PolarHBondContact O-N 2.92Å; L594-F597 PolarHBondContact O-N 2.77Å; L594-L598 WeakPolarHBondContact O-CB 3.44Å; L594-L598 VanDerWaalsContact O-CG 3.27Å; L594-L598 WeakPolarHBondContact O-CG 3.17Å; L594-L598 PolarHBondContact O-N 3.39Å
595	I	82.6	Confident	74.9	Confident	94 Å²	94	102.4 Å²	102.4	48%	0.482	53%	0.528	S	S	.	.	H	α-helix	trans	-63.5	-45.6	174.6	-70.8	166.6	0	0	0	110.2	I591 I592 F597 L598 V599	I591-I595 HydrophobicContact CG2-CD1 3.74Å; I591-I595 HydrophobicContact CG2-CG1 4.43Å; I591-I595 WeakPolarHBondContact O-CB 3.47Å; I591-I595 VanDerWaalsContact O-CG1 3.26Å; I591-I595 WeakPolarHBondContact O-CG1 3.49Å; I591-I595 PolarHBondContact O-N 3.28Å; I592-I595 PolarHBondContact O-N 3.46Å; I595-F597 VanDerWaalsContact C-N 3.33Å; I595-F597 PolarHBondContact O-N 2.99Å; I595-L598 PolarHBondContact O-N 2.81Å; I595-V599 WeakPolarHBondContact O-CB 3.37Å; I595-V599 VanDerWaalsContact O-CG2 3.31Å; I595-V599 WeakPolarHBondContact O-CG2 3.31Å; I595-V599 PolarHBondContact O-N 3.18Å
596	L	80	Confident	72.9	Confident	91 Å²	91	110.9 Å²	110.9	48%	0.476	55%	0.552	S	S	.	*	H	α-helix	trans	-61.4	-41	174.5	-72.9	170.8	0	0	0	111.5	I592 I593 V599 F600	I592-L596 HydrophobicContact CG2-CD1 3.92Å; I592-L596 HydrophobicContact CG2-CG 4.41Å; I592-L596 WeakPolarHBondContact O-CB 3.25Å; I592-L596 VanDerWaalsContact O-CG 3.28Å; I592-L596 WeakPolarHBondContact O-CG 3.47Å; I592-L596 PolarHBondContact O-N 3.22Å; I593-L596 PolarHBondContact O-N 2.78Å; L596-V599 PolarHBondContact O-N 3.06Å; L596-F600 WeakPolarHBondContact O-CB 3.43Å; L596-F600 WeakPolarHBondContact O-CD2 3.31Å; L596-F600 PolarHBondContact O-N 3.05Å
597	F	79.8	Confident	70.6	Confident	128 Å²	128	117.3 Å²	117.3	56%	0.561	57%	0.57	S	S	*	*	H	α-helix	trans	-66.5	-39.5	177.6	-153	-90.9	0	0	0	111.7	I593 L594 I595 F600 Q601	I593-F597 VanDerWaalsContact O-CB 3.3Å; I593-F597 WeakPolarHBondContact O-CB 3.28Å; I593-F597 PolarHBondContact O-N 2.89Å; L594-F597 PolarHBondContact O-N 2.77Å; I595-F597 VanDerWaalsContact C-N 3.33Å; I595-F597 PolarHBondContact O-N 2.99Å; F597-F600 PolarHBondContact O-N 3Å; F597-Q601 HydrophobicContact CD1-CG 3.94Å; F597-Q601 HydrophobicContact CE1-CG 4.08Å; F597-Q601 WeakPolarHBondContact O-CB 3.28Å; F597-Q601 WeakPolarHBondContact O-CG 3.31Å; F597-Q601 PolarHBondContact O-N 2.96Å
598	L	79.3	Confident	68	Low	120 Å²	120	122.5 Å²	122.5	63%	0.628	59%	0.588	S	S	*	*	H	α-helix	trans	-65.2	-41.2	173.2	-72.8	168	0	0	0	111.8	L594 I595 Q601 Y602	L594-L598 WeakPolarHBondContact O-CB 3.44Å; L594-L598 VanDerWaalsContact O-CG 3.27Å; L594-L598 WeakPolarHBondContact O-CG 3.17Å; L594-L598 PolarHBondContact O-N 3.39Å; I595-L598 PolarHBondContact O-N 2.81Å; L598-Q601 PolarHBondContact O-N 3.01Å; L598-Y602 WeakPolarHBondContact O-CB 3.32Å; L598-Y602 PolarHBondContact O-N 2.84Å
599	V	74.4	Confident	65.8	Low	90 Å²	90	125.7 Å²	125.7	55%	0.545	61%	0.605	S	S	.	*	H	α-helix	trans	-63.9	-43.1	174.3	169.2	0	0	0	0	111.3	I595 L596 Y602 D603	I595-V599 WeakPolarHBondContact O-CB 3.37Å; I595-V599 VanDerWaalsContact O-CG2 3.31Å; I595-V599 WeakPolarHBondContact O-CG2 3.31Å; I595-V599 PolarHBondContact O-N 3.18Å; L596-V599 PolarHBondContact O-N 3.06Å; V599-Y602 PolarHBondContact O-N 3.43Å; V599-Y602 VanDerWaalsContact O-N 3.15Å; V599-D603 PolarHBondContact O-N 3.36Å
600	F	65.5	Low	63.1	Low	159 Å²	159	132.1 Å²	132.1	70%	0.697	63%	0.632	S	S	*	*	H	α-helix	trans	-70.2	-27	175.9	-92.9	-75.6	0	0	0	113.9	L596 F597 Y602	L596-F600 WeakPolarHBondContact O-CB 3.43Å; L596-F600 WeakPolarHBondContact O-CD2 3.31Å; L596-F600 PolarHBondContact O-N 3.05Å; F597-F600 PolarHBondContact O-N 3Å; F600-Y602 VanDerWaalsContact C-N 3.34Å
601	Q	64.9	Low	60.6	Low	124 Å²	124	136.9 Å²	136.9	58%	0.579	65%	0.649	S	S	*	*	H	α-helix	trans	-72.1	-28.9	169.3	-73.2	-78.2	-28.1	0	0	111.8	F597 L598	F597-Q601 HydrophobicContact CD1-CG 3.94Å; F597-Q601 HydrophobicContact CE1-CG 4.08Å; F597-Q601 WeakPolarHBondContact O-CB 3.28Å; F597-Q601 WeakPolarHBondContact O-CG 3.31Å; F597-Q601 PolarHBondContact O-N 2.96Å; L598-Q601 PolarHBondContact O-N 3.01Å
602	Y	56.8	Low	57.8	Low	214 Å²	214	143.9 Å²	143.9	84%	0.839	67%	0.67	S	S	*	*	H	α-helix	trans	-85	-23.9	-173.4	-151.4	-91.9	0	0	0	114.8	L598 V599 F600	L598-Y602 WeakPolarHBondContact O-CB 3.32Å; L598-Y602 PolarHBondContact O-N 2.84Å; V599-Y602 PolarHBondContact O-N 3.43Å; V599-Y602 VanDerWaalsContact O-N 3.15Å; F600-Y602 VanDerWaalsContact C-N 3.34Å
603	D	46	Very low	55.4	Low	80 Å²	80	147.2 Å²	147.2	43%	0.428	69%	0.694	S	S	.	*			trans	-131.9	104.4	173.7	-165.5	-0.6	0	0	0	113.7	V599 N605	V599-D603 PolarHBondContact O-N 3.36Å; D603-N605 VanDerWaalsContact C-N 3.32Å; D603-N605 PolarHBondContact O-N 3.13Å; D603-N605 WeakPolarHBondContact OD1-CB 3.18Å; D603-N605 PolarHBondContact OD1-N 2.79Å; D603-N605 PolarHBondContact OD1-ND2 2.04Å
604	N	47.1	Very low	52.7	Low	138 Å²	138	150.2 Å²	150.2	74%	0.738	70%	0.703	S	S	*	*			trans	-81.9	5.1	-176	-88.5	-84.6	0	0	0	114.6
605	N	50.7	Low	50.2	Low	124 Å²	124	150.9 Å²	150.9	66%	0.663	71%	0.711	S	S	*	*			trans	-102.7	1.8	-155	-69.7	-60.9	0	0	0	119.3	D603 R607	D603-N605 VanDerWaalsContact C-N 3.32Å; D603-N605 PolarHBondContact O-N 3.13Å; D603-N605 WeakPolarHBondContact OD1-CB 3.18Å; D603-N605 PolarHBondContact OD1-N 2.79Å; D603-N605 PolarHBondContact OD1-ND2 2.04Å; N605-R607 PolarHBondContact O-N 3.03Å
606	W	37.5	Very low	47.7	Very low	235 Å²	235	156.2 Å²	156.2	89%	0.89	73%	0.73	S	S	*	*			trans	-99.2	81.6	-174.9	-72.6	93	0	0	0	115.1
607	R	37.7	Very low	45.1	Very low	233 Å²	233	155.3 Å²	155.3	88%	0.879	74%	0.743	S	S	*	*			trans	-89.5	113.4	176.9	-70.3	-176.4	175.4	-159.6	0.8	114.3	N605	N605-R607 PolarHBondContact O-N 3.03Å
608	K	32.4	Very low	42.9	Very low	206 Å²	206	157.1 Å²	157.1	90%	0.896	76%	0.757	S	S	*	*			trans	62.1	163.3	140.7	-79.3	-172	174.9	-179.6	0	118.9
609	P	37.5	Very low	40.6	Very low	111 Å²	111	162.8 Å²	162.8	72%	0.721	77%	0.77	S	S	*	*			trans	-122.7	156.8	-139.8	41.9	-32.3	0	0	0	117.8
610	L	30.3	Very low	38.2	Very low	163 Å²	163	163.6 Å²	163.6	85%	0.853	78%	0.779	S	S	*	*			trans	-129	119	154.3	-69.1	171.7	0	0	0	107.4
611	K	33.3	Very low	36.8	Very low	184 Å²	184	161.7 Å²	161.7	80%	0.8	78%	0.782	S	S	*	*				70	97.7	70	-76.4	-170.9	174.2	178.2	0	114.5
612	R	26.4	Very low	35.4	Very low	241 Å²	241	161 Å²	161	91%	0.909	79%	0.788	S	S	*	*			trans	29.8	109.8	146	-65.4	-179.9	177.2	172.9	-0.6	117.6
613	V	31.9	Very low	34.3	Very low	147 Å²	147	157 Å²	157	89%	0.891	79%	0.786	S	S	*	*			trans	-108.3	138	143.8	179	0	0	0	0	108.3
614	K	29	Very low	33.6	Very low	174 Å²	174	161.1 Å²	161.1	76%	0.757	81%	0.807	S	S	*	*			trans	-120.5	163.5	169.7	-80.3	-169.8	170.3	-171.2	0	109.1
615	T	30.1	Very low	32.6	Very low	112 Å²	112	159.2 Å²	159.2	69%	0.687	81%	0.805	S	S	*	*			trans	89.7	138.7	150.8	76.9	0	0	0	0	120.5
616	K	30.2	Very low	31.7	Very low	207 Å²	207	160.6 Å²	160.6	90%	0.9	81%	0.81	S	S	*	*			trans	74.6	149.4	149.6	-70.4	160.5	-179.6	-174	0	117.6
617	G	26.7	Very low	31.4	Very low	72 Å²	72	159.6 Å²	159.6	74%	0.742	81%	0.808	S	S	*	*			trans	-148.6	176.6	-166.4	0	0	0	0	0	115.3
618	I	32.6	Very low	31.1	Very low	165 Å²	165	154.1 Å²	154.1	85%	0.846	81%	0.805	S	S	*	*			trans	-155.7	138.9	-166.4	-78.2	171.3	0	0	0	106
619	W	30.5	Very low	30.9	Very low	239 Å²	239	153.9 Å²	153.9	91%	0.905	80%	0.804	S	S	*	*			cis	-164.1	-171.5	-15.7	-133.9	35.6	0	0	0	110.3
620	C	26	Very low	30.7	Very low	108 Å²	108	154.7 Å²	154.7	73%	0.73	81%	0.81	S	S	*	*			trans	-92.2	-177.4	174.4	-50.1	0	0	0	0	111.3
621	P	34.6	Very low	30.7	Very low	118 Å²	118	151.2 Å²	151.2	77%	0.766	80%	0.799	S	S	*	*			cis	-124.1	-141.6	-0.3	38.7	-15.9	0	0	0	110.1
622	P	35.2	Very low	30.5	Very low	109 Å²	109	148.4 Å²	148.4	71%	0.708	79%	0.789	S	S	*	*			cis	-137.7	165.3	-12.8	40.2	-20.9	0	0	0	118.8
623	V	34	Very low	30.6	Very low	130 Å²	130	143.7 Å²	143.7	79%	0.788	79%	0.786	S	S	*	*			trans	35	106.8	139.5	-175.3	0	0	0	0	120.7
624	L	31.1	Very low	30.3	Very low	168 Å²	168	143.7 Å²	143.7	88%	0.88	78%	0.781	S	S	*	*				-163.4	155.9	95.5	-124.7	144.9	0	0	0	110.3
625	S	26.2	Very low	30.3	Very low	98 Å²	98	142.7 Å²	142.7	69%	0.685	78%	0.784	S	S	*	*			trans	-133.1	150.5	-169.5	55.5	0	0	0	0	113.2
626	I	31.8	Very low	30.2	Very low	152 Å²	152	145.8 Å²	145.8	78%	0.779	80%	0.795	S	S	*	*			trans	-175	115	141.6	-96.2	150.1	0	0	0	111.4
627	Y	31.5	Very low	30.1	Very low	214 Å²	214	139.3 Å²	139.3	84%	0.839	79%	0.787	S	S	*	*			trans	44.2	135.4	150.5	-70.1	-93.5	0	0	0	126.1
628	S	32	Very low	30.1	Very low	118 Å²	118	145 Å²	145	83%	0.825	80%	0.795	S	S	*	*			trans	106.4	143.8	144.4	-29.7	0	0	0	0	120.6
629	K	28.7	Very low	29.8	Very low	201 Å²	201	146.3 Å²	146.3	87%	0.874	80%	0.797	S	S	*	*			trans	-91.1	172.4	-179.5	-82.2	-175.7	178.5	-173.7	0	111.5
630	P	33.4	Very low	29.6	Very low	129 Å²	129	139.5 Å²	139.5	84%	0.838	79%	0.786	S	S	*	*			cis	-141.5	-148.3	31.5	44.1	-22.3	0	0	0	116.8
631	S	30.2	Very low	29.6	Very low	90 Å²	90	139.6 Å²	139.6	63%	0.629	79%	0.788	S	S	*	*			trans	-127.1	171.9	-157.7	52.7	0	0	0	0	114.5
632	Q	28.7	Very low	29.3	Very low	125 Å²	125	139 Å²	139	58%	0.584	78%	0.781	S	S	*	*			trans	57.8	116.8	165.9	-74	153.8	-66.8	0	0	116.2
633	V	28.1	Very low	28.8	Very low	142 Å²	142	144 Å²	144	86%	0.861	79%	0.788	S	S	*	*				61	83.6	68.7	-175.9	0	0	0	0	111.5
634	D	26.8	Very low	28.5	Very low	146 Å²	146	146.8 Å²	146.8	78%	0.781	79%	0.79	S	S	*	*			trans	-155.1	176.1	136.1	-138.5	-17.5	0	0	0	110.9
635	L	27.5	Very low	28.3	Very low	154 Å²	154	145.2 Å²	145.2	81%	0.806	79%	0.787	S	S	*	*			trans	-37.8	137.7	-162.9	-88.3	80.6	0	0	0	120.4
636	L	28.5	Very low	28.5	Very low	176 Å²	176	143.5 Å²	143.5	92%	0.921	79%	0.785	S	S	*	*			trans	-45.1	145.2	148.6	-58.2	150.8	0	0	0	111.8
637	G	28.6	Very low	28.2	Very low	72 Å²	72	144 Å²	144	74%	0.742	79%	0.789	S	S	*	*			cis	177	105.2	-3.6	0	0	0	0	0	109.8
638	Q	25.6	Very low	28.1	Very low	192 Å²	192	143.3 Å²	143.3	90%	0.897	79%	0.79	S	S	*	*			trans	-84.4	176.1	165.6	-77.4	-171.3	-16.8	0	0	110.6
639	Q	25.9	Very low	28	Very low	191 Å²	191	143.1 Å²	143.1	89%	0.893	79%	0.788	S	S	*	*			trans	79.3	141.3	-173	-52.6	-178.4	9.6	0	0	113.5
640	S	26.6	Very low	28	Very low	96 Å²	96	137.5 Å²	137.5	67%	0.671	78%	0.779	S	S	*	*			cis	-159	155.7	-11.1	41.1	0	0	0	0	112.3
641	S	26.9	Very low	27.9	Very low	111 Å²	111	138.4 Å²	138.4	78%	0.776	78%	0.782	S	S	*	*			trans	-131.7	53.3	160.5	52.9	0	0	0	0	110.2	Y643	S641-Y643 PolarHBondContact O-N 3.02Å; S641-Y643 VanDerWaalsContact O-N 3.17Å
642	V	27.3	Very low	27.7	Very low	104 Å²	104	137.3 Å²	137.3	63%	0.63	79%	0.785	S	S	*	*			trans	-67.2	111.1	171.3	177.4	0	0	0	0	108.2	F644	V642-F644 VanDerWaalsContact C-N 3.28Å; V642-F644 HydrophobicContact CB-CD2 4.48Å; V642-F644 HydrophobicContact CG1-CD2 3.67Å; V642-F644 HydrophobicContact CG1-CE2 3.99Å; V642-F644 PolarHBondContact O-N 3.46Å
643	Y	26.2	Very low	27.7	Very low	215 Å²	215	138.1 Å²	138.1	84%	0.843	80%	0.798	S	S	*	*			trans	-71.5	85.2	169.4	-92.6	-83.1	0	0	0	110.2	S641 T645	S641-Y643 PolarHBondContact O-N 3.02Å; S641-Y643 VanDerWaalsContact O-N 3.17Å; Y643-T645 PolarHBondContact O-N 3.4Å
644	F	26	Very low	27.6	Very low	189 Å²	189	137.2 Å²	137.2	83%	0.829	79%	0.793	S	S	*	*			trans	-69.6	94.6	164.4	-103	-80.4	0	0	0	109.6	V642 G646	V642-F644 VanDerWaalsContact C-N 3.28Å; V642-F644 HydrophobicContact CB-CD2 4.48Å; V642-F644 HydrophobicContact CG1-CD2 3.67Å; V642-F644 HydrophobicContact CG1-CE2 3.99Å; V642-F644 PolarHBondContact O-N 3.46Å; F644-G646 PolarHBondContact O-N 3.13Å
645	T	28	Very low	27.7	Very low	134 Å²	134	138.9 Å²	138.9	82%	0.822	80%	0.796	S	S	*	*			trans	-72.2	82.9	160.6	37.9	0	0	0	0	109.1	Y643	Y643-T645 PolarHBondContact O-N 3.4Å
646	G	29.3	Very low	27.9	Very low	62 Å²	62	137.1 Å²	137.1	64%	0.639	79%	0.794	S	S	*	*			trans	-58.5	138.1	176.7	0	0	0	0	0	112	F644 K648	F644-G646 PolarHBondContact O-N 3.13Å; G646-K648 PolarHBondContact O-N 2.89Å
647	L	27	Very low	27.9	Very low	164 Å²	164	134.3 Å²	134.3	86%	0.859	79%	0.786	S	S	*	*			trans	-54.8	133.6	-175.8	-65.2	90.2	0	0	0	112.7
648	K	29.3	Very low	27.8	Very low	199 Å²	199	138.2 Å²	138.2	87%	0.865	79%	0.789	S	S	*	*				-165	152.7	114.2	-102.7	153.3	-171.6	175.9	0	114.5	G646	G646-K648 PolarHBondContact O-N 2.89Å
649	S	29.4	Very low	27.7	Very low	114 Å²	114	135.5 Å²	135.5	80%	0.797	79%	0.786	S	S	*	*			trans	-25.5	159.7	164.9	-49	0	0	0	0	118.6
650	A	29.6	Very low	27.7	Very low	82 Å²	82	132.7 Å²	132.7	68%	0.678	78%	0.782	S	S	*	*			cis	-178.1	165.4	-17.8	0	0	0	0	0	108.5
651	V	30.1	Very low	27.5	Very low	148 Å²	148	137 Å²	137	90%	0.897	79%	0.794	S	S	*	*			trans	66.9	129.2	173.5	-169.1	0	0	0	0	113.9
652	G	26.1	Very low	27.6	Very low	67 Å²	67	137.9 Å²	137.9	69%	0.691	80%	0.795	S	S	*	*			trans	-111.6	162.7	179.8	0	0	0	0	0	113.3
653	V	28.6	Very low	27.6	Very low	143 Å²	143	140.1 Å²	140.1	87%	0.867	80%	0.802	S	S	*	*			trans	-134.4	157	163.3	-179.3	0	0	0	0	107.4
654	T	26.9	Very low	27.6	Very low	123 Å²	123	137 Å²	137	76%	0.755	80%	0.8	S	S	*	*			trans	-80.1	169.6	-175	45	0	0	0	0	114.5
655	E	27.6	Very low	27.7	Very low	181 Å²	181	137.5 Å²	137.5	85%	0.846	81%	0.805	S	S	*	*			trans	106.8	136.4	164.9	-59.7	-175	179.9	0	0	117.1
656	P	32.6	Very low	27.6	Very low	116 Å²	116	136.1 Å²	136.1	75%	0.753	80%	0.801	S	S	*	*			trans	-82.7	159.8	175.3	37	-36	0	0	0	110.9
657	P	28.5	Very low	27.6	Very low	118 Å²	118	143.1 Å²	143.1	77%	0.766	81%	0.813	S	S	*	*			cis	-152.3	-121.4	48.8	41.6	-17.1	0	0	0	113.6
658	L	25.5	Very low	27.8	Very low	153 Å²	153	146.1 Å²	146.1	80%	0.801	82%	0.815	S	S	*	*			trans	86.2	119.9	167.5	-111.8	70.1	0	0	0	119.8
659	T	23.3	Very low	27.7	Very low	136 Å²	136	146.7 Å²	146.7	83%	0.834	82%	0.818	S	S	*	*			trans	-79.5	145.5	163.5	34.3	0	0	0	0	111.4
660	T	26.3	Very low	27.6	Very low	132 Å²	132	148 Å²	148	81%	0.81	82%	0.816	S	S	*	*			trans	-137.1	127.5	163.2	49.6	0	0	0	0	110.2
661	M	23.8	Very low	27.7	Very low	185 Å²	185	149.3 Å²	149.3	91%	0.911	81%	0.811	S	S	*	*			trans	-82.8	145.6	179.6	-62.9	160.9	64.5	0	0	111.6
662	T	28.7	Very low	27.8	Very low	130 Å²	130	152.2 Å²	152.2	80%	0.798	81%	0.812	S	S	*	*			trans	-135	89.4	163.6	54.8	0	0	0	0	111.9
663	I	26.3	Very low	27.8	Very low	151 Å²	151	156.7 Å²	156.7	77%	0.774	82%	0.819	S	S	*	*			trans	39.9	100.1	140.6	-48.9	169.9	0	0	0	116.6
664	N	27.8	Very low	28	Very low	151 Å²	151	158.4 Å²	158.4	81%	0.807	82%	0.815	S	S	*	*			trans	-170.2	61	134.1	-102.3	-31.8	0	0	0	113
665	E	26.2	Very low	28.2	Very low	199 Å²	199	162 Å²	162	93%	0.93	82%	0.823	S	S	*	*			trans	-119.6	96.3	165.6	-71.9	-165.4	146.6	0	0	110.3
666	S	26.1	Very low	28.2	Very low	105 Å²	105	159.4 Å²	159.4	73%	0.734	82%	0.82	S	S	*	*			trans	-159	59.2	175.4	63.8	0	0	0	0	112.8
667	K	30.5	Very low	28	Very low	208 Å²	208	160 Å²	160	90%	0.904	82%	0.824	S	S	*	*	S	Bend	trans	-156.8	11.5	165.8	-119.1	163.6	-170	176	0	117
668	Y	30.4	Very low	28.4	Very low	228 Å²	228	158.4 Å²	158.4	89%	0.894	82%	0.816	S	S	*	*	S	Bend	trans	-96.7	2.3	176.7	-142.1	-95.6	0	0	0	114
669	F	26.8	Very low	28.5	Very low	210 Å²	210	156.3 Å²	156.3	92%	0.921	82%	0.82	S	S	*	*	S	Bend	trans	-136	68.8	177.9	-102.9	-85.8	0	0	0	110.9
670	D	29	Very low	28.9	Very low	141 Å²	141	154.5 Å²	154.5	75%	0.754	81%	0.813	S	S	*	*	S	Bend	trans	-152.4	165.5	158.3	-138.9	-31.9	0	0	0	110.7	K672	D670-K672 PolarHBondContact O-N 3.06Å
671	N	31.5	Very low	29.3	Very low	111 Å²	111	152.4 Å²	152.4	59%	0.594	80%	0.804	S	S	*	*	S	Bend	trans	64	14.2	-179.8	-72.3	-29.9	0	0	0	118.7
672	K	31.2	Very low	29.7	Very low	208 Å²	208	151.2 Å²	151.2	90%	0.904	79%	0.794	S	S	*	*	S	Bend	trans	-103.9	33.9	159.3	-149.3	179.6	-175.4	-180	0	113.4	D670	D670-K672 PolarHBondContact O-N 3.06Å
673	L	27.4	Very low	29.7	Very low	162 Å²	162	153.2 Å²	153.2	85%	0.848	79%	0.792	S	S	*	*			trans	-143.1	42.4	178.7	-149	92.8	0	0	0	114.7
674	K	31	Very low	30.1	Very low	179 Å²	179	153 Å²	153	78%	0.778	79%	0.788	S	S	*	*	S	Bend	trans	-130.3	131	163.5	-72.2	-179	179.6	167.4	0	109.5
675	Q	31	Very low	30.4	Very low	197 Å²	197	152.6 Å²	152.6	92%	0.921	78%	0.781	S	S	*	*			trans	69.8	73.7	-179.5	-54.7	-176.4	0.9	0	0	116.3
676	T	28.5	Very low	30.6	Very low	127 Å²	127	152.5 Å²	152.5	78%	0.779	77%	0.773	S	S	*	*			trans	-93.8	153.6	132.7	54.4	0	0	0	0	107.9
677	P	29.3	Very low	31	Very low	128 Å²	128	153.6 Å²	153.6	83%	0.831	77%	0.77	S	S	*	*				-133	153.5	90.1	37.3	-26.8	0	0	0	112.3
678	S	35.6	Very low	31.1	Very low	86 Å²	86	150 Å²	150	60%	0.601	76%	0.761	S	S	*	*			cis	-139	142.6	15.6	49.6	0	0	0	0	112.4	S680	S678-S680 PolarHBondContact O-N 3.29Å
679	A	28.1	Very low	31.2	Very low	108 Å²	108	144.4 Å²	144.4	89%	0.893	76%	0.755	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.8	80.3	179	0	0	0	0	0	111.7
680	S	31.2	Very low	31.3	Very low	98 Å²	98	139.7 Å²	139.7	69%	0.685	75%	0.748	S	S	*	*	T	Hydrogen-bonded Turn	trans	-149.6	-11.8	173.5	68.2	0	0	0	0	117.1	S678	S678-S680 PolarHBondContact O-N 3.29Å
681	S	35	Very low	31.5	Very low	88 Å²	88	140.1 Å²	140.1	62%	0.615	76%	0.756	S	S	*	*	S	Bend	trans	-106.4	-44.7	-173.7	50.4	0	0	0	0	114.7	F683 Q684	S681-F683 VanDerWaalsContact C-N 3.32Å; S681-F683 PolarHBondContact O-N 3.31Å; S681-Q684 PolarHBondContact O-N 3.23Å
682	F	32.2	Very low	31.3	Very low	160 Å²	160	138.8 Å²	138.8	70%	0.702	76%	0.76	S	S	*	*	G	3₁₀ helix	trans	-73.8	-20.8	-173.4	-155	-101.4	0	0	0	114.2	Q684 E685	F682-Q684 PolarHBondContact O-N 2.81Å; F682-Q684 VanDerWaalsContact O-N 3.15Å; F682-E685 PolarHBondContact O-N 2.89Å
683	F	29.7	Very low	31.4	Very low	173 Å²	173	136.6 Å²	136.6	76%	0.759	76%	0.759	S	S	*	*	G	3₁₀ helix	trans	-68.8	-10.2	179.9	-131.3	-83.8	0	0	0	113.6	S681 L687	S681-F683 VanDerWaalsContact C-N 3.32Å; S681-F683 PolarHBondContact O-N 3.31Å; F683-L687 WeakPolarHBondContact O-CD1 3.41Å
684	Q	33.8	Very low	31.4	Very low	146 Å²	146	137.6 Å²	137.6	68%	0.682	76%	0.759	S	S	*	*	G	3₁₀ helix	trans	-94.7	-18.1	-177.8	-150.6	175.9	13.9	0	0	113.5	S681 F682 N688	S681-Q684 PolarHBondContact O-N 3.23Å; F682-Q684 PolarHBondContact O-N 2.81Å; F682-Q684 VanDerWaalsContact O-N 3.15Å; Q684-N688 PolarHBondContact O-ND2 3.42Å
685	E	33.7	Very low	31.4	Very low	143 Å²	143	137.9 Å²	137.9	67%	0.668	76%	0.76	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.5	-32.1	-176.5	-154.5	158.3	-142.5	0	0	112	F682 L687 N688	F682-E685 PolarHBondContact O-N 2.89Å; E685-L687 PolarHBondContact O-N 3.32Å; E685-N688 PolarHBondContact O-N 2.93Å
686	Y	31.8	Very low	31.4	Very low	197 Å²	197	135.7 Å²	135.7	77%	0.773	76%	0.755	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.6	-14.7	172.1	-171.5	-107.4	0	0	0	114
687	L	33.2	Very low	31.3	Very low	127 Å²	127	135.7 Å²	135.7	67%	0.665	76%	0.755	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.2	-2.3	179	-70.5	173.1	0	0	0	114.1	F683 E685	F683-L687 WeakPolarHBondContact O-CD1 3.41Å; E685-L687 PolarHBondContact O-N 3.32Å
688	N	34.1	Very low	31.3	Very low	132 Å²	132	139.2 Å²	139.2	71%	0.706	76%	0.758	S	S	*	*	S	Bend	trans	-114.7	5.3	-162.6	-73.5	-23.7	0	0	0	116.6	Q684 E685	Q684-N688 PolarHBondContact O-ND2 3.42Å; E685-N688 PolarHBondContact O-N 2.93Å
689	S	32.4	Very low	31	Very low	112 Å²	112	142 Å²	142	78%	0.783	77%	0.765	S	S	*	*	S	Bend	trans	-135.3	139.9	173.8	63.8	0	0	0	0	112.9
690	S	29	Very low	30.8	Very low	111 Å²	111	144.9 Å²	144.9	78%	0.776	77%	0.765	S	S	*	*			trans	-107.5	130.4	-160.1	57.2	0	0	0	0	114.3
691	T	31.8	Very low	30.6	Very low	150 Å²	150	144.8 Å²	144.8	92%	0.92	76%	0.764	S	S	*	*				-164.8	141.2	128.4	19.5	0	0	0	0	110.4
692	A	28	Very low	30.3	Very low	82 Å²	82	148.1 Å²	148.1	68%	0.678	78%	0.775	S	S	*	*			trans	-90.6	158.7	-177.8	0	0	0	0	0	111.2
693	N	32	Very low	30	Very low	162 Å²	162	147.7 Å²	147.7	87%	0.866	79%	0.785	S	S	*	*				-154.3	173	63	-80.9	-42.3	0	0	0	114
694	E	27.8	Very low	30	Very low	184 Å²	184	144.6 Å²	144.6	86%	0.86	79%	0.785	S	S	*	*			trans	-102.8	177.2	-163.6	-53	169.3	117.9	0	0	115.1
695	K	30.8	Very low	29.8	Very low	184 Å²	184	145.9 Å²	145.9	80%	0.8	79%	0.788	S	S	*	*			trans	106.5	126.9	172.4	-64.6	-175	179.1	-179.2	0	115.1
696	D	31.4	Very low	29.5	Very low	151 Å²	151	148.5 Å²	148.5	81%	0.807	79%	0.793	S	S	*	*			cis	-137.7	155.5	-3.5	-84.4	-48	0	0	0	110.9
697	T	26.2	Very low	29.5	Very low	128 Å²	128	145.3 Å²	145.3	79%	0.785	79%	0.789	S	S	*	*			trans	-134.5	124.3	-167.1	-49.6	0	0	0	0	112.1
698	F	29.5	Very low	29.2	Very low	202 Å²	202	146.9 Å²	146.9	89%	0.886	79%	0.793	S	S	*	*			trans	-179.5	152.6	161.3	-92.9	-48.1	0	0	0	109.4
699	L	29.6	Very low	29	Very low	145 Å²	145	148.2 Å²	148.2	76%	0.759	80%	0.795	S	S	*	*			cis	-152.6	143.7	-2.4	-150.4	149.2	0	0	0	109.1
700	L	23.5	Very low	29	Very low	168 Å²	168	150.7 Å²	150.7	88%	0.88	79%	0.794	S	S	*	*			trans	-100.7	146.3	179.5	-86.1	160.9	0	0	0	113.1
701	S	27.2	Very low	28.9	Very low	96 Å²	96	152.8 Å²	152.8	67%	0.671	79%	0.794	S	S	*	*			trans	-163.5	155.3	149	57.6	0	0	0	0	115.5
702	N	27.9	Very low	28.7	Very low	157 Å²	157	152.8 Å²	152.8	84%	0.84	79%	0.787	S	S	*	*			trans	79.7	113.4	160.3	-57.9	-27.2	0	0	0	120.4
703	V	27.1	Very low	28.9	Very low	151 Å²	151	153.7 Å²	153.7	92%	0.915	79%	0.794	S	S	*	*			trans	-145.9	141.8	174.7	172.3	0	0	0	0	109.6
704	S	28.8	Very low	28.8	Very low	108 Å²	108	149.1 Å²	149.1	76%	0.755	79%	0.785	S	S	*	*			trans	-168	149.7	171.2	58.6	0	0	0	0	112.2
705	K	30.4	Very low	28.7	Very low	173 Å²	173	148.4 Å²	148.4	75%	0.752	79%	0.786	S	S	*	*			cis	-171.2	135.6	-14.3	-114.3	-171.2	174.7	-174.4	0	109.5
706	Y	28	Very low	28.7	Very low	198 Å²	198	147.1 Å²	147.1	78%	0.776	79%	0.787	S	S	*	*			trans	59.8	163.2	157	-70.4	-74.3	0	0	0	118.7
707	N	31.4	Very low	28.5	Very low	130 Å²	130	144.6 Å²	144.6	70%	0.695	78%	0.781	S	S	*	*			cis	-121.6	-124.2	14	-160.7	43.5	0	0	0	117.3
708	H	27.3	Very low	28.7	Very low	160 Å²	160	143.9 Å²	143.9	74%	0.741	77%	0.773	S	S	*	*			trans	-161	-168.5	-146.8	-160.6	-115.1	0	0	0	113.2
709	E	29.5	Very low	28.8	Very low	160 Å²	160	142 Å²	142	75%	0.748	76%	0.764	S	S	*	*			trans	76	132.4	172.7	-69.6	163.3	-161.8	0	0	115.7
710	E	30.9	Very low	28.7	Very low	165 Å²	165	142.5 Å²	142.5	77%	0.771	77%	0.766	S	S	*	*			cis	-140.2	142.4	7	-112.9	-178.7	153.7	0	0	113.4
711	M	27.7	Very low	29.2	Very low	155 Å²	155	139.9 Å²	139.9	76%	0.764	76%	0.759	S	S	*	*			trans	37.3	163.8	138.1	-64.2	178	61.3	0	0	125.4
712	I	28.3	Very low	29.3	Very low	150 Å²	150	146 Å²	146	77%	0.769	77%	0.768	S	S	*	*				176.7	153.8	-53.5	-97.8	165.2	0	0	0	110.9
713	A	31.8	Very low	29.2	Very low	101 Å²	101	143.7 Å²	143.7	84%	0.835	76%	0.759	S	S	*	*			trans	71.1	150.9	169	0	0	0	0	0	118
714	G	30.2	Very low	29.2	Very low	66 Å²	66	142.9 Å²	142.9	68%	0.68	75%	0.75	S	S	*	*			cis	-174.8	126.6	-10	0	0	0	0	0	109.4
715	L	24.5	Very low	29.2	Very low	169 Å²	169	145.1 Å²	145.1	89%	0.885	75%	0.752	S	S	*	*				66.8	121.5	81	-94.5	172.9	0	0	0	116.3
716	L	30.8	Very low	29	Very low	156 Å²	156	141.4 Å²	141.4	82%	0.817	75%	0.747	S	S	*	*			trans	97	108.1	156.4	-61.2	170.2	0	0	0	121.9
717	S	29	Very low	29.1	Very low	98 Å²	98	139.2 Å²	139.2	69%	0.685	75%	0.749	S	S	*	*			trans	78.1	123.3	130.6	-102.7	0	0	0	0	124.6
718	D	28.5	Very low	28.9	Very low	113 Å²	113	139.3 Å²	139.3	60%	0.604	75%	0.749	S	S	*	*				75.7	124.6	124.8	-82.8	50.7	0	0	0	124.1
719	K	32.4	Very low	29.1	Very low	162 Å²	162	138 Å²	138	70%	0.704	75%	0.747	S	S	*	*			trans	85.4	99	135.9	-70.7	179.4	178.1	91.8	0	121.4
720	I	28.3	Very low	29	Very low	157 Å²	157	137.2 Å²	137.2	81%	0.805	75%	0.748	S	S	*	*				80.3	139.1	119	-71.8	169.1	0	0	0	118.3
721	P	33.8	Very low	29	Very low	112 Å²	112	139.2 Å²	139.2	73%	0.727	76%	0.755	S	S	*	*			trans	-114.9	-174.7	-161.7	44	-34.1	0	0	0	114.2
722	R	28.1	Very low	28.9	Very low	225 Å²	225	136.7 Å²	136.7	85%	0.849	75%	0.753	S	S	*	*			trans	-179.3	141	142.3	-105	175.3	-169.8	-165.1	2.8	115.3
723	T	27.4	Very low	29.2	Very low	108 Å²	108	134.5 Å²	134.5	66%	0.663	75%	0.748	S	S	*	*			trans	56.9	150.7	142.6	59.8	0	0	0	0	121
724	D	25.8	Very low	29	Very low	134 Å²	134	133.4 Å²	133.4	72%	0.717	73%	0.734	S	S	*	*			cis	-169.6	-170.5	-14.7	-95.9	-18.9	0	0	0	106.7
725	I	29.7	Very low	28.7	Very low	155 Å²	155	136.3 Å²	136.3	80%	0.795	74%	0.743	S	S	*	*			trans	77	109.4	168.3	-48	171	0	0	0	113.4
726	S	25.1	Very low	28.8	Very low	95 Å²	95	135.8 Å²	135.8	66%	0.664	73%	0.733	S	S	*	*			cis	102.7	155.8	24.7	80.8	0	0	0	0	114.4
727	L	31.2	Very low	28.7	Very low	153 Å²	153	137.1 Å²	137.1	80%	0.801	73%	0.733	S	S	*	*			trans	87.9	150.5	-178.9	-54.9	167.7	0	0	0	115.6
728	N	26.4	Very low	28.6	Very low	131 Å²	131	141.2 Å²	141.2	70%	0.701	74%	0.738	S	S	*	*			cis	-176.8	-176.3	-43.7	-122.1	46.3	0	0	0	109.1
729	D	31.5	Very low	28.4	Very low	132 Å²	132	146.2 Å²	146.2	71%	0.706	75%	0.748	S	S	*	*			trans	70.3	102.5	165	-49.7	-18	0	0	0	115.4
730	D	26.9	Very low	28	Very low	145 Å²	145	145.6 Å²	145.6	78%	0.775	75%	0.752	S	S	*	*				72.2	121	75.8	-88.5	-36.2	0	0	0	115.2
731	F	31.5	Very low	27.9	Very low	206 Å²	206	143 Å²	143	90%	0.904	74%	0.744	S	S	*	*				-174.2	138.5	114.8	-107.3	-75	0	0	0	112.3
732	S	26.4	Very low	27.5	Very low	103 Å²	103	145.5 Å²	145.5	72%	0.72	75%	0.745	S	S	*	*			trans	-125.5	-156.3	171	-150.2	0	0	0	0	107.1
733	P	35	Very low	27.6	Very low	104 Å²	104	140.1 Å²	140.1	68%	0.675	73%	0.734	S	S	*	*			cis	-139.4	-166.4	-17.6	30.1	-5.8	0	0	0	114.3
734	S	26.5	Very low	27.6	Very low	77 Å²	77	142.7 Å²	142.7	54%	0.538	74%	0.736	S	S	.	*			trans	89.8	115	144.8	-57.5	0	0	0	0	121.5
735	C	24.7	Very low	27.7	Very low	127 Å²	127	143.6 Å²	143.6	86%	0.858	74%	0.74	S	S	*	*				179.7	153.1	99.3	-101.2	0	0	0	0	111.8
736	K	26.6	Very low	27.3	Very low	158 Å²	158	141.6 Å²	141.6	69%	0.687	74%	0.735	S	S	*	*			cis	159.5	140.6	-37	-107.6	177.8	174.1	158.8	0	107.5
737	K	27.4	Very low	27.3	Very low	185 Å²	185	141.8 Å²	141.8	80%	0.804	74%	0.736	S	S	*	*			trans	74.9	146.5	165.8	-63.7	162.2	-178.1	174.3	0	115.5
738	K	27.1	Very low	27	Very low	184 Å²	184	141.2 Å²	141.2	80%	0.8	73%	0.734	S	S	*	*			cis	-146.5	150.9	-1.5	-99.1	148.6	173.3	-170	0	106.5
739	R	23.7	Very low	26.9	Very low	217 Å²	217	142.6 Å²	142.6	82%	0.819	74%	0.738	S	S	*	*			cis	86.3	110.7	29.8	-165.5	-164.2	-153.4	-161.9	9.7	115.3
740	L	25.7	Very low	26.7	Very low	149 Å²	149	143.7 Å²	143.7	78%	0.78	74%	0.742	S	S	*	*			trans	174.6	115.4	137.5	-108.1	80.4	0	0	0	105.9
741	T	25.4	Very low	26.6	Very low	103 Å²	103	141.4 Å²	141.4	63%	0.632	74%	0.735	S	S	*	*				70.2	148.2	71.4	63.2	0	0	0	0	115.9
742	Q	25	Very low	26.3	Very low	164 Å²	164	138.9 Å²	138.9	77%	0.766	73%	0.731	S	S	*	*			cis	172.9	137.2	-18.2	171.9	170.6	-7.4	0	0	108.3
743	D	29.8	Very low	26.2	Very low	113 Å²	113	141.3 Å²	141.3	60%	0.604	74%	0.736	S	S	*	*			trans	179.6	131.9	147.2	-98.9	2.2	0	0	0	110.8
744	K	28.4	Very low	25.9	Very low	162 Å²	162	140.3 Å²	140.3	70%	0.704	74%	0.737	S	S	*	*				70.2	141.3	93	-63.2	-175.3	-167.3	101.5	0	114.2
745	L	27.3	Very low	25.8	Very low	152 Å²	152	145 Å²	145	80%	0.796	76%	0.756	S	S	*	*			cis	-142.9	-175.3	5.5	-151.6	73.6	0	0	0	111.6
746	T	22.8	Very low	25.8	Very low	114 Å²	114	146 Å²	146	70%	0.699	75%	0.752	S	S	*	*			trans	-93.1	-178.9	-173.2	49.9	0	0	0	0	114.6
747	S	24.3	Very low	25.8	Very low	98 Å²	98	148.7 Å²	148.7	69%	0.685	76%	0.764	S	S	*	*			trans	68.5	143.1	169.1	48.1	0	0	0	0	116
748	D	24.6	Very low	25.7	Very low	141 Å²	141	145.7 Å²	145.7	75%	0.754	76%	0.761	S	S	*	*			cis	-159.2	170.4	2	-121.3	-17.5	0	0	0	112.7
749	M	24.6	Very low	25.6	Very low	161 Å²	161	141.7 Å²	141.7	79%	0.793	75%	0.752	S	S	*	*			trans	72.4	145.5	155.4	-72.7	176.7	-174.6	0	0	122.4
750	I	26.5	Very low	25.7	Very low	155 Å²	155	137.8 Å²	137.8	80%	0.795	76%	0.755	S	S	*	*			trans	76.3	118	160.7	-61.9	150.4	0	0	0	118.1
751	P	24.9	Very low	25.7	Very low	96 Å²	96	137.1 Å²	137.1	62%	0.623	75%	0.746	S	S	*	*			trans	-87	151.8	159	36.2	-32.3	0	0	0	111.3
752	N	25.7	Very low	25.7	Very low	153 Å²	153	142 Å²	142	82%	0.818	75%	0.754	S	S	*	*			trans	179.4	157.2	133.8	-99.5	-40.7	0	0	0	114.6
753	N	24.5	Very low	25.7	Very low	154 Å²	154	143.1 Å²	143.1	82%	0.824	76%	0.764	S	S	*	*			trans	-51.3	141	178.1	-59.4	-42.9	0	0	0	115.8
754	A	27.8	Very low	25.6	Very low	83 Å²	83	140.1 Å²	140.1	69%	0.686	76%	0.76	S	S	*	*			trans	-158.8	73.5	155.6	0	0	0	0	0	112.6	L756	A754-L756 PolarHBondContact O-N 3.4Å; A754-L756 VanDerWaalsContact O-N 3.15Å
755	N	25.5	Very low	25.5	Very low	176 Å²	176	140.1 Å²	140.1	94%	0.941	77%	0.768	S	S	*	*			trans	-70.9	104.6	165.7	-84.9	-11.6	0	0	0	109.1
756	L	24.8	Very low	25.4	Very low	147 Å²	147	140.1 Å²	140.1	77%	0.77	77%	0.767	S	S	*	*			trans	-114.4	68.8	-166.7	-155.1	91	0	0	0	113.5	A754	A754-L756 PolarHBondContact O-N 3.4Å; A754-L756 VanDerWaalsContact O-N 3.15Å
757	F	26.2	Very low	25.6	Very low	215 Å²	215	144.5 Å²	144.5	94%	0.943	78%	0.777	S	S	*	*			trans	-130.3	72	166.9	-88.5	-72.1	0	0	0	112.1
758	T	24.6	Very low	25.6	Very low	123 Å²	123	145.6 Å²	145.6	76%	0.755	79%	0.785	S	S	*	*			trans	-141.5	169.3	161.8	36.5	0	0	0	0	109
759	V	24.8	Very low	25.7	Very low	99 Å²	99	147.8 Å²	147.8	60%	0.6	79%	0.79	S	S	*	*			trans	74.8	114.3	177.6	-168.4	0	0	0	0	113.3	K761 Y762	V759-K761 HydrophobicContact CG1-CB 4.41Å; V759-Y762 HydrophobicContact CG1-CD2 4.18Å
760	P	26.7	Very low	25.9	Very low	136 Å²	136	147.7 Å²	147.7	88%	0.883	79%	0.788	S	S	*	*				-117.5	102.5	103	32.8	-33	0	0	0	112.1
761	K	25.3	Very low	26	Very low	135 Å²	135	146.9 Å²	146.9	59%	0.587	79%	0.79	S	S	*	*			trans	-147.7	23.2	174.2	-149.8	-170.5	177.5	-173.2	0	113.2	V759 E1178	V759-K761 HydrophobicContact CG1-CB 4.41Å; K761-E1178 IonicContact NZ-OE1 3.63Å; K761-E1178 PolarHBondContact NZ-OE1 3.06Å; K761-E1178 IonicContact NZ-OE2 2.81Å; K761-E1178 PolarHBondContact NZ-OE2 3.39Å
762	Y	26.6	Very low	26.1	Very low	206 Å²	206	145.7 Å²	145.7	81%	0.808	80%	0.796	S	S	*	*			trans	-135.1	96.6	173.6	-79.9	-75.6	0	0	0	111.1	V759	V759-Y762 HydrophobicContact CG1-CD2 4.18Å
763	L	25.1	Very low	26.1	Very low	187 Å²	187	143.1 Å²	143.1	98%	0.979	79%	0.79	S	S	*	*			trans	-144	86.7	160.8	-127.2	175.7	0	0	0	107.2
764	G	26.1	Very low	26.2	Very low	50 Å²	50	144.4 Å²	144.4	52%	0.515	79%	0.788	S	S	.	*	S	Bend	trans	149.5	130.4	-165.9	0	0	0	0	0	108.8
765	N	26.8	Very low	26	Very low	162 Å²	162	147.3 Å²	147.3	87%	0.866	79%	0.788	S	S	*	*			trans	70.8	61.5	-176.8	-53.7	0.4	0	0	0	115.7
766	L	25	Very low	26	Very low	151 Å²	151	146.7 Å²	146.7	79%	0.791	78%	0.779	S	S	*	*				-66.4	163.9	126.1	-86.5	84.4	0	0	0	108.6
767	F	27.1	Very low	26.1	Very low	206 Å²	206	149.6 Å²	149.6	90%	0.904	79%	0.786	S	S	*	*			trans	77.9	91.5	-172.7	-50.2	-70.4	0	0	0	114.4
768	S	24.7	Very low	26	Very low	121 Å²	121	142.3 Å²	142.3	85%	0.846	77%	0.772	S	S	*	*			trans	-140.4	73.4	161.9	64.9	0	0	0	0	110.3
769	E	27.4	Very low	26	Very low	187 Å²	187	145.2 Å²	145.2	87%	0.874	78%	0.776	S	S	*	*			trans	-110.8	141.2	154.7	-69.2	172.8	168.4	0	0	105.2
770	E	28.5	Very low	26.1	Very low	160 Å²	160	148.9 Å²	148.9	75%	0.748	79%	0.787	S	S	*	*			cis	-160.1	146.9	3.5	-131.6	-172.6	171.6	0	0	110.1
771	T	28	Very low	26	Very low	137 Å²	137	150.4 Å²	150.4	84%	0.84	78%	0.782	S	S	*	*			trans	60.6	171.3	158.6	73.2	0	0	0	0	120.5
772	G	27.3	Very low	26.1	Very low	71 Å²	71	151.5 Å²	151.5	73%	0.732	79%	0.787	S	S	*	*			trans	114.4	66.3	141	0	0	0	0	0	119.2
773	S	24.7	Very low	26.3	Very low	100 Å²	100	149.3 Å²	149.3	70%	0.699	78%	0.784	S	S	*	*			trans	-48.5	144.2	161	52.2	0	0	0	0	114.9
774	F	26.6	Very low	26.3	Very low	180 Å²	180	148 Å²	148	79%	0.789	77%	0.77	S	S	*	*				-171.7	-173.4	109.5	-111.6	-77.3	0	0	0	113.2
775	Q	24.3	Very low	26.2	Very low	144 Å²	144	152.3 Å²	152.3	67%	0.673	78%	0.777	S	S	*	*			trans	-113.1	155	-157	-56.3	163.2	-83.5	0	0	115.1
776	H	25.7	Very low	26.1	Very low	163 Å²	163	151.1 Å²	151.1	76%	0.755	77%	0.771	S	S	*	*			trans	63.7	161.1	144.2	-84.4	-53.2	0	0	0	122.5
777	F	25.9	Very low	25.9	Very low	208 Å²	208	152.9 Å²	152.9	91%	0.912	78%	0.775	S	S	*	*			trans	71.3	135.6	-179.7	-58.1	-82.4	0	0	0	116.1
778	G	25	Very low	25.6	Very low	63 Å²	63	149 Å²	149	65%	0.649	77%	0.772	S	S	*	*			cis	152.1	118.3	-8.2	0	0	0	0	0	112.4
779	E	24.9	Very low	25.5	Very low	183 Å²	183	152.8 Å²	152.8	86%	0.855	77%	0.773	S	S	*	*			trans	61.5	121.4	163.8	-69	158.8	-178.8	0	0	116.7
780	E	26.2	Very low	25.4	Very low	176 Å²	176	153.6 Å²	153.6	82%	0.822	77%	0.774	S	S	*	*				73	150.5	107.7	-59.8	-155.7	138.4	0	0	114.3
781	E	25.4	Very low	25.2	Very low	168 Å²	168	151.7 Å²	151.7	79%	0.785	77%	0.769	S	S	*	*			cis	-144.5	-167.8	22	-147.7	-170.3	170.8	0	0	112.4
782	K	27.6	Very low	25.1	Very low	158 Å²	158	153.8 Å²	153.8	69%	0.687	77%	0.774	S	S	*	*			trans	-91	154.8	-174.3	-56.2	160.1	-174.6	163.3	0	111.9
783	H	30.1	Very low	25	Very low	160 Å²	160	157 Å²	157	74%	0.741	77%	0.768	S	S	*	*				178.8	147	108.9	-102.5	-62.2	0	0	0	116.5
784	K	25.3	Very low	25.1	Very low	160 Å²	160	158.3 Å²	158.3	70%	0.696	77%	0.767	S	S	*	*			trans	69.2	109.4	140.9	-82.3	-176.7	175.2	-178.4	0	121.7
785	Q	23.7	Very low	25	Very low	141 Å²	141	160 Å²	160	66%	0.659	77%	0.768	S	S	*	*				76.9	151.1	111.9	-84.9	-172.2	-103.3	0	0	122.1
786	D	24.2	Very low	25.2	Very low	137 Å²	137	164.2 Å²	164.2	73%	0.733	78%	0.779	S	S	*	*			trans	74	163.9	156.6	-53.5	-14.4	0	0	0	118.6
787	E	22.1	Very low	25.3	Very low	188 Å²	188	162.8 Å²	162.8	88%	0.879	78%	0.778	S	S	*	*			trans	-77.8	134.7	-156.4	-51.7	165.8	113.8	0	0	113
788	C	20.7	Very low	25.4	Very low	123 Å²	123	158.2 Å²	158.2	83%	0.831	77%	0.771	S	S	*	*				-168.4	153.4	128.8	-104.8	0	0	0	0	113.7
789	K	22.4	Very low	25.6	Very low	201 Å²	201	163.4 Å²	163.4	87%	0.874	78%	0.783	S	S	*	*			trans	-65.9	135.5	160.1	-64.1	167.2	178.3	170.4	0	108.6
790	F	24	Very low	25.9	Very low	205 Å²	205	161.8 Å²	161.8	90%	0.899	78%	0.78	S	S	*	*			trans	-134.4	127.9	153.1	-118	-84.3	0	0	0	111.6
791	D	24.5	Very low	26.2	Very low	120 Å²	120	158.4 Å²	158.4	64%	0.642	77%	0.773	S	S	*	*			trans	-88.6	122.3	-178.5	176.4	19	0	0	0	109
792	L	27.3	Very low	26.5	Very low	180 Å²	180	158.1 Å²	158.1	94%	0.942	77%	0.772	S	S	*	*			trans	-106.8	71	174.2	-104.2	172.6	0	0	0	110.9
793	K	24.5	Very low	26.7	Very low	139 Å²	139	158.7 Å²	158.7	60%	0.604	78%	0.777	S	S	*	*			trans	-78.5	158.4	179	-163.6	175.9	-179.9	172.7	0	112.2
794	N	26.3	Very low	26.6	Very low	127 Å²	127	156.2 Å²	156.2	68%	0.679	78%	0.778	S	S	*	*			trans	72	135.1	175.5	-28.6	-74.8	0	0	0	113.5
795	R	25.2	Very low	26.9	Very low	217 Å²	217	153.2 Å²	153.2	82%	0.819	78%	0.776	S	S	*	*			cis	-147.2	139.7	20.2	-61.9	171.3	-177.8	-179.5	0.1	111.7
796	Y	28.6	Very low	27.2	Very low	231 Å²	231	154.9 Å²	154.9	91%	0.906	78%	0.782	S	S	*	*				-162.7	106	111	-117.8	-75.9	0	0	0	108.9
797	D	26.9	Very low	27.5	Very low	134 Å²	134	155.1 Å²	155.1	72%	0.717	78%	0.781	S	S	*	*			trans	-78.3	144.7	-178.1	-59.2	-88	0	0	0	112
798	S	27.7	Very low	27.7	Very low	111 Å²	111	151.3 Å²	151.3	78%	0.776	77%	0.771	S	S	*	*				179.2	152.7	110.3	44.6	0	0	0	0	113.7
799	L	30.1	Very low	28.1	Very low	173 Å²	173	151.7 Å²	151.7	91%	0.906	77%	0.765	S	S	*	*			trans	76.4	79.5	167.9	-52.2	179.8	0	0	0	119.1
800	L	30.5	Very low	28.4	Very low	149 Å²	149	148.5 Å²	148.5	78%	0.78	76%	0.757	S	S	*	*			trans	-76.2	-179.2	154.8	-95.5	165.3	0	0	0	111.3	Q802	L800-Q802 HydrophobicContact CD2-CG 4.47Å
801	P	33.2	Very low	28.6	Very low	105 Å²	105	147.4 Å²	147.4	68%	0.682	76%	0.755	S	S	*	*			cis	-139.4	148.9	27.9	39.3	-17.6	0	0	0	118.8
802	Q	31	Very low	28.7	Very low	161 Å²	161	146.4 Å²	146.4	75%	0.752	76%	0.757	S	S	*	*				71	153.7	105.3	-56.1	-176.3	-37.3	0	0	117	L800	L800-Q802 HydrophobicContact CD2-CG 4.47Å
803	E	32.3	Very low	28.5	Very low	171 Å²	171	145.1 Å²	145.1	80%	0.799	75%	0.751	S	S	*	*			cis	-133	142.5	13.5	-66.3	179.7	127.5	0	0	111.1
804	S	28.7	Very low	28.5	Very low	108 Å²	108	146.1 Å²	146.1	76%	0.755	76%	0.763	S	S	*	*				63.3	140.3	87.4	131.5	0	0	0	0	116.9
805	S	31.4	Very low	28.5	Very low	96 Å²	96	146.9 Å²	146.9	67%	0.671	77%	0.766	S	S	*	*			cis	-169	-166.8	-12.5	52.5	0	0	0	0	108.7
806	K	30.1	Very low	28.4	Very low	177 Å²	177	143.4 Å²	143.4	77%	0.77	76%	0.764	S	S	*	*			cis	-174.3	167.8	9.7	-137.5	168.7	-174	173.2	0	110.9
807	I	29.5	Very low	28.2	Very low	142 Å²	142	137.2 Å²	137.2	73%	0.728	75%	0.754	S	S	*	*			trans	70.8	143.2	150.1	-77.3	160.3	0	0	0	121.2
808	T	27.7	Very low	28.1	Very low	108 Å²	108	137.6 Å²	137.6	66%	0.663	76%	0.762	S	S	*	*				-173	150.4	-51.7	24.1	0	0	0	0	114.2
809	N	28.8	Very low	28	Very low	131 Å²	131	143.9 Å²	143.9	70%	0.701	77%	0.77	S	S	*	*			trans	80.3	133	144.1	-68.5	12.8	0	0	0	125.7
810	N	27.6	Very low	27.7	Very low	133 Å²	133	139.1 Å²	139.1	71%	0.711	76%	0.762	S	S	*	*			trans	60.7	143.5	143.4	-57.3	14.3	0	0	0	119.7
811	E	29.8	Very low	27.5	Very low	183 Å²	183	141.7 Å²	141.7	86%	0.855	77%	0.767	S	S	*	*			cis	-154.3	-155.4	38	-146.8	148.7	-112.2	0	0	112.8
812	S	24.8	Very low	27.1	Very low	98 Å²	98	146.2 Å²	146.2	69%	0.685	78%	0.776	S	S	*	*			trans	-127.2	159.9	-154.8	59.8	0	0	0	0	118.9
813	L	25	Very low	26.9	Very low	154 Å²	154	143.1 Å²	143.1	81%	0.806	78%	0.778	S	S	*	*			trans	42.5	117.3	152	-71.8	163.7	0	0	0	120.4
814	N	24	Very low	26.5	Very low	160 Å²	160	142.4 Å²	142.4	86%	0.856	78%	0.78	S	S	*	*				-168	175.8	118.1	-111.3	-67.6	0	0	0	114.9
815	L	25.8	Very low	26.3	Very low	143 Å²	143	144.3 Å²	144.3	75%	0.749	78%	0.78	S	S	*	*			trans	-82	171	-174.1	-89.9	75.6	0	0	0	115.5
816	D	23.1	Very low	26	Very low	144 Å²	144	149.4 Å²	149.4	77%	0.77	79%	0.79	S	S	*	*			trans	88	122.5	149.7	-79.9	-31.3	0	0	0	122.6
817	S	23.5	Very low	25.7	Very low	100 Å²	100	147.7 Å²	147.7	70%	0.699	79%	0.788	S	S	*	*			trans	41.7	119.9	147.4	70.4	0	0	0	0	120.8
818	T	25.6	Very low	25.4	Very low	143 Å²	143	149.6 Å²	149.6	88%	0.877	80%	0.796	S	S	*	*				-169.9	149.8	110.2	17.9	0	0	0	0	113.8
819	Y	24.7	Very low	25.3	Very low	243 Å²	243	148.2 Å²	148.2	95%	0.953	80%	0.803	S	S	*	*			trans	-67.1	134.3	164.5	-95	-120.1	0	0	0	110.6
820	G	24.1	Very low	25.4	Very low	72 Å²	72	145.4 Å²	145.4	74%	0.742	79%	0.793	S	S	*	*			trans	-163.9	41.4	-169.9	0	0	0	0	0	122.1
821	K	26	Very low	26	Very low	203 Å²	203	143.8 Å²	143.8	88%	0.883	79%	0.785	S	S	*	*			trans	54.3	110.8	158.6	-65	175.7	179.5	171.6	0	120.2
822	K	25.9	Very low	26.6	Very low	200 Å²	200	140.3 Å²	140.3	87%	0.87	77%	0.772	S	S	*	*			trans	36	110.9	132.5	-65.4	-172.7	174.8	-173.6	0	119.4
823	A	26	Very low	27.5	Very low	96 Å²	96	142.5 Å²	142.5	79%	0.793	77%	0.769	S	S	*	*			trans	-112.8	137	136.7	0	0	0	0	0	108.7
824	N	23.8	Very low	28.5	Very low	156 Å²	156	141.6 Å²	141.6	83%	0.834	76%	0.761	S	S	*	*			trans	-84.8	116.3	175.6	-69.5	-24.1	0	0	0	109.4
825	I	24.9	Very low	29.5	Very low	149 Å²	149	134.6 Å²	134.6	76%	0.764	72%	0.724	S	S	*	*			trans	-113.5	124.2	163.4	-62	-179.5	0	0	0	107.6	I827	I825-I827 HydrophobicContact CG2-CD1 4.04Å; I825-I827 HydrophobicContact CG2-CG1 4.05Å
826	K	24.7	Very low	30.5	Very low	202 Å²	202	131.5 Å²	131.5	88%	0.878	70%	0.704	S	S	*	*			trans	-121.9	86.9	-174.1	-178.2	-166.7	177.8	-174.2	0	108.6
827	I	24	Very low	31.7	Very low	142 Å²	142	132 Å²	132	73%	0.728	70%	0.7	S	S	*	*			trans	-133.6	133.4	177.7	-57.5	179.7	0	0	0	107.9	I825	I825-I827 HydrophobicContact CG2-CD1 4.04Å; I825-I827 HydrophobicContact CG2-CG1 4.05Å
828	M	23.3	Very low	33	Very low	182 Å²	182	130.1 Å²	130.1	90%	0.897	68%	0.681	S	S	*	*			trans	-91.9	135.7	172.4	-57.6	-179.8	-168.5	0	0	109.3
829	G	25.2	Very low	34.1	Very low	78 Å²	78	123.5 Å²	123.5	80%	0.804	64%	0.641	S	S	*	*			trans	76.8	98.7	163.8	0	0	0	0	0	116.9
830	S	30.9	Very low	35.2	Very low	72 Å²	72	115 Å²	115	50%	0.503	62%	0.616	S	S	.	*			trans	-155.6	-27.5	165.1	-167.9	0	0	0	0	115.2	N832 K833	S830-N832 VanDerWaalsContact C-N 3.33Å; S830-N832 PolarHBondContact O-N 2.93Å; S830-K833 WeakPolarHBondContact O-CB 3.42Å; S830-K833 PolarHBondContact O-N 3.03Å
831	D	41.3	Very low	36.2	Very low	100 Å²	100	115.5 Å²	115.5	54%	0.535	61%	0.609	S	S	.	*	T	Hydrogen-bonded Turn	trans	-59.6	-29.9	-154	-58.9	16.7	0	0	0	116.4	K833 E834 V835	D831-K833 PolarHBondContact O-N 3.41Å; D831-K833 VanDerWaalsContact O-N 3.13Å; D831-E834 PolarHBondContact O-N 3.41Å; D831-V835 PolarHBondContact O-N 2.95Å
832	N	41.1	Very low	37.2	Very low	110 Å²	110	109 Å²	109	59%	0.588	58%	0.583	S	S	*	*	H	α-helix	trans	-56.6	-30.8	173.8	-74.6	-3.3	0	0	0	112.1	S830 E834 V835 F836	S830-N832 VanDerWaalsContact C-N 3.33Å; S830-N832 PolarHBondContact O-N 2.93Å; N832-E834 VanDerWaalsContact C-N 3.34Å; N832-E834 PolarHBondContact O-N 3.36Å; N832-V835 PolarHBondContact O-N 2.97Å; N832-F836 WeakPolarHBondContact O-CB 3.43Å; N832-F836 WeakPolarHBondContact O-CD2 3.21Å; N832-F836 PolarHBondContact O-N 2.94Å
833	K	44.3	Very low	37.7	Very low	144 Å²	144	107.8 Å²	107.8	63%	0.626	59%	0.587	S	S	*	*	H	α-helix	trans	-70.4	-25.4	176.4	-71.3	-178	174.7	176.3	0	113.4	S830 D831 K837	S830-K833 WeakPolarHBondContact O-CB 3.42Å; S830-K833 PolarHBondContact O-N 3.03Å; D831-K833 PolarHBondContact O-N 3.41Å; D831-K833 VanDerWaalsContact O-N 3.13Å; K833-K837 WeakPolarHBondContact O-CB 3.27Å; K833-K837 PolarHBondContact O-N 3.25Å
834	E	45.6	Very low	38.4	Very low	134 Å²	134	106.8 Å²	106.8	63%	0.626	59%	0.585	S	S	*	*	H	α-helix	trans	-76.7	-44.9	171	-71.4	-152.3	141.5	0	0	111.3	D831 N832 F836 K837 I838	D831-E834 PolarHBondContact O-N 3.41Å; N832-E834 VanDerWaalsContact C-N 3.34Å; N832-E834 PolarHBondContact O-N 3.36Å; E834-F836 PolarHBondContact O-N 3.24Å; E834-K837 WeakPolarHBondContact O-CB 3.27Å; E834-K837 PolarHBondContact O-N 2.88Å; E834-K837 VanDerWaalsContact O-N 3.11Å; E834-I838 VanDerWaalsContact O-CG1 3.31Å; E834-I838 WeakPolarHBondContact O-CG1 3.4Å; E834-I838 PolarHBondContact O-N 2.04Å
835	V	45.7	Very low	39.2	Very low	14 Å²	14	103 Å²	103	9%	0.085	57%	0.565	C	S	.	*	H	α-helix	trans	-62.8	-43.1	179.5	-175.4	0	0	0	0	111.1	D831 N832 I838 I839 L897 I914	D831-V835 PolarHBondContact O-N 2.95Å; N832-V835 PolarHBondContact O-N 2.97Å; V835-I838 PolarHBondContact O-N 3.28Å; V835-I839 HydrophobicContact CG1-CD1 3.96Å; V835-I839 WeakPolarHBondContact O-CG1 3.43Å; V835-I839 PolarHBondContact O-N 2.84Å; V835-L897 HydrophobicContact CG1-CD2 4Å; V835-I914 HydrophobicContact CG1-CD1 4.41Å; V835-I914 HydrophobicContact CG1-CG1 4.29Å
836	F	46.7	Very low	39.8	Very low	77 Å²	77	102 Å²	102	34%	0.338	56%	0.556	S	S	.	*	H	α-helix	trans	-64.1	-37.5	172.3	-92.1	-87.7	0	0	0	112.9	N832 E834 I839 S840 L897	N832-F836 WeakPolarHBondContact O-CB 3.43Å; N832-F836 WeakPolarHBondContact O-CD2 3.21Å; N832-F836 PolarHBondContact O-N 2.94Å; E834-F836 PolarHBondContact O-N 3.24Å; F836-I839 PolarHBondContact O-N 2.96Å; F836-S840 VanDerWaalsContact O-CB 3.31Å; F836-S840 WeakPolarHBondContact O-CB 3.43Å; F836-S840 PolarHBondContact O-N 3.39Å; F836-S840 PolarHBondContact O-OG 3.3Å; F836-L897 HydrophobicContact CE2-CD1 4.4Å
837	K	49.2	Very low	40.2	Very low	154 Å²	154	97.5 Å²	97.5	67%	0.67	55%	0.548	S	S	*	.	H	α-helix	trans	-58.9	-50.4	172.8	-107.1	-175.8	172.5	-176	0	111.4	K833 E834 I839 S840 S841	K833-K837 WeakPolarHBondContact O-CB 3.27Å; K833-K837 PolarHBondContact O-N 3.25Å; E834-K837 WeakPolarHBondContact O-CB 3.27Å; E834-K837 PolarHBondContact O-N 2.88Å; E834-K837 VanDerWaalsContact O-N 3.11Å; K837-I839 PolarHBondContact O-N 3.5Å; K837-S840 WeakPolarHBondContact CA-OG 3.49Å; K837-S840 PolarHBondContact O-N 3.16Å; K837-S840 PolarHBondContact O-OG 3.2Å; K837-S841 WeakPolarHBondContact O-CB 3.48Å; K837-S841 PolarHBondContact O-N 3.37Å; K837-S841 PolarHBondContact O-OG 3.01Å
838	I	50.1	Low	40.6	Very low	61 Å²	61	95.8 Å²	95.8	31%	0.313	55%	0.547	S	S	.	.	H	α-helix	trans	-57.7	-50.8	180	-67.8	163.3	0	0	0	109.6	E834 V835 S840 S841 L842 I910	E834-I838 VanDerWaalsContact O-CG1 3.31Å; E834-I838 WeakPolarHBondContact O-CG1 3.4Å; E834-I838 PolarHBondContact O-N 2.04Å; V835-I838 PolarHBondContact O-N 3.28Å; I838-S840 VanDerWaalsContact C-N 3.33Å; I838-S840 PolarHBondContact O-N 3.16Å; I838-S841 WeakPolarHBondContact CA-OG 3.48Å; I838-S841 PolarHBondContact O-N 3.21Å; I838-S841 PolarHBondContact O-OG 3.14Å; I838-L842 PolarHBondContact O-N 2.79Å; I838-I910 HydrophobicContact CG2-CD1 3.66Å
839	I	49.1	Very low	41.5	Very low	5 Å²	5	89.5 Å²	89.5	3%	0.026	52%	0.517	C	S	.	.	H	α-helix	trans	-58.9	-42.1	177.2	-70.4	168.9	0	0	0	111.8	V835 F836 K837 S841 L842 L897 L900 M904	V835-I839 HydrophobicContact CG1-CD1 3.96Å; V835-I839 WeakPolarHBondContact O-CG1 3.43Å; V835-I839 PolarHBondContact O-N 2.84Å; F836-I839 PolarHBondContact O-N 2.96Å; K837-I839 PolarHBondContact O-N 3.5Å; I839-S841 PolarHBondContact O-N 2.97Å; I839-L842 PolarHBondContact O-N 3Å; I839-L897 HydrophobicContact CD1-CD1 3.65Å; I839-L900 HydrophobicContact CG2-CD2 4.19Å; I839-M904 HydrophobicContact CG2-CE 4.17Å; I839-M904 HydrophobicContact CG2-SD 3.97Å
840	S	47.3	Very low	42.2	Very low	63 Å²	63	90.4 Å²	90.4	44%	0.441	51%	0.507	S	S	.	.	H	α-helix	trans	-70.2	-11.7	176.9	72	0	0	0	0	114.8	F836 K837 I838	F836-S840 VanDerWaalsContact O-CB 3.31Å; F836-S840 WeakPolarHBondContact O-CB 3.43Å; F836-S840 PolarHBondContact O-N 3.39Å; F836-S840 PolarHBondContact O-OG 3.3Å; K837-S840 WeakPolarHBondContact CA-OG 3.49Å; K837-S840 PolarHBondContact O-N 3.16Å; K837-S840 PolarHBondContact O-OG 3.2Å; I838-S840 VanDerWaalsContact C-N 3.33Å; I838-S840 PolarHBondContact O-N 3.16Å
841	S	45.2	Very low	42.6	Very low	84 Å²	84	91.7 Å²	91.7	59%	0.587	51%	0.512	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.3	3.3	-178.4	67.9	0	0	0	0	114.4	K837 I838 I839 D843	K837-S841 WeakPolarHBondContact O-CB 3.48Å; K837-S841 PolarHBondContact O-N 3.37Å; K837-S841 PolarHBondContact O-OG 3.01Å; I838-S841 WeakPolarHBondContact CA-OG 3.48Å; I838-S841 PolarHBondContact O-N 3.21Å; I838-S841 PolarHBondContact O-OG 3.14Å; I839-S841 PolarHBondContact O-N 2.97Å; S841-D843 PolarHBondContact O-N 3.02Å
842	L	46.5	Very low	42.6	Very low	66 Å²	66	89.7 Å²	89.7	35%	0.346	50%	0.499	S	S	.	.			trans	-84.5	103.1	177.2	-71	169.5	0	0	0	110.7	I838 I839 G844 M904 V906	I838-L842 PolarHBondContact O-N 2.79Å; I839-L842 PolarHBondContact O-N 3Å; L842-G844 PolarHBondContact O-N 3.49Å; L842-M904 HydrophobicContact CB-CE 4.09Å; L842-M904 HydrophobicContact CD1-CE 3.78Å; L842-V906 HydrophobicContact CD1-CG1 3.99Å
843	D	37.8	Very low	42.7	Very low	175 Å²	175	88.7 Å²	88.7	94%	0.936	49%	0.49	S	S	*	.	S	Bend	trans	-61.7	118	166.4	-79.1	-43.2	0	0	0	109.9	S841	S841-D843 PolarHBondContact O-N 3.02Å
844	G	39.8	Very low	42.7	Very low	74 Å²	74	84.4 Å²	84.4	76%	0.763	48%	0.478	S	S	*	.			trans	155.1	2.5	-176	0	0	0	0	0	116.7	L842 H846	L842-G844 PolarHBondContact O-N 3.49Å; G844-H846 PolarHBondContact O-N 2.94Å
845	L	40.3	Very low	42.5	Very low	77 Å²	77	86.6 Å²	86.6	40%	0.403	48%	0.48	S	S	.	.			trans	-60.3	106.8	179.2	-81.3	155.9	0	0	0	112.3	K853	L845-K853 HydrophobicContact CD1-CB 4Å; L845-K853 HydrophobicContact CD1-CD 3.73Å; L845-K853 HydrophobicContact CD1-CG 3.68Å
846	H	37.1	Very low	42.5	Very low	128 Å²	128	87.6 Å²	87.6	59%	0.593	49%	0.485	S	S	*	.			trans	-57	136.6	179.7	-167	-100.5	0	0	0	111.5	G844 C848 N849	G844-H846 PolarHBondContact O-N 2.94Å; H846-C848 PolarHBondContact CE1-SG 3.47Å; H846-C848 PolarHBondContact ND1-SG 3.03Å; H846-C848 PolarHBondContact O-N 3.43Å; H846-N849 PolarHBondContact O-N 2.99Å
847	P	34.4	Very low	42.5	Very low	107 Å²	107	88.2 Å²	88.2	70%	0.695	49%	0.489	S	S	*	.	G	3₁₀ helix	trans	-63.4	-10.4	-170.5	23.4	-35	0	0	0	115.4	N849 V850	P847-N849 VanDerWaalsContact C-N 3.29Å; P847-V850 WeakPolarHBondContact O-CG2 3.47Å
848	C	32.7	Very low	42.3	Very low	107 Å²	107	86.5 Å²	86.5	72%	0.723	48%	0.483	S	S	*	.	G	3₁₀ helix	trans	-77.9	-8.9	171.5	-53.9	0	0	0	0	114	H846	H846-C848 PolarHBondContact CE1-SG 3.47Å; H846-C848 PolarHBondContact ND1-SG 3.03Å; H846-C848 PolarHBondContact O-N 3.43Å
849	N	40.5	Very low	41.9	Very low	50 Å²	50	85.5 Å²	85.5	27%	0.267	48%	0.48	S	S	.	.	G	3₁₀ helix	trans	-119.6	25.8	-167	-152.5	12.4	0	0	0	114	H846 P847 T851 Q852 K853	H846-N849 PolarHBondContact O-N 2.99Å; P847-N849 VanDerWaalsContact C-N 3.29Å; N849-T851 PolarHBondContact O-N 3.37Å; N849-Q852 PolarHBondContact ND2-OE1 3.42Å; N849-Q852 PolarHBondContact O-N 3.26Å; N849-Q852 WeakPolarHBondContact OD1-CB 3.05Å; N849-Q852 VanDerWaalsContact OD1-CD 3.24Å; N849-Q852 WeakPolarHBondContact OD1-CG 3.31Å; N849-Q852 PolarHBondContact OD1-OE1 2.99Å; N849-K853 PolarHBondContact O-N 3.12Å
850	V	40	Very low	41.6	Very low	96 Å²	96	88.3 Å²	88.3	58%	0.582	49%	0.494	S	S	*	.	H	α-helix	trans	-56.2	-32.2	-179.5	-177.4	0	0	0	0	112.3	P847 Q852 K853 S854	P847-V850 WeakPolarHBondContact O-CG2 3.47Å; V850-Q852 PolarHBondContact O-N 3.47Å; V850-K853 WeakPolarHBondContact O-CB 3.4Å; V850-K853 PolarHBondContact O-N 2.85Å; V850-S854 PolarHBondContact O-N 3.48Å; V850-S854 PolarHBondContact O-OG 3.36Å
851	T	39.4	Very low	41.4	Very low	99 Å²	99	89.2 Å²	89.2	61%	0.607	49%	0.494	S	S	*	.	H	α-helix	trans	-70.3	-22	176.7	39.6	0	0	0	0	114.6	N849 S854 R855	N849-T851 PolarHBondContact O-N 3.37Å; T851-S854 PolarHBondContact O-OG 2.92Å; T851-R855 WeakPolarHBondContact O-CB 3.48Å; T851-R855 VanDerWaalsContact O-CG 3.29Å; T851-R855 WeakPolarHBondContact O-CG 3.18Å; T851-R855 PolarHBondContact O-N 3.1Å
852	Q	41.5	Very low	41.2	Very low	59 Å²	59	89.4 Å²	89.4	28%	0.276	49%	0.488	S	S	.	.	H	α-helix	trans	-80.6	-37.8	168	-75.5	-171.6	-5.7	0	0	111.2	N849 V850 R855 I856	N849-Q852 PolarHBondContact ND2-OE1 3.42Å; N849-Q852 PolarHBondContact O-N 3.26Å; N849-Q852 WeakPolarHBondContact OD1-CB 3.05Å; N849-Q852 VanDerWaalsContact OD1-CD 3.24Å; N849-Q852 WeakPolarHBondContact OD1-CG 3.31Å; N849-Q852 PolarHBondContact OD1-OE1 2.99Å; V850-Q852 PolarHBondContact O-N 3.47Å; Q852-R855 PolarHBondContact O-N 2.03Å; Q852-I856 VanDerWaalsContact O-CG1 3.31Å; Q852-I856 WeakPolarHBondContact O-CG1 3.17Å; Q852-I856 PolarHBondContact O-N 3Å
853	K	42.8	Very low	40.7	Very low	89 Å²	89	89.5 Å²	89.5	39%	0.387	49%	0.49	S	S	.	.	H	α-helix	trans	-58.2	-52.2	173.4	-168	-179.7	-164.2	-89.2	0	111.2	L845 N849 V850 R855 I856 E857	L845-K853 HydrophobicContact CD1-CB 4Å; L845-K853 HydrophobicContact CD1-CD 3.73Å; L845-K853 HydrophobicContact CD1-CG 3.68Å; N849-K853 PolarHBondContact O-N 3.12Å; V850-K853 WeakPolarHBondContact O-CB 3.4Å; V850-K853 PolarHBondContact O-N 2.85Å; K853-R855 VanDerWaalsContact C-N 3.32Å; K853-R855 PolarHBondContact O-N 3.08Å; K853-I856 PolarHBondContact O-N 3.06Å; K853-I856 VanDerWaalsContact O-N 3.13Å; K853-E857 HydrophobicContact CG-CG 4.45Å; K853-E857 IonicContact NZ-OE1 2.62Å; K853-E857 PolarHBondContact NZ-OE1 3.04Å; K853-E857 IonicContact NZ-OE2 3.72Å; K853-E857 WeakPolarHBondContact O-CG 3.47Å; K853-E857 PolarHBondContact O-N 2.03Å
854	S	45.2	Very low	40.5	Very low	53 Å²	53	87.4 Å²	87.4	37%	0.371	47%	0.472	S	S	.	.	H	α-helix	trans	-63.7	-35.7	-179.6	63.8	0	0	0	0	112.7	V850 T851 E857 Q858	V850-S854 PolarHBondContact O-N 3.48Å; V850-S854 PolarHBondContact O-OG 3.36Å; T851-S854 PolarHBondContact O-OG 2.92Å; S854-E857 PolarHBondContact O-N 2.79Å; S854-Q858 WeakPolarHBondContact O-CB 3.41Å; S854-Q858 PolarHBondContact O-N 2.91Å
855	R	42.3	Very low	40	Very low	180 Å²	180	88.6 Å²	88.6	68%	0.679	47%	0.468	S	S	*	.	H	α-helix	trans	-63.3	-41.5	172.2	-84.4	176.6	160.3	-174.8	-6	112.9	T851 Q852 K853 V859	T851-R855 WeakPolarHBondContact O-CB 3.48Å; T851-R855 VanDerWaalsContact O-CG 3.29Å; T851-R855 WeakPolarHBondContact O-CG 3.18Å; T851-R855 PolarHBondContact O-N 3.1Å; Q852-R855 PolarHBondContact O-N 2.03Å; K853-R855 VanDerWaalsContact C-N 3.32Å; K853-R855 PolarHBondContact O-N 3.08Å; R855-V859 VanDerWaalsContact O-CG2 3.3Å; R855-V859 WeakPolarHBondContact O-CG2 3.46Å; R855-V859 PolarHBondContact O-N 2.73Å; R855-V859 VanDerWaalsContact O-N 3.09Å
856	I	44.7	Very low	39.7	Very low	36 Å²	36	92 Å²	92	19%	0.185	48%	0.482	C	S	.	.	H	α-helix	trans	-66.9	-43.8	176.8	-68.4	164.5	0	0	0	110.3	Q852 K853 I860	Q852-I856 VanDerWaalsContact O-CG1 3.31Å; Q852-I856 WeakPolarHBondContact O-CG1 3.17Å; Q852-I856 PolarHBondContact O-N 3Å; K853-I856 PolarHBondContact O-N 3.06Å; K853-I856 VanDerWaalsContact O-N 3.13Å; I856-I860 HydrophobicContact CG2-CD1 3.97Å; I856-I860 WeakPolarHBondContact O-CD1 3.5Å; I856-I860 VanDerWaalsContact O-CG1 3.27Å; I856-I860 WeakPolarHBondContact O-CG1 3.22Å; I856-I860 PolarHBondContact O-N 3.38Å; I856-I860 VanDerWaalsContact O-N 3.15Å
857	E	46	Very low	39.4	Very low	89 Å²	89	92.2 Å²	92.2	42%	0.416	49%	0.487	S	S	.	.	H	α-helix	trans	-64.3	-42.4	177.1	-70	173.2	145	0	0	112.2	K853 S854 I860 D861	K853-E857 HydrophobicContact CG-CG 4.45Å; K853-E857 IonicContact NZ-OE1 2.62Å; K853-E857 PolarHBondContact NZ-OE1 3.04Å; K853-E857 IonicContact NZ-OE2 3.72Å; K853-E857 WeakPolarHBondContact O-CG 3.47Å; K853-E857 PolarHBondContact O-N 2.03Å; S854-E857 PolarHBondContact O-N 2.79Å; E857-I860 WeakPolarHBondContact O-CB 3.4Å; E857-I860 PolarHBondContact O-N 2.84Å; E857-I860 VanDerWaalsContact O-N 3.15Å; E857-D861 PolarHBondContact O-N 2.86Å
858	Q	45.2	Very low	39.2	Very low	119 Å²	119	96.3 Å²	96.3	56%	0.556	49%	0.494	S	S	*	.	H	α-helix	trans	-62.7	-45.9	177.6	-173.8	169.6	15.3	0	0	111.8	S854 I860 D861 D862	S854-Q858 WeakPolarHBondContact O-CB 3.41Å; S854-Q858 PolarHBondContact O-N 2.91Å; Q858-I860 PolarHBondContact O-N 3.06Å; Q858-D861 PolarHBondContact O-N 3.15Å; Q858-D861 VanDerWaalsContact O-N 3.13Å; Q858-D862 PolarHBondContact O-N 3.06Å
859	V	41.6	Very low	38.9	Very low	39 Å²	39	94.7 Å²	94.7	24%	0.236	50%	0.495	C	S	.	.	H	α-helix	trans	-61.4	-31	174.3	168.3	0	0	0	0	112.1	R855 N863 I891	R855-V859 VanDerWaalsContact O-CG2 3.3Å; R855-V859 WeakPolarHBondContact O-CG2 3.46Å; R855-V859 PolarHBondContact O-N 2.73Å; R855-V859 VanDerWaalsContact O-N 3.09Å; V859-N863 PolarHBondContact O-ND2 2.79Å; V859-I891 HydrophobicContact CG1-CD1 3.98Å; V859-I891 HydrophobicContact CG2-CD1 3.98Å; V859-I891 HydrophobicContact CG2-CG1 4.44Å; V859-I891 HydrophobicContact CG2-CG2 4.08Å
860	I	43.5	Very low	38.3	Very low	64 Å²	64	99.5 Å²	99.5	33%	0.328	53%	0.526	S	S	.	.	H	α-helix	trans	-73.2	-35.6	175.8	-72.1	165.6	0	0	0	111.9	I856 E857 Q858	I856-I860 HydrophobicContact CG2-CD1 3.97Å; I856-I860 WeakPolarHBondContact O-CD1 3.5Å; I856-I860 VanDerWaalsContact O-CG1 3.27Å; I856-I860 WeakPolarHBondContact O-CG1 3.22Å; I856-I860 PolarHBondContact O-N 3.38Å; I856-I860 VanDerWaalsContact O-N 3.15Å; E857-I860 WeakPolarHBondContact O-CB 3.4Å; E857-I860 PolarHBondContact O-N 2.84Å; E857-I860 VanDerWaalsContact O-N 3.15Å; Q858-I860 PolarHBondContact O-N 3.06Å
861	D	42.9	Very low	37.6	Very low	82 Å²	82	103.2 Å²	103.2	44%	0.439	54%	0.537	S	S	.	.	H	α-helix	trans	-83	-36.4	179.8	-85.5	-14.1	0	0	0	113.9	E857 Q858 N863 K864 C865	E857-D861 PolarHBondContact O-N 2.86Å; Q858-D861 PolarHBondContact O-N 3.15Å; Q858-D861 VanDerWaalsContact O-N 3.13Å; D861-N863 PolarHBondContact O-N 2.98Å; D861-K864 WeakPolarHBondContact O-CB 3.46Å; D861-K864 PolarHBondContact O-N 3.34Å; D861-K864 WeakPolarHBondContact OD1-CD 3.33Å; D861-K864 WeakPolarHBondContact OD1-CE 3.3Å; D861-K864 IonicContact OD1-NZ 2.62Å; D861-K864 PolarHBondContact OD1-NZ 2.83Å; D861-C865 PolarHBondContact O-N 3.32Å
862	D	41.4	Very low	36.9	Very low	88 Å²	88	106.6 Å²	106.6	47%	0.471	55%	0.548	S	S	.	.	H	α-helix	trans	-57.5	-36.8	173.9	-73.3	-32.4	0	0	0	111.3	Q858 K864 C865 Q866	Q858-D862 PolarHBondContact O-N 3.06Å; D862-K864 VanDerWaalsContact C-N 3.25Å; D862-K864 PolarHBondContact O-N 2.93Å; D862-C865 PolarHBondContact O-N 3.42Å; D862-Q866 PolarHBondContact O-N 3.44Å
863	N	35.1	Very low	36.4	Very low	69 Å²	69	112.2 Å²	112.2	37%	0.369	58%	0.579	S	S	.	*	H	α-helix	trans	-64.6	-20.9	173.9	-91.4	-88.9	0	0	0	114.4	V859 D861 N867	V859-N863 PolarHBondContact O-ND2 2.79Å; D861-N863 PolarHBondContact O-N 2.98Å; N863-N867 PolarHBondContact O-ND2 3.07Å; N863-N867 VanDerWaalsContact O-ND2 3.1Å
864	K	35.3	Very low	35.7	Very low	131 Å²	131	112.2 Å²	112.2	57%	0.57	59%	0.59	S	S	*	*	H	α-helix	trans	-81.4	-31.9	174.5	-62.2	174.7	-170.8	162.8	0	112	D861 D862	D861-K864 WeakPolarHBondContact O-CB 3.46Å; D861-K864 PolarHBondContact O-N 3.34Å; D861-K864 WeakPolarHBondContact OD1-CD 3.33Å; D861-K864 WeakPolarHBondContact OD1-CE 3.3Å; D861-K864 IonicContact OD1-NZ 2.62Å; D861-K864 PolarHBondContact OD1-NZ 2.83Å; D862-K864 VanDerWaalsContact C-N 3.25Å; D862-K864 PolarHBondContact O-N 2.93Å
865	C	29	Very low	34.8	Very low	99 Å²	99	115.8 Å²	115.8	67%	0.669	61%	0.605	S	S	*	*	H	α-helix	trans	-75.7	-36.3	-175.9	-70.6	0	0	0	0	113.1	D861 D862 N867	D861-C865 PolarHBondContact O-N 3.32Å; D862-C865 PolarHBondContact O-N 3.42Å; C865-N867 PolarHBondContact O-N 3.3Å
866	Q	34	Very low	34.1	Very low	149 Å²	149	116.4 Å²	116.4	70%	0.696	61%	0.613	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.3	-10.8	-177.3	-67.9	-175.7	-16.3	0	0	115	D862	D862-Q866 PolarHBondContact O-N 3.44Å
867	N	30.6	Very low	33.1	Very low	131 Å²	131	119.5 Å²	119.5	70%	0.701	64%	0.643	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.4	25.9	-175.5	-76.5	-78.3	0	0	0	114.2	N863 C865	N863-N867 PolarHBondContact O-ND2 3.07Å; N863-N867 VanDerWaalsContact O-ND2 3.1Å; C865-N867 PolarHBondContact O-N 3.3Å
868	K	29.2	Very low	32.1	Very low	194 Å²	194	118.3 Å²	118.3	84%	0.843	66%	0.655	S	S	*	*	S	Bend	trans	-135.1	80.8	177	-74.6	-171	175.8	-179.9	0	113.5
869	G	26.8	Very low	31.1	Very low	72 Å²	72	119.5 Å²	119.5	74%	0.742	67%	0.671	S	S	*	*			trans	116.8	81.3	153.5	0	0	0	0	0	116.9
870	V	28	Very low	30.3	Very low	152 Å²	152	126.7 Å²	126.7	92%	0.921	70%	0.702	S	S	*	*			trans	-137	98.8	139.5	-177.3	0	0	0	0	107.6
871	E	24.9	Very low	29.6	Very low	174 Å²	174	130.4 Å²	130.4	81%	0.813	72%	0.722	S	S	*	*			trans	-95.6	145.9	162.9	-79	-171.3	120.2	0	0	109.4
872	M	25.2	Very low	28.9	Very low	170 Å²	170	138 Å²	138	84%	0.837	75%	0.747	S	S	*	*			trans	46.2	108	158.5	-56.2	-179.1	84.5	0	0	118.5
873	L	30.3	Very low	28.2	Very low	176 Å²	176	141.7 Å²	141.7	92%	0.921	77%	0.765	S	S	*	*				-168.7	175.1	112	-101.6	164	0	0	0	111.2
874	S	27.5	Very low	27.9	Very low	90 Å²	90	142.9 Å²	142.9	63%	0.629	77%	0.772	S	S	*	*			trans	-143.8	156.7	-165.8	58.5	0	0	0	0	114.7
875	N	27.7	Very low	27.6	Very low	127 Å²	127	142.4 Å²	142.4	68%	0.679	78%	0.776	S	S	*	*			trans	94.4	114	164.7	-57	-78.7	0	0	0	118.9
876	K	26.6	Very low	27.7	Very low	194 Å²	194	142 Å²	142	84%	0.843	77%	0.767	S	S	*	*			trans	54.1	117.9	134	-55.4	175.8	-176.3	177.5	0	116.6
877	A	24.7	Very low	27.6	Very low	100 Å²	100	138.8 Å²	138.8	83%	0.826	75%	0.754	S	S	*	*			cis	-171.8	141.3	44.4	0	0	0	0	0	112.9
878	G	24.5	Very low	27.5	Very low	65 Å²	65	137.1 Å²	137.1	67%	0.67	75%	0.753	S	S	*	*	S	Bend	trans	83.5	153.1	175.9	0	0	0	0	0	113.6
879	T	24.8	Very low	27.8	Very low	143 Å²	143	133.9 Å²	133.9	88%	0.877	74%	0.738	S	S	*	*			trans	38.5	86.4	167.8	52.7	0	0	0	0	116.4
880	E	25.3	Very low	27.9	Very low	191 Å²	191	136.3 Å²	136.3	89%	0.893	73%	0.734	S	S	*	*			trans	-123.2	124.3	155.4	-72.1	-175.5	147	0	0	108.3
881	D	26.9	Very low	28.1	Very low	142 Å²	142	132.6 Å²	132.6	76%	0.759	71%	0.709	S	S	*	*			trans	-71.3	149.1	-175.4	-61.8	-80.5	0	0	0	112.2	L883	D881-L883 PolarHBondContact O-N 3.34Å; D881-L883 VanDerWaalsContact O-N 3.08Å
882	Y	28.1	Very low	28.5	Very low	241 Å²	241	128.8 Å²	128.8	95%	0.945	70%	0.697	S	S	*	*			trans	-72.6	102.3	167.4	-101.5	-92.4	0	0	0	109.3	D884	Y882-D884 PolarHBondContact O-N 3.02Å
883	L	27.3	Very low	28.6	Very low	165 Å²	165	123.6 Å²	123.6	86%	0.864	69%	0.687	S	S	*	*			trans	-60.4	120.6	-175.1	-79.5	97.4	0	0	0	113.2	D881 D885	D881-L883 PolarHBondContact O-N 3.34Å; D881-L883 VanDerWaalsContact O-N 3.08Å; L883-D885 PolarHBondContact O-N 2.95Å
884	D	28.3	Very low	28.9	Very low	95 Å²	95	120.5 Å²	120.5	51%	0.508	67%	0.671	S	S	.	*			trans	44.8	67.1	142.8	-157.2	-0.9	0	0	0	118.5	Y882 N886 L887	Y882-D884 PolarHBondContact O-N 3.02Å; D884-N886 PolarHBondContact O-N 3.29Å; D884-N886 WeakPolarHBondContact OD1-CA 3.42Å; D884-N886 WeakPolarHBondContact OD1-CB 3.44Å; D884-N886 PolarHBondContact OD1-N 3.23Å; D884-L887 PolarHBondContact OD1-N 3.39Å
885	D	29.7	Very low	29.8	Very low	121 Å²	121	119.2 Å²	119.2	65%	0.647	66%	0.656	S	S	*	*	S	Bend	trans	-87	26.3	157	-155	34.3	0	0	0	111.2	L883 K889	L883-D885 PolarHBondContact O-N 2.95Å; D885-K889 PolarHBondContact O-NZ 2.84Å; D885-K889 IonicContact OD2-NZ 3.75Å
886	N	31.6	Very low	31.4	Very low	91 Å²	91	115.1 Å²	115.1	49%	0.487	64%	0.637	S	S	.	*			trans	-113.7	-24	-171.3	-81.4	-30	0	0	0	114	D884 S888 K889 N890	D884-N886 PolarHBondContact O-N 3.29Å; D884-N886 WeakPolarHBondContact OD1-CA 3.42Å; D884-N886 WeakPolarHBondContact OD1-CB 3.44Å; D884-N886 PolarHBondContact OD1-N 3.23Å; N886-S888 PolarHBondContact O-N 3.36Å; N886-K889 WeakPolarHBondContact O-CB 3.46Å; N886-K889 PolarHBondContact O-N 3.01Å; N886-N890 PolarHBondContact O-N 3.39Å; N886-N890 PolarHBondContact O-ND2 3.35Å; N886-N890 VanDerWaalsContact O-ND2 3.13Å
887	L	31.9	Very low	33.3	Very low	81 Å²	81	108.3 Å²	108.3	42%	0.424	61%	0.609	S	S	.	*	T	Hydrogen-bonded Turn	trans	-64.3	-24.9	179.2	-151.6	69.9	0	0	0	113.3	D884 K889 I891	D884-L887 PolarHBondContact OD1-N 3.39Å; L887-K889 VanDerWaalsContact C-N 3.28Å; L887-K889 PolarHBondContact O-N 3.33Å; L887-I891 HydrophobicContact CG-CD1 4.36Å
888	S	28.7	Very low	35.6	Very low	96 Å²	96	104.1 Å²	104.1	67%	0.671	57%	0.573	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.1	-11.3	170.9	59.2	0	0	0	0	114.5	N886	N886-S888 PolarHBondContact O-N 3.36Å
889	K	34.1	Very low	37.8	Very low	126 Å²	126	101.3 Å²	101.3	55%	0.548	54%	0.542	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.9	-13.9	179.9	-61.9	176.4	-177.5	116.3	0	113.4	D885 N886 L887	D885-K889 PolarHBondContact O-NZ 2.84Å; D885-K889 IonicContact OD2-NZ 3.75Å; N886-K889 WeakPolarHBondContact O-CB 3.46Å; N886-K889 PolarHBondContact O-N 3.01Å; L887-K889 VanDerWaalsContact C-N 3.28Å; L887-K889 PolarHBondContact O-N 3.33Å
890	N	30.8	Very low	40.1	Very low	122 Å²	122	96 Å²	96	65%	0.652	51%	0.509	S	S	*	.	S	Bend	trans	-108.5	0.1	-172.2	-73	-43.8	0	0	0	114.6	N886	N886-N890 PolarHBondContact O-N 3.39Å; N886-N890 PolarHBondContact O-ND2 3.35Å; N886-N890 VanDerWaalsContact O-ND2 3.13Å
891	I	30.7	Very low	42.4	Very low	75 Å²	75	87 Å²	87	39%	0.385	47%	0.466	S	S	.	.	S	Bend	trans	-107	110.9	175.1	-62.4	171.8	0	0	0	108.2	V859 L887	V859-I891 HydrophobicContact CG1-CD1 3.98Å; V859-I891 HydrophobicContact CG2-CD1 3.98Å; V859-I891 HydrophobicContact CG2-CG1 4.44Å; V859-I891 HydrophobicContact CG2-CG2 4.08Å; L887-I891 HydrophobicContact CG-CD1 4.36Å
892	V	32.9	Very low	44.9	Very low	94 Å²	94	80.2 Å²	80.2	57%	0.57	43%	0.43	S	S	*	.			trans	69.1	90	-171.1	-166.4	0	0	0	0	113.9	Q895	V892-Q895 HydrophobicContact CG1-CB 3.83Å; V892-Q895 WeakPolarHBondContact CG1-O 3.5Å
893	G	29.1	Very low	47.3	Very low	61 Å²	61	74.1 Å²	74.1	63%	0.629	41%	0.41	S	S	*	.	S	Bend	trans	-64.5	153.4	151.8	0	0	0	0	0	111	Q895	G893-Q895 VanDerWaalsContact C-N 3.27Å; G893-Q895 PolarHBondContact O-N 3.45Å
894	D	35.5	Very low	49.7	Very low	111 Å²	111	68.8 Å²	68.8	59%	0.594	38%	0.381	S	S	*	.	S	Bend	trans	65.9	-11.6	169.5	-65.1	5.7	0	0	0	119.6	D930 S931	D894-D930 WeakPolarHBondContact O-CB 3.29Å; D894-S931 WeakPolarHBondContact CB-OG 3.35Å; D894-S931 VanDerWaalsContact CG-CB 3.41Å; D894-S931 WeakPolarHBondContact OD2-CB 3.38Å; D894-S931 PolarHBondContact OD2-OG 2.97Å
895	Q	46.6	Very low	52.3	Low	63 Å²	63	67.5 Å²	67.5	29%	0.294	38%	0.375	S	S	.	.			trans	-132	112.2	177	-68.4	-172.2	-30.2	0	0	113	V892 G893 H899	V892-Q895 HydrophobicContact CG1-CB 3.83Å; V892-Q895 WeakPolarHBondContact CG1-O 3.5Å; G893-Q895 VanDerWaalsContact C-N 3.27Å; G893-Q895 PolarHBondContact O-N 3.45Å; Q895-H899 HydrophobicContact CB-CB 4.43Å
896	S	61.5	Low	54.4	Low	41 Å²	41	62.8 Å²	62.8	29%	0.287	35%	0.35	S	S	.	.			trans	-68	156.3	170	67.3	0	0	0	0	111.5	L898 H899 L900	S896-L898 PolarHBondContact O-N 2.97Å; S896-H899 WeakPolarHBondContact O-CB 3.36Å; S896-H899 PolarHBondContact O-N 3.01Å; S896-H899 PolarHBondContact OG-ND1 2.9Å; S896-L900 PolarHBondContact O-N 3.06Å
897	L	66.3	Low	56.4	Low	50 Å²	50	59.1 Å²	59.1	26%	0.262	33%	0.334	S	S	.	.	H	α-helix	trans	-52	-31.3	178.1	-171.5	64.2	0	0	0	112.9	V835 F836 I839 L900 A901 I914	V835-L897 HydrophobicContact CG1-CD2 4Å; F836-L897 HydrophobicContact CE2-CD1 4.4Å; I839-L897 HydrophobicContact CD1-CD1 3.65Å; L897-L900 PolarHBondContact O-N 3.48Å; L897-A901 WeakPolarHBondContact O-CB 3.31Å; L897-A901 PolarHBondContact O-N 3.25Å; L897-I914 HydrophobicContact CD2-CD1 4.45Å; L897-I914 HydrophobicContact CD2-CG1 4.23Å; L897-I914 HydrophobicContact CG-CD1 4.17Å; L897-I914 HydrophobicContact CG-CG1 4.44Å
898	L	72.6	Confident	58.5	Low	13 Å²	13	59.4 Å²	59.4	7%	0.068	33%	0.333	C	S	.	.	H	α-helix	trans	-65.7	-34.1	175.2	-172.4	63.9	0	0	0	113.3	S896 A902 I911 I914 A936 L952	S896-L898 PolarHBondContact O-N 2.97Å; L898-A902 WeakPolarHBondContact O-CB 3.34Å; L898-A902 PolarHBondContact O-N 3.27Å; L898-I911 HydrophobicContact CD1-CG2 4.26Å; L898-I914 HydrophobicContact CB-CG2 4Å; L898-I914 HydrophobicContact CD1-CB 4.5Å; L898-I914 HydrophobicContact CD1-CG2 3.98Å; L898-A936 HydrophobicContact CD2-CB 3.95Å; L898-A936 HydrophobicContact CG-CB 3.81Å; L898-L952 HydrophobicContact CD1-CD2 4.14Å
899	H	72	Confident	60.5	Low	5 Å²	5	60.4 Å²	60.4	2%	0.023	33%	0.331	C	S	.	.	H	α-helix	trans	-70.8	-39.7	175.2	-74	89.2	0	0	0	112	Q895 S896 A902 H903 Y928 R934 A936	Q895-H899 HydrophobicContact CB-CB 4.43Å; S896-H899 WeakPolarHBondContact O-CB 3.36Å; S896-H899 PolarHBondContact O-N 3.01Å; S896-H899 PolarHBondContact OG-ND1 2.9Å; H899-A902 PolarHBondContact O-N 2.86Å; H899-H903 WeakPolarHBondContact O-CB 3.29Å; H899-H903 PolarHBondContact O-N 3.47Å; H899-Y928 PolarHBondContact CE1-O 3.47Å; H899-Y928 VanDerWaalsContact CE1-O 3.25Å; H899-R934 PolarHBondContact NE2-O 3.48Å; H899-R934 VanDerWaalsContact NE2-O 3.17Å; H899-A936 PolarHBondContact NE2-N 3.11Å
900	L	71.3	Confident	62.3	Low	33 Å²	33	56 Å²	56	17%	0.173	31%	0.313	C	S	.	.	H	α-helix	trans	-64.3	-47.5	174.6	-175.6	64.3	0	0	0	110.6	I839 S896 L897 A902 H903 M904	I839-L900 HydrophobicContact CG2-CD2 4.19Å; S896-L900 PolarHBondContact O-N 3.06Å; L897-L900 PolarHBondContact O-N 3.48Å; L900-A902 PolarHBondContact O-N 3.27Å; L900-H903 PolarHBondContact O-N 3.09Å; L900-M904 HydrophobicContact CD1-CG 4.3Å; L900-M904 HydrophobicContact CD1-SD 3.89Å; L900-M904 HydrophobicContact CD2-SD 4.41Å; L900-M904 HydrophobicContact CG-CG 4.49Å; L900-M904 HydrophobicContact CG-SD 3.82Å; L900-M904 WeakPolarHBondContact O-CB 3.42Å; L900-M904 VanDerWaalsContact O-CG 3.31Å; L900-M904 WeakPolarHBondContact O-CG 3.38Å; L900-M904 PolarHBondContact O-N 3.04Å
901	A	74.9	Confident	64.3	Low	0 Å²	0	50.2 Å²	50.2	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-57.6	-45.5	173.6	0	0	0	0	0	112.7	L897 H903 M904 V906 I911 I914 S948	L897-A901 WeakPolarHBondContact O-CB 3.31Å; L897-A901 PolarHBondContact O-N 3.25Å; A901-H903 VanDerWaalsContact C-N 3.33Å; A901-H903 PolarHBondContact O-N 3.07Å; A901-M904 PolarHBondContact O-N 3.24Å; A901-V906 HydrophobicContact CB-CG2 3.72Å; A901-V906 WeakPolarHBondContact O-CG2 3.13Å; A901-I911 HydrophobicContact CB-CG1 4.45Å; A901-I914 HydrophobicContact CB-CD1 3.46Å; A901-I914 VanDerWaalsContact CB-CD1 3.46Å; A901-S948 PolarHBondContact O-OG 2.75Å
902	A	80	Confident	66.3	Low	0 Å²	0	48.4 Å²	48.4	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-56.1	-45.9	176.1	0	0	0	0	0	112	L898 H899 L900 A936 A940 S945 S948 L952	L898-A902 WeakPolarHBondContact O-CB 3.34Å; L898-A902 PolarHBondContact O-N 3.27Å; H899-A902 PolarHBondContact O-N 2.86Å; L900-A902 PolarHBondContact O-N 3.27Å; A902-A936 HydrophobicContact CB-CB 4.21Å; A902-A936 WeakPolarHBondContact CB-O 3.42Å; A902-A940 HydrophobicContact CB-CB 4.07Å; A902-S945 WeakPolarHBondContact O-CB 3.34Å; A902-S945 PolarHBondContact O-OG 3.15Å; A902-S948 WeakPolarHBondContact O-CB 3.37Å; A902-S948 PolarHBondContact O-OG 3.22Å; A902-L952 HydrophobicContact CB-CD1 3.76Å
903	H	78.5	Confident	67.9	Low	113 Å²	113	49.6 Å²	49.6	52%	0.523	27%	0.271	S	S	.	.	H	α-helix	trans	-74.7	-23.2	179.7	-166.5	-43.7	0	0	0	113.7	H899 L900 A901 N905 A943 S945	H899-H903 WeakPolarHBondContact O-CB 3.29Å; H899-H903 PolarHBondContact O-N 3.47Å; L900-H903 PolarHBondContact O-N 3.09Å; A901-H903 VanDerWaalsContact C-N 3.33Å; A901-H903 PolarHBondContact O-N 3.07Å; H903-N905 VanDerWaalsContact C-N 3.35Å; H903-A943 HydrophobicContact CB-CB 4.17Å; H903-S945 PolarHBondContact O-OG 3.02Å
904	M	76.6	Confident	69.7	Low	54 Å²	54	47.5 Å²	47.5	27%	0.266	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.9	10.6	-179.4	-73.4	-177.2	74.2	0	0	113.9	I839 L842 L900 A901 V906	I839-M904 HydrophobicContact CG2-CE 4.17Å; I839-M904 HydrophobicContact CG2-SD 3.97Å; L842-M904 HydrophobicContact CB-CE 4.09Å; L842-M904 HydrophobicContact CD1-CE 3.78Å; L900-M904 HydrophobicContact CD1-CG 4.3Å; L900-M904 HydrophobicContact CD1-SD 3.89Å; L900-M904 HydrophobicContact CD2-SD 4.41Å; L900-M904 HydrophobicContact CG-CG 4.49Å; L900-M904 HydrophobicContact CG-SD 3.82Å; L900-M904 WeakPolarHBondContact O-CB 3.42Å; L900-M904 VanDerWaalsContact O-CG 3.31Å; L900-M904 WeakPolarHBondContact O-CG 3.38Å; L900-M904 PolarHBondContact O-N 3.04Å; A901-M904 PolarHBondContact O-N 3.24Å; M904-V906 HydrophobicContact CB-CG1 3.58Å; M904-V906 PolarHBondContact O-N 3.24Å; M904-V906 VanDerWaalsContact O-N 3.11Å
905	N	83.9	Confident	71	Confident	68 Å²	68	43.3 Å²	43.3	36%	0.364	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	48.4	35.3	-178.5	-161.6	41.2	0	0	0	114.9	H903 G907 S945 L946 E947 S948	H903-N905 VanDerWaalsContact C-N 3.35Å; N905-G907 PolarHBondContact O-N 3.43Å; N905-S945 WeakPolarHBondContact OD1-CA 3.49Å; N905-S945 PolarHBondContact OD1-O 2.88Å; N905-L946 PolarHBondContact OD1-N 3.03Å; N905-E947 PolarHBondContact OD1-N 2.85Å; N905-S948 VanDerWaalsContact CA-OG 3.28Å; N905-S948 WeakPolarHBondContact CA-OG 3.45Å; N905-S948 PolarHBondContact OD1-N 3.21Å
906	V	73.1	Confident	71.7	Confident	21 Å²	21	46.4 Å²	46.4	13%	0.127	24%	0.238	C	C	.	.			trans	-70.8	-1.9	-165.9	-55.6	0	0	0	0	115.3	L842 A901 M904 I910 I911	L842-V906 HydrophobicContact CD1-CG1 3.99Å; A901-V906 HydrophobicContact CB-CG2 3.72Å; A901-V906 WeakPolarHBondContact O-CG2 3.13Å; M904-V906 HydrophobicContact CB-CG1 3.58Å; M904-V906 PolarHBondContact O-N 3.24Å; M904-V906 VanDerWaalsContact O-N 3.11Å; V906-I910 HydrophobicContact CB-CB 3.98Å; V906-I910 HydrophobicContact CB-CD1 4.05Å; V906-I910 HydrophobicContact CB-CG2 3.97Å; V906-I910 HydrophobicContact CG2-CB 3.68Å; V906-I910 HydrophobicContact CG2-CG2 3.57Å; V906-I911 HydrophobicContact CG2-CD1 4.28Å; V906-I911 HydrophobicContact CG2-CG1 3.85Å
907	G	72.8	Confident	71.1	Confident	15 Å²	15	48.3 Å²	48.3	16%	0.155	25%	0.245	C	C	.	.	H	α-helix	trans	72.8	177	177.2	0	0	0	0	0	115	N905 D909 I911	N905-G907 PolarHBondContact O-N 3.43Å; G907-D909 PolarHBondContact O-N 3.27Å; G907-I911 PolarHBondContact O-N 2.7Å
908	H	75.6	Confident	70.1	Confident	86 Å²	86	50.1 Å²	50.1	40%	0.398	25%	0.252	S	S	.	.	H	α-helix	trans	-58.5	-49.6	-167.7	-175	-94.1	0	0	0	113.4	I910 I911 N912 S951	H908-I910 VanDerWaalsContact C-N 3.32Å; H908-I910 PolarHBondContact O-N 2.95Å; H908-I911 PolarHBondContact O-N 2.81Å; H908-N912 VanDerWaalsContact O-CB 3.23Å; H908-N912 WeakPolarHBondContact O-CB 3.22Å; H908-N912 PolarHBondContact O-N 3.19Å; H908-S951 WeakPolarHBondContact CA-OG 3.47Å; H908-S951 WeakPolarHBondContact CB-OG 3.48Å; H908-S951 PolarHBondContact N-OG 3.39Å
909	D	72.6	Confident	68.4	Low	118 Å²	118	55.3 Å²	55.3	63%	0.631	29%	0.286	S	S	*	.	H	α-helix	trans	-64.5	-34.1	-171.5	-66.4	-15	0	0	0	113.6	G907 K913	G907-D909 PolarHBondContact O-N 3.27Å; D909-K913 WeakPolarHBondContact O-CB 3.37Å; D909-K913 WeakPolarHBondContact O-CD 3.3Å; D909-K913 WeakPolarHBondContact O-CG 3.44Å; D909-K913 PolarHBondContact O-N 3.04Å; D909-K913 VanDerWaalsContact O-N 3.11Å
910	I	71.3	Confident	66.7	Low	33 Å²	33	59.9 Å²	59.9	17%	0.169	31%	0.311	C	S	.	.	H	α-helix	trans	-79.7	-42.2	179.2	-63.7	172.5	0	0	0	110.1	I838 V906 H908 N912 K913 I914	I838-I910 HydrophobicContact CG2-CD1 3.66Å; V906-I910 HydrophobicContact CB-CB 3.98Å; V906-I910 HydrophobicContact CB-CD1 4.05Å; V906-I910 HydrophobicContact CB-CG2 3.97Å; V906-I910 HydrophobicContact CG2-CB 3.68Å; V906-I910 HydrophobicContact CG2-CG2 3.57Å; H908-I910 VanDerWaalsContact C-N 3.32Å; H908-I910 PolarHBondContact O-N 2.95Å; I910-N912 VanDerWaalsContact C-N 3.34Å; I910-N912 PolarHBondContact O-N 2.99Å; I910-K913 PolarHBondContact O-N 2.99Å; I910-I914 HydrophobicContact CG2-CD1 3.97Å; I910-I914 VanDerWaalsContact O-CG1 3.29Å; I910-I914 WeakPolarHBondContact O-CG1 3.33Å; I910-I914 PolarHBondContact O-N 3Å
911	I	73.1	Confident	65.1	Low	0 Å²	0	65.2 Å²	65.2	0%	0	34%	0.335	C	S	.	.	H	α-helix	trans	-60.8	-44.8	173.8	-75.2	163.8	0	0	0	110.8	L898 A901 V906 G907 H908 I914 C915 L952 L955	L898-I911 HydrophobicContact CD1-CG2 4.26Å; A901-I911 HydrophobicContact CB-CG1 4.45Å; V906-I911 HydrophobicContact CG2-CD1 4.28Å; V906-I911 HydrophobicContact CG2-CG1 3.85Å; G907-I911 PolarHBondContact O-N 2.7Å; H908-I911 PolarHBondContact O-N 2.81Å; I911-I914 PolarHBondContact O-N 2.73Å; I911-C915 WeakPolarHBondContact O-CB 3.33Å; I911-C915 PolarHBondContact O-N 2.75Å; I911-C915 PolarHBondContact O-SG 2.96Å; I911-C915 VanDerWaalsContact O-SG 3.33Å; I911-L952 HydrophobicContact CD1-CD1 4.46Å; I911-L952 HydrophobicContact CD1-CG 4.28Å; I911-L952 HydrophobicContact CG2-CD2 3.74Å; I911-L952 HydrophobicContact CG2-CG 4.18Å; I911-L955 HydrophobicContact CG2-CD1 3.74Å
912	N	71.3	Confident	63.4	Low	37 Å²	37	70.8 Å²	70.8	20%	0.198	36%	0.356	C	S	.	.	H	α-helix	trans	-68.9	-37.4	-178.1	-158.1	36.3	0	0	0	111.8	H908 I910 C915 H916	H908-N912 VanDerWaalsContact O-CB 3.23Å; H908-N912 WeakPolarHBondContact O-CB 3.22Å; H908-N912 PolarHBondContact O-N 3.19Å; I910-N912 VanDerWaalsContact C-N 3.34Å; I910-N912 PolarHBondContact O-N 2.99Å; N912-C915 PolarHBondContact O-N 3Å; N912-H916 PolarHBondContact ND2-NE2 3.29Å; N912-H916 WeakPolarHBondContact O-CB 3.45Å; N912-H916 PolarHBondContact O-CD2 2.79Å; N912-H916 PolarHBondContact O-N 2.84Å; N912-H916 PolarHBondContact OD1-CD2 3.36Å; N912-H916 PolarHBondContact OD1-NE2 3.3Å
913	K	66.4	Low	61.5	Low	120 Å²	120	72.6 Å²	72.6	52%	0.522	37%	0.368	S	S	.	.	H	α-helix	trans	-60	-43.9	169.1	-78.9	172	-178	-178.3	0	112.4	D909 I910 H916 N917	D909-K913 WeakPolarHBondContact O-CB 3.37Å; D909-K913 WeakPolarHBondContact O-CD 3.3Å; D909-K913 WeakPolarHBondContact O-CG 3.44Å; D909-K913 PolarHBondContact O-N 3.04Å; D909-K913 VanDerWaalsContact O-N 3.11Å; I910-K913 PolarHBondContact O-N 2.99Å; K913-H916 PolarHBondContact O-N 2.83Å; K913-N917 WeakPolarHBondContact O-CB 3.23Å; K913-N917 VanDerWaalsContact O-CG 3.25Å; K913-N917 PolarHBondContact O-N 3.42Å; K913-N917 PolarHBondContact O-OD1 2.98Å
914	I	67.9	Low	59.8	Low	17 Å²	17	69 Å²	69	9%	0.087	35%	0.352	C	S	.	.	H	α-helix	trans	-64.1	-43.9	177.3	-68.5	164.5	0	0	0	110.6	V835 L897 L898 A901 I910 I911 H916	V835-I914 HydrophobicContact CG1-CD1 4.41Å; V835-I914 HydrophobicContact CG1-CG1 4.29Å; L897-I914 HydrophobicContact CD2-CD1 4.45Å; L897-I914 HydrophobicContact CD2-CG1 4.23Å; L897-I914 HydrophobicContact CG-CD1 4.17Å; L897-I914 HydrophobicContact CG-CG1 4.44Å; L898-I914 HydrophobicContact CB-CG2 4Å; L898-I914 HydrophobicContact CD1-CB 4.5Å; L898-I914 HydrophobicContact CD1-CG2 3.98Å; A901-I914 HydrophobicContact CB-CD1 3.46Å; A901-I914 VanDerWaalsContact CB-CD1 3.46Å; I910-I914 HydrophobicContact CG2-CD1 3.97Å; I910-I914 VanDerWaalsContact O-CG1 3.29Å; I910-I914 WeakPolarHBondContact O-CG1 3.33Å; I910-I914 PolarHBondContact O-N 3Å; I911-I914 PolarHBondContact O-N 2.73Å; I914-H916 VanDerWaalsContact C-N 3.33Å; I914-H916 PolarHBondContact O-N 3.17Å
915	C	63.7	Low	58	Low	22 Å²	22	66.8 Å²	66.8	15%	0.149	34%	0.343	C	S	.	.	H	α-helix	trans	-67.9	-26.8	178.1	-71.1	0	0	0	0	114.2	I911 N912 L924	I911-C915 WeakPolarHBondContact O-CB 3.33Å; I911-C915 PolarHBondContact O-N 2.75Å; I911-C915 PolarHBondContact O-SG 2.96Å; I911-C915 VanDerWaalsContact O-SG 3.33Å; N912-C915 PolarHBondContact O-N 3Å; C915-L924 HydrophobicContact CB-CD2 3.57Å; C915-L924 HydrophobicContact CB-CG 4.01Å
916	H	61.1	Low	56	Low	128 Å²	128	65.7 Å²	65.7	59%	0.593	34%	0.339	S	S	*	.	H	α-helix	trans	-94.4	-16	179.3	-72.4	-33.4	0	0	0	114.8	N912 K913 I914	N912-H916 PolarHBondContact ND2-NE2 3.29Å; N912-H916 WeakPolarHBondContact O-CB 3.45Å; N912-H916 PolarHBondContact O-CD2 2.79Å; N912-H916 PolarHBondContact O-N 2.84Å; N912-H916 PolarHBondContact OD1-CD2 3.36Å; N912-H916 PolarHBondContact OD1-NE2 3.3Å; K913-H916 PolarHBondContact O-N 2.83Å; I914-H916 VanDerWaalsContact C-N 3.33Å; I914-H916 PolarHBondContact O-N 3.17Å
917	N	48	Very low	54.8	Low	81 Å²	81	67.7 Å²	67.7	43%	0.433	35%	0.349	S	S	.	.	S	Bend	trans	-82.7	-6.8	179.1	-80.2	8.5	0	0	0	114.5	K913	K913-N917 WeakPolarHBondContact O-CB 3.23Å; K913-N917 VanDerWaalsContact O-CG 3.25Å; K913-N917 PolarHBondContact O-N 3.42Å; K913-N917 PolarHBondContact O-OD1 2.98Å
918	E	46.4	Very low	53.8	Low	88 Å²	88	71.4 Å²	71.4	41%	0.411	36%	0.359	S	S	.	.	S	Bend	trans	-68.5	125.8	172.1	-78.9	-94.7	104.2	0	0	110.9	N920 Y928	E918-N920 PolarHBondContact O-N 3.12Å; E918-Y928 WeakPolarHBondContact OE2-CE2 3Å; E918-Y928 PolarHBondContact OE2-OH 2.95Å
919	P	35.5	Very low	52.9	Low	122 Å²	122	70.9 Å²	70.9	79%	0.792	36%	0.361	S	S	*	.	S	Bend	trans	-65.8	7.5	-175	-24.7	35	0	0	0	117.2
920	N	36.6	Very low	51.9	Low	102 Å²	102	65.6 Å²	65.6	55%	0.545	33%	0.333	S	S	.	.	S	Bend	trans	-139	123.7	-177.3	-73.4	-88.4	0	0	0	109.9	E918 R922	E918-N920 PolarHBondContact O-N 3.12Å; N920-R922 HydrophobicContact CB-CG 4.43Å; N920-R922 PolarHBondContact O-N 2.9Å
921	Q	36.9	Very low	50.9	Low	144 Å²	144	66.4 Å²	66.4	67%	0.673	34%	0.341	S	S	*	.			trans	-70.6	54.3	-174.2	-57.1	-176.4	0.2	0	0	115.4	K964	Q921-K964 PolarHBondContact O-NZ 2.94Å
922	R	39.1	Very low	49.9	Very low	118 Å²	118	73.3 Å²	73.3	45%	0.445	37%	0.372	S	S	.	.	P	Polyproline II helix	trans	-75.2	144.7	177.4	-63.8	-178.9	-179.7	171.2	3	110.5	N920 L927	N920-R922 HydrophobicContact CB-CG 4.43Å; N920-R922 PolarHBondContact O-N 2.9Å; R922-L927 HydrophobicContact CB-CD1 4.39Å
923	P	40.9	Very low	49.3	Very low	37 Å²	37	71.6 Å²	71.6	24%	0.24	36%	0.362	C	S	.	.	P	Polyproline II helix	trans	-61.3	149.6	175	-21.7	33.8	0	0	0	112.5	A959 K964	P923-A959 HydrophobicContact CB-CB 4.07Å; P923-K964 HydrophobicContact CG-CB 4.33Å; P923-K964 HydrophobicContact CG-CD 4.46Å
924	L	42.6	Very low	49.2	Very low	38 Å²	38	69.7 Å²	69.7	20%	0.199	35%	0.352	C	S	.	.	S	Bend	trans	-86.5	164.7	-165.1	-70.8	66.3	0	0	0	112.3	C915 T926 L955	C915-L924 HydrophobicContact CB-CD2 3.57Å; C915-L924 HydrophobicContact CB-CG 4.01Å; L924-T926 VanDerWaalsContact C-N 3.29Å; L924-T926 PolarHBondContact O-N 3.06Å; L924-L955 HydrophobicContact CB-CB 4.27Å; L924-L955 HydrophobicContact CD2-CB 3.76Å; L924-L955 HydrophobicContact CD2-CD1 4.08Å; L924-L955 HydrophobicContact CD2-CD2 3.69Å; L924-L955 HydrophobicContact CD2-CG 4.03Å
925	G	40.1	Very low	49.7	Very low	7 Å²	7	69.2 Å²	69.2	7%	0.072	35%	0.35	C	S	.	.	S	Bend	trans	78.3	-55.1	168	0	0	0	0	0	116.3
926	T	41	Very low	50.4	Low	45 Å²	45	68.2 Å²	68.2	28%	0.276	34%	0.343	S	S	.	.	S	Bend	trans	-92.3	-14.3	-163.3	45.7	0	0	0	0	116.1	L924 E956	L924-T926 VanDerWaalsContact C-N 3.29Å; L924-T926 PolarHBondContact O-N 3.06Å; T926-E956 HydrophobicContact CG2-CG 4.05Å; T926-E956 WeakPolarHBondContact CG2-OE1 3.01Å
927	L	48	Very low	51.5	Low	64 Å²	64	62.1 Å²	62.1	34%	0.335	32%	0.315	S	S	.	.	S	Bend	trans	-96.4	-16.7	-172.8	-76.2	173.8	0	0	0	115.4	R922 V969	R922-L927 HydrophobicContact CB-CD1 4.39Å; L927-V969 HydrophobicContact CD1-CG2 4.07Å; L927-V969 HydrophobicContact CD2-CB 3.94Å; L927-V969 HydrophobicContact CD2-CG2 3.6Å; L927-V969 HydrophobicContact CG-CG2 4.5Å
928	Y	51.4	Low	53.2	Low	93 Å²	93	58.4 Å²	58.4	37%	0.365	30%	0.295	S	S	.	.			trans	-103.9	102.6	170.2	-73.6	-63.8	0	0	0	108.6	H899 E918	H899-Y928 PolarHBondContact CE1-O 3.47Å; H899-Y928 VanDerWaalsContact CE1-O 3.25Å; E918-Y928 WeakPolarHBondContact OE2-CE2 3Å; E918-Y928 PolarHBondContact OE2-OH 2.95Å
929	V	56.1	Low	54.9	Low	74 Å²	74	54.6 Å²	54.6	45%	0.448	28%	0.279	S	S	.	.	B	Isolated β-bridge	trans	-97.5	148.6	164.5	-66.7	0	0	0	0	110.1	G933 R934 T935	V929-G933 VanDerWaalsContact CG1-O 3.31Å; V929-G933 WeakPolarHBondContact CG1-O 3.44Å; V929-R934 CarbonylContact C-O 3.6Å; V929-R934 VanDerWaalsContact CA-O 3.22Å; V929-R934 WeakPolarHBondContact CA-O 3.41Å; V929-T935 HydrophobicContact CG1-CG2 4.11Å
930	D	53.2	Low	57.4	Low	8 Å²	8	48.8 Å²	48.8	4%	0.043	24%	0.241	C	C	.	.			trans	-73.3	178	165.6	73.6	3.6	0	0	0	111.7	D894 F932 G933 R934	D894-D930 WeakPolarHBondContact O-CB 3.29Å; D930-F932 PolarHBondContact O-N 3.47Å; D930-F932 VanDerWaalsContact O-N 3.15Å; D930-F932 WeakPolarHBondContact OD1-CA 3.34Å; D930-F932 WeakPolarHBondContact OD1-CB 3.36Å; D930-F932 PolarHBondContact OD1-N 3.41Å; D930-G933 WeakPolarHBondContact O-CA 3.42Å; D930-G933 PolarHBondContact O-N 2.9Å; D930-G933 PolarHBondContact OD1-N 3.36Å; D930-R934 PolarHBondContact N-O 2.85Å; D930-R934 WeakPolarHBondContact OD1-CB 3Å; D930-R934 PolarHBondContact OD1-N 3.13Å; D930-R934 IonicContact OD1-NE 2.82Å; D930-R934 IonicContact OD2-CZ 2.83Å; D930-R934 IonicContact OD2-NE 2.63Å; D930-R934 PolarHBondContact OD2-NE 3.24Å; D930-R934 IonicContact OD2-NH2 2.67Å; D930-R934 PolarHBondContact OD2-NH2 2.89Å
931	S	49.6	Very low	59.9	Low	49 Å²	49	44 Å²	44	34%	0.343	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-17.6	179.3	54	0	0	0	0	114.4	D894 G933 R993	D894-S931 WeakPolarHBondContact CB-OG 3.35Å; D894-S931 VanDerWaalsContact CG-CB 3.41Å; D894-S931 WeakPolarHBondContact OD2-CB 3.38Å; D894-S931 PolarHBondContact OD2-OG 2.97Å; S931-G933 VanDerWaalsContact C-N 3.35Å; S931-R993 PolarHBondContact O-NH1 2.84Å
932	F	51.7	Low	62.3	Low	146 Å²	146	38.9 Å²	38.9	64%	0.64	20%	0.197	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.9	-10.6	172	-54.7	-85.1	0	0	0	112.5	D930 R934	D930-F932 PolarHBondContact O-N 3.47Å; D930-F932 VanDerWaalsContact O-N 3.15Å; D930-F932 WeakPolarHBondContact OD1-CA 3.34Å; D930-F932 WeakPolarHBondContact OD1-CB 3.36Å; D930-F932 PolarHBondContact OD1-N 3.41Å; F932-R934 HydrophobicContact CB-CG 4.39Å
933	G	59	Low	64.5	Low	0 Å²	0	34.5 Å²	34.5	0%	0	19%	0.186	C	C	.	.	S	Bend	trans	91	5.8	-177.3	0	0	0	0	0	114.6	V929 D930 S931	V929-G933 VanDerWaalsContact CG1-O 3.31Å; V929-G933 WeakPolarHBondContact CG1-O 3.44Å; D930-G933 WeakPolarHBondContact O-CA 3.42Å; D930-G933 PolarHBondContact O-N 2.9Å; D930-G933 PolarHBondContact OD1-N 3.36Å; S931-G933 VanDerWaalsContact C-N 3.35Å
934	R	64	Low	66.7	Low	80 Å²	80	36.6 Å²	36.6	30%	0.302	20%	0.196	S	C	.	.			trans	-78.1	132.7	-179.6	-64.6	-179.5	-61.2	-165.8	0.4	110	H899 V929 D930 F932 T938	H899-R934 PolarHBondContact NE2-O 3.48Å; H899-R934 VanDerWaalsContact NE2-O 3.17Å; V929-R934 CarbonylContact C-O 3.6Å; V929-R934 VanDerWaalsContact CA-O 3.22Å; V929-R934 WeakPolarHBondContact CA-O 3.41Å; D930-R934 PolarHBondContact N-O 2.85Å; D930-R934 WeakPolarHBondContact OD1-CB 3Å; D930-R934 PolarHBondContact OD1-N 3.13Å; D930-R934 IonicContact OD1-NE 2.82Å; D930-R934 IonicContact OD2-CZ 2.83Å; D930-R934 IonicContact OD2-NE 2.63Å; D930-R934 PolarHBondContact OD2-NE 3.24Å; D930-R934 IonicContact OD2-NH2 2.67Å; D930-R934 PolarHBondContact OD2-NH2 2.89Å; F932-R934 HydrophobicContact CB-CG 4.39Å; R934-T938 WeakPolarHBondContact CA-OG1 3.45Å; R934-T938 VanDerWaalsContact CB-OG1 3.29Å; R934-T938 WeakPolarHBondContact CB-OG1 3.44Å
935	T	78.1	Confident	69	Low	8 Å²	8	35 Å²	35	5%	0.049	19%	0.188	C	C	.	.	B	Isolated β-bridge	trans	-73.7	162.1	168.4	67.7	0	0	0	0	110.9	V929 L937 T938 S939	V929-T935 HydrophobicContact CG1-CG2 4.11Å; T935-L937 PolarHBondContact O-N 3.14Å; T935-L937 PolarHBondContact OG1-N 3.06Å; T935-T938 PolarHBondContact N-OG1 2.86Å; T935-T938 PolarHBondContact O-N 3.02Å; T935-T938 PolarHBondContact O-OG1 2.91Å; T935-T938 PolarHBondContact OG1-N 2.87Å; T935-T938 PolarHBondContact OG1-OG1 3.2Å; T935-S939 PolarHBondContact O-N 3.01Å
936	A	79.1	Confident	71.3	Confident	0 Å²	0	37 Å²	37	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-53.4	-38.6	172	0	0	0	0	0	112.6	L898 H899 A902 S939 A940 L952	L898-A936 HydrophobicContact CD2-CB 3.95Å; L898-A936 HydrophobicContact CG-CB 3.81Å; H899-A936 PolarHBondContact NE2-N 3.11Å; A902-A936 HydrophobicContact CB-CB 4.21Å; A902-A936 WeakPolarHBondContact CB-O 3.42Å; A936-S939 PolarHBondContact O-N 2.95Å; A936-A940 PolarHBondContact O-N 3.35Å; A936-L952 HydrophobicContact CB-CD1 4.19Å; A936-L952 HydrophobicContact CB-CD2 4.32Å
937	L	84.8	Confident	73.5	Confident	1 Å²	1	38.7 Å²	38.7	1%	0.005	20%	0.201	C	C	.	.	H	α-helix	trans	-63.2	-45.1	175.9	176	60.2	0	0	0	111.9	T935 S939 A940 A941 V949 L952 Y953 E956 P997	T935-L937 PolarHBondContact O-N 3.14Å; T935-L937 PolarHBondContact OG1-N 3.06Å; L937-S939 VanDerWaalsContact C-N 3.28Å; L937-S939 PolarHBondContact O-N 3.06Å; L937-A940 PolarHBondContact O-N 2.86Å; L937-A941 WeakPolarHBondContact O-CB 3.48Å; L937-A941 PolarHBondContact O-N 3.45Å; L937-V949 HydrophobicContact CD1-CB 4.49Å; L937-V949 HydrophobicContact CD1-CG1 4.16Å; L937-L952 HydrophobicContact CB-CB 4.13Å; L937-L952 HydrophobicContact CD1-CB 3.94Å; L937-Y953 HydrophobicContact CD2-CD2 4.1Å; L937-E956 WeakPolarHBondContact CD2-OE2 3.24Å; L937-P997 HydrophobicContact CD2-CB 4.23Å; L937-P997 HydrophobicContact CD2-CG 3.72Å; L937-P997 HydrophobicContact CG-CB 4.11Å; L937-P997 HydrophobicContact CG-CG 3.95Å
938	T	83.3	Confident	75.4	Confident	2 Å²	2	35.7 Å²	35.7	1%	0.012	19%	0.185	C	C	.	.	H	α-helix	trans	-65.4	-32.5	176.6	59.2	0	0	0	0	112.5	R934 T935 A941 A942 C995 P997 V1000	R934-T938 WeakPolarHBondContact CA-OG1 3.45Å; R934-T938 VanDerWaalsContact CB-OG1 3.29Å; R934-T938 WeakPolarHBondContact CB-OG1 3.44Å; T935-T938 PolarHBondContact N-OG1 2.86Å; T935-T938 PolarHBondContact O-N 3.02Å; T935-T938 PolarHBondContact O-OG1 2.91Å; T935-T938 PolarHBondContact OG1-N 2.87Å; T935-T938 PolarHBondContact OG1-OG1 3.2Å; T938-A941 PolarHBondContact O-N 2.82Å; T938-A942 WeakPolarHBondContact O-CB 3.38Å; T938-A942 PolarHBondContact O-N 2.99Å; T938-C995 HydrophobicContact CG2-CB 4.31Å; T938-C995 WeakPolarHBondContact CG2-O 3.16Å; T938-P997 HydrophobicContact CG2-CB 4.35Å; T938-P997 HydrophobicContact CG2-CG 3.94Å; T938-V1000 HydrophobicContact CG2-CG2 4.44Å
939	S	82.7	Confident	77.2	Confident	9 Å²	9	31.3 Å²	31.3	6%	0.063	17%	0.168	C	C	.	.	H	α-helix	trans	-70.4	-39.7	174.3	-71.2	0	0	0	0	112.5	T935 A936 L937 A941 A942 A943	T935-S939 PolarHBondContact O-N 3.01Å; A936-S939 PolarHBondContact O-N 2.95Å; L937-S939 VanDerWaalsContact C-N 3.28Å; L937-S939 PolarHBondContact O-N 3.06Å; S939-A941 VanDerWaalsContact C-N 3.32Å; S939-A942 PolarHBondContact O-N 3.48Å; S939-A943 VanDerWaalsContact O-CB 3.24Å; S939-A943 WeakPolarHBondContact O-CB 3.46Å; S939-A943 PolarHBondContact O-N 3.21Å
940	A	88.1	Confident	78.7	Confident	0 Å²	0	31.2 Å²	31.2	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-62.3	-39.8	169.6	0	0	0	0	0	112	A902 A936 L937 A943 N944 S945 V949 L952	A902-A940 HydrophobicContact CB-CB 4.07Å; A936-A940 PolarHBondContact O-N 3.35Å; L937-A940 PolarHBondContact O-N 2.86Å; A940-A943 CarbonylContact O-C 3.52Å; A940-A943 PolarHBondContact O-N 3.07Å; A940-N944 PolarHBondContact O-N 2.76Å; A940-S945 PolarHBondContact O-N 2.9Å; A940-V949 HydrophobicContact CB-CG2 3.71Å; A940-L952 HydrophobicContact CB-CD1 3.99Å
941	A	88.8	Confident	80.2	Confident	0 Å²	0	31.1 Å²	31.1	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-68.5	-33.8	179.5	0	0	0	0	0	113	L937 T938 S939 V949 P997 A1001 N1006 V1009	L937-A941 WeakPolarHBondContact O-CB 3.48Å; L937-A941 PolarHBondContact O-N 3.45Å; T938-A941 PolarHBondContact O-N 2.82Å; S939-A941 VanDerWaalsContact C-N 3.32Å; A941-V949 HydrophobicContact CB-CG2 4.25Å; A941-P997 HydrophobicContact CB-CB 4.4Å; A941-A1001 HydrophobicContact CB-CB 4.33Å; A941-N1006 PolarHBondContact O-ND2 3.45Å; A941-V1009 HydrophobicContact CB-CG1 4.24Å
942	A	86.4	Confident	81.9	Confident	37 Å²	37	28.9 Å²	28.9	31%	0.306	15%	0.146	S	C	.	.	H	α-helix	trans	-70.8	-40.4	170	0	0	0	0	0	112.4	T938 S939 N944 V1000 N1006	T938-A942 WeakPolarHBondContact O-CB 3.38Å; T938-A942 PolarHBondContact O-N 2.99Å; S939-A942 PolarHBondContact O-N 3.48Å; A942-N944 PolarHBondContact O-N 3.13Å; A942-V1000 HydrophobicContact CB-CG1 3.75Å; A942-N1006 PolarHBondContact O-ND2 2.88Å
943	A	84.7	Confident	83.5	Confident	26 Å²	26	23.4 Å²	23.4	22%	0.215	12%	0.121	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.6	21	-175.8	0	0	0	0	0	114.6	H903 S939 A940 S945	H903-A943 HydrophobicContact CB-CB 4.17Å; S939-A943 VanDerWaalsContact O-CB 3.24Å; S939-A943 WeakPolarHBondContact O-CB 3.46Å; S939-A943 PolarHBondContact O-N 3.21Å; A940-A943 CarbonylContact O-C 3.52Å; A940-A943 PolarHBondContact O-N 3.07Å; A943-S945 PolarHBondContact O-N 2.78Å; A943-S945 PolarHBondContact O-OG 2.88Å
944	N	88.9	Confident	84.5	Confident	82 Å²	82	26.5 Å²	26.5	44%	0.439	14%	0.136	S	C	.	.	T	Hydrogen-bonded Turn	trans	46.9	27.7	-176.6	-154.8	13.4	0	0	0	114.7	A940 A942 L946 N1006 V1009	A940-N944 PolarHBondContact O-N 2.76Å; A942-N944 PolarHBondContact O-N 3.13Å; N944-L946 PolarHBondContact O-N 2.99Å; N944-N1006 HydrophobicContact CB-CB 4.41Å; N944-N1006 WeakPolarHBondContact CB-OD1 3.02Å; N944-N1006 PolarHBondContact N-ND2 2.79Å; N944-V1009 WeakPolarHBondContact OD1-CG2 3.23Å
945	S	89.6	Confident	85	Confident	4 Å²	4	23 Å²	23	3%	0.028	12%	0.123	C	C	.	.			trans	-90.3	73	-165.8	-70.7	0	0	0	0	110.5	A902 H903 N905 A940 A943 E947 S948 V949	A902-S945 WeakPolarHBondContact O-CB 3.34Å; A902-S945 PolarHBondContact O-OG 3.15Å; H903-S945 PolarHBondContact O-OG 3.02Å; N905-S945 WeakPolarHBondContact OD1-CA 3.49Å; N905-S945 PolarHBondContact OD1-O 2.88Å; A940-S945 PolarHBondContact O-N 2.9Å; A943-S945 PolarHBondContact O-N 2.78Å; A943-S945 PolarHBondContact O-OG 2.88Å; S945-E947 VanDerWaalsContact C-N 3.35Å; S945-E947 PolarHBondContact O-N 3.18Å; S945-S948 CarbonylContact O-C 3.49Å; S945-S948 WeakPolarHBondContact O-CA 3.35Å; S945-S948 WeakPolarHBondContact O-CB 2.95Å; S945-S948 PolarHBondContact O-N 3.48Å; S945-V949 WeakPolarHBondContact O-CG2 3.12Å; S945-V949 PolarHBondContact O-N 2.77Å
946	L	89.3	Confident	84.7	Confident	50 Å²	50	24.6 Å²	24.6	26%	0.262	13%	0.13	S	C	.	.	H	α-helix	trans	-51.4	-42.9	-170.1	-177	63.7	0	0	0	114.8	N905 N944 V949 K950 V1009 C1012	N905-L946 PolarHBondContact OD1-N 3.03Å; N944-L946 PolarHBondContact O-N 2.99Å; L946-V949 PolarHBondContact O-N 3.14Å; L946-K950 WeakPolarHBondContact O-CG 3.42Å; L946-K950 PolarHBondContact O-N 3.44Å; L946-V1009 HydrophobicContact CD1-CG2 4.41Å; L946-C1012 HydrophobicContact CD1-CB 3.56Å
947	E	87.1	Confident	84.3	Confident	80 Å²	80	27.8 Å²	27.8	37%	0.374	14%	0.144	S	C	.	.	H	α-helix	trans	-75.4	-33.5	179.5	-59.2	-50.2	128.3	0	0	111.6	N905 S945 K950 S951	N905-E947 PolarHBondContact OD1-N 2.85Å; S945-E947 VanDerWaalsContact C-N 3.35Å; S945-E947 PolarHBondContact O-N 3.18Å; E947-K950 IonicContact OE1-NZ 3.9Å; E947-K950 PolarHBondContact OE1-NZ 3.01Å; E947-K950 WeakPolarHBondContact OE2-CD 3.44Å; E947-K950 IonicContact OE2-NZ 3.13Å; E947-K950 PolarHBondContact OE2-NZ 3.35Å; E947-S951 VanDerWaalsContact O-CB 3.32Å; E947-S951 WeakPolarHBondContact O-CB 3.42Å; E947-S951 PolarHBondContact O-N 2.96Å; E947-S951 VanDerWaalsContact O-N 3.09Å; E947-S951 PolarHBondContact O-OG 3.49Å
948	S	87.9	Confident	83.5	Confident	0 Å²	0	32.3 Å²	32.3	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-63.3	-42.3	168.3	-65.7	0	0	0	0	111.9	A901 A902 N905 S945 S951 L952	A901-S948 PolarHBondContact O-OG 2.75Å; A902-S948 WeakPolarHBondContact O-CB 3.37Å; A902-S948 PolarHBondContact O-OG 3.22Å; N905-S948 VanDerWaalsContact CA-OG 3.28Å; N905-S948 WeakPolarHBondContact CA-OG 3.45Å; N905-S948 PolarHBondContact OD1-N 3.21Å; S945-S948 CarbonylContact O-C 3.49Å; S945-S948 WeakPolarHBondContact O-CA 3.35Å; S945-S948 WeakPolarHBondContact O-CB 2.95Å; S945-S948 PolarHBondContact O-N 3.48Å; S948-S951 PolarHBondContact O-N 2.92Å; S948-L952 VanDerWaalsContact O-CB 3.3Å; S948-L952 WeakPolarHBondContact O-CB 3.22Å; S948-L952 WeakPolarHBondContact O-CD1 3.21Å; S948-L952 VanDerWaalsContact O-CG 3.26Å; S948-L952 WeakPolarHBondContact O-CG 3.37Å; S948-L952 PolarHBondContact O-N 3.47Å
949	V	88.1	Confident	82.3	Confident	1 Å²	1	33.3 Å²	33.3	1%	0.006	17%	0.173	C	C	.	.	H	α-helix	trans	-62	-51.7	178.6	170.4	0	0	0	0	110.8	L937 A940 A941 S945 L946 S951 L952 Y953 V1009 L1013	L937-V949 HydrophobicContact CD1-CB 4.49Å; L937-V949 HydrophobicContact CD1-CG1 4.16Å; A940-V949 HydrophobicContact CB-CG2 3.71Å; A941-V949 HydrophobicContact CB-CG2 4.25Å; S945-V949 WeakPolarHBondContact O-CG2 3.12Å; S945-V949 PolarHBondContact O-N 2.77Å; L946-V949 PolarHBondContact O-N 3.14Å; V949-S951 VanDerWaalsContact C-N 3.31Å; V949-S951 PolarHBondContact O-N 2.76Å; V949-L952 PolarHBondContact O-N 2.9Å; V949-Y953 WeakPolarHBondContact O-CB 3.44Å; V949-Y953 PolarHBondContact O-N 2.77Å; V949-V1009 HydrophobicContact CG1-CG1 4.31Å; V949-V1009 HydrophobicContact CG2-CG1 4.02Å; V949-V1009 HydrophobicContact CG2-CG2 4.49Å; V949-L1013 HydrophobicContact CG1-CD2 3.8Å; V949-L1013 HydrophobicContact CG1-CG 4.1Å
950	K	88.2	Confident	81.1	Confident	72 Å²	72	39.1 Å²	39.1	31%	0.313	20%	0.203	S	C	.	.	H	α-helix	trans	-53.4	-49	175.7	-71.8	166	-179.3	171.3	0	111.7	L946 E947 Q954	L946-K950 WeakPolarHBondContact O-CG 3.42Å; L946-K950 PolarHBondContact O-N 3.44Å; E947-K950 IonicContact OE1-NZ 3.9Å; E947-K950 PolarHBondContact OE1-NZ 3.01Å; E947-K950 WeakPolarHBondContact OE2-CD 3.44Å; E947-K950 IonicContact OE2-NZ 3.13Å; E947-K950 PolarHBondContact OE2-NZ 3.35Å; K950-Q954 WeakPolarHBondContact O-CB 3.32Å; K950-Q954 PolarHBondContact O-N 3.06Å
951	S	84.9	Confident	79.7	Confident	6 Å²	6	44.4 Å²	44.4	4%	0.042	23%	0.231	C	C	.	.	H	α-helix	trans	-63.6	-53.2	-177.4	-54.9	0	0	0	0	111.4	H908 E947 S948 V949 Y953 Q954 L955	H908-S951 WeakPolarHBondContact CA-OG 3.47Å; H908-S951 WeakPolarHBondContact CB-OG 3.48Å; H908-S951 PolarHBondContact N-OG 3.39Å; E947-S951 VanDerWaalsContact O-CB 3.32Å; E947-S951 WeakPolarHBondContact O-CB 3.42Å; E947-S951 PolarHBondContact O-N 2.96Å; E947-S951 VanDerWaalsContact O-N 3.09Å; E947-S951 PolarHBondContact O-OG 3.49Å; S948-S951 PolarHBondContact O-N 2.92Å; V949-S951 VanDerWaalsContact C-N 3.31Å; V949-S951 PolarHBondContact O-N 2.76Å; S951-Y953 PolarHBondContact O-N 2.03Å; S951-Q954 PolarHBondContact O-N 3.36Å; S951-L955 WeakPolarHBondContact O-CB 3.43Å; S951-L955 WeakPolarHBondContact O-CD1 3.4Å; S951-L955 WeakPolarHBondContact O-CG 3.4Å; S951-L955 PolarHBondContact O-N 2.96Å
952	L	85.4	Confident	77.8	Confident	2 Å²	2	46.2 Å²	46.2	1%	0.01	24%	0.24	C	C	.	.	H	α-helix	trans	-66.4	-37.3	-177.9	-69	164.2	0	0	0	112	L898 A902 I911 A936 L937 A940 S948 V949 L955 E956	L898-L952 HydrophobicContact CD1-CD2 4.14Å; A902-L952 HydrophobicContact CB-CD1 3.76Å; I911-L952 HydrophobicContact CD1-CD1 4.46Å; I911-L952 HydrophobicContact CD1-CG 4.28Å; I911-L952 HydrophobicContact CG2-CD2 3.74Å; I911-L952 HydrophobicContact CG2-CG 4.18Å; A936-L952 HydrophobicContact CB-CD1 4.19Å; A936-L952 HydrophobicContact CB-CD2 4.32Å; L937-L952 HydrophobicContact CB-CB 4.13Å; L937-L952 HydrophobicContact CD1-CB 3.94Å; A940-L952 HydrophobicContact CB-CD1 3.99Å; S948-L952 VanDerWaalsContact O-CB 3.3Å; S948-L952 WeakPolarHBondContact O-CB 3.22Å; S948-L952 WeakPolarHBondContact O-CD1 3.21Å; S948-L952 VanDerWaalsContact O-CG 3.26Å; S948-L952 WeakPolarHBondContact O-CG 3.37Å; S948-L952 PolarHBondContact O-N 3.47Å; V949-L952 PolarHBondContact O-N 2.9Å; L952-L955 PolarHBondContact O-N 3.39Å; L952-E956 WeakPolarHBondContact O-CB 3.47Å; L952-E956 PolarHBondContact O-N 3.1Å
953	Y	84.1	Confident	75.8	Confident	32 Å²	32	50 Å²	50	13%	0.125	25%	0.25	C	S	.	.	H	α-helix	trans	-68.4	-40.9	177.4	-176	-93.5	0	0	0	112.2	L937 V949 S951 E956 K957 L1013 E1016 C1018	L937-Y953 HydrophobicContact CD2-CD2 4.1Å; V949-Y953 WeakPolarHBondContact O-CB 3.44Å; V949-Y953 PolarHBondContact O-N 2.77Å; S951-Y953 PolarHBondContact O-N 2.03Å; Y953-E956 PolarHBondContact O-N 3.49Å; Y953-K957 HydrophobicContact CD1-CD 4.27Å; Y953-K957 HydrophobicContact CE1-CD 3.8Å; Y953-K957 WeakPolarHBondContact O-CB 3.35Å; Y953-K957 PolarHBondContact O-N 2.96Å; Y953-L1013 HydrophobicContact CD2-CD2 4.07Å; Y953-L1013 HydrophobicContact CE2-CD2 4.47Å; Y953-E1016 HydrophobicContact CD1-CB 3.92Å; Y953-E1016 HydrophobicContact CD1-CG 4.4Å; Y953-E1016 HydrophobicContact CE1-CB 3.58Å; Y953-E1016 HydrophobicContact CE1-CG 4.46Å; Y953-E1016 WeakPolarHBondContact CE1-O 3.27Å; Y953-E1016 PolarHBondContact OH-O 3.49Å; Y953-E1016 VanDerWaalsContact OH-O 3.06Å; Y953-C1018 HydrophobicContact CE2-CB 4.11Å; Y953-C1018 WeakPolarHBondContact OH-CA 3.41Å; Y953-C1018 PolarHBondContact OH-N 3.21Å
954	Q	81	Confident	73.5	Confident	64 Å²	64	52.6 Å²	52.6	30%	0.299	26%	0.256	S	S	.	.	H	α-helix	trans	-65.6	-43.3	172.6	-76.3	-71.1	6.1	0	0	111.7	K950 S951 E956 K957 E958 E1016	K950-Q954 WeakPolarHBondContact O-CB 3.32Å; K950-Q954 PolarHBondContact O-N 3.06Å; S951-Q954 PolarHBondContact O-N 3.36Å; Q954-E956 VanDerWaalsContact C-N 3.27Å; Q954-E956 PolarHBondContact O-N 3.49Å; Q954-K957 WeakPolarHBondContact O-CB 3.05Å; Q954-K957 PolarHBondContact O-N 2.92Å; Q954-K957 VanDerWaalsContact O-N 3.16Å; Q954-E958 WeakPolarHBondContact O-CB 3.35Å; Q954-E958 WeakPolarHBondContact O-CG 3.43Å; Q954-E958 PolarHBondContact O-N 2.78Å; Q954-E1016 PolarHBondContact NE2-OE1 3.49Å; Q954-E1016 PolarHBondContact NE2-OE2 3.23Å
955	L	74.3	Confident	70.6	Confident	8 Å²	8	53.5 Å²	53.5	4%	0.042	27%	0.267	C	S	.	.	H	α-helix	trans	-63.8	-30.7	177.3	-67.1	166.7	0	0	0	112.6	I911 L924 S951 L952 A959	I911-L955 HydrophobicContact CG2-CD1 3.74Å; L924-L955 HydrophobicContact CB-CB 4.27Å; L924-L955 HydrophobicContact CD2-CB 3.76Å; L924-L955 HydrophobicContact CD2-CD1 4.08Å; L924-L955 HydrophobicContact CD2-CD2 3.69Å; L924-L955 HydrophobicContact CD2-CG 4.03Å; S951-L955 WeakPolarHBondContact O-CB 3.43Å; S951-L955 WeakPolarHBondContact O-CD1 3.4Å; S951-L955 WeakPolarHBondContact O-CG 3.4Å; S951-L955 PolarHBondContact O-N 2.96Å; L952-L955 PolarHBondContact O-N 3.39Å; L955-A959 VanDerWaalsContact O-CB 3.27Å; L955-A959 WeakPolarHBondContact O-CB 3.24Å; L955-A959 PolarHBondContact O-N 3.17Å
956	E	72.4	Confident	68	Low	40 Å²	40	58.4 Å²	58.4	19%	0.187	30%	0.297	C	S	.	.	H	α-helix	trans	-74.5	-42.1	171.6	-171.8	171.8	157.2	0	0	112.3	T926 L937 L952 Y953 Q954 A959 L960	T926-E956 HydrophobicContact CG2-CG 4.05Å; T926-E956 WeakPolarHBondContact CG2-OE1 3.01Å; L937-E956 WeakPolarHBondContact CD2-OE2 3.24Å; L952-E956 WeakPolarHBondContact O-CB 3.47Å; L952-E956 PolarHBondContact O-N 3.1Å; Y953-E956 PolarHBondContact O-N 3.49Å; Q954-E956 VanDerWaalsContact C-N 3.27Å; Q954-E956 PolarHBondContact O-N 3.49Å; E956-A959 WeakPolarHBondContact O-CB 3.47Å; E956-A959 PolarHBondContact O-N 3.3Å; E956-L960 HydrophobicContact CG-CD1 4.33Å; E956-L960 VanDerWaalsContact O-CG 3.3Å; E956-L960 WeakPolarHBondContact O-CG 3.02Å; E956-L960 PolarHBondContact O-N 2.84Å
957	K	70.6	Confident	65.1	Low	68 Å²	68	64.4 Å²	64.4	30%	0.296	32%	0.32	S	S	.	.	H	α-helix	trans	-61.3	-43.1	174.9	-177.7	166.2	168	174.6	0	111.5	Y953 Q954 L960 L961 E1016	Y953-K957 HydrophobicContact CD1-CD 4.27Å; Y953-K957 HydrophobicContact CE1-CD 3.8Å; Y953-K957 WeakPolarHBondContact O-CB 3.35Å; Y953-K957 PolarHBondContact O-N 2.96Å; Q954-K957 WeakPolarHBondContact O-CB 3.05Å; Q954-K957 PolarHBondContact O-N 2.92Å; Q954-K957 VanDerWaalsContact O-N 3.16Å; K957-L960 PolarHBondContact O-N 3.09Å; K957-L961 HydrophobicContact CG-CD1 4.43Å; K957-L961 WeakPolarHBondContact O-CB 3.2Å; K957-L961 WeakPolarHBondContact O-CD1 3.34Å; K957-L961 VanDerWaalsContact O-CG 3.24Å; K957-L961 WeakPolarHBondContact O-CG 3.46Å; K957-L961 PolarHBondContact O-N 3.48Å; K957-E1016 PolarHBondContact NZ-O 2.86Å; K957-E1016 IonicContact NZ-OE2 3.89Å; K957-E1016 PolarHBondContact NZ-OE2 2.63Å
958	E	68	Low	62.2	Low	95 Å²	95	64.4 Å²	64.4	44%	0.444	33%	0.329	S	S	.	.	H	α-helix	trans	-63.5	-44.8	170.1	-73.1	177.7	-174.2	0	0	112	Q954 L960 L961 N962	Q954-E958 WeakPolarHBondContact O-CB 3.35Å; Q954-E958 WeakPolarHBondContact O-CG 3.43Å; Q954-E958 PolarHBondContact O-N 2.78Å; E958-L960 VanDerWaalsContact C-N 3.31Å; E958-L960 PolarHBondContact O-N 3.25Å; E958-L961 PolarHBondContact O-N 3.04Å; E958-N962 WeakPolarHBondContact O-CB 3.22Å; E958-N962 PolarHBondContact O-N 2.98Å; E958-N962 PolarHBondContact O-ND2 3.09Å
959	A	58.8	Low	59.3	Low	23 Å²	23	68 Å²	68	19%	0.19	35%	0.351	C	S	.	.	H	α-helix	trans	-58.9	-41.2	176.8	0	0	0	0	0	112.4	P923 L955 E956	P923-A959 HydrophobicContact CB-CB 4.07Å; L955-A959 VanDerWaalsContact O-CB 3.27Å; L955-A959 WeakPolarHBondContact O-CB 3.24Å; L955-A959 PolarHBondContact O-N 3.17Å; E956-A959 WeakPolarHBondContact O-CB 3.47Å; E956-A959 PolarHBondContact O-N 3.3Å
960	L	56.5	Low	56.3	Low	131 Å²	131	76.9 Å²	76.9	69%	0.686	39%	0.39	S	S	*	.	H	α-helix	trans	-68.9	-45.1	176.3	-70.7	167	0	0	0	112.4	E956 K957 E958 N962	E956-L960 HydrophobicContact CG-CD1 4.33Å; E956-L960 VanDerWaalsContact O-CG 3.3Å; E956-L960 WeakPolarHBondContact O-CG 3.02Å; E956-L960 PolarHBondContact O-N 2.84Å; K957-L960 PolarHBondContact O-N 3.09Å; E958-L960 VanDerWaalsContact C-N 3.31Å; E958-L960 PolarHBondContact O-N 3.25Å; L960-N962 VanDerWaalsContact C-N 3.27Å; L960-N962 PolarHBondContact O-N 3.36Å
961	L	58	Low	53.4	Low	111 Å²	111	76.5 Å²	76.5	58%	0.581	40%	0.396	S	S	*	.	H	α-helix	trans	-60.3	-36.6	177	-77.8	165.7	0	0	0	112.4	K957 E958 K963	K957-L961 HydrophobicContact CG-CD1 4.43Å; K957-L961 WeakPolarHBondContact O-CB 3.2Å; K957-L961 WeakPolarHBondContact O-CD1 3.34Å; K957-L961 VanDerWaalsContact O-CG 3.24Å; K957-L961 WeakPolarHBondContact O-CG 3.46Å; K957-L961 PolarHBondContact O-N 3.48Å; E958-L961 PolarHBondContact O-N 3.04Å; L961-K963 PolarHBondContact O-N 2.89Å
962	N	50.5	Low	50.6	Low	38 Å²	38	83.9 Å²	83.9	20%	0.203	43%	0.429	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.6	0.6	-171.6	-79.1	-40.5	0	0	0	115.7	K109 E958 L960 K964	K109-N962 WeakPolarHBondContact CE-OD1 3.02Å; K109-N962 VanDerWaalsContact NZ-CG 3.28Å; K109-N962 PolarHBondContact NZ-OD1 3.38Å; E958-N962 WeakPolarHBondContact O-CB 3.22Å; E958-N962 PolarHBondContact O-N 2.98Å; E958-N962 PolarHBondContact O-ND2 3.09Å; L960-N962 VanDerWaalsContact C-N 3.27Å; L960-N962 PolarHBondContact O-N 3.36Å; N962-K964 PolarHBondContact O-N 3.3Å
963	K	43.4	Very low	47.7	Very low	118 Å²	118	92.6 Å²	92.6	51%	0.513	47%	0.47	S	S	.	.			trans	49.1	18.8	172.4	-66.1	-172.6	-173.3	169	0	116.9	M112 F115 L961	M112-K963 HydrophobicContact CE-CB 4.21Å; F115-K963 HydrophobicContact CE2-CD 4.1Å; F115-K963 HydrophobicContact CE2-CG 4.42Å; L961-K963 PolarHBondContact O-N 2.89Å
964	K	35.8	Very low	45	Very low	79 Å²	79	96.9 Å²	96.9	34%	0.343	49%	0.494	S	S	.	.			trans	-55.7	124.3	172	-88.7	-173.4	167.7	-177.6	0	108	Q921 P923 N962 V966	Q921-K964 PolarHBondContact O-NZ 2.94Å; P923-K964 HydrophobicContact CG-CB 4.33Å; P923-K964 HydrophobicContact CG-CD 4.46Å; N962-K964 PolarHBondContact O-N 3.3Å; K964-V966 PolarHBondContact O-N 3.46Å
965	P	29.8	Very low	42.2	Very low	102 Å²	102	98.5 Å²	98.5	66%	0.662	51%	0.508	S	S	*	.			trans	-65.8	113.2	-176.4	25.3	-33.4	0	0	0	109.4	K967	P965-K967 PolarHBondContact O-N 3.31Å
966	V	33.1	Very low	40	Very low	107 Å²	107	103.1 Å²	103.1	65%	0.648	54%	0.537	S	S	*	.			trans	-68.6	83.6	169.6	-175.9	0	0	0	0	107.6	K964 S968	K964-V966 PolarHBondContact O-N 3.46Å; V966-S968 PolarHBondContact O-N 3.48Å
967	K	29.4	Very low	38	Very low	175 Å²	175	106.7 Å²	106.7	76%	0.761	56%	0.564	S	S	*	*			trans	-53.4	109.5	156.5	-79.3	-174.2	176.8	179.3	0	105.1	P965 V969	P965-K967 PolarHBondContact O-N 3.31Å; K967-V969 PolarHBondContact O-N 2.93Å
968	S	25.6	Very low	35.9	Very low	80 Å²	80	111.7 Å²	111.7	56%	0.559	59%	0.586	S	S	*	*			trans	-45.9	109.1	-175.4	58.3	0	0	0	0	109	V966 K970	V966-S968 PolarHBondContact O-N 3.48Å; S968-K970 PolarHBondContact O-N 3.11Å
969	V	28.2	Very low	34	Very low	76 Å²	76	113.2 Å²	113.2	46%	0.461	60%	0.604	S	S	.	*			trans	-62.6	114.3	-175.4	169	0	0	0	0	106.5	L927 K967 S971	L927-V969 HydrophobicContact CD1-CG2 4.07Å; L927-V969 HydrophobicContact CD2-CB 3.94Å; L927-V969 HydrophobicContact CD2-CG2 3.6Å; L927-V969 HydrophobicContact CG-CG2 4.5Å; K967-V969 PolarHBondContact O-N 2.93Å; V969-S971 PolarHBondContact O-N 3.41Å; V969-S971 VanDerWaalsContact O-N 3.13Å
970	K	24.5	Very low	32.6	Very low	187 Å²	187	118.3 Å²	118.3	81%	0.813	63%	0.633	S	S	*	*			trans	-54.8	123.1	165.2	-72.2	-174	175.2	-174.1	0	105.9	S968 H972	S968-K970 PolarHBondContact O-N 3.11Å; K970-H972 PolarHBondContact O-N 2.92Å
971	S	27.6	Very low	31.1	Very low	64 Å²	64	117.5 Å²	117.5	45%	0.448	64%	0.637	S	S	.	*			trans	-40.4	140.3	166.6	42.4	0	0	0	0	109.5	V969 Q973 I974	V969-S971 PolarHBondContact O-N 3.41Å; V969-S971 VanDerWaalsContact O-N 3.13Å; S971-Q973 PolarHBondContact O-N 2.87Å; S971-I974 PolarHBondContact OG-N 3.34Å; S971-I974 PolarHBondContact OG-O 2.91Å
972	H	25.9	Very low	29.6	Very low	161 Å²	161	124 Å²	124	75%	0.745	65%	0.654	S	S	*	*	S	Bend	trans	-67.4	91.4	161.5	-78.9	24	0	0	0	106.7	K970	K970-H972 PolarHBondContact O-N 2.92Å
973	Q	24.1	Very low	28.7	Very low	185 Å²	185	127.9 Å²	127.9	86%	0.864	68%	0.683	S	S	*	*	S	Bend	trans	50.4	63.2	174.2	-64.8	174.8	-65.3	0	0	115.4	S971	S971-Q973 PolarHBondContact O-N 2.87Å
974	I	26.5	Very low	28	Very low	122 Å²	122	133.4 Å²	133.4	63%	0.626	70%	0.701	S	S	*	*			trans	-126.3	119.5	154.6	-55.8	179.5	0	0	0	107.7	S971	S971-I974 PolarHBondContact OG-N 3.34Å; S971-I974 PolarHBondContact OG-O 2.91Å
975	T	24.1	Very low	27.5	Very low	98 Å²	98	140 Å²	140	60%	0.601	72%	0.724	S	S	*	*			trans	-102.4	91.5	-161.5	33.7	0	0	0	0	113.7
976	T	28	Very low	27.3	Very low	106 Å²	106	144.9 Å²	144.9	65%	0.65	73%	0.729	S	S	*	*			trans	-132.6	139	170.1	53.8	0	0	0	0	112.9
977	P	28.9	Very low	27.1	Very low	114 Å²	114	150.1 Å²	150.1	74%	0.74	74%	0.739	S	S	*	*	P	Polyproline II helix	trans	-92.4	155.9	-178.9	35.6	-34.8	0	0	0	113.8
978	K	26.6	Very low	26.9	Very low	174 Å²	174	150.8 Å²	150.8	76%	0.757	74%	0.744	S	S	*	*	P	Polyproline II helix	trans	-85.5	137.4	-177.4	-61.2	-178.7	178.9	-175.9	0	113.4
979	P	29.4	Very low	27	Very low	127 Å²	127	152.8 Å²	152.8	83%	0.825	75%	0.753	S	S	*	*	P	Polyproline II helix	trans	-89.6	166	163.5	35.5	-33.3	0	0	0	112.9
980	T	29.8	Very low	26.8	Very low	130 Å²	130	155.3 Å²	155.3	80%	0.798	77%	0.773	S	S	*	*			trans	-125.1	161.4	-171.5	51.2	0	0	0	0	114.4
981	C	24.6	Very low	26.9	Very low	114 Å²	114	154 Å²	154	77%	0.77	77%	0.77	S	S	*	*			trans	68.6	102.5	157.7	-71.9	0	0	0	0	121.9
982	R	26.3	Very low	27	Very low	248 Å²	248	155.2 Å²	155.2	94%	0.936	78%	0.778	S	S	*	*				33.5	105.9	122.1	-64	176.9	171.3	175.6	-2.7	119.1
983	S	30.4	Very low	27.3	Very low	119 Å²	119	155.1 Å²	155.1	83%	0.832	77%	0.771	S	S	*	*				-161.9	111.8	120.6	-161	0	0	0	0	114.6
984	R	28.8	Very low	28.1	Very low	234 Å²	234	151.8 Å²	151.8	88%	0.883	76%	0.755	S	S	*	*			trans	13.6	118.8	160.7	-67.3	179.3	170	-179.2	-3.6	121.3
985	R	26.4	Very low	29.4	Very low	217 Å²	217	148.8 Å²	148.8	82%	0.819	75%	0.745	S	S	*	*	S	Bend	trans	91.7	122.5	155.5	-62.9	-177	172.1	180	-2.1	117.4
986	R	26	Very low	31.8	Very low	204 Å²	204	145.1 Å²	145.1	77%	0.77	72%	0.723	S	S	*	*	S	Bend	trans	72.7	154.6	-176	-57.5	-175	-177.5	169.9	2.6	114.4
987	Y	27.8	Very low	34.5	Very low	217 Å²	217	141.2 Å²	141.2	85%	0.851	70%	0.699	S	S	*	*			trans	55.2	109.3	-172.7	-70.3	-85.9	0	0	0	117
988	Q	26.2	Very low	37.4	Very low	189 Å²	189	135.8 Å²	135.8	88%	0.883	66%	0.664	S	S	*	*			trans	-94.9	120.4	163.6	-178.4	165.8	-22	0	0	108.6
989	V	26.7	Very low	40.3	Very low	122 Å²	122	127.8 Å²	127.8	74%	0.739	63%	0.63	S	S	*	*			trans	-30.1	136.3	179.3	-179	0	0	0	0	115.5	E991	V989-E991 PolarHBondContact O-N 2.64Å; V989-E991 VanDerWaalsContact O-N 3.13Å
990	C	25	Very low	43	Very low	130 Å²	130	122.4 Å²	122.4	88%	0.878	60%	0.595	S	S	*	*			trans	-67.6	100.9	170.7	-56	0	0	0	0	112	S992	C990-S992 PolarHBondContact O-N 2.69Å
991	E	26.5	Very low	45.9	Very low	160 Å²	160	116.2 Å²	116.2	75%	0.748	56%	0.557	S	S	*	*			trans	-89.6	88.5	164.9	-69.5	-166.9	132	0	0	110.7	V989	V989-E991 PolarHBondContact O-N 2.64Å; V989-E991 VanDerWaalsContact O-N 3.13Å
992	S	30.4	Very low	49.2	Very low	89 Å²	89	110.8 Å²	110.8	62%	0.622	52%	0.52	S	S	*	.	T	Hydrogen-bonded Turn	trans	41.1	87.4	151.6	59.2	0	0	0	0	118.8	C990 Q994	C990-S992 PolarHBondContact O-N 2.69Å; S992-Q994 PolarHBondContact O-N 2.99Å
993	R	30.8	Very low	52.1	Low	158 Å²	158	102.8 Å²	102.8	60%	0.596	49%	0.493	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.2	9	158.6	-66.3	-166.9	179.6	-177	-2.1	118.8	S931 C995	S931-R993 PolarHBondContact O-NH1 2.84Å; R993-C995 PolarHBondContact O-N 3.43Å
994	Q	41.2	Very low	54.8	Low	115 Å²	115	99.5 Å²	99.5	54%	0.537	47%	0.473	S	S	.	.			trans	-72	87.5	-177.9	-74.6	179.3	3	0	0	111.8	S992 S996	S992-Q994 PolarHBondContact O-N 2.99Å; Q994-S996 PolarHBondContact O-N 3.17Å
995	C	53.2	Low	57.6	Low	60 Å²	60	90.1 Å²	90.1	41%	0.405	45%	0.45	S	S	.	.			trans	-56.9	125.1	169	-58.7	0	0	0	0	109.5	T938 R993 P997 V1000	T938-C995 HydrophobicContact CG2-CB 4.31Å; T938-C995 WeakPolarHBondContact CG2-O 3.16Å; R993-C995 PolarHBondContact O-N 3.43Å; C995-P997 WeakPolarHBondContact O-CD 3.13Å; C995-V1000 HydrophobicContact CB-CG2 3.57Å
996	S	75.9	Confident	60.8	Low	21 Å²	21	80.7 Å²	80.7	15%	0.147	42%	0.415	C	S	.	.			trans	-61.4	121.8	177.5	179.8	0	0	0	0	109.8	Q994 I998 I999 V1000 T1022	Q994-S996 PolarHBondContact O-N 3.17Å; S996-I998 PolarHBondContact O-N 2.93Å; S996-I998 VanDerWaalsContact O-N 3.12Å; S996-I998 WeakPolarHBondContact OG-CG2 3.38Å; S996-I999 WeakPolarHBondContact O-CA 3.39Å; S996-I999 PolarHBondContact O-N 3.25Å; S996-V1000 PolarHBondContact O-N 3.36Å; S996-T1022 WeakPolarHBondContact CB-OG1 3.43Å; S996-T1022 PolarHBondContact OG-OG1 2.83Å
997	P	84.3	Confident	63.9	Low	23 Å²	23	72.3 Å²	72.3	15%	0.149	39%	0.386	C	S	.	.	H	α-helix	trans	-56.3	-33.7	-173.5	-27.7	34.2	0	0	0	113.8	L937 T938 A941 C995 V1000 A1001 L1013	L937-P997 HydrophobicContact CD2-CB 4.23Å; L937-P997 HydrophobicContact CD2-CG 3.72Å; L937-P997 HydrophobicContact CG-CB 4.11Å; L937-P997 HydrophobicContact CG-CG 3.95Å; T938-P997 HydrophobicContact CG2-CB 4.35Å; T938-P997 HydrophobicContact CG2-CG 3.94Å; A941-P997 HydrophobicContact CB-CB 4.4Å; C995-P997 WeakPolarHBondContact O-CD 3.13Å; P997-V1000 PolarHBondContact O-N 2.92Å; P997-A1001 WeakPolarHBondContact O-CB 3.29Å; P997-A1001 PolarHBondContact O-N 3.3Å; P997-L1013 HydrophobicContact CB-CD1 4.27Å
998	I	88.6	Confident	66.9	Low	0 Å²	0	66.1 Å²	66.1	0%	0	36%	0.364	C	S	.	.	H	α-helix	trans	-70.5	-36.8	175	-171.7	171.4	0	0	0	112.4	S996 V1000 A1001 I1002 V1010 L1013 L1014 V1030	S996-I998 PolarHBondContact O-N 2.93Å; S996-I998 VanDerWaalsContact O-N 3.12Å; S996-I998 WeakPolarHBondContact OG-CG2 3.38Å; I998-V1000 VanDerWaalsContact C-N 3.35Å; I998-A1001 PolarHBondContact O-N 2.7Å; I998-I1002 HydrophobicContact CG1-CD1 4.07Å; I998-I1002 HydrophobicContact CG1-CG1 4.47Å; I998-I1002 WeakPolarHBondContact O-CD1 3.33Å; I998-I1002 WeakPolarHBondContact O-CG1 3.31Å; I998-I1002 PolarHBondContact O-N 2.99Å; I998-V1010 HydrophobicContact CD1-CG1 4.23Å; I998-V1010 HydrophobicContact CG1-CG1 4.13Å; I998-L1013 HydrophobicContact CB-CD1 4.14Å; I998-L1014 HydrophobicContact CD1-CD1 4.47Å; I998-L1014 HydrophobicContact CD1-CD2 3.55Å; I998-L1014 HydrophobicContact CD1-CG 3.76Å; I998-V1030 HydrophobicContact CG1-CG1 4.5Å; I998-V1030 HydrophobicContact CG2-CG1 4.12Å
999	I	88.3	Confident	70	Confident	7 Å²	7	57.1 Å²	57.1	4%	0.036	32%	0.322	C	S	.	.	H	α-helix	trans	-64.3	-42.7	173.8	-65.4	179.9	0	0	0	110.1	S996 I1002 Q1003 V1030 W1033	S996-I999 WeakPolarHBondContact O-CA 3.39Å; S996-I999 PolarHBondContact O-N 3.25Å; I999-I1002 PolarHBondContact O-N 2.91Å; I999-Q1003 HydrophobicContact CG2-CG 4.36Å; I999-Q1003 WeakPolarHBondContact O-CB 3.43Å; I999-Q1003 VanDerWaalsContact O-CG 3.31Å; I999-Q1003 WeakPolarHBondContact O-CG 3.48Å; I999-Q1003 PolarHBondContact O-N 3.22Å; I999-V1030 HydrophobicContact CG1-CG1 4.01Å; I999-W1033 HydrophobicContact CG2-CG 4.11Å
1000	V	86.9	Confident	73.1	Confident	14 Å²	14	51.3 Å²	51.3	9%	0.085	29%	0.287	C	S	.	.	H	α-helix	trans	-63.8	-41.7	177.2	179.3	0	0	0	0	111.7	T938 A942 C995 S996 P997 I998 I1002 Q1003 A1004	T938-V1000 HydrophobicContact CG2-CG2 4.44Å; A942-V1000 HydrophobicContact CB-CG1 3.75Å; C995-V1000 HydrophobicContact CB-CG2 3.57Å; S996-V1000 PolarHBondContact O-N 3.36Å; P997-V1000 PolarHBondContact O-N 2.92Å; I998-V1000 VanDerWaalsContact C-N 3.35Å; V1000-I1002 VanDerWaalsContact C-N 3.35Å; V1000-I1002 PolarHBondContact O-N 2.99Å; V1000-Q1003 PolarHBondContact O-N 2.87Å; V1000-A1004 WeakPolarHBondContact O-CB 3.36Å; V1000-A1004 PolarHBondContact O-N 2.86Å
1001	A	90.7	Very high	76.3	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-64.1	-37.5	174.9	0	0	0	0	0	112.6	A941 P997 I998 A1004 G1005 N1006 V1009 V1010 L1013	A941-A1001 HydrophobicContact CB-CB 4.33Å; P997-A1001 WeakPolarHBondContact O-CB 3.29Å; P997-A1001 PolarHBondContact O-N 3.3Å; I998-A1001 PolarHBondContact O-N 2.7Å; A1001-A1004 PolarHBondContact O-N 2.7Å; A1001-G1005 PolarHBondContact O-N 2.87Å; A1001-G1005 VanDerWaalsContact O-N 3.1Å; A1001-N1006 PolarHBondContact O-N 3.07Å; A1001-V1009 HydrophobicContact CB-CB 4.41Å; A1001-V1009 HydrophobicContact CB-CG1 3.74Å; A1001-V1010 HydrophobicContact CB-CG2 3.55Å; A1001-L1013 HydrophobicContact CB-CD1 4.3Å
1002	I	92.1	Very high	79.4	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-67.7	-42.6	174.9	-66.1	167.8	0	0	0	111.2	I998 I999 V1000 A1004 G1005 V1010 V1030 W1033 A1034 T1037 I1042 L1046	I998-I1002 HydrophobicContact CG1-CD1 4.07Å; I998-I1002 HydrophobicContact CG1-CG1 4.47Å; I998-I1002 WeakPolarHBondContact O-CD1 3.33Å; I998-I1002 WeakPolarHBondContact O-CG1 3.31Å; I998-I1002 PolarHBondContact O-N 2.99Å; I999-I1002 PolarHBondContact O-N 2.91Å; V1000-I1002 VanDerWaalsContact C-N 3.35Å; V1000-I1002 PolarHBondContact O-N 2.99Å; I1002-A1004 VanDerWaalsContact C-N 3.32Å; I1002-A1004 PolarHBondContact O-N 3.41Å; I1002-G1005 PolarHBondContact O-N 2.03Å; I1002-G1005 VanDerWaalsContact O-N 3.13Å; I1002-V1010 HydrophobicContact CB-CG2 4.47Å; I1002-V1010 HydrophobicContact CD1-CG1 4.49Å; I1002-V1010 HydrophobicContact CG1-CG1 4.1Å; I1002-V1010 HydrophobicContact CG1-CG2 3.57Å; I1002-V1030 HydrophobicContact CD1-CB 3.63Å; I1002-V1030 HydrophobicContact CD1-CG1 3.86Å; I1002-W1033 HydrophobicContact CG2-CB 3.75Å; I1002-A1034 HydrophobicContact CG2-CB 4.03Å; I1002-T1037 WeakPolarHBondContact O-CG2 3.23Å; I1002-I1042 HydrophobicContact CD1-CG2 4.14Å; I1002-I1042 HydrophobicContact CG1-CD1 4.3Å; I1002-I1042 HydrophobicContact CG1-CG2 3.87Å; I1002-I1042 HydrophobicContact CG2-CD1 4.45Å; I1002-I1042 HydrophobicContact CG2-CG2 4.33Å; I1002-L1046 HydrophobicContact CD1-CD1 4.39Å
1003	Q	88.8	Confident	82.2	Confident	79 Å²	79	37.5 Å²	37.5	37%	0.369	20%	0.201	S	C	.	.	H	α-helix	trans	-61.2	-39.2	175.6	-76.2	169.8	-25	0	0	112.2	I999 V1000 G1005 W1033	I999-Q1003 HydrophobicContact CG2-CG 4.36Å; I999-Q1003 WeakPolarHBondContact O-CB 3.43Å; I999-Q1003 VanDerWaalsContact O-CG 3.31Å; I999-Q1003 WeakPolarHBondContact O-CG 3.48Å; I999-Q1003 PolarHBondContact O-N 3.22Å; V1000-Q1003 PolarHBondContact O-N 2.87Å; Q1003-G1005 VanDerWaalsContact C-N 3.3Å; Q1003-W1033 HydrophobicContact CG-CD2 3.89Å; Q1003-W1033 HydrophobicContact CG-CE3 3.52Å; Q1003-W1033 HydrophobicContact CG-CG 4.49Å; Q1003-W1033 HydrophobicContact CG-CH2 4.44Å; Q1003-W1033 HydrophobicContact CG-CZ3 3.83Å
1004	A	86	Confident	84.9	Confident	50 Å²	50	31.3 Å²	31.3	41%	0.413	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.7	-8.3	175.7	0	0	0	0	0	114	V1000 A1001 I1002 N1006	V1000-A1004 WeakPolarHBondContact O-CB 3.36Å; V1000-A1004 PolarHBondContact O-N 2.86Å; A1001-A1004 PolarHBondContact O-N 2.7Å; I1002-A1004 VanDerWaalsContact C-N 3.32Å; I1002-A1004 PolarHBondContact O-N 3.41Å; A1004-N1006 VanDerWaalsContact C-N 3.32Å; A1004-N1006 WeakPolarHBondContact CB-ND2 3.09Å; A1004-N1006 PolarHBondContact O-N 2.99Å
1005	G	87.9	Confident	87.1	Confident	38 Å²	38	31.9 Å²	31.9	39%	0.392	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	75.8	12.7	-177.9	0	0	0	0	0	115.3	A1001 I1002 Q1003 D1007	A1001-G1005 PolarHBondContact O-N 2.87Å; A1001-G1005 VanDerWaalsContact O-N 3.1Å; I1002-G1005 PolarHBondContact O-N 2.03Å; I1002-G1005 VanDerWaalsContact O-N 3.13Å; Q1003-G1005 VanDerWaalsContact C-N 3.3Å; G1005-D1007 VanDerWaalsContact C-N 3.33Å; G1005-D1007 PolarHBondContact O-N 3.16Å
1006	N	92.7	Very high	88.5	Confident	19 Å²	19	32 Å²	32	10%	0.102	18%	0.181	C	C	.	.			trans	-79.1	74.8	-173.3	-65	-30.6	0	0	0	111.9	A941 A942 N944 A1001 A1004 E1008 V1009 V1010	A941-N1006 PolarHBondContact O-ND2 3.45Å; A942-N1006 PolarHBondContact O-ND2 2.88Å; N944-N1006 HydrophobicContact CB-CB 4.41Å; N944-N1006 WeakPolarHBondContact CB-OD1 3.02Å; N944-N1006 PolarHBondContact N-ND2 2.79Å; A1001-N1006 PolarHBondContact O-N 3.07Å; A1004-N1006 VanDerWaalsContact C-N 3.32Å; A1004-N1006 WeakPolarHBondContact CB-ND2 3.09Å; A1004-N1006 PolarHBondContact O-N 2.99Å; N1006-E1008 PolarHBondContact O-N 3.19Å; N1006-V1009 HydrophobicContact CB-CB 3.98Å; N1006-V1009 HydrophobicContact CB-CG2 4.31Å; N1006-V1009 WeakPolarHBondContact O-CB 3.38Å; N1006-V1009 PolarHBondContact O-N 3.04Å; N1006-V1009 VanDerWaalsContact O-N 3.11Å; N1006-V1010 WeakPolarHBondContact O-CG2 3.19Å; N1006-V1010 PolarHBondContact O-N 3.31Å
1007	D	91.7	Very high	88.6	Confident	28 Å²	28	33.6 Å²	33.6	15%	0.15	20%	0.2	C	C	.	.	H	α-helix	trans	-54.7	-46	-173.7	62.4	-12.6	0	0	0	115.2	G1005 V1009 V1010 K1011 K1041 I1042 Y1045	G1005-D1007 VanDerWaalsContact C-N 3.33Å; G1005-D1007 PolarHBondContact O-N 3.16Å; D1007-V1009 VanDerWaalsContact C-N 3.33Å; D1007-V1009 PolarHBondContact O-N 2.89Å; D1007-V1010 PolarHBondContact O-N 3.42Å; D1007-K1011 WeakPolarHBondContact O-CB 3.48Å; D1007-K1011 PolarHBondContact O-N 2.92Å; D1007-K1041 HydrophobicContact CB-CD 4.29Å; D1007-K1041 WeakPolarHBondContact OD2-CD 3.24Å; D1007-K1041 WeakPolarHBondContact OD2-CE 3.39Å; D1007-K1041 IonicContact OD2-NZ 3.4Å; D1007-K1041 PolarHBondContact OD2-NZ 2.83Å; D1007-I1042 HydrophobicContact CB-CG1 4.17Å; D1007-Y1045 HydrophobicContact CB-CE2 4.38Å
1008	E	90.7	Very high	88.3	Confident	86 Å²	86	32.8 Å²	32.8	40%	0.402	20%	0.195	S	C	.	.	H	α-helix	trans	-68.8	-29.4	177.1	-68.7	-67.9	174	0	0	112.7	N1006 K1011 C1012	N1006-E1008 PolarHBondContact O-N 3.19Å; E1008-K1011 IonicContact OE1-NZ 3.75Å; E1008-K1011 IonicContact OE2-NZ 3.6Å; E1008-K1011 PolarHBondContact OE2-NZ 2.88Å; E1008-C1012 VanDerWaalsContact O-CB 3.29Å; E1008-C1012 WeakPolarHBondContact O-CB 3.45Å; E1008-C1012 PolarHBondContact O-N 3.45Å
1009	V	91.3	Very high	87.7	Confident	0 Å²	0	36.2 Å²	36.2	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-71.4	-42	171.6	167.6	0	0	0	0	110.9	A941 N944 L946 V949 A1001 N1006 D1007 K1011 C1012 L1013	A941-V1009 HydrophobicContact CB-CG1 4.24Å; N944-V1009 WeakPolarHBondContact OD1-CG2 3.23Å; L946-V1009 HydrophobicContact CD1-CG2 4.41Å; V949-V1009 HydrophobicContact CG1-CG1 4.31Å; V949-V1009 HydrophobicContact CG2-CG1 4.02Å; V949-V1009 HydrophobicContact CG2-CG2 4.49Å; A1001-V1009 HydrophobicContact CB-CB 4.41Å; A1001-V1009 HydrophobicContact CB-CG1 3.74Å; N1006-V1009 HydrophobicContact CB-CB 3.98Å; N1006-V1009 HydrophobicContact CB-CG2 4.31Å; N1006-V1009 WeakPolarHBondContact O-CB 3.38Å; N1006-V1009 PolarHBondContact O-N 3.04Å; N1006-V1009 VanDerWaalsContact O-N 3.11Å; D1007-V1009 VanDerWaalsContact C-N 3.33Å; D1007-V1009 PolarHBondContact O-N 2.89Å; V1009-K1011 VanDerWaalsContact C-N 3.31Å; V1009-K1011 PolarHBondContact O-N 3.45Å; V1009-C1012 PolarHBondContact O-N 2.91Å; V1009-L1013 HydrophobicContact CG1-CD1 3.99Å; V1009-L1013 HydrophobicContact CG1-CG 4.43Å; V1009-L1013 WeakPolarHBondContact O-CB 3.42Å; V1009-L1013 WeakPolarHBondContact O-CG 3.41Å; V1009-L1013 PolarHBondContact O-N 3.31Å
1010	V	91.6	Very high	87.4	Confident	0 Å²	0	38.7 Å²	38.7	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-59.3	-45.1	174.6	172.7	0	0	0	0	110.6	I998 A1001 I1002 N1006 D1007 L1013 L1014 I1042	I998-V1010 HydrophobicContact CD1-CG1 4.23Å; I998-V1010 HydrophobicContact CG1-CG1 4.13Å; A1001-V1010 HydrophobicContact CB-CG2 3.55Å; I1002-V1010 HydrophobicContact CB-CG2 4.47Å; I1002-V1010 HydrophobicContact CD1-CG1 4.49Å; I1002-V1010 HydrophobicContact CG1-CG1 4.1Å; I1002-V1010 HydrophobicContact CG1-CG2 3.57Å; N1006-V1010 WeakPolarHBondContact O-CG2 3.19Å; N1006-V1010 PolarHBondContact O-N 3.31Å; D1007-V1010 PolarHBondContact O-N 3.42Å; V1010-L1013 PolarHBondContact O-N 3.44Å; V1010-L1014 HydrophobicContact CG1-CD1 4.11Å; V1010-L1014 WeakPolarHBondContact O-CG 3.34Å; V1010-L1014 PolarHBondContact O-N 3.37Å; V1010-I1042 HydrophobicContact CB-CG1 4.44Å; V1010-I1042 HydrophobicContact CG1-CG1 4.39Å; V1010-I1042 HydrophobicContact CG1-CG2 4.21Å; V1010-I1042 HydrophobicContact CG2-CD1 4.06Å; V1010-I1042 HydrophobicContact CG2-CG1 4.45Å
1011	K	92.2	Very high	86.9	Confident	71 Å²	71	43.4 Å²	43.4	31%	0.309	25%	0.252	S	S	.	.	H	α-helix	trans	-61	-49.5	174.7	177.3	177.4	142.8	-139.7	0	111.9	D1007 E1008 V1009 L1013 L1014 D1015 Y1045	D1007-K1011 WeakPolarHBondContact O-CB 3.48Å; D1007-K1011 PolarHBondContact O-N 2.92Å; E1008-K1011 IonicContact OE1-NZ 3.75Å; E1008-K1011 IonicContact OE2-NZ 3.6Å; E1008-K1011 PolarHBondContact OE2-NZ 2.88Å; V1009-K1011 VanDerWaalsContact C-N 3.31Å; V1009-K1011 PolarHBondContact O-N 3.45Å; K1011-L1013 VanDerWaalsContact C-N 3.28Å; K1011-L1013 PolarHBondContact O-N 2.92Å; K1011-L1014 PolarHBondContact O-N 2.96Å; K1011-L1014 VanDerWaalsContact O-N 3.09Å; K1011-D1015 PolarHBondContact O-N 3.4Å; K1011-Y1045 HydrophobicContact CB-CD2 4.04Å; K1011-Y1045 HydrophobicContact CB-CE2 3.89Å; K1011-Y1045 HydrophobicContact CD-CE1 3.99Å; K1011-Y1045 HydrophobicContact CD-CE2 4.29Å
1012	C	91.3	Very high	86.1	Confident	18 Å²	18	45.6 Å²	45.6	12%	0.122	27%	0.265	C	S	.	.	H	α-helix	trans	-57.5	-39.8	176.9	-172	0	0	0	0	112.7	L946 E1008 V1009 E1016	L946-C1012 HydrophobicContact CD1-CB 3.56Å; E1008-C1012 VanDerWaalsContact O-CB 3.29Å; E1008-C1012 WeakPolarHBondContact O-CB 3.45Å; E1008-C1012 PolarHBondContact O-N 3.45Å; V1009-C1012 PolarHBondContact O-N 2.91Å; C1012-E1016 WeakPolarHBondContact O-CB 3Å; C1012-E1016 PolarHBondContact O-N 3.31Å
1013	L	89	Confident	85.4	Confident	1 Å²	1	48.9 Å²	48.9	1%	0.005	29%	0.285	C	S	.	.	H	α-helix	trans	-66.9	-41.2	175.4	-74.2	170.3	0	0	0	111.9	V949 Y953 P997 I998 A1001 V1009 V1010 K1011 G1017 C1018	V949-L1013 HydrophobicContact CG1-CD2 3.8Å; V949-L1013 HydrophobicContact CG1-CG 4.1Å; Y953-L1013 HydrophobicContact CD2-CD2 4.07Å; Y953-L1013 HydrophobicContact CE2-CD2 4.47Å; P997-L1013 HydrophobicContact CB-CD1 4.27Å; I998-L1013 HydrophobicContact CB-CD1 4.14Å; A1001-L1013 HydrophobicContact CB-CD1 4.3Å; V1009-L1013 HydrophobicContact CG1-CD1 3.99Å; V1009-L1013 HydrophobicContact CG1-CG 4.43Å; V1009-L1013 WeakPolarHBondContact O-CB 3.42Å; V1009-L1013 WeakPolarHBondContact O-CG 3.41Å; V1009-L1013 PolarHBondContact O-N 3.31Å; V1010-L1013 PolarHBondContact O-N 3.44Å; K1011-L1013 VanDerWaalsContact C-N 3.28Å; K1011-L1013 PolarHBondContact O-N 2.92Å; L1013-G1017 PolarHBondContact O-N 2.69Å; L1013-C1018 HydrophobicContact CB-CB 3.83Å; L1013-C1018 HydrophobicContact CD2-CB 4.3Å; L1013-C1018 WeakPolarHBondContact O-CB 3.21Å; L1013-C1018 PolarHBondContact O-N 3.24Å
1014	L	88.7	Confident	84.7	Confident	28 Å²	28	46.8 Å²	46.8	15%	0.147	28%	0.276	C	S	.	.	H	α-helix	trans	-64.8	-44	175.7	-71.4	170.6	0	0	0	112.1	I998 V1010 K1011 E1016 G1017 Y1020 L1046	I998-L1014 HydrophobicContact CD1-CD1 4.47Å; I998-L1014 HydrophobicContact CD1-CD2 3.55Å; I998-L1014 HydrophobicContact CD1-CG 3.76Å; V1010-L1014 HydrophobicContact CG1-CD1 4.11Å; V1010-L1014 WeakPolarHBondContact O-CG 3.34Å; V1010-L1014 PolarHBondContact O-N 3.37Å; K1011-L1014 PolarHBondContact O-N 2.96Å; K1011-L1014 VanDerWaalsContact O-N 3.09Å; L1014-E1016 VanDerWaalsContact C-N 3.34Å; L1014-E1016 PolarHBondContact O-N 2.98Å; L1014-G1017 PolarHBondContact O-N 3.27Å; L1014-G1017 VanDerWaalsContact O-N 3.09Å; L1014-Y1020 HydrophobicContact CD2-CD1 3.83Å; L1014-Y1020 HydrophobicContact CD2-CG 4.02Å; L1014-L1046 HydrophobicContact CD1-CD2 4.23Å; L1014-L1046 HydrophobicContact CD2-CD2 4.4Å
1015	D	86.9	Confident	83.9	Confident	127 Å²	127	51.8 Å²	51.8	68%	0.679	29%	0.291	S	S	*	.	H	α-helix	trans	-64.3	-37.3	178.4	-69.7	-25.6	0	0	0	111.8	K1011 G1017	K1011-D1015 PolarHBondContact O-N 3.4Å; D1015-G1017 PolarHBondContact O-N 3.05Å
1016	E	81.7	Confident	83.5	Confident	62 Å²	62	54 Å²	54	29%	0.29	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.5	1.4	173.9	-81.9	-71.7	171.4	0	0	114.5	Y953 Q954 K957 C1012 L1014	Y953-E1016 HydrophobicContact CD1-CB 3.92Å; Y953-E1016 HydrophobicContact CD1-CG 4.4Å; Y953-E1016 HydrophobicContact CE1-CB 3.58Å; Y953-E1016 HydrophobicContact CE1-CG 4.46Å; Y953-E1016 WeakPolarHBondContact CE1-O 3.27Å; Y953-E1016 PolarHBondContact OH-O 3.49Å; Y953-E1016 VanDerWaalsContact OH-O 3.06Å; Q954-E1016 PolarHBondContact NE2-OE1 3.49Å; Q954-E1016 PolarHBondContact NE2-OE2 3.23Å; K957-E1016 PolarHBondContact NZ-O 2.86Å; K957-E1016 IonicContact NZ-OE2 3.89Å; K957-E1016 PolarHBondContact NZ-OE2 2.63Å; C1012-E1016 WeakPolarHBondContact O-CB 3Å; C1012-E1016 PolarHBondContact O-N 3.31Å; L1014-E1016 VanDerWaalsContact C-N 3.34Å; L1014-E1016 PolarHBondContact O-N 2.98Å
1017	G	79.2	Confident	83	Confident	54 Å²	54	53.6 Å²	53.6	56%	0.557	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	86.4	22.9	172.2	0	0	0	0	0	116	L1013 L1014 D1015	L1013-G1017 PolarHBondContact O-N 2.69Å; L1014-G1017 PolarHBondContact O-N 3.27Å; L1014-G1017 VanDerWaalsContact O-N 3.09Å; D1015-G1017 PolarHBondContact O-N 3.05Å
1018	C	78	Confident	82.8	Confident	6 Å²	6	53.5 Å²	53.5	4%	0.041	29%	0.286	C	S	.	.			trans	-61	135.8	-177.8	-173.3	0	0	0	0	112.3	Y953 L1013 Y1020	Y953-C1018 HydrophobicContact CE2-CB 4.11Å; Y953-C1018 WeakPolarHBondContact OH-CA 3.41Å; Y953-C1018 PolarHBondContact OH-N 3.21Å; L1013-C1018 HydrophobicContact CB-CB 3.83Å; L1013-C1018 HydrophobicContact CD2-CB 4.3Å; L1013-C1018 WeakPolarHBondContact O-CB 3.21Å; L1013-C1018 PolarHBondContact O-N 3.24Å; C1018-Y1020 PolarHBondContact O-N 2.87Å
1019	P	76.3	Confident	82.8	Confident	73 Å²	73	49.4 Å²	49.4	47%	0.474	27%	0.266	S	S	.	.			trans	-62.8	93.7	178.4	-26.2	36.5	0	0	0	114.8	N1021 T1022	P1019-N1021 VanDerWaalsContact C-N 3.29Å; P1019-N1021 PolarHBondContact O-N 3.01Å; P1019-T1022 HydrophobicContact CB-CG2 4.36Å; P1019-T1022 PolarHBondContact O-OG1 3.37Å
1020	Y	81.9	Confident	82.8	Confident	58 Å²	58	49.4 Å²	49.4	23%	0.227	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.4	-3.1	176.4	63.6	-91	0	0	0	114.3	L1014 C1018 T1022 V1030 C1049 K1050 L1055	L1014-Y1020 HydrophobicContact CD2-CD1 3.83Å; L1014-Y1020 HydrophobicContact CD2-CG 4.02Å; C1018-Y1020 PolarHBondContact O-N 2.87Å; Y1020-T1022 VanDerWaalsContact C-N 3.32Å; Y1020-V1030 WeakPolarHBondContact O-CG1 3.42Å; Y1020-V1030 WeakPolarHBondContact O-CG2 3.35Å; Y1020-C1049 HydrophobicContact CD2-CB 4.21Å; Y1020-C1049 HydrophobicContact CE1-CB 4.13Å; Y1020-C1049 HydrophobicContact CE2-CB 3.66Å; Y1020-K1050 PolarHBondContact OH-O 2.88Å; Y1020-K1050 VanDerWaalsContact OH-O 3.09Å; Y1020-L1055 HydrophobicContact CD2-CD1 4.01Å; Y1020-L1055 HydrophobicContact CE2-CD1 4.21Å
1021	N	76.1	Confident	83	Confident	114 Å²	114	49.4 Å²	49.4	61%	0.61	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.6	2.8	177.8	66.4	-25.4	0	0	0	113.5	P1019	P1019-N1021 VanDerWaalsContact C-N 3.29Å; P1019-N1021 PolarHBondContact O-N 3.01Å
1022	T	74	Confident	83.1	Confident	45 Å²	45	46 Å²	46	28%	0.276	25%	0.252	S	S	.	.			trans	-65.9	149.1	173.9	52.6	0	0	0	0	112	S996 P1019 Y1020	S996-T1022 WeakPolarHBondContact CB-OG1 3.43Å; S996-T1022 PolarHBondContact OG-OG1 2.83Å; P1019-T1022 HydrophobicContact CB-CG2 4.36Å; P1019-T1022 PolarHBondContact O-OG1 3.37Å; Y1020-T1022 VanDerWaalsContact C-N 3.32Å
1023	V	77.9	Confident	83.3	Confident	69 Å²	69	46.1 Å²	46.1	42%	0.418	25%	0.25	S	C	.	.	B	Isolated β-bridge	trans	-112.3	157.4	166	-67.2	0	0	0	0	110.2	G1027 R1028 N1029 M1058	V1023-G1027 WeakPolarHBondContact CG1-O 3.22Å; V1023-R1028 CarbonylContact C-O 3.37Å; V1023-R1028 VanDerWaalsContact CA-O 3.27Å; V1023-R1028 WeakPolarHBondContact CA-O 3.42Å; V1023-N1029 HydrophobicContact CG1-CB 4.11Å; V1023-M1058 HydrophobicContact CG1-CE 3.66Å
1024	D	74.4	Confident	83.5	Confident	35 Å²	35	46.1 Å²	46.1	19%	0.187	25%	0.249	C	C	.	.			trans	-83.3	-172.9	168.2	68.1	8.3	0	0	0	112.4	Y1026 G1027 R1028 W1033	D1024-Y1026 PolarHBondContact O-N 3.26Å; D1024-Y1026 WeakPolarHBondContact OD1-CA 3.03Å; D1024-Y1026 WeakPolarHBondContact OD1-CB 3.47Å; D1024-Y1026 PolarHBondContact OD1-N 3.38Å; D1024-G1027 PolarHBondContact O-N 2.91Å; D1024-G1027 PolarHBondContact OD1-N 2.93Å; D1024-R1028 PolarHBondContact N-O 3.42Å; D1024-R1028 WeakPolarHBondContact OD1-CB 3.19Å; D1024-R1028 PolarHBondContact OD1-N 2.69Å; D1024-W1033 VanDerWaalsContact OD2-CE2 3.29Å; D1024-W1033 VanDerWaalsContact OD2-CZ2 3.25Å; D1024-W1033 WeakPolarHBondContact OD2-CZ2 3.04Å; D1024-W1033 PolarHBondContact OD2-NE1 2.82Å
1025	Q	69.2	Low	83.9	Confident	156 Å²	156	44.8 Å²	44.8	73%	0.729	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.5	1.1	177	73.4	-172.6	30.6	0	0	115.2
1026	Y	78	Confident	84.2	Confident	85 Å²	85	40.6 Å²	40.6	33%	0.333	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-118.5	9.1	-179.6	-58.4	-57.3	0	0	0	112.3	D1024 R1028 D1060 D1061 W1062	D1024-Y1026 PolarHBondContact O-N 3.26Å; D1024-Y1026 WeakPolarHBondContact OD1-CA 3.03Å; D1024-Y1026 WeakPolarHBondContact OD1-CB 3.47Å; D1024-Y1026 PolarHBondContact OD1-N 3.38Å; Y1026-R1028 PolarHBondContact O-N 3.22Å; Y1026-D1060 WeakPolarHBondContact O-CB 3.44Å; Y1026-D1061 WeakPolarHBondContact CA-OD2 3.35Å; Y1026-D1061 PolarHBondContact O-N 3.37Å; Y1026-W1062 AromaticContact CD1-CH2 3.55Å; Y1026-W1062 HydrophobicContact CD1-CH2 3.55Å; Y1026-W1062 AromaticContact CD1-CZ3 3.64Å; Y1026-W1062 HydrophobicContact CD1-CZ3 3.64Å; Y1026-W1062 AromaticContact CE1-CH2 3.97Å; Y1026-W1062 HydrophobicContact CE1-CH2 3.97Å; Y1026-W1062 HydrophobicContact CE1-CZ3 4.46Å; Y1026-W1062 HydrophobicContact CG-CH2 4.28Å; Y1026-W1062 AromaticContact CG-CZ3 3.95Å; Y1026-W1062 HydrophobicContact CG-CZ3 3.95Å
1027	G	82.2	Confident	84.6	Confident	9 Å²	9	40 Å²	40	9%	0.093	22%	0.222	C	C	.	.	S	Bend	trans	74.4	4.2	-174.6	0	0	0	0	0	114.3	V1023 D1024 D1061	V1023-G1027 WeakPolarHBondContact CG1-O 3.22Å; D1024-G1027 PolarHBondContact O-N 2.91Å; D1024-G1027 PolarHBondContact OD1-N 2.93Å; G1027-D1061 PolarHBondContact N-OD2 2.94Å
1028	R	87.9	Confident	85.3	Confident	26 Å²	26	39.4 Å²	39.4	10%	0.098	21%	0.206	C	C	.	.			trans	-82.3	127.2	-175.6	-59.9	171.7	178.5	167.6	1.7	110.7	V1023 D1024 Y1026 H1032 D1060 R1064	V1023-R1028 CarbonylContact C-O 3.37Å; V1023-R1028 VanDerWaalsContact CA-O 3.27Å; V1023-R1028 WeakPolarHBondContact CA-O 3.42Å; D1024-R1028 PolarHBondContact N-O 3.42Å; D1024-R1028 WeakPolarHBondContact OD1-CB 3.19Å; D1024-R1028 PolarHBondContact OD1-N 2.69Å; Y1026-R1028 PolarHBondContact O-N 3.22Å; R1028-H1032 HydrophobicContact CB-CB 3.83Å; R1028-H1032 HydrophobicContact CG-CB 4.27Å; R1028-D1060 HydrophobicContact CG-CB 3.67Å; R1028-D1060 IonicContact NE-OD2 3.19Å; R1028-D1060 PolarHBondContact NE-OD2 3.45Å; R1028-R1064 VanDerWaalsContact NH2-NH2 3.12Å
1029	N	90.3	Very high	86.1	Confident	0 Å²	0	40.1 Å²	40.1	0%	0	21%	0.211	C	C	.	.	B	Isolated β-bridge	trans	-90.2	175.8	174.3	64.3	43.1	0	0	0	112.2	V1023 V1031 H1032 W1033 L1055	V1023-N1029 HydrophobicContact CG1-CB 4.11Å; N1029-V1031 PolarHBondContact O-N 3.3Å; N1029-V1031 VanDerWaalsContact O-N 3.07Å; N1029-V1031 WeakPolarHBondContact OD1-CA 3.37Å; N1029-V1031 WeakPolarHBondContact OD1-CB 3.24Å; N1029-V1031 PolarHBondContact OD1-N 2.62Å; N1029-H1032 VanDerWaalsContact CG-ND1 3.26Å; N1029-H1032 PolarHBondContact N-ND1 3.41Å; N1029-H1032 PolarHBondContact ND2-ND1 3.22Å; N1029-H1032 WeakPolarHBondContact O-CB 3.3Å; N1029-H1032 PolarHBondContact O-N 2.91Å; N1029-H1032 PolarHBondContact OD1-N 3.17Å; N1029-H1032 PolarHBondContact OD1-ND1 3.14Å; N1029-W1033 PolarHBondContact O-N 3.14Å; N1029-L1055 HydrophobicContact CB-CD2 4.08Å; N1029-L1055 PolarHBondContact ND2-O 2.74Å
1030	V	92.3	Very high	86.9	Confident	0 Å²	0	39.1 Å²	39.1	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-50.7	-30.9	176.7	-65.2	0	0	0	0	115.1	I998 I999 I1002 Y1020 A1034 L1046 L1055	I998-V1030 HydrophobicContact CG1-CG1 4.5Å; I998-V1030 HydrophobicContact CG2-CG1 4.12Å; I999-V1030 HydrophobicContact CG1-CG1 4.01Å; I1002-V1030 HydrophobicContact CD1-CB 3.63Å; I1002-V1030 HydrophobicContact CD1-CG1 3.86Å; Y1020-V1030 WeakPolarHBondContact O-CG1 3.42Å; Y1020-V1030 WeakPolarHBondContact O-CG2 3.35Å; V1030-A1034 WeakPolarHBondContact O-CB 3.42Å; V1030-A1034 PolarHBondContact O-N 2.84Å; V1030-L1046 HydrophobicContact CB-CD1 4.07Å; V1030-L1046 HydrophobicContact CB-CD2 4.17Å; V1030-L1046 HydrophobicContact CG2-CD1 3.95Å; V1030-L1046 HydrophobicContact CG2-CD2 3.66Å; V1030-L1046 HydrophobicContact CG2-CG 4.45Å; V1030-L1055 HydrophobicContact CG2-CD1 4.31Å
1031	V	95	Very high	87.5	Confident	0 Å²	0	42.1 Å²	42.1	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-76.7	-33	-179.7	-170.5	0	0	0	0	111.2	N1029 A1035 L1043 L1046 F1052 L1055 P1066 L1082	N1029-V1031 PolarHBondContact O-N 3.3Å; N1029-V1031 VanDerWaalsContact O-N 3.07Å; N1029-V1031 WeakPolarHBondContact OD1-CA 3.37Å; N1029-V1031 WeakPolarHBondContact OD1-CB 3.24Å; N1029-V1031 PolarHBondContact OD1-N 2.62Å; V1031-A1035 WeakPolarHBondContact O-CB 3.47Å; V1031-A1035 PolarHBondContact O-N 2.9Å; V1031-L1043 HydrophobicContact CG1-CD2 3.99Å; V1031-L1046 HydrophobicContact CG2-CD1 4.32Å; V1031-F1052 HydrophobicContact CG1-CE2 3.92Å; V1031-F1052 HydrophobicContact CG1-CZ 4.26Å; V1031-F1052 HydrophobicContact CG2-CD2 3.96Å; V1031-F1052 HydrophobicContact CG2-CE2 3.83Å; V1031-L1055 HydrophobicContact CB-CB 4.44Å; V1031-L1055 HydrophobicContact CG2-CB 3.63Å; V1031-L1055 HydrophobicContact CG2-CD1 4.38Å; V1031-P1066 HydrophobicContact CB-CG 4.2Å; V1031-P1066 HydrophobicContact CG1-CB 4Å; V1031-P1066 HydrophobicContact CG1-CG 4.01Å; V1031-L1082 HydrophobicContact CG1-CD2 4.19Å
1032	H	94.8	Very high	88.3	Confident	0 Å²	0	36.7 Å²	36.7	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-61.9	-47	171.7	-68.5	72.9	0	0	0	110.5	R1028 N1029 A1035 V1036 M1058 R1064 L1069	R1028-H1032 HydrophobicContact CB-CB 3.83Å; R1028-H1032 HydrophobicContact CG-CB 4.27Å; N1029-H1032 VanDerWaalsContact CG-ND1 3.26Å; N1029-H1032 PolarHBondContact N-ND1 3.41Å; N1029-H1032 PolarHBondContact ND2-ND1 3.22Å; N1029-H1032 WeakPolarHBondContact O-CB 3.3Å; N1029-H1032 PolarHBondContact O-N 2.91Å; N1029-H1032 PolarHBondContact OD1-N 3.17Å; N1029-H1032 PolarHBondContact OD1-ND1 3.14Å; H1032-A1035 PolarHBondContact O-N 3.18Å; H1032-V1036 WeakPolarHBondContact O-CG2 3.36Å; H1032-V1036 PolarHBondContact O-N 3.32Å; H1032-M1058 PolarHBondContact CE1-O 3.33Å; H1032-M1058 PolarHBondContact NE2-O 2.74Å; H1032-R1064 PolarHBondContact NE2-O 3.09Å; H1032-L1069 HydrophobicContact CB-CD1 4Å
1033	W	94.7	Very high	89.4	Confident	21 Å²	21	34.5 Å²	34.5	8%	0.08	18%	0.176	C	C	.	.	H	α-helix	trans	-67.6	-41.1	179.8	-75.2	105.8	0	0	0	112.7	I999 I1002 Q1003 D1024 N1029 A1035 V1036 T1037	I999-W1033 HydrophobicContact CG2-CG 4.11Å; I1002-W1033 HydrophobicContact CG2-CB 3.75Å; Q1003-W1033 HydrophobicContact CG-CD2 3.89Å; Q1003-W1033 HydrophobicContact CG-CE3 3.52Å; Q1003-W1033 HydrophobicContact CG-CG 4.49Å; Q1003-W1033 HydrophobicContact CG-CH2 4.44Å; Q1003-W1033 HydrophobicContact CG-CZ3 3.83Å; D1024-W1033 VanDerWaalsContact OD2-CE2 3.29Å; D1024-W1033 VanDerWaalsContact OD2-CZ2 3.25Å; D1024-W1033 WeakPolarHBondContact OD2-CZ2 3.04Å; D1024-W1033 PolarHBondContact OD2-NE1 2.82Å; N1029-W1033 PolarHBondContact O-N 3.14Å; W1033-A1035 VanDerWaalsContact C-N 3.27Å; W1033-A1035 PolarHBondContact O-N 2.97Å; W1033-V1036 PolarHBondContact O-N 2.99Å; W1033-T1037 PolarHBondContact O-N 3.47Å; W1033-T1037 PolarHBondContact O-OG1 3.49Å
1034	A	94.7	Very high	90.2	Very high	0 Å²	0	33 Å²	33	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-67.2	-28.3	176.1	0	0	0	0	0	113.3	I1002 V1030 N1038 S1039 I1042 L1043 L1046	I1002-A1034 HydrophobicContact CG2-CB 4.03Å; V1030-A1034 WeakPolarHBondContact O-CB 3.42Å; V1030-A1034 PolarHBondContact O-N 2.84Å; A1034-N1038 PolarHBondContact O-N 2.04Å; A1034-S1039 PolarHBondContact O-N 3.3Å; A1034-I1042 HydrophobicContact CB-CB 4.31Å; A1034-I1042 HydrophobicContact CB-CG2 3.51Å; A1034-L1043 HydrophobicContact CB-CD2 3.65Å; A1034-L1043 HydrophobicContact CB-CG 3.95Å; A1034-L1046 HydrophobicContact CB-CD1 3.92Å
1035	A	95.9	Very high	91.1	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-73.1	-42	173.3	0	0	0	0	0	111.8	V1031 H1032 W1033 N1038 P1066 A1070 C1075 L1082	V1031-A1035 WeakPolarHBondContact O-CB 3.47Å; V1031-A1035 PolarHBondContact O-N 2.9Å; H1032-A1035 PolarHBondContact O-N 3.18Å; W1033-A1035 VanDerWaalsContact C-N 3.27Å; W1033-A1035 PolarHBondContact O-N 2.97Å; A1035-N1038 PolarHBondContact O-N 2.85Å; A1035-P1066 HydrophobicContact CB-CB 4.03Å; A1035-P1066 WeakPolarHBondContact CB-O 3.44Å; A1035-A1070 HydrophobicContact CB-CB 4.15Å; A1035-C1075 WeakPolarHBondContact O-CB 3.4Å; A1035-C1075 PolarHBondContact O-SG 2.02Å; A1035-L1082 HydrophobicContact CB-CD1 3.94Å
1036	V	93	Very high	92.2	Very high	39 Å²	39	26.5 Å²	26.5	24%	0.236	14%	0.137	C	C	.	.	H	α-helix	trans	-65.3	-36.5	174.5	164.8	0	0	0	0	112.8	H1032 W1033 N1038 L1069 E1073 C1075	H1032-V1036 WeakPolarHBondContact O-CG2 3.36Å; H1032-V1036 PolarHBondContact O-N 3.32Å; W1033-V1036 PolarHBondContact O-N 2.99Å; V1036-N1038 PolarHBondContact O-N 2.97Å; V1036-L1069 HydrophobicContact CG2-CB 3.72Å; V1036-L1069 HydrophobicContact CG2-CD1 3.98Å; V1036-L1069 HydrophobicContact CG2-CG 4.42Å; V1036-E1073 HydrophobicContact CG1-CG 4.3Å; V1036-E1073 HydrophobicContact CG2-CG 4.21Å; V1036-C1075 PolarHBondContact O-SG 3.47Å; V1036-C1075 VanDerWaalsContact O-SG 3.33Å
1037	T	91.2	Very high	92.9	Very high	49 Å²	49	24 Å²	24	30%	0.301	13%	0.133	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.8	9.8	175.8	62.5	0	0	0	0	113.8	I1002 W1033 S1039	I1002-T1037 WeakPolarHBondContact O-CG2 3.23Å; W1033-T1037 PolarHBondContact O-N 3.47Å; W1033-T1037 PolarHBondContact O-OG1 3.49Å; T1037-S1039 PolarHBondContact O-N 2.97Å
1038	N	94.1	Very high	93.3	Very high	42 Å²	42	30.9 Å²	30.9	23%	0.225	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	51.3	23.1	-177.9	-168.7	62.4	0	0	0	114.3	A1034 A1035 V1036 V1040 C1075 E1077 A1078	A1034-N1038 PolarHBondContact O-N 2.04Å; A1035-N1038 PolarHBondContact O-N 2.85Å; V1036-N1038 PolarHBondContact O-N 2.97Å; N1038-V1040 PolarHBondContact O-N 2.04Å; N1038-C1075 HydrophobicContact CB-CB 3.77Å; N1038-C1075 VanDerWaalsContact OD1-C 3.27Å; N1038-C1075 WeakPolarHBondContact OD1-CA 3.42Å; N1038-C1075 WeakPolarHBondContact OD1-CB 3.5Å; N1038-C1075 PolarHBondContact OD1-O 3.42Å; N1038-E1077 PolarHBondContact ND2-OE2 3.48Å; N1038-E1077 PolarHBondContact OD1-N 3.31Å; N1038-A1078 PolarHBondContact OD1-N 3.16Å
1039	S	93.4	Very high	93.2	Very high	22 Å²	22	30.8 Å²	30.8	15%	0.154	17%	0.166	C	C	.	.			trans	-88.9	86.1	-166.5	-172.6	0	0	0	0	112.2	A1034 T1037 K1041 I1042 L1043	A1034-S1039 PolarHBondContact O-N 3.3Å; T1037-S1039 PolarHBondContact O-N 2.97Å; S1039-K1041 PolarHBondContact O-N 3.1Å; S1039-I1042 PolarHBondContact O-N 2.94Å; S1039-I1042 WeakPolarHBondContact OG-CD1 3.46Å; S1039-I1042 WeakPolarHBondContact OG-CG1 3.18Å; S1039-L1043 WeakPolarHBondContact O-CG 3.16Å; S1039-L1043 PolarHBondContact O-N 2.95Å
1040	V	94.2	Very high	92.8	Very high	52 Å²	52	38.9 Å²	38.9	32%	0.315	20%	0.201	S	C	.	.	H	α-helix	trans	-55	-35.4	177.4	-178.1	0	0	0	0	112.3	N1038 L1043 A1044 E1077 F1081	N1038-V1040 PolarHBondContact O-N 2.04Å; V1040-L1043 PolarHBondContact O-N 3.07Å; V1040-A1044 VanDerWaalsContact O-CB 3.29Å; V1040-A1044 WeakPolarHBondContact O-CB 3.19Å; V1040-A1044 PolarHBondContact O-N 2.73Å; V1040-E1077 HydrophobicContact CG2-CB 3.61Å; V1040-F1081 HydrophobicContact CG1-CD2 3.82Å; V1040-F1081 HydrophobicContact CG1-CE2 4.45Å; V1040-F1081 HydrophobicContact CG1-CG 4.43Å
1041	K	94.2	Very high	92.2	Very high	120 Å²	120	40.9 Å²	40.9	52%	0.522	22%	0.223	S	C	.	.	H	α-helix	trans	-60.1	-50.3	173.8	-71.4	-178	175.1	178.6	0	112.1	D1007 S1039 A1044 Y1045	D1007-K1041 HydrophobicContact CB-CD 4.29Å; D1007-K1041 WeakPolarHBondContact OD2-CD 3.24Å; D1007-K1041 WeakPolarHBondContact OD2-CE 3.39Å; D1007-K1041 IonicContact OD2-NZ 3.4Å; D1007-K1041 PolarHBondContact OD2-NZ 2.83Å; S1039-K1041 PolarHBondContact O-N 3.1Å; K1041-A1044 WeakPolarHBondContact O-CB 3.33Å; K1041-A1044 PolarHBondContact O-N 2.58Å; K1041-A1044 VanDerWaalsContact O-N 3.14Å; K1041-Y1045 HydrophobicContact CB-CE2 4.49Å; K1041-Y1045 WeakPolarHBondContact O-CD2 3.4Å; K1041-Y1045 PolarHBondContact O-N 2.82Å
1042	I	93.9	Very high	91.9	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-65.1	-42.6	179.5	-70.8	173.6	0	0	0	110	I1002 D1007 V1010 A1034 S1039 A1044 Y1045 L1046	I1002-I1042 HydrophobicContact CD1-CG2 4.14Å; I1002-I1042 HydrophobicContact CG1-CD1 4.3Å; I1002-I1042 HydrophobicContact CG1-CG2 3.87Å; I1002-I1042 HydrophobicContact CG2-CD1 4.45Å; I1002-I1042 HydrophobicContact CG2-CG2 4.33Å; D1007-I1042 HydrophobicContact CB-CG1 4.17Å; V1010-I1042 HydrophobicContact CB-CG1 4.44Å; V1010-I1042 HydrophobicContact CG1-CG1 4.39Å; V1010-I1042 HydrophobicContact CG1-CG2 4.21Å; V1010-I1042 HydrophobicContact CG2-CD1 4.06Å; V1010-I1042 HydrophobicContact CG2-CG1 4.45Å; A1034-I1042 HydrophobicContact CB-CB 4.31Å; A1034-I1042 HydrophobicContact CB-CG2 3.51Å; S1039-I1042 PolarHBondContact O-N 2.94Å; S1039-I1042 WeakPolarHBondContact OG-CD1 3.46Å; S1039-I1042 WeakPolarHBondContact OG-CG1 3.18Å; I1042-A1044 VanDerWaalsContact C-N 3.25Å; I1042-A1044 PolarHBondContact O-N 3.03Å; I1042-Y1045 PolarHBondContact O-N 2.63Å; I1042-L1046 HydrophobicContact CG2-CD1 3.84Å; I1042-L1046 HydrophobicContact CG2-CG 4.29Å; I1042-L1046 WeakPolarHBondContact O-CB 3.08Å; I1042-L1046 VanDerWaalsContact O-CG 3.3Å; I1042-L1046 WeakPolarHBondContact O-CG 3.12Å; I1042-L1046 PolarHBondContact O-N 3.35Å
1043	L	95.4	Very high	91.3	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-59.2	-36.2	173.2	-69.1	170.9	0	0	0	111.9	V1031 A1034 S1039 V1040 A1047 A1078 F1081	V1031-L1043 HydrophobicContact CG1-CD2 3.99Å; A1034-L1043 HydrophobicContact CB-CD2 3.65Å; A1034-L1043 HydrophobicContact CB-CG 3.95Å; S1039-L1043 WeakPolarHBondContact O-CG 3.16Å; S1039-L1043 PolarHBondContact O-N 2.95Å; V1040-L1043 PolarHBondContact O-N 3.07Å; L1043-A1047 WeakPolarHBondContact O-CB 3.5Å; L1043-A1047 PolarHBondContact O-N 2.92Å; L1043-A1078 HydrophobicContact CD1-CB 3.83Å; L1043-F1081 HydrophobicContact CB-CD1 3.66Å; L1043-F1081 HydrophobicContact CB-CE1 3.6Å; L1043-F1081 HydrophobicContact CB-CG 4.28Å; L1043-F1081 HydrophobicContact CB-CZ 4.16Å; L1043-F1081 HydrophobicContact CD1-CB 4.46Å; L1043-F1081 HydrophobicContact CD1-CD1 4.11Å; L1043-F1081 HydrophobicContact CD1-CG 4.47Å; L1043-F1081 HydrophobicContact CG-CD1 4.41Å
1044	A	94.9	Very high	90.8	Very high	36 Å²	36	53.2 Å²	53.2	30%	0.298	28%	0.284	S	S	.	.	H	α-helix	trans	-72.8	-31.9	175.5	0	0	0	0	0	114.1	V1040 K1041 I1042 Q1048 F1081	V1040-A1044 VanDerWaalsContact O-CB 3.29Å; V1040-A1044 WeakPolarHBondContact O-CB 3.19Å; V1040-A1044 PolarHBondContact O-N 2.73Å; K1041-A1044 WeakPolarHBondContact O-CB 3.33Å; K1041-A1044 PolarHBondContact O-N 2.58Å; K1041-A1044 VanDerWaalsContact O-N 3.14Å; I1042-A1044 VanDerWaalsContact C-N 3.25Å; I1042-A1044 PolarHBondContact O-N 3.03Å; A1044-Q1048 PolarHBondContact O-NE2 3.03Å; A1044-F1081 HydrophobicContact CB-CE2 4.12Å; A1044-F1081 HydrophobicContact CB-CZ 4.24Å
1045	Y	93.8	Very high	90.6	Very high	53 Å²	53	54 Å²	54	21%	0.208	29%	0.287	C	S	.	.	H	α-helix	trans	-68.7	-49.3	168.6	-58	-36.9	0	0	0	110.7	D1007 K1011 K1041 I1042 A1047 Q1048	D1007-Y1045 HydrophobicContact CB-CE2 4.38Å; K1011-Y1045 HydrophobicContact CB-CD2 4.04Å; K1011-Y1045 HydrophobicContact CB-CE2 3.89Å; K1011-Y1045 HydrophobicContact CD-CE1 3.99Å; K1011-Y1045 HydrophobicContact CD-CE2 4.29Å; K1041-Y1045 HydrophobicContact CB-CE2 4.49Å; K1041-Y1045 WeakPolarHBondContact O-CD2 3.4Å; K1041-Y1045 PolarHBondContact O-N 2.82Å; I1042-Y1045 PolarHBondContact O-N 2.63Å; Y1045-A1047 VanDerWaalsContact C-N 3.26Å; Y1045-A1047 PolarHBondContact O-N 3.42Å; Y1045-Q1048 WeakPolarHBondContact O-CB 3.42Å; Y1045-Q1048 PolarHBondContact O-N 3.1Å
1046	L	93	Very high	90.4	Very high	2 Å²	2	54.3 Å²	54.3	1%	0.01	29%	0.289	C	S	.	.	H	α-helix	trans	-61.1	-32.3	178	-68.4	173.8	0	0	0	112.8	I1002 L1014 V1030 V1031 A1034 I1042 Q1048 C1049 F1052	I1002-L1046 HydrophobicContact CD1-CD1 4.39Å; L1014-L1046 HydrophobicContact CD1-CD2 4.23Å; L1014-L1046 HydrophobicContact CD2-CD2 4.4Å; V1030-L1046 HydrophobicContact CB-CD1 4.07Å; V1030-L1046 HydrophobicContact CB-CD2 4.17Å; V1030-L1046 HydrophobicContact CG2-CD1 3.95Å; V1030-L1046 HydrophobicContact CG2-CD2 3.66Å; V1030-L1046 HydrophobicContact CG2-CG 4.45Å; V1031-L1046 HydrophobicContact CG2-CD1 4.32Å; A1034-L1046 HydrophobicContact CB-CD1 3.92Å; I1042-L1046 HydrophobicContact CG2-CD1 3.84Å; I1042-L1046 HydrophobicContact CG2-CG 4.29Å; I1042-L1046 WeakPolarHBondContact O-CB 3.08Å; I1042-L1046 VanDerWaalsContact O-CG 3.3Å; I1042-L1046 WeakPolarHBondContact O-CG 3.12Å; I1042-L1046 PolarHBondContact O-N 3.35Å; L1046-Q1048 PolarHBondContact O-N 3.06Å; L1046-C1049 VanDerWaalsContact O-CB 3.27Å; L1046-C1049 WeakPolarHBondContact O-CB 3.5Å; L1046-C1049 PolarHBondContact O-N 2.84Å; L1046-F1052 VanDerWaalsContact C-CD2 3.42Å; L1046-F1052 HydrophobicContact CB-CD2 3.92Å; L1046-F1052 HydrophobicContact CB-CE2 3.96Å; L1046-F1052 WeakPolarHBondContact O-CB 3.39Å; L1046-F1052 VanDerWaalsContact O-CD2 3.27Å; L1046-F1052 WeakPolarHBondContact O-CD2 3.44Å
1047	A	92	Very high	90.3	Very high	32 Å²	32	54.3 Å²	54.3	26%	0.264	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-18.3	176.3	0	0	0	0	0	114.1	L1043 Y1045 C1049 F1052 F1081	L1043-A1047 WeakPolarHBondContact O-CB 3.5Å; L1043-A1047 PolarHBondContact O-N 2.92Å; Y1045-A1047 VanDerWaalsContact C-N 3.26Å; Y1045-A1047 PolarHBondContact O-N 3.42Å; A1047-C1049 VanDerWaalsContact C-N 3.35Å; A1047-F1052 HydrophobicContact CB-CD1 4.25Å; A1047-F1052 HydrophobicContact CB-CD2 4.44Å; A1047-F1052 HydrophobicContact CB-CE1 4.23Å; A1047-F1052 HydrophobicContact CB-CE2 4.41Å; A1047-F1052 HydrophobicContact CB-CG 4.36Å; A1047-F1052 HydrophobicContact CB-CZ 4.31Å; A1047-F1081 HydrophobicContact CB-CE1 4.31Å; A1047-F1081 HydrophobicContact CB-CZ 3.97Å
1048	Q	90	Very high	90.3	Very high	155 Å²	155	54.9 Å²	54.9	72%	0.724	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.2	-14.5	173.4	-63.5	165.7	66.3	0	0	111.9	A1044 Y1045 L1046	A1044-Q1048 PolarHBondContact O-NE2 3.03Å; Y1045-Q1048 WeakPolarHBondContact O-CB 3.42Å; Y1045-Q1048 PolarHBondContact O-N 3.1Å; L1046-Q1048 PolarHBondContact O-N 3.06Å
1049	C	86.7	Confident	90	Very high	23 Å²	23	56.4 Å²	56.4	16%	0.155	29%	0.292	C	S	.	.	S	Bend	trans	-80.2	136.8	-176.8	-55.5	0	0	0	0	112.8	Y1020 L1046 A1047 G1051 F1052	Y1020-C1049 HydrophobicContact CD2-CB 4.21Å; Y1020-C1049 HydrophobicContact CE1-CB 4.13Å; Y1020-C1049 HydrophobicContact CE2-CB 3.66Å; L1046-C1049 VanDerWaalsContact O-CB 3.27Å; L1046-C1049 WeakPolarHBondContact O-CB 3.5Å; L1046-C1049 PolarHBondContact O-N 2.84Å; A1047-C1049 VanDerWaalsContact C-N 3.35Å; C1049-G1051 PolarHBondContact O-N 2.94Å; C1049-F1052 PolarHBondContact O-N 3.12Å; C1049-F1052 VanDerWaalsContact O-N 3.16Å
1050	K	81.3	Confident	89.7	Confident	170 Å²	170	55.6 Å²	55.6	74%	0.739	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.7	107.3	179.7	-73.7	-173.1	178.4	-179	0	111.6	Y1020	Y1020-K1050 PolarHBondContact OH-O 2.88Å; Y1020-K1050 VanDerWaalsContact OH-O 3.09Å
1051	G	80.2	Confident	89.2	Confident	43 Å²	43	58.3 Å²	58.3	44%	0.443	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	110.2	6	178.4	0	0	0	0	0	115	C1049 A1053 R1054 L1055	C1049-G1051 PolarHBondContact O-N 2.94Å; G1051-A1053 PolarHBondContact O-N 2.86Å; G1051-A1053 VanDerWaalsContact O-N 3.16Å; G1051-R1054 WeakPolarHBondContact O-CA 3.4Å; G1051-R1054 WeakPolarHBondContact O-CB 3.26Å; G1051-R1054 PolarHBondContact O-N 2.87Å; G1051-L1055 PolarHBondContact O-N 2.92Å
1052	F	88.9	Confident	88.8	Confident	15 Å²	15	57.5 Å²	57.5	7%	0.066	29%	0.293	C	S	.	.	H	α-helix	trans	-44.2	-47	172.2	-179.7	-101.4	0	0	0	113.2	V1031 L1046 A1047 C1049 R1054 L1055 M1056 F1081 K1085	V1031-F1052 HydrophobicContact CG1-CE2 3.92Å; V1031-F1052 HydrophobicContact CG1-CZ 4.26Å; V1031-F1052 HydrophobicContact CG2-CD2 3.96Å; V1031-F1052 HydrophobicContact CG2-CE2 3.83Å; L1046-F1052 VanDerWaalsContact C-CD2 3.42Å; L1046-F1052 HydrophobicContact CB-CD2 3.92Å; L1046-F1052 HydrophobicContact CB-CE2 3.96Å; L1046-F1052 WeakPolarHBondContact O-CB 3.39Å; L1046-F1052 VanDerWaalsContact O-CD2 3.27Å; L1046-F1052 WeakPolarHBondContact O-CD2 3.44Å; A1047-F1052 HydrophobicContact CB-CD1 4.25Å; A1047-F1052 HydrophobicContact CB-CD2 4.44Å; A1047-F1052 HydrophobicContact CB-CE1 4.23Å; A1047-F1052 HydrophobicContact CB-CE2 4.41Å; A1047-F1052 HydrophobicContact CB-CG 4.36Å; A1047-F1052 HydrophobicContact CB-CZ 4.31Å; C1049-F1052 PolarHBondContact O-N 3.12Å; C1049-F1052 VanDerWaalsContact O-N 3.16Å; F1052-R1054 PolarHBondContact O-N 3.46Å; F1052-R1054 VanDerWaalsContact O-N 3.11Å; F1052-L1055 PolarHBondContact O-N 3.42Å; F1052-M1056 HydrophobicContact CD1-CB 4.45Å; F1052-M1056 HydrophobicContact CD1-SD 4.25Å; F1052-M1056 HydrophobicContact CE1-CB 4.21Å; F1052-M1056 HydrophobicContact CE1-CG 4.33Å; F1052-M1056 HydrophobicContact CE1-SD 3.62Å; F1052-M1056 HydrophobicContact CZ-CB 4.49Å; F1052-M1056 HydrophobicContact CZ-SD 4.37Å; F1052-M1056 VanDerWaalsContact O-CB 3.27Å; F1052-M1056 WeakPolarHBondContact O-CB 3.15Å; F1052-M1056 PolarHBondContact O-N 3.09Å; F1052-F1081 HydrophobicContact CZ-CE1 4.16Å; F1052-K1085 HydrophobicContact CE1-CB 4.03Å; F1052-K1085 HydrophobicContact CE1-CG 4.11Å
1053	A	82.9	Confident	88.5	Confident	66 Å²	66	60.5 Å²	60.5	55%	0.545	31%	0.309	S	S	.	.	H	α-helix	trans	-60.3	-22.9	179.4	0	0	0	0	0	114.9	G1051 M1056 N1057	G1051-A1053 PolarHBondContact O-N 2.86Å; G1051-A1053 VanDerWaalsContact O-N 3.16Å; A1053-M1056 HydrophobicContact CB-CE 4.46Å; A1053-N1057 PolarHBondContact O-ND2 3.33Å
1054	R	84.1	Confident	88.3	Confident	199 Å²	199	61.6 Å²	61.6	75%	0.751	31%	0.313	S	S	*	.	H	α-helix	trans	-78.2	-45.6	170.2	175.9	-178.5	170.2	178.8	-3.2	110.9	G1051 F1052 N1057 M1058	G1051-R1054 WeakPolarHBondContact O-CA 3.4Å; G1051-R1054 WeakPolarHBondContact O-CB 3.26Å; G1051-R1054 PolarHBondContact O-N 2.87Å; F1052-R1054 PolarHBondContact O-N 3.46Å; F1052-R1054 VanDerWaalsContact O-N 3.11Å; R1054-N1057 PolarHBondContact O-N 3.43Å; R1054-M1058 WeakPolarHBondContact O-CB 3.3Å; R1054-M1058 PolarHBondContact O-N 3.04Å
1055	L	89.3	Confident	88.2	Confident	15 Å²	15	59.9 Å²	59.9	8%	0.079	30%	0.299	C	S	.	.	H	α-helix	trans	-68	-37.5	-178.4	-60.6	172.2	0	0	0	112.1	Y1020 N1029 V1030 V1031 G1051 F1052 N1057 M1058	Y1020-L1055 HydrophobicContact CD2-CD1 4.01Å; Y1020-L1055 HydrophobicContact CE2-CD1 4.21Å; N1029-L1055 HydrophobicContact CB-CD2 4.08Å; N1029-L1055 PolarHBondContact ND2-O 2.74Å; V1030-L1055 HydrophobicContact CG2-CD1 4.31Å; V1031-L1055 HydrophobicContact CB-CB 4.44Å; V1031-L1055 HydrophobicContact CG2-CB 3.63Å; V1031-L1055 HydrophobicContact CG2-CD1 4.38Å; G1051-L1055 PolarHBondContact O-N 2.92Å; F1052-L1055 PolarHBondContact O-N 3.42Å; L1055-N1057 VanDerWaalsContact C-N 3.25Å; L1055-N1057 PolarHBondContact O-N 2.04Å; L1055-M1058 HydrophobicContact CD2-SD 4.48Å; L1055-M1058 WeakPolarHBondContact O-CB 3.34Å; L1055-M1058 PolarHBondContact O-N 3.34Å
1056	M	92.1	Very high	88.3	Confident	7 Å²	7	57.3 Å²	57.3	3%	0.034	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-26	176.9	177.4	179.1	75.1	0	0	114.4	F1052 A1053 P1066 L1082 K1085 A1087	F1052-M1056 HydrophobicContact CD1-CB 4.45Å; F1052-M1056 HydrophobicContact CD1-SD 4.25Å; F1052-M1056 HydrophobicContact CE1-CB 4.21Å; F1052-M1056 HydrophobicContact CE1-CG 4.33Å; F1052-M1056 HydrophobicContact CE1-SD 3.62Å; F1052-M1056 HydrophobicContact CZ-CB 4.49Å; F1052-M1056 HydrophobicContact CZ-SD 4.37Å; F1052-M1056 VanDerWaalsContact O-CB 3.27Å; F1052-M1056 WeakPolarHBondContact O-CB 3.15Å; F1052-M1056 PolarHBondContact O-N 3.09Å; A1053-M1056 HydrophobicContact CB-CE 4.46Å; M1056-P1066 WeakPolarHBondContact O-CD 3.45Å; M1056-L1082 HydrophobicContact CG-CD2 3.93Å; M1056-L1082 HydrophobicContact SD-CD2 4.44Å; M1056-K1085 WeakPolarHBondContact CE-O 3.28Å; M1056-K1085 HydrophobicContact SD-CB 3.69Å; M1056-A1087 HydrophobicContact CG-CB 4.09Å; M1056-A1087 HydrophobicContact SD-CB 4.26Å
1057	N	91.5	Very high	88.5	Confident	39 Å²	39	57.3 Å²	57.3	21%	0.209	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	-121.3	13.2	179.2	-58.8	-76.7	0	0	0	112.2	A1053 R1054 L1055 K1088	A1053-N1057 PolarHBondContact O-ND2 3.33Å; R1054-N1057 PolarHBondContact O-N 3.43Å; L1055-N1057 VanDerWaalsContact C-N 3.25Å; L1055-N1057 PolarHBondContact O-N 2.04Å; N1057-K1088 WeakPolarHBondContact OD1-CB 3.37Å; N1057-K1088 WeakPolarHBondContact OD1-CG 3.5Å; N1057-K1088 PolarHBondContact OD1-N 3.3Å
1058	M	90.8	Very high	88.6	Confident	62 Å²	62	55.8 Å²	55.8	31%	0.305	28%	0.276	S	S	.	.			trans	-73.5	147.4	169.2	179.7	166.7	169.8	0	0	108.5	V1023 H1032 R1054 L1055	V1023-M1058 HydrophobicContact CG1-CE 3.66Å; H1032-M1058 PolarHBondContact CE1-O 3.33Å; H1032-M1058 PolarHBondContact NE2-O 2.74Å; R1054-M1058 WeakPolarHBondContact O-CB 3.3Å; R1054-M1058 PolarHBondContact O-N 3.04Å; L1055-M1058 HydrophobicContact CD2-SD 4.48Å; L1055-M1058 WeakPolarHBondContact O-CB 3.34Å; L1055-M1058 PolarHBondContact O-N 3.34Å
1059	K	88.4	Confident	88.8	Confident	73 Å²	73	48.5 Å²	48.5	32%	0.317	24%	0.242	S	C	.	.			trans	-97.2	144.4	176.9	-70.1	165.7	153.1	-82.6	0	110.4	D1063 R1064 T1065 I1091 I1092	K1059-D1063 VanDerWaalsContact CD-OD1 3.25Å; K1059-D1063 WeakPolarHBondContact CD-OD1 3.49Å; K1059-D1063 VanDerWaalsContact CE-OD1 3.3Å; K1059-D1063 WeakPolarHBondContact CE-OD1 3.32Å; K1059-D1063 WeakPolarHBondContact CG-O 3.17Å; K1059-D1063 VanDerWaalsContact NZ-CB 3.35Å; K1059-D1063 VanDerWaalsContact NZ-CG 3.34Å; K1059-D1063 PolarHBondContact NZ-O 3.49Å; K1059-D1063 IonicContact NZ-OD1 2.83Å; K1059-D1063 PolarHBondContact NZ-OD1 3.49Å; K1059-R1064 CarbonylContact C-O 3.54Å; K1059-R1064 WeakPolarHBondContact CA-O 3.21Å; K1059-T1065 HydrophobicContact CG-CG2 4.31Å; K1059-I1091 VanDerWaalsContact CE-CG2 3.42Å; K1059-I1092 PolarHBondContact NZ-O 3.42Å
1060	D	86.4	Confident	89.2	Confident	6 Å²	6	47.4 Å²	47.4	3%	0.032	24%	0.235	C	C	.	.			trans	-78.8	177.1	163.9	85.9	-7.4	0	0	0	111.1	Y1026 R1028 W1062 D1063 R1064	Y1026-D1060 WeakPolarHBondContact O-CB 3.44Å; R1028-D1060 HydrophobicContact CG-CB 3.67Å; R1028-D1060 IonicContact NE-OD2 3.19Å; R1028-D1060 PolarHBondContact NE-OD2 3.45Å; D1060-W1062 PolarHBondContact O-N 2.67Å; D1060-W1062 WeakPolarHBondContact OD1-CA 3.46Å; D1060-W1062 PolarHBondContact OD1-N 3.41Å; D1060-D1063 PolarHBondContact O-N 3.4Å; D1060-R1064 PolarHBondContact N-O 2.83Å; D1060-R1064 WeakPolarHBondContact OD1-CB 3.35Å; D1060-R1064 IonicContact OD1-CZ 2.69Å; D1060-R1064 PolarHBondContact OD1-N 2.81Å; D1060-R1064 VanDerWaalsContact OD1-N 3.13Å; D1060-R1064 IonicContact OD1-NE 3.79Å; D1060-R1064 PolarHBondContact OD1-NE 2.97Å; D1060-R1064 IonicContact OD1-NH2 2.74Å; D1060-R1064 IonicContact OD2-CZ 2.7Å; D1060-R1064 IonicContact OD2-NE 2.69Å; D1060-R1064 PolarHBondContact OD2-NE 2.86Å; D1060-R1064 VanDerWaalsContact OD2-NE 3.13Å; D1060-R1064 IonicContact OD2-NH2 2.63Å; D1060-R1064 PolarHBondContact OD2-NH2 3.4Å
1061	D	84.7	Confident	89.9	Confident	108 Å²	108	39.3 Å²	39.3	58%	0.578	20%	0.199	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.6	-9.1	-175	-67.7	-31.4	0	0	0	114	Y1026 G1027	Y1026-D1061 WeakPolarHBondContact CA-OD2 3.35Å; Y1026-D1061 PolarHBondContact O-N 3.37Å; G1027-D1061 PolarHBondContact N-OD2 2.94Å
1062	W	84.8	Confident	90.4	Very high	103 Å²	103	40.4 Å²	40.4	39%	0.39	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103.3	24.7	172	-68.3	-85.4	0	0	0	112.6	Y1026 D1060 R1064 C1094	Y1026-W1062 AromaticContact CD1-CH2 3.55Å; Y1026-W1062 HydrophobicContact CD1-CH2 3.55Å; Y1026-W1062 AromaticContact CD1-CZ3 3.64Å; Y1026-W1062 HydrophobicContact CD1-CZ3 3.64Å; Y1026-W1062 AromaticContact CE1-CH2 3.97Å; Y1026-W1062 HydrophobicContact CE1-CH2 3.97Å; Y1026-W1062 HydrophobicContact CE1-CZ3 4.46Å; Y1026-W1062 HydrophobicContact CG-CH2 4.28Å; Y1026-W1062 AromaticContact CG-CZ3 3.95Å; Y1026-W1062 HydrophobicContact CG-CZ3 3.95Å; D1060-W1062 PolarHBondContact O-N 2.67Å; D1060-W1062 WeakPolarHBondContact OD1-CA 3.46Å; D1060-W1062 PolarHBondContact OD1-N 3.41Å; W1062-R1064 HydrophobicContact CB-CG 4.3Å; W1062-R1064 PolarHBondContact O-N 3.31Å; W1062-C1094 VanDerWaalsContact O-CB 3.3Å; W1062-C1094 WeakPolarHBondContact O-CB 3.49Å; W1062-C1094 PolarHBondContact O-N 2.93Å; W1062-C1094 PolarHBondContact O-SG 3.26Å; W1062-C1094 VanDerWaalsContact O-SG 3.38Å
1063	D	87	Confident	90.6	Very high	63 Å²	63	43.5 Å²	43.5	34%	0.337	21%	0.205	S	C	.	.	S	Bend	trans	62.8	6.7	-178.4	-99.2	-52.7	0	0	0	113.7	K1059 D1060 C1094	K1059-D1063 VanDerWaalsContact CD-OD1 3.25Å; K1059-D1063 WeakPolarHBondContact CD-OD1 3.49Å; K1059-D1063 VanDerWaalsContact CE-OD1 3.3Å; K1059-D1063 WeakPolarHBondContact CE-OD1 3.32Å; K1059-D1063 WeakPolarHBondContact CG-O 3.17Å; K1059-D1063 VanDerWaalsContact NZ-CB 3.35Å; K1059-D1063 VanDerWaalsContact NZ-CG 3.34Å; K1059-D1063 PolarHBondContact NZ-O 3.49Å; K1059-D1063 IonicContact NZ-OD1 2.83Å; K1059-D1063 PolarHBondContact NZ-OD1 3.49Å; D1060-D1063 PolarHBondContact O-N 3.4Å; D1063-C1094 HydrophobicContact CB-CB 4.21Å
1064	R	90.9	Very high	91.1	Very high	23 Å²	23	41.7 Å²	41.7	9%	0.087	19%	0.192	C	C	.	.			trans	-85.2	151.3	-175.3	-59.1	174.3	-60.8	-131.6	3	112.2	R1028 H1032 K1059 D1060 W1062 M1068 D1093	R1028-R1064 VanDerWaalsContact NH2-NH2 3.12Å; H1032-R1064 PolarHBondContact NE2-O 3.09Å; K1059-R1064 CarbonylContact C-O 3.54Å; K1059-R1064 WeakPolarHBondContact CA-O 3.21Å; D1060-R1064 PolarHBondContact N-O 2.83Å; D1060-R1064 WeakPolarHBondContact OD1-CB 3.35Å; D1060-R1064 IonicContact OD1-CZ 2.69Å; D1060-R1064 PolarHBondContact OD1-N 2.81Å; D1060-R1064 VanDerWaalsContact OD1-N 3.13Å; D1060-R1064 IonicContact OD1-NE 3.79Å; D1060-R1064 PolarHBondContact OD1-NE 2.97Å; D1060-R1064 IonicContact OD1-NH2 2.74Å; D1060-R1064 IonicContact OD2-CZ 2.7Å; D1060-R1064 IonicContact OD2-NE 2.69Å; D1060-R1064 PolarHBondContact OD2-NE 2.86Å; D1060-R1064 VanDerWaalsContact OD2-NE 3.13Å; D1060-R1064 IonicContact OD2-NH2 2.63Å; D1060-R1064 PolarHBondContact OD2-NH2 3.4Å; W1062-R1064 HydrophobicContact CB-CG 4.3Å; W1062-R1064 PolarHBondContact O-N 3.31Å; R1064-M1068 HydrophobicContact CB-CB 4.39Å; R1064-D1093 HydrophobicContact CG-CB 3.69Å
1065	T	93.9	Very high	91.6	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	16%	0.16	C	C	.	.			trans	-103.8	167.3	175.4	62.9	0	0	0	0	112.3	K1059 I1067 M1068 L1069 I1091	K1059-T1065 HydrophobicContact CG-CG2 4.31Å; T1065-I1067 VanDerWaalsContact C-N 3.27Å; T1065-I1067 PolarHBondContact O-N 3.38Å; T1065-I1067 VanDerWaalsContact OG1-CG2 3.3Å; T1065-I1067 WeakPolarHBondContact OG1-CG2 3.45Å; T1065-M1068 HydrophobicContact CG2-SD 4.13Å; T1065-M1068 PolarHBondContact N-SD 3.01Å; T1065-M1068 WeakPolarHBondContact O-CB 3.38Å; T1065-M1068 PolarHBondContact O-N 2.82Å; T1065-M1068 VanDerWaalsContact O-N 3.07Å; T1065-M1068 VanDerWaalsContact OG1-CG 3.23Å; T1065-M1068 WeakPolarHBondContact OG1-CG 3.25Å; T1065-M1068 PolarHBondContact OG1-N 3.03Å; T1065-M1068 PolarHBondContact OG1-SD 3.03Å; T1065-M1068 VanDerWaalsContact OG1-SD 3.35Å; T1065-L1069 PolarHBondContact O-N 3.27Å; T1065-I1091 HydrophobicContact CG2-CB 4.09Å; T1065-I1091 HydrophobicContact CG2-CD1 3.77Å; T1065-I1091 HydrophobicContact CG2-CG2 3.72Å
1066	P	95.7	Very high	91.8	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-53	-39.9	173.9	-29	35.7	0	0	0	114.3	V1031 A1035 M1056 L1069 A1070 L1082	V1031-P1066 HydrophobicContact CB-CG 4.2Å; V1031-P1066 HydrophobicContact CG1-CB 4Å; V1031-P1066 HydrophobicContact CG1-CG 4.01Å; A1035-P1066 HydrophobicContact CB-CB 4.03Å; A1035-P1066 WeakPolarHBondContact CB-O 3.44Å; M1056-P1066 WeakPolarHBondContact O-CD 3.45Å; P1066-L1069 PolarHBondContact O-N 2.66Å; P1066-A1070 PolarHBondContact O-N 2.89Å; P1066-L1082 HydrophobicContact CB-CD1 4.25Å
1067	I	96.2	Very high	91.9	Very high	1 Å²	1	39.1 Å²	39.1	1%	0.005	19%	0.19	C	C	.	.	H	α-helix	trans	-69.9	-34.1	178.5	-173.7	165.1	0	0	0	111.9	T1065 A1070 I1071 V1079 L1082 L1083 A1087 V1089	T1065-I1067 VanDerWaalsContact C-N 3.27Å; T1065-I1067 PolarHBondContact O-N 3.38Å; T1065-I1067 VanDerWaalsContact OG1-CG2 3.3Å; T1065-I1067 WeakPolarHBondContact OG1-CG2 3.45Å; I1067-A1070 PolarHBondContact O-N 3.33Å; I1067-I1071 HydrophobicContact CG1-CD1 4.09Å; I1067-I1071 WeakPolarHBondContact O-CB 3.47Å; I1067-I1071 WeakPolarHBondContact O-CD1 3.42Å; I1067-I1071 VanDerWaalsContact O-CG1 3.23Å; I1067-I1071 WeakPolarHBondContact O-CG1 3.37Å; I1067-I1071 PolarHBondContact O-N 3.4Å; I1067-V1079 HydrophobicContact CD1-CG1 4.23Å; I1067-V1079 HydrophobicContact CG1-CG1 4.35Å; I1067-L1082 HydrophobicContact CB-CB 4.35Å; I1067-L1082 HydrophobicContact CB-CD1 4Å; I1067-L1082 HydrophobicContact CD1-CB 4.3Å; I1067-L1083 HydrophobicContact CD1-CD2 3.51Å; I1067-L1083 HydrophobicContact CD1-CG 3.78Å; I1067-A1087 HydrophobicContact CB-CB 4.38Å; I1067-A1087 HydrophobicContact CD1-CB 4.18Å; I1067-A1087 HydrophobicContact CG2-CB 4.23Å; I1067-V1089 HydrophobicContact CD1-CG1 4.14Å
1068	M	94.9	Very high	92.1	Very high	1 Å²	1	37.3 Å²	37.3	1%	0.005	18%	0.18	C	C	.	.	H	α-helix	trans	-68	-36.7	174.9	-65.5	166.6	110.1	0	0	112	R1064 T1065 R1072 I1091 D1093 N1097 L1102	R1064-M1068 HydrophobicContact CB-CB 4.39Å; T1065-M1068 HydrophobicContact CG2-SD 4.13Å; T1065-M1068 PolarHBondContact N-SD 3.01Å; T1065-M1068 WeakPolarHBondContact O-CB 3.38Å; T1065-M1068 PolarHBondContact O-N 2.82Å; T1065-M1068 VanDerWaalsContact O-N 3.07Å; T1065-M1068 VanDerWaalsContact OG1-CG 3.23Å; T1065-M1068 WeakPolarHBondContact OG1-CG 3.25Å; T1065-M1068 PolarHBondContact OG1-N 3.03Å; T1065-M1068 PolarHBondContact OG1-SD 3.03Å; T1065-M1068 VanDerWaalsContact OG1-SD 3.35Å; M1068-R1072 VanDerWaalsContact O-CB 3.32Å; M1068-R1072 WeakPolarHBondContact O-CB 3.47Å; M1068-R1072 PolarHBondContact O-N 3.24Å; M1068-I1091 WeakPolarHBondContact CE-O 3.23Å; M1068-I1091 HydrophobicContact SD-CG2 4.3Å; M1068-D1093 HydrophobicContact CE-CB 3.91Å; M1068-N1097 VanDerWaalsContact CE-O 3.22Å; M1068-N1097 WeakPolarHBondContact CE-O 3.28Å; M1068-L1102 HydrophobicContact CB-CD1 3.75Å; M1068-L1102 HydrophobicContact CE-CD1 4.07Å; M1068-L1102 HydrophobicContact CG-CD1 3.95Å
1069	L	94.2	Very high	92.3	Very high	1 Å²	1	34.3 Å²	34.3	1%	0.005	17%	0.165	C	C	.	.	H	α-helix	trans	-67.4	-45.8	171.4	-67.4	-176.9	0	0	0	111.5	H1032 V1036 T1065 P1066 I1071 R1072 E1073	H1032-L1069 HydrophobicContact CB-CD1 4Å; V1036-L1069 HydrophobicContact CG2-CB 3.72Å; V1036-L1069 HydrophobicContact CG2-CD1 3.98Å; V1036-L1069 HydrophobicContact CG2-CG 4.42Å; T1065-L1069 PolarHBondContact O-N 3.27Å; P1066-L1069 PolarHBondContact O-N 2.66Å; L1069-I1071 VanDerWaalsContact C-N 3.26Å; L1069-I1071 PolarHBondContact O-N 2.66Å; L1069-R1072 PolarHBondContact O-N 3.24Å; L1069-E1073 WeakPolarHBondContact O-CG 3.42Å; L1069-E1073 PolarHBondContact O-N 3.42Å
1070	A	95.6	Very high	92.7	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-57.2	-39.5	174.5	0	0	0	0	0	112.5	A1035 P1066 I1067 G1074 C1075 A1078 V1079 L1082	A1035-A1070 HydrophobicContact CB-CB 4.15Å; P1066-A1070 PolarHBondContact O-N 2.89Å; I1067-A1070 PolarHBondContact O-N 3.33Å; A1070-G1074 CarbonylContact O-C 3.53Å; A1070-G1074 PolarHBondContact O-N 3.26Å; A1070-G1074 VanDerWaalsContact O-N 3.14Å; A1070-C1075 HydrophobicContact CB-CB 3.99Å; A1070-C1075 PolarHBondContact O-N 2.93Å; A1070-A1078 HydrophobicContact CB-CB 4.06Å; A1070-V1079 HydrophobicContact CB-CG2 3.67Å; A1070-L1082 HydrophobicContact CB-CD1 4.48Å
1071	I	94.9	Very high	93.2	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-62.9	-47.4	171.7	-70.5	160.6	0	0	0	110.9	I1067 L1069 E1073 G1074 V1079 C1099 L1102 C1103 Y1108 I1111 L1115	I1067-I1071 HydrophobicContact CG1-CD1 4.09Å; I1067-I1071 WeakPolarHBondContact O-CB 3.47Å; I1067-I1071 WeakPolarHBondContact O-CD1 3.42Å; I1067-I1071 VanDerWaalsContact O-CG1 3.23Å; I1067-I1071 WeakPolarHBondContact O-CG1 3.37Å; I1067-I1071 PolarHBondContact O-N 3.4Å; L1069-I1071 VanDerWaalsContact C-N 3.26Å; L1069-I1071 PolarHBondContact O-N 2.66Å; I1071-E1073 VanDerWaalsContact C-N 3.34Å; I1071-E1073 PolarHBondContact O-N 3.13Å; I1071-G1074 PolarHBondContact O-N 2.98Å; I1071-V1079 HydrophobicContact CG1-CG2 3.84Å; I1071-C1099 HydrophobicContact CD1-CB 3.54Å; I1071-C1099 VanDerWaalsContact CD1-SG 3.56Å; I1071-L1102 HydrophobicContact CG2-CB 3.68Å; I1071-C1103 HydrophobicContact CG2-CB 4.43Å; I1071-C1103 WeakPolarHBondContact CG2-SG 3.4Å; I1071-Y1108 WeakPolarHBondContact O-CD2 3.24Å; I1071-Y1108 WeakPolarHBondContact O-CE2 3.41Å; I1071-I1111 HydrophobicContact CG1-CG2 4.06Å; I1071-L1115 HydrophobicContact CD1-CD1 3.79Å; I1071-L1115 HydrophobicContact CD1-CD2 4.49Å; I1071-L1115 HydrophobicContact CG1-CD1 4.26Å
1072	R	92.2	Very high	93.7	Very high	67 Å²	67	30.7 Å²	30.7	25%	0.253	15%	0.145	S	C	.	.	H	α-helix	trans	-65	-34	-175.1	-162.8	-172.9	76.3	137.6	11.8	113.5	M1068 L1069	M1068-R1072 VanDerWaalsContact O-CB 3.32Å; M1068-R1072 WeakPolarHBondContact O-CB 3.47Å; M1068-R1072 PolarHBondContact O-N 3.24Å; L1069-R1072 PolarHBondContact O-N 3.24Å
1073	E	92.5	Very high	94.2	Very high	80 Å²	80	26 Å²	26	37%	0.374	13%	0.128	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.9	0.1	176.7	-43.6	-48.4	131.9	0	0	113.6	V1036 L1069 I1071	V1036-E1073 HydrophobicContact CG1-CG 4.3Å; V1036-E1073 HydrophobicContact CG2-CG 4.21Å; L1069-E1073 WeakPolarHBondContact O-CG 3.42Å; L1069-E1073 PolarHBondContact O-N 3.42Å; I1071-E1073 VanDerWaalsContact C-N 3.34Å; I1071-E1073 PolarHBondContact O-N 3.13Å
1074	G	92.7	Very high	94.5	Very high	27 Å²	27	28.1 Å²	28.1	28%	0.278	14%	0.139	S	C	.	.	T	Hydrogen-bonded Turn	trans	79.3	16.5	177.9	0	0	0	0	0	116.1	A1070 I1071 Q1076	A1070-G1074 CarbonylContact O-C 3.53Å; A1070-G1074 PolarHBondContact O-N 3.26Å; A1070-G1074 VanDerWaalsContact O-N 3.14Å; I1071-G1074 PolarHBondContact O-N 2.98Å; G1074-Q1076 VanDerWaalsContact C-N 3.33Å; G1074-Q1076 PolarHBondContact O-N 3.18Å
1075	C	94.3	Very high	94.7	Very high	12 Å²	12	30.6 Å²	30.6	8%	0.081	15%	0.151	C	C	.	.			trans	-75	72	-175.4	-54.1	0	0	0	0	113.1	A1035 V1036 N1038 A1070 E1077 A1078 V1079	A1035-C1075 WeakPolarHBondContact O-CB 3.4Å; A1035-C1075 PolarHBondContact O-SG 2.02Å; V1036-C1075 PolarHBondContact O-SG 3.47Å; V1036-C1075 VanDerWaalsContact O-SG 3.33Å; N1038-C1075 HydrophobicContact CB-CB 3.77Å; N1038-C1075 VanDerWaalsContact OD1-C 3.27Å; N1038-C1075 WeakPolarHBondContact OD1-CA 3.42Å; N1038-C1075 WeakPolarHBondContact OD1-CB 3.5Å; N1038-C1075 PolarHBondContact OD1-O 3.42Å; A1070-C1075 HydrophobicContact CB-CB 3.99Å; A1070-C1075 PolarHBondContact O-N 2.93Å; C1075-E1077 VanDerWaalsContact C-N 3.35Å; C1075-E1077 PolarHBondContact O-N 2.95Å; C1075-A1078 HydrophobicContact CB-CB 4.06Å; C1075-A1078 PolarHBondContact O-N 3.31Å; C1075-V1079 WeakPolarHBondContact O-CG2 3.28Å; C1075-V1079 PolarHBondContact O-N 2.73Å
1076	Q	93.6	Very high	94.5	Very high	50 Å²	50	35.4 Å²	35.4	23%	0.234	17%	0.173	C	C	.	.	H	α-helix	trans	-50.8	-46	-175.5	-172.4	-151.9	-45.1	0	0	113.8	G1074 V1079 E1080 K1110 I1111 I1114	G1074-Q1076 VanDerWaalsContact C-N 3.33Å; G1074-Q1076 PolarHBondContact O-N 3.18Å; Q1076-V1079 WeakPolarHBondContact O-CB 3.05Å; Q1076-V1079 PolarHBondContact O-N 3.13Å; Q1076-E1080 PolarHBondContact NE2-OE1 2.92Å; Q1076-E1080 PolarHBondContact O-N 3.01Å; Q1076-K1110 VanDerWaalsContact CD-NZ 3.32Å; Q1076-K1110 VanDerWaalsContact NE2-NZ 3.15Å; Q1076-K1110 VanDerWaalsContact OE1-CE 3.26Å; Q1076-I1111 HydrophobicContact CB-CD1 4.39Å; Q1076-I1111 HydrophobicContact CB-CG1 4.24Å; Q1076-I1111 HydrophobicContact CG-CG1 4.35Å; Q1076-I1114 HydrophobicContact CG-CD1 3.68Å
1077	E	94.4	Very high	94.3	Very high	106 Å²	106	35.4 Å²	35.4	50%	0.495	17%	0.173	S	C	.	.	H	α-helix	trans	-71.4	-35.2	-174.4	-52.2	177.3	135.2	0	0	111.6	N1038 V1040 C1075 E1080 F1081	N1038-E1077 PolarHBondContact ND2-OE2 3.48Å; N1038-E1077 PolarHBondContact OD1-N 3.31Å; V1040-E1077 HydrophobicContact CG2-CB 3.61Å; C1075-E1077 VanDerWaalsContact C-N 3.35Å; C1075-E1077 PolarHBondContact O-N 2.95Å; E1077-E1080 PolarHBondContact O-N 3.23Å; E1077-F1081 WeakPolarHBondContact O-CB 3.47Å; E1077-F1081 PolarHBondContact O-N 2.99Å
1078	A	95.9	Very high	93.9	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-66	-38.3	170	0	0	0	0	0	112.2	N1038 L1043 A1070 C1075 F1081 L1082	N1038-A1078 PolarHBondContact OD1-N 3.16Å; L1043-A1078 HydrophobicContact CD1-CB 3.83Å; A1070-A1078 HydrophobicContact CB-CB 4.06Å; C1075-A1078 HydrophobicContact CB-CB 4.06Å; C1075-A1078 PolarHBondContact O-N 3.31Å; A1078-F1081 PolarHBondContact O-N 2.89Å; A1078-L1082 VanDerWaalsContact O-CB 3.31Å; A1078-L1082 WeakPolarHBondContact O-CB 3.46Å; A1078-L1082 WeakPolarHBondContact O-CD1 3.14Å; A1078-L1082 WeakPolarHBondContact O-CG 3.38Å; A1078-L1082 PolarHBondContact O-N 3.42Å
1079	V	96.2	Very high	93.7	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-61.3	-49.2	173.1	175.7	0	0	0	0	110.5	I1067 A1070 I1071 C1075 Q1076 F1081 L1082 L1083 I1111	I1067-V1079 HydrophobicContact CD1-CG1 4.23Å; I1067-V1079 HydrophobicContact CG1-CG1 4.35Å; A1070-V1079 HydrophobicContact CB-CG2 3.67Å; I1071-V1079 HydrophobicContact CG1-CG2 3.84Å; C1075-V1079 WeakPolarHBondContact O-CG2 3.28Å; C1075-V1079 PolarHBondContact O-N 2.73Å; Q1076-V1079 WeakPolarHBondContact O-CB 3.05Å; Q1076-V1079 PolarHBondContact O-N 3.13Å; V1079-F1081 PolarHBondContact O-N 3.23Å; V1079-L1082 PolarHBondContact O-N 2.98Å; V1079-L1083 HydrophobicContact CG1-CD1 3.75Å; V1079-L1083 HydrophobicContact CG1-CG 4.19Å; V1079-L1083 WeakPolarHBondContact O-CB 3.37Å; V1079-L1083 VanDerWaalsContact O-CG 3.24Å; V1079-L1083 WeakPolarHBondContact O-CG 3.33Å; V1079-L1083 PolarHBondContact O-N 3.09Å; V1079-I1111 HydrophobicContact CB-CG2 4.29Å; V1079-I1111 HydrophobicContact CG1-CG2 3.97Å; V1079-I1111 HydrophobicContact CG2-CG2 4.02Å
1080	E	95.6	Very high	93.3	Very high	82 Å²	82	49.3 Å²	49.3	38%	0.383	24%	0.237	S	C	.	.	H	α-helix	trans	-57.3	-46.6	177.6	-73.3	172.6	-166.2	0	0	112.2	Q1076 E1077 L1083 D1084 I1114	Q1076-E1080 PolarHBondContact NE2-OE1 2.92Å; Q1076-E1080 PolarHBondContact O-N 3.01Å; E1077-E1080 PolarHBondContact O-N 3.23Å; E1080-L1083 PolarHBondContact O-N 3.48Å; E1080-D1084 PolarHBondContact O-N 2.82Å; E1080-I1114 HydrophobicContact CG-CD1 4.09Å; E1080-I1114 HydrophobicContact CG-CG2 4.14Å; E1080-I1114 WeakPolarHBondContact OE1-CD1 3.35Å
1081	F	96.9	Very high	92.8	Very high	28 Å²	28	50.6 Å²	50.6	12%	0.123	24%	0.243	C	C	.	.	H	α-helix	trans	-64	-41.4	177.4	-174.6	-84.4	0	0	0	112.8	V1040 L1043 A1044 A1047 F1052 E1077 A1078 V1079 L1083 D1084 K1085	V1040-F1081 HydrophobicContact CG1-CD2 3.82Å; V1040-F1081 HydrophobicContact CG1-CE2 4.45Å; V1040-F1081 HydrophobicContact CG1-CG 4.43Å; L1043-F1081 HydrophobicContact CB-CD1 3.66Å; L1043-F1081 HydrophobicContact CB-CE1 3.6Å; L1043-F1081 HydrophobicContact CB-CG 4.28Å; L1043-F1081 HydrophobicContact CB-CZ 4.16Å; L1043-F1081 HydrophobicContact CD1-CB 4.46Å; L1043-F1081 HydrophobicContact CD1-CD1 4.11Å; L1043-F1081 HydrophobicContact CD1-CG 4.47Å; L1043-F1081 HydrophobicContact CG-CD1 4.41Å; A1044-F1081 HydrophobicContact CB-CE2 4.12Å; A1044-F1081 HydrophobicContact CB-CZ 4.24Å; A1047-F1081 HydrophobicContact CB-CE1 4.31Å; A1047-F1081 HydrophobicContact CB-CZ 3.97Å; F1052-F1081 HydrophobicContact CZ-CE1 4.16Å; E1077-F1081 WeakPolarHBondContact O-CB 3.47Å; E1077-F1081 PolarHBondContact O-N 2.99Å; A1078-F1081 PolarHBondContact O-N 2.89Å; V1079-F1081 PolarHBondContact O-N 3.23Å; F1081-L1083 VanDerWaalsContact C-N 3.35Å; F1081-D1084 PolarHBondContact O-N 3.06Å; F1081-K1085 HydrophobicContact CD1-CG 4.07Å; F1081-K1085 HydrophobicContact CE1-CG 3.64Å; F1081-K1085 HydrophobicContact CZ-CG 4.06Å; F1081-K1085 WeakPolarHBondContact O-CG 3.45Å; F1081-K1085 PolarHBondContact O-N 3.02Å
1082	L	96.3	Very high	92.3	Very high	0 Å²	0	54 Å²	54	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-68.7	-34.5	179	-71.2	167.3	0	0	0	111.7	V1031 A1035 M1056 P1066 I1067 A1070 A1078 V1079 K1085 Q1086 A1087	V1031-L1082 HydrophobicContact CG1-CD2 4.19Å; A1035-L1082 HydrophobicContact CB-CD1 3.94Å; M1056-L1082 HydrophobicContact CG-CD2 3.93Å; M1056-L1082 HydrophobicContact SD-CD2 4.44Å; P1066-L1082 HydrophobicContact CB-CD1 4.25Å; I1067-L1082 HydrophobicContact CB-CB 4.35Å; I1067-L1082 HydrophobicContact CB-CD1 4Å; I1067-L1082 HydrophobicContact CD1-CB 4.3Å; A1070-L1082 HydrophobicContact CB-CD1 4.48Å; A1078-L1082 VanDerWaalsContact O-CB 3.31Å; A1078-L1082 WeakPolarHBondContact O-CB 3.46Å; A1078-L1082 WeakPolarHBondContact O-CD1 3.14Å; A1078-L1082 WeakPolarHBondContact O-CG 3.38Å; A1078-L1082 PolarHBondContact O-N 3.42Å; V1079-L1082 PolarHBondContact O-N 2.98Å; L1082-K1085 CarbonylContact O-C 3.6Å; L1082-K1085 PolarHBondContact O-N 3.44Å; L1082-Q1086 PolarHBondContact O-N 2.98Å; L1082-A1087 HydrophobicContact CB-CB 4.03Å; L1082-A1087 WeakPolarHBondContact O-CB 3.31Å; L1082-A1087 PolarHBondContact O-N 2.8Å
1083	L	94.6	Very high	91.9	Very high	4 Å²	4	51.2 Å²	51.2	2%	0.021	25%	0.251	C	S	.	.	H	α-helix	trans	-68.1	-44.1	173.7	-70.4	175.8	0	0	0	112.1	I1067 V1079 E1080 F1081 K1085 Q1086 V1089 I1114 L1115 Y1118	I1067-L1083 HydrophobicContact CD1-CD2 3.51Å; I1067-L1083 HydrophobicContact CD1-CG 3.78Å; V1079-L1083 HydrophobicContact CG1-CD1 3.75Å; V1079-L1083 HydrophobicContact CG1-CG 4.19Å; V1079-L1083 WeakPolarHBondContact O-CB 3.37Å; V1079-L1083 VanDerWaalsContact O-CG 3.24Å; V1079-L1083 WeakPolarHBondContact O-CG 3.33Å; V1079-L1083 PolarHBondContact O-N 3.09Å; E1080-L1083 PolarHBondContact O-N 3.48Å; F1081-L1083 VanDerWaalsContact C-N 3.35Å; L1083-K1085 VanDerWaalsContact C-N 3.29Å; L1083-K1085 PolarHBondContact O-N 2.8Å; L1083-Q1086 WeakPolarHBondContact O-CA 3.29Å; L1083-Q1086 PolarHBondContact O-N 3.42Å; L1083-V1089 HydrophobicContact CD2-CG1 3.51Å; L1083-I1114 HydrophobicContact CD1-CG2 3.72Å; L1083-L1115 HydrophobicContact CD1-CD2 4.12Å; L1083-L1115 HydrophobicContact CD2-CD2 4.12Å; L1083-Y1118 HydrophobicContact CB-CD2 3.82Å; L1083-Y1118 HydrophobicContact CB-CE2 3.72Å; L1083-Y1118 HydrophobicContact CB-CG 4.32Å; L1083-Y1118 HydrophobicContact CD1-CD2 4.4Å; L1083-Y1118 HydrophobicContact CD1-CG 4.25Å; L1083-Y1118 HydrophobicContact CD2-CD1 3.7Å; L1083-Y1118 HydrophobicContact CD2-CD2 4.28Å; L1083-Y1118 HydrophobicContact CD2-CE1 3.79Å; L1083-Y1118 HydrophobicContact CD2-CE2 4.36Å; L1083-Y1118 HydrophobicContact CD2-CG 3.94Å; L1083-Y1118 HydrophobicContact CG-CD2 4.39Å; L1083-Y1118 HydrophobicContact CG-CG 4.4Å; L1083-Y1118 WeakPolarHBondContact O-CE2 3.45Å; L1083-Y1118 PolarHBondContact O-OH 3.5Å
1084	D	93.5	Very high	91.5	Very high	108 Å²	108	49.9 Å²	49.9	58%	0.578	25%	0.25	S	C	*	.	H	α-helix	trans	-56.4	-43	171.3	170.4	77.9	0	0	0	111.6	E1080 F1081 Q1086	E1080-D1084 PolarHBondContact O-N 2.82Å; F1081-D1084 PolarHBondContact O-N 3.06Å; D1084-Q1086 PolarHBondContact O-N 3.4Å; D1084-Q1086 VanDerWaalsContact O-N 3.13Å
1085	K	94	Very high	90.9	Very high	75 Å²	75	53.4 Å²	53.4	33%	0.326	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.9	10	174.5	-60.8	-62.4	176.1	-66.4	0	114.8	F1052 M1056 F1081 L1082 L1083	F1052-K1085 HydrophobicContact CE1-CB 4.03Å; F1052-K1085 HydrophobicContact CE1-CG 4.11Å; M1056-K1085 WeakPolarHBondContact CE-O 3.28Å; M1056-K1085 HydrophobicContact SD-CB 3.69Å; F1081-K1085 HydrophobicContact CD1-CG 4.07Å; F1081-K1085 HydrophobicContact CE1-CG 3.64Å; F1081-K1085 HydrophobicContact CZ-CG 4.06Å; F1081-K1085 WeakPolarHBondContact O-CG 3.45Å; F1081-K1085 PolarHBondContact O-N 3.02Å; L1082-K1085 CarbonylContact O-C 3.6Å; L1082-K1085 PolarHBondContact O-N 3.44Å; L1083-K1085 VanDerWaalsContact C-N 3.29Å; L1083-K1085 PolarHBondContact O-N 2.8Å
1086	Q	89.8	Confident	90.2	Very high	102 Å²	102	55.4 Å²	55.4	48%	0.477	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	66.1	35.3	174.9	-54.7	-179.4	7.2	0	0	115.9	L1082 L1083 D1084	L1082-Q1086 PolarHBondContact O-N 2.98Å; L1083-Q1086 WeakPolarHBondContact O-CA 3.29Å; L1083-Q1086 PolarHBondContact O-N 3.42Å; D1084-Q1086 PolarHBondContact O-N 3.4Å; D1084-Q1086 VanDerWaalsContact O-N 3.13Å
1087	A	91.8	Very high	89.7	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	27%	0.265	C	S	.	.			trans	-53	147.5	169.3	0	0	0	0	0	112.6	M1056 I1067 L1082 V1089	M1056-A1087 HydrophobicContact CG-CB 4.09Å; M1056-A1087 HydrophobicContact SD-CB 4.26Å; I1067-A1087 HydrophobicContact CB-CB 4.38Å; I1067-A1087 HydrophobicContact CD1-CB 4.18Å; I1067-A1087 HydrophobicContact CG2-CB 4.23Å; L1082-A1087 HydrophobicContact CB-CB 4.03Å; L1082-A1087 WeakPolarHBondContact O-CB 3.31Å; L1082-A1087 PolarHBondContact O-N 2.8Å; A1087-V1089 PolarHBondContact O-N 3.01Å
1088	K	89.1	Confident	89.4	Confident	121 Å²	121	52 Å²	52	53%	0.526	26%	0.255	S	S	.	.			trans	-84.9	103.4	-178.9	-72.1	-174.2	169.1	-158.3	0	111.6	N1057 E1090 I1091	N1057-K1088 WeakPolarHBondContact OD1-CB 3.37Å; N1057-K1088 WeakPolarHBondContact OD1-CG 3.5Å; N1057-K1088 PolarHBondContact OD1-N 3.3Å; K1088-E1090 VanDerWaalsContact C-N 3.31Å; K1088-I1091 HydrophobicContact CB-CD1 3.73Å; K1088-I1091 HydrophobicContact CB-CG1 4.01Å; K1088-I1091 HydrophobicContact CD-CD1 4.04Å; K1088-I1091 HydrophobicContact CD-CG1 4.5Å
1089	V	90.3	Very high	89.2	Confident	8 Å²	8	52.1 Å²	52.1	5%	0.048	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.8	-18.1	175.1	-62.7	0	0	0	0	114.3	I1067 L1083 A1087 I1091 C1099 L1115 I1119	I1067-V1089 HydrophobicContact CD1-CG1 4.14Å; L1083-V1089 HydrophobicContact CD2-CG1 3.51Å; A1087-V1089 PolarHBondContact O-N 3.01Å; V1089-I1091 VanDerWaalsContact C-N 3.27Å; V1089-I1091 PolarHBondContact O-N 3.48Å; V1089-C1099 HydrophobicContact CB-CB 4.28Å; V1089-L1115 HydrophobicContact CG1-CD2 3.73Å; V1089-I1119 HydrophobicContact CG2-CD1 4.34Å; V1089-I1119 HydrophobicContact CG2-CG1 4.09Å
1090	E	85	Confident	89	Confident	166 Å²	166	54.3 Å²	54.3	78%	0.776	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.6	10.4	-178	-62.2	166.6	-106.8	0	0	113.7	K1088	K1088-E1090 VanDerWaalsContact C-N 3.31Å
1091	I	86.2	Confident	88.6	Confident	27 Å²	27	52.2 Å²	52.2	14%	0.138	26%	0.262	C	S	.	.			trans	-85.6	134.3	172.7	-68.8	173.3	0	0	0	108.5	K1059 T1065 M1068 K1088 V1089	K1059-I1091 VanDerWaalsContact CE-CG2 3.42Å; T1065-I1091 HydrophobicContact CG2-CB 4.09Å; T1065-I1091 HydrophobicContact CG2-CD1 3.77Å; T1065-I1091 HydrophobicContact CG2-CG2 3.72Å; M1068-I1091 WeakPolarHBondContact CE-O 3.23Å; M1068-I1091 HydrophobicContact SD-CG2 4.3Å; K1088-I1091 HydrophobicContact CB-CD1 3.73Å; K1088-I1091 HydrophobicContact CB-CG1 4.01Å; K1088-I1091 HydrophobicContact CD-CD1 4.04Å; K1088-I1091 HydrophobicContact CD-CG1 4.5Å; V1089-I1091 VanDerWaalsContact C-N 3.27Å; V1089-I1091 PolarHBondContact O-N 3.48Å
1092	I	83.6	Confident	88.2	Confident	72 Å²	72	51.1 Å²	51.1	37%	0.369	26%	0.257	S	S	.	.			trans	-99.7	152.2	170.8	64.1	177.2	0	0	0	112	K1059 E1096 N1097 D1098	K1059-I1092 PolarHBondContact NZ-O 3.42Å; I1092-E1096 HydrophobicContact CD1-CB 4.31Å; I1092-E1096 HydrophobicContact CD1-CG 4.21Å; I1092-N1097 CarbonylContact C-O 3.51Å; I1092-N1097 VanDerWaalsContact CA-O 3.26Å; I1092-N1097 WeakPolarHBondContact CA-O 3.39Å; I1092-D1098 HydrophobicContact CG2-CB 4.07Å
1093	D	82.9	Confident	87.9	Confident	7 Å²	7	51.2 Å²	51.2	4%	0.037	26%	0.258	C	S	.	.			trans	-87.8	-175.6	177.2	77.4	4.6	0	0	0	112.9	R1064 M1068 M1095 E1096 N1097	R1064-D1093 HydrophobicContact CG-CB 3.69Å; M1068-D1093 HydrophobicContact CE-CB 3.91Å; D1093-M1095 PolarHBondContact O-N 3.17Å; D1093-M1095 WeakPolarHBondContact OD1-CA 3.44Å; D1093-M1095 WeakPolarHBondContact OD1-CB 3.19Å; D1093-M1095 PolarHBondContact OD1-N 3.19Å; D1093-E1096 PolarHBondContact O-N 3.42Å; D1093-E1096 PolarHBondContact OD1-N 3.43Å; D1093-E1096 VanDerWaalsContact OD1-N 3.08Å; D1093-N1097 PolarHBondContact N-O 3.38Å; D1093-N1097 PolarHBondContact OD1-N 3.38Å
1094	C	84.1	Confident	87.5	Confident	53 Å²	53	55.5 Å²	55.5	36%	0.358	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-19.5	-179.6	67.2	0	0	0	0	113.9	W1062 D1063 E1096	W1062-C1094 VanDerWaalsContact O-CB 3.3Å; W1062-C1094 WeakPolarHBondContact O-CB 3.49Å; W1062-C1094 PolarHBondContact O-N 2.93Å; W1062-C1094 PolarHBondContact O-SG 3.26Å; W1062-C1094 VanDerWaalsContact O-SG 3.38Å; D1063-C1094 HydrophobicContact CB-CB 4.21Å; C1094-E1096 VanDerWaalsContact C-N 3.35Å
1095	M	81.3	Confident	87.1	Confident	101 Å²	101	54.9 Å²	54.9	50%	0.498	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90	-2.7	175	-53.7	-160.4	-53.7	0	0	112.2	K232 D1093 N1097	K232-M1095 WeakPolarHBondContact CE-O 3.05Å; K232-M1095 PolarHBondContact NZ-O 3.39Å; D1093-M1095 PolarHBondContact O-N 3.17Å; D1093-M1095 WeakPolarHBondContact OD1-CA 3.44Å; D1093-M1095 WeakPolarHBondContact OD1-CB 3.19Å; D1093-M1095 PolarHBondContact OD1-N 3.19Å; M1095-N1097 VanDerWaalsContact C-N 3.32Å
1096	E	78.4	Confident	86.8	Confident	54 Å²	54	55.6 Å²	55.6	25%	0.252	28%	0.281	S	S	.	.			trans	69.7	20.8	-171.6	-56.8	158.9	-119.9	0	0	114.4	F220 K232 I1092 D1093 C1094	F220-E1096 HydrophobicContact CE2-CG 4Å; F220-E1096 HydrophobicContact CZ-CG 4.43Å; F220-E1096 WeakPolarHBondContact CZ-OE2 3.16Å; K232-E1096 IonicContact NZ-OE1 2.69Å; K232-E1096 PolarHBondContact NZ-OE1 2.92Å; K232-E1096 IonicContact NZ-OE2 2.75Å; I1092-E1096 HydrophobicContact CD1-CB 4.31Å; I1092-E1096 HydrophobicContact CD1-CG 4.21Å; D1093-E1096 PolarHBondContact O-N 3.42Å; D1093-E1096 PolarHBondContact OD1-N 3.43Å; D1093-E1096 VanDerWaalsContact OD1-N 3.08Å; C1094-E1096 VanDerWaalsContact C-N 3.35Å
1097	N	83.1	Confident	86.6	Confident	31 Å²	31	53.1 Å²	53.1	17%	0.166	28%	0.283	C	S	.	.			trans	-76.9	138.5	168.4	-70.4	-19.5	0	0	0	110.4	M1068 I1092 D1093 M1095 L1102 E1105	M1068-N1097 VanDerWaalsContact CE-O 3.22Å; M1068-N1097 WeakPolarHBondContact CE-O 3.28Å; I1092-N1097 CarbonylContact C-O 3.51Å; I1092-N1097 VanDerWaalsContact CA-O 3.26Å; I1092-N1097 WeakPolarHBondContact CA-O 3.39Å; D1093-N1097 PolarHBondContact N-O 3.38Å; D1093-N1097 PolarHBondContact OD1-N 3.38Å; M1095-N1097 VanDerWaalsContact C-N 3.32Å; N1097-L1102 HydrophobicContact CB-CD2 3.82Å; N1097-L1102 HydrophobicContact CB-CG 3.88Å; N1097-E1105 PolarHBondContact ND2-OE2 2.87Å
1098	D	88.9	Confident	86.6	Confident	54 Å²	54	57 Å²	57	29%	0.289	30%	0.298	S	S	.	.			trans	-98.7	-179.5	167.7	82.1	-23.9	0	0	0	111.4	I1092 L1100 S1101 L1102	I1092-D1098 HydrophobicContact CG2-CB 4.07Å; D1098-L1100 VanDerWaalsContact C-N 3.29Å; D1098-L1100 PolarHBondContact O-N 3.2Å; D1098-L1100 PolarHBondContact OD1-N 2.99Å; D1098-L1100 VanDerWaalsContact OD1-N 3.17Å; D1098-S1101 PolarHBondContact N-OG 2.79Å; D1098-S1101 PolarHBondContact O-OG 3.31Å; D1098-S1101 VanDerWaalsContact OD1-CB 3.3Å; D1098-S1101 WeakPolarHBondContact OD1-CB 3.42Å; D1098-S1101 PolarHBondContact OD1-N 2.92Å; D1098-S1101 PolarHBondContact OD1-OG 3.23Å; D1098-L1102 WeakPolarHBondContact O-CB 3.3Å; D1098-L1102 VanDerWaalsContact O-CG 3.28Å; D1098-L1102 WeakPolarHBondContact O-CG 3.13Å; D1098-L1102 PolarHBondContact O-N 3.28Å
1099	C	92.1	Very high	86.5	Confident	2 Å²	2	59 Å²	59	1%	0.014	31%	0.307	C	S	.	.	H	α-helix	trans	-62.3	-29.8	179.8	-71.7	0	0	0	0	114.5	I1071 V1089 C1103 L1115	I1071-C1099 HydrophobicContact CD1-CB 3.54Å; I1071-C1099 VanDerWaalsContact CD1-SG 3.56Å; V1089-C1099 HydrophobicContact CB-CB 4.28Å; C1099-C1103 PolarHBondContact O-N 2.93Å; C1099-L1115 HydrophobicContact CB-CD1 4.12Å; C1099-L1115 HydrophobicContact CB-CD2 4.19Å
1100	L	91.7	Very high	86.5	Confident	45 Å²	45	64.1 Å²	64.1	24%	0.236	33%	0.329	C	S	.	.	H	α-helix	trans	-81.6	-42.6	-178.4	-70.3	173.4	0	0	0	112	D1098 C1103 T1104 L1115 I1116 I1119	D1098-L1100 VanDerWaalsContact C-N 3.29Å; D1098-L1100 PolarHBondContact O-N 3.2Å; D1098-L1100 PolarHBondContact OD1-N 2.99Å; D1098-L1100 VanDerWaalsContact OD1-N 3.17Å; L1100-C1103 WeakPolarHBondContact O-CB 3.29Å; L1100-C1103 PolarHBondContact O-N 3.25Å; L1100-T1104 PolarHBondContact O-N 3.11Å; L1100-T1104 PolarHBondContact O-OG1 3.31Å; L1100-L1115 HydrophobicContact CD2-CB 3.88Å; L1100-I1116 HydrophobicContact CD2-CG1 3.86Å; L1100-I1119 HydrophobicContact CD1-CD1 3.88Å; L1100-I1119 HydrophobicContact CD2-CD1 4.29Å; L1100-I1119 HydrophobicContact CG-CD1 4.16Å
1101	S	87.2	Confident	86.9	Confident	39 Å²	39	56.5 Å²	56.5	27%	0.273	29%	0.293	S	S	.	.	H	α-helix	trans	-64.8	-39.5	174	50.3	0	0	0	0	111.8	D1098 C1103 T1104 E1105	D1098-S1101 PolarHBondContact N-OG 2.79Å; D1098-S1101 PolarHBondContact O-OG 3.31Å; D1098-S1101 VanDerWaalsContact OD1-CB 3.3Å; D1098-S1101 WeakPolarHBondContact OD1-CB 3.42Å; D1098-S1101 PolarHBondContact OD1-N 2.92Å; D1098-S1101 PolarHBondContact OD1-OG 3.23Å; S1101-C1103 PolarHBondContact O-N 2.91Å; S1101-T1104 WeakPolarHBondContact O-CB 3.32Å; S1101-T1104 PolarHBondContact O-N 3.22Å; S1101-T1104 VanDerWaalsContact O-N 3.1Å; S1101-E1105 WeakPolarHBondContact O-CB 3.41Å; S1101-E1105 PolarHBondContact O-N 2.99Å
1102	L	89.2	Confident	87.2	Confident	5 Å²	5	58 Å²	58	3%	0.026	30%	0.3	C	S	.	.	H	α-helix	trans	-58.7	-44.7	170.4	-73.3	174.1	0	0	0	112.3	M1068 I1071 N1097 D1098 T1104 E1105 K1106	M1068-L1102 HydrophobicContact CB-CD1 3.75Å; M1068-L1102 HydrophobicContact CE-CD1 4.07Å; M1068-L1102 HydrophobicContact CG-CD1 3.95Å; I1071-L1102 HydrophobicContact CG2-CB 3.68Å; N1097-L1102 HydrophobicContact CB-CD2 3.82Å; N1097-L1102 HydrophobicContact CB-CG 3.88Å; D1098-L1102 WeakPolarHBondContact O-CB 3.3Å; D1098-L1102 VanDerWaalsContact O-CG 3.28Å; D1098-L1102 WeakPolarHBondContact O-CG 3.13Å; D1098-L1102 PolarHBondContact O-N 3.28Å; L1102-T1104 VanDerWaalsContact C-N 3.26Å; L1102-T1104 PolarHBondContact O-N 2.93Å; L1102-E1105 PolarHBondContact O-N 2.91Å; L1102-K1106 WeakPolarHBondContact O-CG 3.31Å; L1102-K1106 PolarHBondContact O-N 3.26Å
1103	C	89	Confident	87.6	Confident	1 Å²	1	60 Å²	60	1%	0.007	31%	0.307	C	S	.	.	H	α-helix	trans	-62	-34	174.2	-87.1	0	0	0	0	113.1	I1071 C1099 L1100 S1101 G1107 Y1108 I1111 H1112 L1115	I1071-C1103 HydrophobicContact CG2-CB 4.43Å; I1071-C1103 WeakPolarHBondContact CG2-SG 3.4Å; C1099-C1103 PolarHBondContact O-N 2.93Å; L1100-C1103 WeakPolarHBondContact O-CB 3.29Å; L1100-C1103 PolarHBondContact O-N 3.25Å; S1101-C1103 PolarHBondContact O-N 2.91Å; C1103-G1107 CarbonylContact O-C 3.57Å; C1103-G1107 PolarHBondContact O-N 3.43Å; C1103-Y1108 PolarHBondContact O-N 3.45Å; C1103-I1111 VanDerWaalsContact SG-CG2 3.57Å; C1103-H1112 HydrophobicContact CB-CB 3.95Å; C1103-L1115 VanDerWaalsContact SG-CD1 3.52Å
1104	T	86.6	Confident	88	Confident	94 Å²	94	61.4 Å²	61.4	58%	0.577	31%	0.314	S	S	*	.	H	α-helix	trans	-74.2	-45	178.9	-54	0	0	0	0	111.1	L1100 S1101 L1102 K1106 G1107	L1100-T1104 PolarHBondContact O-N 3.11Å; L1100-T1104 PolarHBondContact O-OG1 3.31Å; S1101-T1104 WeakPolarHBondContact O-CB 3.32Å; S1101-T1104 PolarHBondContact O-N 3.22Å; S1101-T1104 VanDerWaalsContact O-N 3.1Å; L1102-T1104 VanDerWaalsContact C-N 3.26Å; L1102-T1104 PolarHBondContact O-N 2.93Å; T1104-K1106 VanDerWaalsContact C-N 3.31Å; T1104-K1106 PolarHBondContact O-N 3.48Å; T1104-G1107 PolarHBondContact O-N 3.01Å
1105	E	84.8	Confident	88.4	Confident	96 Å²	96	58.9 Å²	58.9	45%	0.449	30%	0.297	S	S	.	.	H	α-helix	trans	-59.4	-38.8	176.5	-167.6	-157.3	112.6	0	0	112.1	N1097 S1101 L1102	N1097-E1105 PolarHBondContact ND2-OE2 2.87Å; S1101-E1105 WeakPolarHBondContact O-CB 3.41Å; S1101-E1105 PolarHBondContact O-N 2.99Å; L1102-E1105 PolarHBondContact O-N 2.91Å
1106	K	87.3	Confident	88.8	Confident	89 Å²	89	56.2 Å²	56.2	39%	0.387	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.3	-3	178.2	-56.5	-46.5	-171.5	-158.8	0	114.7	L1102 T1104 Y1108	L1102-K1106 WeakPolarHBondContact O-CG 3.31Å; L1102-K1106 PolarHBondContact O-N 3.26Å; T1104-K1106 VanDerWaalsContact C-N 3.31Å; T1104-K1106 PolarHBondContact O-N 3.48Å; K1106-Y1108 VanDerWaalsContact C-N 3.29Å; K1106-Y1108 HydrophobicContact CB-CD2 3.46Å; K1106-Y1108 VanDerWaalsContact CB-CD2 3.46Å; K1106-Y1108 HydrophobicContact CB-CE2 3.36Å; K1106-Y1108 HydrophobicContact CB-CG 4.22Å; K1106-Y1108 HydrophobicContact CG-CD2 4.36Å; K1106-Y1108 HydrophobicContact CG-CE2 3.99Å; K1106-Y1108 PolarHBondContact O-N 2.91Å
1107	G	86.4	Confident	89.3	Confident	50 Å²	50	58 Å²	58	52%	0.515	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	68.6	16.5	178.3	0	0	0	0	0	115.9	C1103 T1104 K1109	C1103-G1107 CarbonylContact O-C 3.57Å; C1103-G1107 PolarHBondContact O-N 3.43Å; T1104-G1107 PolarHBondContact O-N 3.01Å; G1107-K1109 VanDerWaalsContact C-N 3.28Å; G1107-K1109 PolarHBondContact O-N 3.22Å
1108	Y	90.7	Very high	89.6	Confident	81 Å²	81	58.4 Å²	58.4	32%	0.318	30%	0.295	S	S	.	.			trans	-77.9	68.8	-175	-64	-47.3	0	0	0	113.2	I1071 C1103 K1106 K1110 I1111 H1112	I1071-Y1108 WeakPolarHBondContact O-CD2 3.24Å; I1071-Y1108 WeakPolarHBondContact O-CE2 3.41Å; C1103-Y1108 PolarHBondContact O-N 3.45Å; K1106-Y1108 VanDerWaalsContact C-N 3.29Å; K1106-Y1108 HydrophobicContact CB-CD2 3.46Å; K1106-Y1108 VanDerWaalsContact CB-CD2 3.46Å; K1106-Y1108 HydrophobicContact CB-CE2 3.36Å; K1106-Y1108 HydrophobicContact CB-CG 4.22Å; K1106-Y1108 HydrophobicContact CG-CD2 4.36Å; K1106-Y1108 HydrophobicContact CG-CE2 3.99Å; K1106-Y1108 PolarHBondContact O-N 2.91Å; Y1108-K1110 VanDerWaalsContact C-N 3.3Å; Y1108-K1110 PolarHBondContact O-N 2.97Å; Y1108-K1110 VanDerWaalsContact O-N 3.12Å; Y1108-I1111 HydrophobicContact CD2-CD1 4.43Å; Y1108-I1111 HydrophobicContact CG-CD1 4.3Å; Y1108-I1111 PolarHBondContact O-N 3.44Å; Y1108-H1112 PolarHBondContact O-N 3.37Å
1109	K	87.9	Confident	89.5	Confident	164 Å²	164	58.2 Å²	58.2	71%	0.713	29%	0.294	S	S	*	.	H	α-helix	trans	-44.7	-46	-176.1	-63.5	-175.7	-180	-177.3	0	114.4	G1107 H1112 E1113	G1107-K1109 VanDerWaalsContact C-N 3.28Å; G1107-K1109 PolarHBondContact O-N 3.22Å; K1109-H1112 WeakPolarHBondContact O-CB 3.38Å; K1109-H1112 PolarHBondContact O-N 3.37Å; K1109-E1113 WeakPolarHBondContact O-CG 3.18Å; K1109-E1113 PolarHBondContact O-N 2.83Å
1110	K	90.4	Very high	89.2	Confident	116 Å²	116	65.9 Å²	65.9	50%	0.504	32%	0.322	S	S	.	.	H	α-helix	trans	-67	-37.9	-178.9	-168.6	178.8	177.4	-163.5	0	113.1	Q1076 Y1108 E1113 I1114	Q1076-K1110 VanDerWaalsContact CD-NZ 3.32Å; Q1076-K1110 VanDerWaalsContact NE2-NZ 3.15Å; Q1076-K1110 VanDerWaalsContact OE1-CE 3.26Å; Y1108-K1110 VanDerWaalsContact C-N 3.3Å; Y1108-K1110 PolarHBondContact O-N 2.97Å; Y1108-K1110 VanDerWaalsContact O-N 3.12Å; K1110-E1113 PolarHBondContact O-N 3.45Å; K1110-I1114 HydrophobicContact CG-CD1 4.38Å; K1110-I1114 WeakPolarHBondContact O-CD1 3.42Å; K1110-I1114 VanDerWaalsContact O-CG1 3.28Å; K1110-I1114 WeakPolarHBondContact O-CG1 3.36Å; K1110-I1114 PolarHBondContact O-N 2.99Å; K1110-I1114 VanDerWaalsContact O-N 3.13Å
1111	I	93.3	Very high	88.7	Confident	6 Å²	6	66.2 Å²	66.2	3%	0.031	33%	0.329	C	S	.	.	H	α-helix	trans	-71.5	-37.1	176.6	-53.8	-177.7	0	0	0	110.1	I1071 Q1076 V1079 C1103 Y1108 I1114 L1115	I1071-I1111 HydrophobicContact CG1-CG2 4.06Å; Q1076-I1111 HydrophobicContact CB-CD1 4.39Å; Q1076-I1111 HydrophobicContact CB-CG1 4.24Å; Q1076-I1111 HydrophobicContact CG-CG1 4.35Å; V1079-I1111 HydrophobicContact CB-CG2 4.29Å; V1079-I1111 HydrophobicContact CG1-CG2 3.97Å; V1079-I1111 HydrophobicContact CG2-CG2 4.02Å; C1103-I1111 VanDerWaalsContact SG-CG2 3.57Å; Y1108-I1111 HydrophobicContact CD2-CD1 4.43Å; Y1108-I1111 HydrophobicContact CG-CD1 4.3Å; Y1108-I1111 PolarHBondContact O-N 3.44Å; I1111-I1114 PolarHBondContact O-N 3.09Å; I1111-L1115 HydrophobicContact CG2-CD1 4.19Å; I1111-L1115 WeakPolarHBondContact O-CG 3.27Å; I1111-L1115 PolarHBondContact O-N 3.37Å
1112	H	92.2	Very high	88.1	Confident	59 Å²	59	68 Å²	68	27%	0.273	33%	0.329	S	S	.	.	H	α-helix	trans	-59.6	-44.6	172.4	-175.1	-104.1	0	0	0	112.3	C1103 Y1108 K1109 L1115 I1116	C1103-H1112 HydrophobicContact CB-CB 3.95Å; Y1108-H1112 PolarHBondContact O-N 3.37Å; K1109-H1112 WeakPolarHBondContact O-CB 3.38Å; K1109-H1112 PolarHBondContact O-N 3.37Å; H1112-L1115 PolarHBondContact O-N 3.37Å; H1112-I1116 WeakPolarHBondContact CE1-CD1 3.5Å; H1112-I1116 WeakPolarHBondContact O-CB 3.43Å; H1112-I1116 WeakPolarHBondContact O-CG1 3.43Å; H1112-I1116 PolarHBondContact O-N 3.11Å
1113	E	91.3	Very high	86.7	Confident	113 Å²	113	72.2 Å²	72.2	53%	0.528	35%	0.352	S	S	.	.	H	α-helix	trans	-60.7	-45	174.1	-73.9	165.7	-164.3	0	0	112.5	K1109 K1110 I1116 N1117	K1109-E1113 WeakPolarHBondContact O-CG 3.18Å; K1109-E1113 PolarHBondContact O-N 2.83Å; K1110-E1113 PolarHBondContact O-N 3.45Å; E1113-I1116 PolarHBondContact O-N 3.48Å; E1113-N1117 WeakPolarHBondContact O-CB 3.44Å; E1113-N1117 VanDerWaalsContact O-CG 3.27Å; E1113-N1117 PolarHBondContact O-N 3.42Å; E1113-N1117 PolarHBondContact O-ND2 3.13Å
1114	I	92.7	Very high	84.7	Confident	36 Å²	36	75.5 Å²	75.5	19%	0.185	38%	0.375	C	S	.	.	H	α-helix	trans	-59.8	-48.1	176.8	-69	159.2	0	0	0	110.7	Q1076 E1080 L1083 K1110 I1111 N1117 Y1118	Q1076-I1114 HydrophobicContact CG-CD1 3.68Å; E1080-I1114 HydrophobicContact CG-CD1 4.09Å; E1080-I1114 HydrophobicContact CG-CG2 4.14Å; E1080-I1114 WeakPolarHBondContact OE1-CD1 3.35Å; L1083-I1114 HydrophobicContact CD1-CG2 3.72Å; K1110-I1114 HydrophobicContact CG-CD1 4.38Å; K1110-I1114 WeakPolarHBondContact O-CD1 3.42Å; K1110-I1114 VanDerWaalsContact O-CG1 3.28Å; K1110-I1114 WeakPolarHBondContact O-CG1 3.36Å; K1110-I1114 PolarHBondContact O-N 2.99Å; K1110-I1114 VanDerWaalsContact O-N 3.13Å; I1111-I1114 PolarHBondContact O-N 3.09Å; I1114-N1117 PolarHBondContact O-N 2.95Å; I1114-Y1118 WeakPolarHBondContact O-CB 3.35Å; I1114-Y1118 PolarHBondContact O-N 2.9Å
1115	L	92	Very high	82.8	Confident	0 Å²	0	75.4 Å²	75.4	0%	0	37%	0.371	C	S	.	.	H	α-helix	trans	-62.6	-45.7	178	-76	163.9	0	0	0	112.4	I1071 L1083 V1089 C1099 L1100 C1103 I1111 H1112 N1117 Y1118 I1119	I1071-L1115 HydrophobicContact CD1-CD1 3.79Å; I1071-L1115 HydrophobicContact CD1-CD2 4.49Å; I1071-L1115 HydrophobicContact CG1-CD1 4.26Å; L1083-L1115 HydrophobicContact CD1-CD2 4.12Å; L1083-L1115 HydrophobicContact CD2-CD2 4.12Å; V1089-L1115 HydrophobicContact CG1-CD2 3.73Å; C1099-L1115 HydrophobicContact CB-CD1 4.12Å; C1099-L1115 HydrophobicContact CB-CD2 4.19Å; L1100-L1115 HydrophobicContact CD2-CB 3.88Å; C1103-L1115 VanDerWaalsContact SG-CD1 3.52Å; I1111-L1115 HydrophobicContact CG2-CD1 4.19Å; I1111-L1115 WeakPolarHBondContact O-CG 3.27Å; I1111-L1115 PolarHBondContact O-N 3.37Å; H1112-L1115 PolarHBondContact O-N 3.37Å; L1115-N1117 VanDerWaalsContact C-N 3.33Å; L1115-N1117 PolarHBondContact O-N 3.26Å; L1115-Y1118 PolarHBondContact O-N 3.38Å; L1115-I1119 WeakPolarHBondContact O-CB 3.44Å; L1115-I1119 VanDerWaalsContact O-CG1 3.29Å; L1115-I1119 WeakPolarHBondContact O-CG1 3.31Å; L1115-I1119 PolarHBondContact O-N 3.42Å
1116	I	89.5	Confident	80.5	Confident	45 Å²	45	75.1 Å²	75.1	23%	0.231	38%	0.376	C	S	.	.	H	α-helix	trans	-60.9	-43.2	177.8	-77.9	-178.7	0	0	0	111	L1100 H1112 E1113 Y1118 I1119 R1120	L1100-I1116 HydrophobicContact CD2-CG1 3.86Å; H1112-I1116 WeakPolarHBondContact CE1-CD1 3.5Å; H1112-I1116 WeakPolarHBondContact O-CB 3.43Å; H1112-I1116 WeakPolarHBondContact O-CG1 3.43Å; H1112-I1116 PolarHBondContact O-N 3.11Å; E1113-I1116 PolarHBondContact O-N 3.48Å; I1116-Y1118 VanDerWaalsContact C-N 3.33Å; I1116-Y1118 PolarHBondContact O-N 3.27Å; I1116-I1119 PolarHBondContact O-N 3.08Å; I1116-R1120 HydrophobicContact CG2-CG 4.44Å; I1116-R1120 WeakPolarHBondContact O-CB 3.31Å; I1116-R1120 WeakPolarHBondContact O-CG 3.34Å; I1116-R1120 PolarHBondContact O-N 2.83Å
1117	N	89.3	Confident	78	Confident	91 Å²	91	79 Å²	79	49%	0.487	39%	0.392	S	S	.	.	H	α-helix	trans	-67.3	-35	178.8	-70.1	-27.7	0	0	0	112.2	E1113 I1114 L1115 R1120 S1121	E1113-N1117 WeakPolarHBondContact O-CB 3.44Å; E1113-N1117 VanDerWaalsContact O-CG 3.27Å; E1113-N1117 PolarHBondContact O-N 3.42Å; E1113-N1117 PolarHBondContact O-ND2 3.13Å; I1114-N1117 PolarHBondContact O-N 2.95Å; L1115-N1117 VanDerWaalsContact C-N 3.33Å; L1115-N1117 PolarHBondContact O-N 3.26Å; N1117-R1120 PolarHBondContact OD1-NH1 3.05Å; N1117-S1121 PolarHBondContact O-N 2.91Å; N1117-S1121 PolarHBondContact O-OG 3.15Å
1118	Y	90.3	Very high	75.4	Confident	40 Å²	40	80.8 Å²	80.8	16%	0.157	40%	0.397	C	S	.	.	H	α-helix	trans	-69	-39.6	173.9	-172.3	-91.6	0	0	0	113.7	L1083 I1114 L1115 I1116 S1121 R1122	L1083-Y1118 HydrophobicContact CB-CD2 3.82Å; L1083-Y1118 HydrophobicContact CB-CE2 3.72Å; L1083-Y1118 HydrophobicContact CB-CG 4.32Å; L1083-Y1118 HydrophobicContact CD1-CD2 4.4Å; L1083-Y1118 HydrophobicContact CD1-CG 4.25Å; L1083-Y1118 HydrophobicContact CD2-CD1 3.7Å; L1083-Y1118 HydrophobicContact CD2-CD2 4.28Å; L1083-Y1118 HydrophobicContact CD2-CE1 3.79Å; L1083-Y1118 HydrophobicContact CD2-CE2 4.36Å; L1083-Y1118 HydrophobicContact CD2-CG 3.94Å; L1083-Y1118 HydrophobicContact CG-CD2 4.39Å; L1083-Y1118 HydrophobicContact CG-CG 4.4Å; L1083-Y1118 WeakPolarHBondContact O-CE2 3.45Å; L1083-Y1118 PolarHBondContact O-OH 3.5Å; I1114-Y1118 WeakPolarHBondContact O-CB 3.35Å; I1114-Y1118 PolarHBondContact O-N 2.9Å; L1115-Y1118 PolarHBondContact O-N 3.38Å; I1116-Y1118 VanDerWaalsContact C-N 3.33Å; I1116-Y1118 PolarHBondContact O-N 3.27Å; Y1118-S1121 PolarHBondContact O-N 3.28Å; Y1118-S1121 PolarHBondContact O-OG 3.15Å; Y1118-R1122 HydrophobicContact CE1-CG 4.3Å; Y1118-R1122 PolarHBondContact O-N 3.13Å; Y1118-R1122 PolarHBondContact OH-NE 3.27Å; Y1118-R1122 PolarHBondContact OH-NH2 3.13Å
1119	I	86.4	Confident	72.6	Confident	50 Å²	50	83.6 Å²	83.6	26%	0.256	42%	0.417	S	S	.	.	H	α-helix	trans	-68.2	-39.4	175.8	-68.8	164	0	0	0	110	V1089 L1100 L1115 I1116 N1123	V1089-I1119 HydrophobicContact CG2-CD1 4.34Å; V1089-I1119 HydrophobicContact CG2-CG1 4.09Å; L1100-I1119 HydrophobicContact CD1-CD1 3.88Å; L1100-I1119 HydrophobicContact CD2-CD1 4.29Å; L1100-I1119 HydrophobicContact CG-CD1 4.16Å; L1115-I1119 WeakPolarHBondContact O-CB 3.44Å; L1115-I1119 VanDerWaalsContact O-CG1 3.29Å; L1115-I1119 WeakPolarHBondContact O-CG1 3.31Å; L1115-I1119 PolarHBondContact O-N 3.42Å; I1116-I1119 PolarHBondContact O-N 3.08Å; I1119-N1123 WeakPolarHBondContact O-CB 3.42Å; I1119-N1123 PolarHBondContact O-N 2.95Å; I1119-N1123 VanDerWaalsContact O-N 3.11Å; I1119-N1123 PolarHBondContact O-ND2 3.48Å
1120	R	85.3	Confident	69.8	Low	163 Å²	163	81 Å²	81	62%	0.615	41%	0.414	S	S	*	.	H	α-helix	trans	-61.1	-43.8	174.1	-76.6	168.8	174.7	168.4	-3	112.7	I1116 N1117 N1123 S1124	I1116-R1120 HydrophobicContact CG2-CG 4.44Å; I1116-R1120 WeakPolarHBondContact O-CB 3.31Å; I1116-R1120 WeakPolarHBondContact O-CG 3.34Å; I1116-R1120 PolarHBondContact O-N 2.83Å; N1117-R1120 PolarHBondContact OD1-NH1 3.05Å; R1120-N1123 PolarHBondContact O-N 3.45Å; R1120-S1124 PolarHBondContact O-N 3.19Å; R1120-S1124 VanDerWaalsContact O-N 3.13Å
1121	S	81.8	Confident	66.8	Low	53 Å²	53	85.4 Å²	85.4	37%	0.371	43%	0.428	S	S	.	.	H	α-helix	trans	-65.1	-50.5	-179.8	60.5	0	0	0	0	111.9	N1117 Y1118 N1123 S1124 D1125	N1117-S1121 PolarHBondContact O-N 2.91Å; N1117-S1121 PolarHBondContact O-OG 3.15Å; Y1118-S1121 PolarHBondContact O-N 3.28Å; Y1118-S1121 PolarHBondContact O-OG 3.15Å; S1121-N1123 VanDerWaalsContact C-N 3.26Å; S1121-N1123 PolarHBondContact O-N 3.43Å; S1121-S1124 WeakPolarHBondContact O-CA 3.46Å; S1121-S1124 WeakPolarHBondContact O-CB 3.45Å; S1121-S1124 PolarHBondContact O-N 3.11Å; S1121-S1124 PolarHBondContact O-OG 2.88Å; S1121-D1125 PolarHBondContact O-N 3.48Å
1122	R	73.2	Confident	63.9	Low	75 Å²	75	93 Å²	93	28%	0.283	47%	0.468	S	S	.	.	H	α-helix	trans	-55.4	-38.9	175.1	-76.2	-167.6	176.1	-163	5.8	113.1	Y1118 S1124 D1125 T1126	Y1118-R1122 HydrophobicContact CE1-CG 4.3Å; Y1118-R1122 PolarHBondContact O-N 3.13Å; Y1118-R1122 PolarHBondContact OH-NE 3.27Å; Y1118-R1122 PolarHBondContact OH-NH2 3.13Å; R1122-S1124 VanDerWaalsContact C-N 3.26Å; R1122-S1124 PolarHBondContact O-N 3.03Å; R1122-D1125 PolarHBondContact O-N 3.22Å; R1122-T1126 PolarHBondContact O-N 2.96Å
1123	N	61.1	Low	60.9	Low	94 Å²	94	99.2 Å²	99.2	50%	0.503	50%	0.495	S	S	.	.	H	α-helix	trans	-75	-12.3	177.8	-74.8	-21.5	0	0	0	114	I1119 R1120 S1121 T1126	I1119-N1123 WeakPolarHBondContact O-CB 3.42Å; I1119-N1123 PolarHBondContact O-N 2.95Å; I1119-N1123 VanDerWaalsContact O-N 3.11Å; I1119-N1123 PolarHBondContact O-ND2 3.48Å; R1120-N1123 PolarHBondContact O-N 3.45Å; S1121-N1123 VanDerWaalsContact C-N 3.26Å; S1121-N1123 PolarHBondContact O-N 3.43Å; N1123-T1126 PolarHBondContact O-OG1 2.88Å
1124	S	47.3	Very low	58	Low	70 Å²	70	103.1 Å²	103.1	49%	0.49	51%	0.51	S	S	.	.	H	α-helix	trans	-83.5	-38.7	168.9	76.4	0	0	0	0	111.8	R1120 S1121 R1122 T1126 K1127 S1128	R1120-S1124 PolarHBondContact O-N 3.19Å; R1120-S1124 VanDerWaalsContact O-N 3.13Å; S1121-S1124 WeakPolarHBondContact O-CA 3.46Å; S1121-S1124 WeakPolarHBondContact O-CB 3.45Å; S1121-S1124 PolarHBondContact O-N 3.11Å; S1121-S1124 PolarHBondContact O-OG 2.88Å; R1122-S1124 VanDerWaalsContact C-N 3.26Å; R1122-S1124 PolarHBondContact O-N 3.03Å; S1124-T1126 VanDerWaalsContact C-N 3.34Å; S1124-T1126 PolarHBondContact O-N 3.36Å; S1124-K1127 PolarHBondContact O-N 2.74Å; S1124-S1128 PolarHBondContact O-N 3.18Å
1125	D	45.7	Very low	54.8	Low	93 Å²	93	106.9 Å²	106.9	50%	0.497	53%	0.534	S	S	.	.	H	α-helix	trans	-60.6	-41.7	178	-65.7	-46.3	0	0	0	111.9	S1121 R1122 K1127 S1128 I1129	S1121-D1125 PolarHBondContact O-N 3.48Å; R1122-D1125 PolarHBondContact O-N 3.22Å; D1125-K1127 VanDerWaalsContact C-N 3.3Å; D1125-K1127 PolarHBondContact O-N 3.37Å; D1125-S1128 WeakPolarHBondContact O-CB 3.35Å; D1125-S1128 PolarHBondContact O-N 2.62Å; D1125-S1128 VanDerWaalsContact O-N 3.16Å; D1125-I1129 WeakPolarHBondContact O-CD1 3.34Å; D1125-I1129 WeakPolarHBondContact O-CG1 3.21Å; D1125-I1129 PolarHBondContact O-N 2.99Å
1126	T	36.3	Very low	51.8	Low	89 Å²	89	113 Å²	113	55%	0.546	57%	0.567	S	S	.	*	H	α-helix	trans	-65.4	-30.1	178.8	55.8	0	0	0	0	113.4	R1122 N1123 S1124	R1122-T1126 PolarHBondContact O-N 2.96Å; N1123-T1126 PolarHBondContact O-OG1 2.88Å; S1124-T1126 VanDerWaalsContact C-N 3.34Å; S1124-T1126 PolarHBondContact O-N 3.36Å
1127	K	34.9	Very low	48.8	Very low	170 Å²	170	117 Å²	117	74%	0.739	59%	0.588	S	S	*	*	H	α-helix	trans	-77.6	-24.2	175.2	-71	-174.8	176.8	-178.5	0	112.8	S1124 D1125 T1130	S1124-K1127 PolarHBondContact O-N 2.74Å; D1125-K1127 VanDerWaalsContact C-N 3.3Å; D1125-K1127 PolarHBondContact O-N 3.37Å; K1127-T1130 PolarHBondContact O-OG1 3.48Å
1128	S	32.9	Very low	45.9	Very low	88 Å²	88	121 Å²	121	62%	0.615	60%	0.601	S	S	*	*	H	α-helix	trans	-69.8	-40.6	176.8	-171.3	0	0	0	0	112.9	S1124 D1125 T1130 R1131	S1124-S1128 PolarHBondContact O-N 3.18Å; D1125-S1128 WeakPolarHBondContact O-CB 3.35Å; D1125-S1128 PolarHBondContact O-N 2.62Å; D1125-S1128 VanDerWaalsContact O-N 3.16Å; S1128-T1130 PolarHBondContact O-N 3.19Å; S1128-R1131 PolarHBondContact O-N 2.75Å
1129	I	30.7	Very low	43	Very low	141 Å²	141	126.8 Å²	126.8	72%	0.723	63%	0.627	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.3	-1.8	-165.9	-68	164.6	0	0	0	114.3	D1125	D1125-I1129 WeakPolarHBondContact O-CD1 3.34Å; D1125-I1129 WeakPolarHBondContact O-CG1 3.21Å; D1125-I1129 PolarHBondContact O-N 2.99Å
1130	T	29.7	Very low	40.2	Very low	108 Å²	108	131.9 Å²	131.9	66%	0.663	65%	0.65	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.7	-4	-179.7	59	0	0	0	0	115.2	K1127 S1128	K1127-T1130 PolarHBondContact O-OG1 3.48Å; S1128-T1130 PolarHBondContact O-N 3.19Å
1131	R	28.2	Very low	37.6	Very low	209 Å²	209	132.4 Å²	132.4	79%	0.789	67%	0.665	S	S	*	*	S	Bend	trans	-138.4	80.2	176.8	-66.3	-172.4	-178.9	92.3	-4.5	113.1	S1128	S1128-R1131 PolarHBondContact O-N 2.75Å
1132	D	31.3	Very low	35.1	Very low	165 Å²	165	133.9 Å²	133.9	88%	0.882	68%	0.68	S	S	*	*				-176	157.4	113.3	-106.9	-33.2	0	0	0	114.7
1133	K	28.7	Very low	32.8	Very low	190 Å²	190	137.5 Å²	137.5	83%	0.826	71%	0.705	S	S	*	*			trans	-113	120.5	171	-65.5	173.6	-179.5	172.8	0	109.5
1134	K	29.9	Very low	31.2	Very low	195 Å²	195	138.8 Å²	138.8	85%	0.848	72%	0.716	S	S	*	*			trans	157.2	127.8	130.8	-88.1	165.5	179.3	178.6	0	116.5
1135	V	27	Very low	30.1	Very low	116 Å²	116	140.5 Å²	140.5	70%	0.703	73%	0.728	S	S	*	*				81.3	130.7	124.9	174.2	0	0	0	0	121.5
1136	N	28.2	Very low	29.2	Very low	128 Å²	128	145.5 Å²	145.5	68%	0.684	75%	0.745	S	S	*	*			trans	62.6	127.9	163.4	-62.8	-10.3	0	0	0	118.2
1137	I	27.8	Very low	28.7	Very low	130 Å²	130	149.3 Å²	149.3	67%	0.667	76%	0.757	S	S	*	*			cis	75	103.3	35.3	-49.8	165	0	0	0	113.7
1138	F	27.1	Very low	28.2	Very low	174 Å²	174	148.9 Å²	148.9	76%	0.763	76%	0.758	S	S	*	*				176.1	137.9	115.5	-95.5	-60.1	0	0	0	115.3
1139	K	29	Very low	27.9	Very low	161 Å²	161	152.8 Å²	152.8	70%	0.7	77%	0.77	S	S	*	*			trans	57.1	114.2	145.6	-78.2	173.8	173.6	-174	0	123.9
1140	E	28.7	Very low	27.6	Very low	158 Å²	158	149.3 Å²	149.3	74%	0.738	77%	0.769	S	S	*	*				32.1	119	108.4	-58	169.4	137.5	0	0	119.7
1141	N	29.9	Very low	27.6	Very low	174 Å²	174	152 Å²	152	93%	0.93	78%	0.779	S	S	*	*				-169.2	176.7	106.5	-103.7	-35.1	0	0	0	112.8
1142	A	28.4	Very low	27.8	Very low	83 Å²	83	147.3 Å²	147.3	69%	0.686	78%	0.778	S	S	*	*			trans	-116.3	-177.9	-168.6	0	0	0	0	0	114.4
1143	D	26.6	Very low	27.8	Very low	151 Å²	151	144.1 Å²	144.1	81%	0.807	77%	0.769	S	S	*	*			trans	80.1	118.1	156.5	-72	-25.7	0	0	0	122.5
1144	V	26	Very low	28	Very low	122 Å²	122	143 Å²	143	74%	0.739	77%	0.768	S	S	*	*				80.2	130.2	126.4	174.8	0	0	0	0	121.1
1145	S	24.9	Very low	28.1	Very low	106 Å²	106	139.4 Å²	139.4	74%	0.741	76%	0.758	S	S	*	*			trans	83.6	119.7	153.6	67.8	0	0	0	0	121.8
1146	K	26.8	Very low	28.3	Very low	197 Å²	197	142 Å²	142	86%	0.857	76%	0.762	S	S	*	*			trans	21.3	152.3	133.9	-59.6	-177.4	175.2	-178.6	0	121.9
1147	Q	26	Very low	28.7	Very low	169 Å²	169	141.2 Å²	141.2	79%	0.79	77%	0.767	S	S	*	*			trans	99.6	98.8	158.5	-55.7	-167.8	-104.1	0	0	117.4
1148	E	25.2	Very low	28.8	Very low	162 Å²	162	139.1 Å²	139.1	76%	0.757	77%	0.769	S	S	*	*				42.5	155.8	120.8	-59.8	-177.2	123.4	0	0	123.3
1149	L	24.8	Very low	29.1	Very low	169 Å²	169	136 Å²	136	89%	0.885	77%	0.766	S	S	*	*			trans	68.8	100.4	164.3	-59.3	138.5	0	0	0	115.6
1150	G	25.9	Very low	29.2	Very low	68 Å²	68	133.5 Å²	133.5	70%	0.701	77%	0.769	S	S	*	*			cis	97.8	122.3	38.7	0	0	0	0	0	111.7
1151	L	29.8	Very low	29.4	Very low	166 Å²	166	134.6 Å²	134.6	87%	0.869	78%	0.776	S	S	*	*			trans	-177.1	116.9	151.8	-118	62.1	0	0	0	107
1152	S	31.3	Very low	29.4	Very low	109 Å²	109	130.5 Å²	130.5	76%	0.762	77%	0.766	S	S	*	*				75.2	140	86.5	-61.9	0	0	0	0	114
1153	S	31.7	Very low	29.8	Very low	99 Å²	99	132.4 Å²	132.4	69%	0.692	77%	0.772	S	S	*	*			cis	-160.7	178	-8.1	48.1	0	0	0	0	107
1154	M	32.6	Very low	29.9	Very low	165 Å²	165	132.2 Å²	132.2	81%	0.813	78%	0.776	S	S	*	*			cis	-156.6	177.4	32.6	-72.6	-175.9	168.9	0	0	108.3
1155	L	31.9	Very low	29.9	Very low	121 Å²	121	132.1 Å²	132.1	63%	0.634	78%	0.776	S	S	*	*			cis	-149.3	137.5	-7.7	-141	75.1	0	0	0	105.7
1156	Q	32.6	Very low	29.9	Very low	169 Å²	169	133 Å²	133	79%	0.79	78%	0.777	S	S	*	*				45.2	141.5	99.1	-40.7	171.8	-8.3	0	0	116.9
1157	S	34.7	Very low	29.8	Very low	113 Å²	113	127.9 Å²	127.9	79%	0.79	77%	0.771	S	S	*	*			cis	-135.5	147.8	19.2	50.3	0	0	0	0	112.7
1158	A	31.7	Very low	29.6	Very low	85 Å²	85	128.7 Å²	128.7	70%	0.702	78%	0.777	S	S	*	*			cis	78.4	154.6	33.7	0	0	0	0	0	114.4
1159	P	33.5	Very low	29.6	Very low	109 Å²	109	127.8 Å²	127.8	71%	0.708	78%	0.783	S	S	*	*			cis	-144.3	153	9.5	40.3	-20.5	0	0	0	119.9
1160	S	30.1	Very low	29.6	Very low	108 Å²	108	126 Å²	126	76%	0.755	78%	0.78	S	S	*	*			trans	65.5	158.9	141.7	77.1	0	0	0	0	120
1161	M	33.2	Very low	29.5	Very low	182 Å²	182	129.2 Å²	129.2	90%	0.897	79%	0.786	S	S	*	*			cis	-147.6	174.4	10.7	-93.4	-156.1	-178.4	0	0	108.6
1162	A	30.5	Very low	29.3	Very low	87 Å²	87	127 Å²	127	72%	0.719	78%	0.781	S	S	*	*			cis	-164.5	168.5	-18.4	0	0	0	0	0	108.9
1163	P	35.1	Very low	29	Very low	123 Å²	123	127.8 Å²	127.8	80%	0.799	78%	0.781	S	S	*	*			trans	-119.7	156.9	-161.1	40.7	-30.9	0	0	0	118.3
1164	V	28.9	Very low	28.7	Very low	148 Å²	148	134.5 Å²	134.5	90%	0.897	79%	0.791	S	S	*	*			trans	-140.8	162.4	161.3	-175.8	0	0	0	0	109.9
1165	T	26.2	Very low	28.4	Very low	120 Å²	120	134.8 Å²	134.8	74%	0.736	79%	0.79	S	S	*	*			trans	-114	167.7	-159	59.4	0	0	0	0	116.7
1166	T	24.9	Very low	28.2	Very low	125 Å²	125	134.4 Å²	134.4	77%	0.767	80%	0.797	S	S	*	*			trans	95.3	144.8	147.2	-46.9	0	0	0	0	119.9
1167	A	24.3	Very low	27.9	Very low	89 Å²	89	131.3 Å²	131.3	74%	0.736	80%	0.801	S	S	*	*			trans	75.7	92.9	162.4	0	0	0	0	0	121.4
1168	M	23.7	Very low	27.6	Very low	186 Å²	186	132.4 Å²	132.4	92%	0.916	79%	0.794	S	S	*	*				24.8	116.7	127.9	-60.8	175.3	177.4	0	0	121
1169	T	23.9	Very low	27.4	Very low	143 Å²	143	135.4 Å²	135.4	88%	0.877	80%	0.798	S	S	*	*				-148.5	152.9	118.3	20.9	0	0	0	0	109.1
1170	T	24.8	Very low	27	Very low	132 Å²	132	137.8 Å²	137.8	81%	0.81	80%	0.803	S	S	*	*			trans	-101.3	115.4	-168.5	49.2	0	0	0	0	113.2
1171	T	24.5	Very low	26.8	Very low	135 Å²	135	138 Å²	138	83%	0.828	80%	0.803	S	S	*	*			trans	-137.4	73.2	171.8	45.3	0	0	0	0	113.3	V1173	T1171-V1173 PolarHBondContact O-N 3.47Å
1172	P	25.2	Very low	26.4	Very low	119 Å²	119	138.4 Å²	138.4	77%	0.773	79%	0.794	S	S	*	*			trans	-73	120.1	161.1	30.1	-29	0	0	0	110
1173	V	25.6	Very low	26.2	Very low	126 Å²	126	140.8 Å²	140.8	76%	0.764	79%	0.792	S	S	*	*			trans	-15.7	126.7	172.2	-178.2	0	0	0	0	116.8	T1171 H1175	T1171-V1173 PolarHBondContact O-N 3.47Å; V1173-H1175 PolarHBondContact O-N 3.02Å; V1173-H1175 VanDerWaalsContact O-N 3.14Å
1174	R	23.8	Very low	25.8	Very low	239 Å²	239	141.3 Å²	141.3	90%	0.902	79%	0.788	S	S	*	*			trans	-63.3	104.2	163.4	-71.9	174	170.7	169.9	-4.7	111
1175	H	26.5	Very low	25.7	Very low	171 Å²	171	141.1 Å²	141.1	79%	0.792	78%	0.778	S	S	*	*			trans	-162.1	156.7	149.1	-91.2	-70.9	0	0	0	107.9	V1173	V1173-H1175 PolarHBondContact O-N 3.02Å; V1173-H1175 VanDerWaalsContact O-N 3.14Å
1176	S	28.8	Very low	25.8	Very low	113 Å²	113	143.9 Å²	143.9	79%	0.79	78%	0.78	S	S	*	*			trans	84	14.8	-177.7	86.3	0	0	0	0	120.2	E1178	S1176-E1178 PolarHBondContact O-N 3.26Å
1177	A	25.9	Very low	25.9	Very low	104 Å²	104	144.3 Å²	144.3	86%	0.86	78%	0.778	S	S	*	*	S	Bend	trans	-78.8	2.4	165.3	0	0	0	0	0	114.4
1178	E	27.4	Very low	26.2	Very low	137 Å²	137	151.8 Å²	151.8	64%	0.64	79%	0.787	S	S	*	*			trans	-130	77.4	-179.3	-68.7	-170.8	-155.6	0	0	110.7	K761 S1176	K761-E1178 IonicContact NZ-OE1 3.63Å; K761-E1178 PolarHBondContact NZ-OE1 3.06Å; K761-E1178 IonicContact NZ-OE2 2.81Å; K761-E1178 PolarHBondContact NZ-OE2 3.39Å; S1176-E1178 PolarHBondContact O-N 3.26Å
1179	N	27.8	Very low	26.3	Very low	148 Å²	148	148 Å²	148	79%	0.791	77%	0.774	S	S	*	*			trans	-146.2	64	159.8	-103	-20.7	0	0	0	109.4	C1181	N1179-C1181 PolarHBondContact O-N 3.44Å
1180	I	26.6	Very low	26.6	Very low	158 Å²	158	146.5 Å²	146.5	81%	0.81	77%	0.769	S	S	*	*			trans	-60.3	119.6	165.8	-62.9	171.3	0	0	0	106.7	R1182	I1180-R1182 VanDerWaalsContact C-N 3.28Å; I1180-R1182 PolarHBondContact O-N 3.1Å
1181	C	25.6	Very low	26.7	Very low	112 Å²	112	147.6 Å²	147.6	76%	0.757	77%	0.77	S	S	*	*			trans	-69	80.8	-177.6	-72.1	0	0	0	0	112.2	N1179 M1183	N1179-C1181 PolarHBondContact O-N 3.44Å; C1181-M1183 PolarHBondContact O-N 3.21Å
1182	R	24.4	Very low	27.1	Very low	191 Å²	191	146.3 Å²	146.3	72%	0.721	77%	0.766	S	S	*	*			trans	-67	107.8	148.1	-73.2	-173.1	176.3	-157.6	2.5	107.2	I1180 E1185	I1180-R1182 VanDerWaalsContact C-N 3.28Å; I1180-R1182 PolarHBondContact O-N 3.1Å; R1182-E1185 IonicContact NH1-OE2 2.62Å; R1182-E1185 PolarHBondContact NH1-OE2 3.4Å
1183	M	26.6	Very low	27.3	Very low	137 Å²	137	148.5 Å²	148.5	68%	0.675	77%	0.771	S	S	*	*			trans	-116	54.7	163.3	-70	-159.8	76.9	0	0	110.1	C1181	C1181-M1183 PolarHBondContact O-N 3.21Å
1184	N	25.8	Very low	27.6	Very low	134 Å²	134	149.6 Å²	149.6	72%	0.717	77%	0.773	S	S	*	*			trans	-126	164.7	154.7	-77.5	-16.5	0	0	0	106
1185	E	26.5	Very low	28.1	Very low	145 Å²	145	146.1 Å²	146.1	68%	0.678	77%	0.767	S	S	*	*			trans	73.4	82.5	-174.2	-53.3	168.3	143	0	0	112.9	R1182	R1182-E1185 IonicContact NH1-OE2 2.62Å; R1182-E1185 PolarHBondContact NH1-OE2 3.4Å
1186	F	28.8	Very low	28.2	Very low	177 Å²	177	144.9 Å²	144.9	78%	0.776	77%	0.771	S	S	*	*			trans	-107	92.4	153.3	-115	-75.7	0	0	0	107	W1188	F1186-W1188 PolarHBondContact O-N 3.29Å
1187	D	28.2	Very low	28.3	Very low	134 Å²	134	144.2 Å²	144.2	72%	0.717	77%	0.766	S	S	*	*			trans	-68.6	124.5	-177.9	-79.3	-43.3	0	0	0	111.9	V1189	D1187-V1189 VanDerWaalsContact C-N 3.28Å; D1187-V1189 HydrophobicContact CB-CG2 3.89Å; D1187-V1189 PolarHBondContact O-N 3.23Å; D1187-V1189 VanDerWaalsContact O-N 3.09Å
1188	W	29.4	Very low	28.6	Very low	247 Å²	247	147.6 Å²	147.6	94%	0.936	76%	0.764	S	S	*	*			trans	-80.1	78.6	162.6	-78.6	86.5	0	0	0	109.4	F1186 S1190	F1186-W1188 PolarHBondContact O-N 3.29Å; W1188-S1190 VanDerWaalsContact C-N 3.29Å; W1188-S1190 PolarHBondContact O-N 2.89Å
1189	V	26.8	Very low	28.8	Very low	106 Å²	106	147.4 Å²	147.4	64%	0.642	77%	0.768	S	S	*	*			trans	-72.1	87	172.7	-170.6	0	0	0	0	109.4	D1187 L1191	D1187-V1189 VanDerWaalsContact C-N 3.28Å; D1187-V1189 HydrophobicContact CB-CG2 3.89Å; D1187-V1189 PolarHBondContact O-N 3.23Å; D1187-V1189 VanDerWaalsContact O-N 3.09Å; V1189-L1191 VanDerWaalsContact C-N 3.32Å; V1189-L1191 HydrophobicContact CG1-CD2 3.86Å; V1189-L1191 HydrophobicContact CG1-CG 4.01Å; V1189-L1191 PolarHBondContact O-N 2.91Å
1190	S	28.8	Very low	29	Very low	111 Å²	111	150 Å²	150	78%	0.776	77%	0.767	S	S	*	*			trans	-70.3	89.4	165.1	59.8	0	0	0	0	109.2	W1188 S1192	W1188-S1190 VanDerWaalsContact C-N 3.29Å; W1188-S1190 PolarHBondContact O-N 2.89Å; S1190-S1192 PolarHBondContact O-N 2.62Å; S1190-S1192 VanDerWaalsContact O-N 3.09Å
1191	L	27.5	Very low	29.1	Very low	156 Å²	156	146.3 Å²	146.3	82%	0.817	76%	0.756	S	S	*	*			trans	-66.5	106.6	169.1	-70.2	177.8	0	0	0	109	V1189	V1189-L1191 VanDerWaalsContact C-N 3.32Å; V1189-L1191 HydrophobicContact CG1-CD2 3.86Å; V1189-L1191 HydrophobicContact CG1-CG 4.01Å; V1189-L1191 PolarHBondContact O-N 2.91Å
1192	S	32.9	Very low	29.4	Very low	107 Å²	107	147.9 Å²	147.9	75%	0.748	76%	0.757	S	S	*	*			trans	-77.1	130.7	161	52.5	0	0	0	0	109.2	S1190 D1194	S1190-S1192 PolarHBondContact O-N 2.62Å; S1190-S1192 VanDerWaalsContact O-N 3.09Å; S1192-D1194 PolarHBondContact O-N 3.22Å
1193	D	30.5	Very low	29.6	Very low	165 Å²	165	144.9 Å²	144.9	88%	0.882	76%	0.764	S	S	*	*			trans	-59.3	120.3	175.4	-63.6	-63.3	0	0	0	111.8
1194	D	31.5	Very low	29.9	Very low	149 Å²	149	145.9 Å²	145.9	80%	0.797	77%	0.772	S	S	*	*			trans	-162.6	150.7	156.3	-124.8	-35.9	0	0	0	111.1	S1192	S1192-D1194 PolarHBondContact O-N 3.22Å
1195	Q	33.4	Very low	30.6	Very low	167 Å²	167	143.2 Å²	143.2	78%	0.78	76%	0.762	S	S	*	*			trans	75.7	129.2	-176	-52.8	-64.1	-84.4	0	0	117.6
1196	V	29.5	Very low	30.9	Very low	144 Å²	144	146.4 Å²	146.4	87%	0.873	77%	0.774	S	S	*	*			trans	-134.7	135.5	-176.4	170.5	0	0	0	0	110.6
1197	S	31.4	Very low	30.9	Very low	99 Å²	99	144.1 Å²	144.1	69%	0.692	77%	0.769	S	S	*	*			trans	-168.8	119.8	152.2	55.3	0	0	0	0	107.2
1198	E	31.2	Very low	30.9	Very low	176 Å²	176	146.6 Å²	146.6	82%	0.822	78%	0.776	S	S	*	*				55.7	120.5	96.5	-61.3	176.3	164.1	0	0	111.3
1199	D	31.2	Very low	31	Very low	133 Å²	133	142 Å²	142	71%	0.711	77%	0.769	S	S	*	*			cis	-168	180	44.9	-146.6	-9.6	0	0	0	113.7
1200	Y	33.1	Very low	31.3	Very low	201 Å²	201	144.6 Å²	144.6	79%	0.788	78%	0.776	S	S	*	*			trans	78.9	112.6	170	-75.4	-79.2	0	0	0	122.4
1201	S	28.2	Very low	31.3	Very low	82 Å²	82	145.7 Å²	145.7	57%	0.573	78%	0.779	S	S	*	*			trans	-47.4	161	152.4	57.6	0	0	0	0	113.8
1202	D	31.4	Very low	31.5	Very low	144 Å²	144	147.1 Å²	147.1	77%	0.77	78%	0.781	S	S	*	*				-164.1	179.2	55.6	-100.1	-61.4	0	0	0	113.7
1203	C	30	Very low	31.5	Very low	129 Å²	129	149.8 Å²	149.8	87%	0.872	79%	0.787	S	S	*	*			trans	83.6	95.5	167.3	-62.3	0	0	0	0	118.9
1204	D	32.8	Very low	31.3	Very low	157 Å²	157	151.6 Å²	151.6	84%	0.84	79%	0.788	S	S	*	*			trans	-145	164.9	158.5	-163.8	35.4	0	0	0	105.8
1205	P	39.1	Very low	31.3	Very low	78 Å²	78	155.9 Å²	155.9	51%	0.506	81%	0.811	S	S	.	*			cis	-122.4	-174	-18.4	40.3	-26.4	0	0	0	112.6	I1207	P1205-I1207 HydrophobicContact CB-CG1 4.35Å
1206	F	32.6	Very low	31.2	Very low	212 Å²	212	155.4 Å²	155.4	93%	0.93	81%	0.812	S	S	*	*			trans	-141.6	136.3	139.3	-118.2	-82.7	0	0	0	110
1207	I	28.9	Very low	31.3	Very low	130 Å²	130	155.9 Å²	155.9	67%	0.667	81%	0.809	S	S	*	*			trans	-119.3	169.2	-174.2	-50.7	177.5	0	0	0	107.8	P1205	P1205-I1207 HydrophobicContact CB-CG1 4.35Å
1208	E	29.4	Very low	31.3	Very low	185 Å²	185	159.1 Å²	159.1	86%	0.864	82%	0.815	S	S	*	*			trans	78.4	134.8	176.9	-49.5	173.3	175.8	0	0	111.3
1209	D	31.2	Very low	31.3	Very low	150 Å²	150	158.1 Å²	158.1	80%	0.802	82%	0.815	S	S	*	*			cis	-149.4	-178.3	26.8	-164	4.9	0	0	0	112.4
1210	M	31.9	Very low	31.3	Very low	161 Å²	161	159.7 Å²	159.7	79%	0.793	82%	0.821	S	S	*	*			trans	75.3	78.5	170.2	-58.7	-177.7	-66.1	0	0	118.1
1211	T	28.8	Very low	31.1	Very low	135 Å²	135	156.9 Å²	156.9	83%	0.828	82%	0.824	S	S	*	*				-76.5	169.6	127.6	49.3	0	0	0	0	110.2
1212	E	31.9	Very low	31.3	Very low	186 Å²	186	162.3 Å²	162.3	87%	0.869	84%	0.841	S	S	*	*			trans	80.7	123.2	-158.9	-53.6	177.5	177	0	0	110.8
1213	D	34.1	Very low	31.3	Very low	162 Å²	162	163.7 Å²	163.7	87%	0.866	85%	0.847	S	S	*	*			cis	-120.3	157.8	7.3	-94	-44.1	0	0	0	113.3
1214	F	25.5	Very low	31.5	Very low	204 Å²	204	166.6 Å²	166.6	90%	0.895	85%	0.845	S	S	*	*			trans	-111.6	119	173.9	-129.3	-84.2	0	0	0	110.4
1215	N	31.2	Very low	31.3	Very low	239 Å²	239	167.5 Å²	167.5	100%	1.278	85%	0.845	S	S	*	*			trans	-164.8	0	160.1	-98.5	-58.7	0	0	0	109.9

Retrieved 1,215 of 1,215 residues in 1600.6 ms (Link to these results)

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