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Transcription elongation factor SPT6

Histone H3-H4 chaperone that plays a role in maintenance of chromatin structure during RNA polymerase II transcription elongation. Required for the transcriptional induction of heat shock response genes and for maximal recruitment of two other elongation factors, Spt5 and Paf1, to the induced Hsp70. Plays a critical role in normal fly development throughout the lifecycle.

AlphaFold DB , UniProt , Accession Q9W420, Species DROME (Drosophila melanogaster, Fruit fly), Gene Spt6, Length 1,831 aa.

						>SPT6H_DROME|Q9W420|Spt6
MAEFLDSEAEESEEEEELDVNERKRLKKLKAAVSDSSEEEEDDEERLREELKDLIDDNPIEEDDGSGYDSDGVGSGKKRKKHEDDDLDDRLEDDDYDLIEENLGVKVERRKRFKRLRRIHDNESDGEEQHVDEGLVREQIAEQLFDENDESIGHRSERSHREADDYDDVDTESDADDFIVDDNGRPIAEKKKKRRPIFTDASLQEGQDIFGVDFDYDDFSKYEEDDYEDDSEGDEYDEDLGVGDDTRVKKKKALKKKVVKKTIFDIYEPSELKRGHFTDMDNEIRKTDIPERMQLREVPVTPVPEGSDELDLEAEWIYKYAFCKHTVSEQEKPESREKMRKPPTTVNKIKQTLEFIRNQQLEVPFIAFYRKEYVKPELNIDDLWKVYYYDGIWCQLNERKRKLKVLFEKMRQFQLDTLCADTDQPVPDDVRLILDSDFERLADVQSMEELKDVHMYFLLNYSHELPRMQAEQRRKAIQERREAKARRQAAAAENGDDAAEAIVVPEPEDDDDPELIDYQLKQASNSSPYAVFRKAGICGFAKHFGLTPEQYAENLRDNYQRNEITQESIGPTELAKQYLSPRFMTTDEVIHAAKYVVARQLAQEPLLRKTMREVYFDRARINIRPTKNGMVLIDENSPVYSMKYVAKKPVSDLFGDQFIKLMMAEEEKLLEITFLEEFEGNACANGTPGDYVEESKALYQLDQFAKHVQEWNKLRAECVQLALQKWVIPDLIKELRSTLHEEAQQFVLRSCTGKLYKWLKVAPYKPQLPPDFGYEEWSTLRGIRVLGLAYDPDHSVAAFCAVTTVEGDISDYLRLPNILKRKNSYNLEEKAQKLADLRKLSDFIKMKKPHIVVIGAESRDAQNIQADIKEILHELETSEQFPPIEVEIIDNELAKIYANSKKGESDFKEYPPLLKQAASLARKMQDPLVEYSQLCDADDEILCLRYHPLQERVPREQLLEQLSLQFINRTSEVGLDINLMVQNSRTINLLQYICGLGPRKGQALLKLLKQSNQRLENRTQLVTVCHLGPRVFINCSGFIKIDTSSLGDSTEAYVEVLDGSRVHPETYEWARKMAIDAMEYDDEETNPAGALEEILESPERLKDLDLDAFAVELERQGFGSKSITLYDIRNELSCLYKDYRTPYTKPSAEELFDMLTKETPDSFYVGKCVTAMVTGFTYRRPQGDQLDSANPVRLDSNESWQCPFCHKDDFPELSEVWNHFDANACPGQPSGVRVRLENGLPGFIHIKNLSDRQVRNPEERVRVSQMIHVRIIKIDIDRFSVECSSRTADLKDVNNEWRPRRDNYYDYVTEEQDNRKVSDAKARALKRKIYARRVIAHPSFFNKSYAEVVAMLAEADQGEVALRPSSKSKDHLTATWKVADDIFQHIDVREEGKENDFSLGRSLWIGTEEFEDLDEIIARHIMPMALAARELIQYKYYKPNMVTGDENERDVMEKLLREEKANDPKKIHYFFTASRAMPGKFLLSYLPKTKVRHEYVTVMPEGYRFRGQIFDTVNSLLRWFKEHWLDPTATPASASASNLTPLHLMRPPPTISSSSQTSLGPQAPYSVTGSVTGGTPRSGISSAVGGGGSSAYSITQSITGYGTSGSSAPGAGVSSSHYGSSSTPSFGAINTPYTPSGQTPFMTPYTPHASQTPRYGHNVPSPSSQSSSSQRHHYGSSSGTGSTPRYHDMGGGGGGGVGGGGGSNAYSMQPHHQQRAKENLDWQLANDAWARRRPQQHQSHQSYHAQQQHHHSQQQPHMGMSMNMGITMSLGRGTGGGGGGGYGSTPVNDYSTGGGHNRGMSSKASVRSTPRTNASPHSMNLGDATPLYDEN
					

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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	35.6	Very low	40.8	Very low	155 Å²	155	101.4 Å²	101.4	76%	0.764	53%	0.527	S	S	*	.				0	-44.8	0	-98.1	-164.1	-171.2	0	0	112.1	F4 L5	M1-F4 PolarHBondContact O-N 3.27Å; M1-L5 WeakPolarHBondContact O-CG 3.44Å; M1-L5 PolarHBondContact O-N 2.7Å
2	A	33.4	Very low	40.9	Very low	65 Å²	65	98 Å²	98	54%	0.537	52%	0.519	S	S	.	.	H	α-helix	trans	-51.7	-67.1	169	0	0	0	0	0	110.3	F4 L5 D6	A2-F4 CarbonylContact O-C 3.56Å; A2-F4 PolarHBondContact O-N 3.3Å; A2-L5 CarbonylContact O-C 3.37Å; A2-L5 WeakPolarHBondContact O-CA 3.36Å; A2-L5 WeakPolarHBondContact O-CB 3.45Å; A2-L5 PolarHBondContact O-N 2.8Å; A2-D6 VanDerWaalsContact C-CG 3.49Å; A2-D6 PolarHBondContact O-N 3.1Å
3	E	38.7	Very low	41	Very low	137 Å²	137	100.2 Å²	100.2	64%	0.64	52%	0.524	S	S	*	.	H	α-helix	trans	-46.8	-28.2	179.5	-58.7	168.4	136.4	0	0	115.9	D6 S7	E3-D6 PolarHBondContact N-OD2 2.97Å; E3-S7 VanDerWaalsContact O-CB 3.31Å; E3-S7 WeakPolarHBondContact O-CB 3.48Å; E3-S7 PolarHBondContact O-N 3.19Å; E3-S7 PolarHBondContact O-OG 2.8Å
4	F	37.4	Very low	40.9	Very low	117 Å²	117	104.3 Å²	104.3	51%	0.513	54%	0.539	S	S	.	.	H	α-helix	trans	-87.8	-33.7	177.1	-175.2	-87.2	0	0	0	113.2	M1 A2 D6 S7 E8	M1-F4 PolarHBondContact O-N 3.27Å; A2-F4 CarbonylContact O-C 3.56Å; A2-F4 PolarHBondContact O-N 3.3Å; F4-D6 VanDerWaalsContact C-N 3.32Å; F4-S7 PolarHBondContact O-OG 3.46Å; F4-E8 HydrophobicContact CE1-CB 4.4Å; F4-E8 WeakPolarHBondContact O-CB 3.41Å; F4-E8 PolarHBondContact O-N 2.98Å
5	L	43.6	Very low	41	Very low	110 Å²	110	104.3 Å²	104.3	58%	0.576	54%	0.536	S	S	*	.	H	α-helix	trans	-71.1	-34	169.3	-74.8	167.5	0	0	0	110.9	M1 A2 A9	M1-L5 WeakPolarHBondContact O-CG 3.44Å; M1-L5 PolarHBondContact O-N 2.7Å; A2-L5 CarbonylContact O-C 3.37Å; A2-L5 WeakPolarHBondContact O-CA 3.36Å; A2-L5 WeakPolarHBondContact O-CB 3.45Å; A2-L5 PolarHBondContact O-N 2.8Å; L5-A9 WeakPolarHBondContact O-CB 3.49Å; L5-A9 PolarHBondContact O-N 3.49Å
6	D	45.1	Very low	41.4	Very low	88 Å²	88	105.1 Å²	105.1	47%	0.471	54%	0.537	S	S	.	.	H	α-helix	trans	-70	-47	175.6	-53.5	-32.3	0	0	0	109.1	A2 E3 F4 A9 E10	A2-D6 VanDerWaalsContact C-CG 3.49Å; A2-D6 PolarHBondContact O-N 3.1Å; E3-D6 PolarHBondContact N-OD2 2.97Å; F4-D6 VanDerWaalsContact C-N 3.32Å; D6-A9 CarbonylContact O-C 3.51Å; D6-A9 WeakPolarHBondContact O-CA 3.17Å; D6-A9 WeakPolarHBondContact O-CB 3.1Å; D6-A9 PolarHBondContact O-N 2.68Å; D6-A9 VanDerWaalsContact O-N 3.13Å; D6-E10 WeakPolarHBondContact O-CG 3.49Å; D6-E10 PolarHBondContact O-N 3.1Å
7	S	43.9	Very low	41.7	Very low	48 Å²	48	104.8 Å²	104.8	34%	0.336	53%	0.532	S	S	.	.	H	α-helix	trans	-68.3	-38.3	175.4	72.5	0	0	0	0	114.6	E3 F4 A9 E10 E11	E3-S7 VanDerWaalsContact O-CB 3.31Å; E3-S7 WeakPolarHBondContact O-CB 3.48Å; E3-S7 PolarHBondContact O-N 3.19Å; E3-S7 PolarHBondContact O-OG 2.8Å; F4-S7 PolarHBondContact O-OG 3.46Å; S7-A9 PolarHBondContact O-N 3.46Å; S7-E10 PolarHBondContact O-N 2.85Å; S7-E11 PolarHBondContact O-N 2.76Å
8	E	42.2	Very low	41.8	Very low	80 Å²	80	102.1 Å²	102.1	37%	0.374	52%	0.519	S	S	.	.	H	α-helix	trans	-76.5	-6.9	174.3	-158.9	172.7	-126.2	0	0	111.4	F4 K733	F4-E8 HydrophobicContact CE1-CB 4.4Å; F4-E8 WeakPolarHBondContact O-CB 3.41Å; F4-E8 PolarHBondContact O-N 2.98Å; E8-K733 IonicContact OE1-NZ 2.75Å; E8-K733 PolarHBondContact OE1-NZ 3.34Å
9	A	45.6	Very low	42.6	Very low	32 Å²	32	101.2 Å²	101.2	26%	0.264	52%	0.516	S	S	.	.	H	α-helix	trans	-89.9	-45.6	165.8	0	0	0	0	0	112	L5 D6 S7 E11 S12 E13	L5-A9 WeakPolarHBondContact O-CB 3.49Å; L5-A9 PolarHBondContact O-N 3.49Å; D6-A9 CarbonylContact O-C 3.51Å; D6-A9 WeakPolarHBondContact O-CA 3.17Å; D6-A9 WeakPolarHBondContact O-CB 3.1Å; D6-A9 PolarHBondContact O-N 2.68Å; D6-A9 VanDerWaalsContact O-N 3.13Å; S7-A9 PolarHBondContact O-N 3.46Å; A9-E11 PolarHBondContact O-N 2.87Å; A9-S12 CarbonylContact O-C 3.03Å; A9-S12 VanDerWaalsContact O-CA 3.3Å; A9-S12 WeakPolarHBondContact O-CA 3.26Å; A9-S12 WeakPolarHBondContact O-CB 3.46Å; A9-S12 PolarHBondContact O-N 2.81Å; A9-S12 PolarHBondContact O-OG 2.73Å; A9-E13 WeakPolarHBondContact O-CG 3.44Å; A9-E13 PolarHBondContact O-N 3.27Å
10	E	43.6	Very low	43.1	Very low	127 Å²	127	101 Å²	101	59%	0.593	52%	0.519	S	S	*	.	H	α-helix	trans	-54.8	-49.6	173.3	-73.2	172.9	156.1	0	0	110.9	D6 S7 S12 E13 E14	D6-E10 WeakPolarHBondContact O-CG 3.49Å; D6-E10 PolarHBondContact O-N 3.1Å; S7-E10 PolarHBondContact O-N 2.85Å; E10-S12 PolarHBondContact O-N 2.78Å; E10-E13 PolarHBondContact O-N 2.55Å; E10-E14 PolarHBondContact O-N 2.84Å
11	E	39.7	Very low	43.8	Very low	156 Å²	156	101 Å²	101	73%	0.729	52%	0.52	S	S	*	.	H	α-helix	trans	-60.8	-13.3	172.9	-75.6	-166.8	164.7	0	0	113.9	S7 A9	S7-E11 PolarHBondContact O-N 2.76Å; A9-E11 PolarHBondContact O-N 2.87Å
12	S	42.4	Very low	44.8	Very low	61 Å²	61	97.6 Å²	97.6	43%	0.427	50%	0.503	S	S	.	.	H	α-helix	trans	-100.1	-31.9	176.7	86.9	0	0	0	0	113.4	A9 E10 E15 E16	A9-S12 CarbonylContact O-C 3.03Å; A9-S12 VanDerWaalsContact O-CA 3.3Å; A9-S12 WeakPolarHBondContact O-CA 3.26Å; A9-S12 WeakPolarHBondContact O-CB 3.46Å; A9-S12 PolarHBondContact O-N 2.81Å; A9-S12 PolarHBondContact O-OG 2.73Å; E10-S12 PolarHBondContact O-N 2.78Å; S12-E15 PolarHBondContact O-N 3.25Å; S12-E16 PolarHBondContact O-N 3.36Å
13	E	41.7	Very low	46.1	Very low	126 Å²	126	98.3 Å²	98.3	59%	0.589	49%	0.491	S	S	*	.	H	α-helix	trans	-74	-33.7	177	-70.2	-179.7	167.3	0	0	110.3	A9 E10 E15 E16 E17	A9-E13 WeakPolarHBondContact O-CG 3.44Å; A9-E13 PolarHBondContact O-N 3.27Å; E10-E13 PolarHBondContact O-N 2.55Å; E13-E15 VanDerWaalsContact C-N 3.26Å; E13-E15 PolarHBondContact O-N 3.33Å; E13-E16 WeakPolarHBondContact O-CA 3.13Å; E13-E16 WeakPolarHBondContact O-CB 3.39Å; E13-E16 PolarHBondContact O-N 2.86Å; E13-E17 PolarHBondContact O-N 3.47Å
14	E	39.9	Very low	47.1	Very low	158 Å²	158	97.7 Å²	97.7	74%	0.738	49%	0.487	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.5	-26.9	167.6	-73.9	-166.5	166.4	0	0	114	E10	E10-E14 PolarHBondContact O-N 2.84Å
15	E	42.8	Very low	48.1	Very low	105 Å²	105	99.9 Å²	99.9	49%	0.491	49%	0.491	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.2	-3.8	170.8	-98.5	-143.8	156.1	0	0	113.5	S12 E13 R23 K30	S12-E15 PolarHBondContact O-N 3.25Å; E13-E15 VanDerWaalsContact C-N 3.26Å; E13-E15 PolarHBondContact O-N 3.33Å; E15-R23 PolarHBondContact O-NE 3.1Å; E15-R23 PolarHBondContact O-NH2 3.44Å; E15-K30 IonicContact OE1-NZ 3.66Å; E15-K30 PolarHBondContact OE1-NZ 3.4Å
16	E	46.3	Very low	48.4	Very low	117 Å²	117	98.1 Å²	98.1	55%	0.547	48%	0.483	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91	-39.1	179.8	-75.5	-86.9	72.8	0	0	114.4	S12 E13 L18 R23	S12-E16 PolarHBondContact O-N 3.36Å; E13-E16 WeakPolarHBondContact O-CA 3.13Å; E13-E16 WeakPolarHBondContact O-CB 3.39Å; E13-E16 PolarHBondContact O-N 2.86Å; E16-L18 VanDerWaalsContact C-N 3.33Å; E16-L18 PolarHBondContact O-N 3.36Å; E16-R23 PolarHBondContact O-NH1 2.99Å; E16-R23 IonicContact OE1-CZ 2.78Å; E16-R23 IonicContact OE1-NH1 2.77Å; E16-R23 PolarHBondContact OE1-NH1 3.15Å; E16-R23 IonicContact OE1-NH2 2.72Å; E16-R23 PolarHBondContact OE1-NH2 2.93Å
17	E	47.7	Very low	48.8	Very low	99 Å²	99	100.9 Å²	100.9	46%	0.463	49%	0.49	S	S	.	.			trans	-69.7	-14.3	-168.4	-64.8	-154.3	107.4	0	0	116.7	E13 D19 G104	E13-E17 PolarHBondContact O-N 3.47Å; E17-D19 PolarHBondContact O-N 3.36Å; E17-G104 PolarHBondContact OE1-N 3.1Å; E17-G104 VanDerWaalsContact OE1-N 3.11Å
18	L	43.6	Very low	49.1	Very low	57 Å²	57	106.3 Å²	106.3	30%	0.298	51%	0.508	S	S	.	.	S	Bend	trans	-64.4	126.6	-175.8	-66.7	168.8	0	0	0	113.8	E16 R23 L26	E16-L18 VanDerWaalsContact C-N 3.33Å; E16-L18 PolarHBondContact O-N 3.36Å; L18-R23 HydrophobicContact CB-CB 4.16Å; L18-R23 HydrophobicContact CB-CG 3.93Å; L18-R23 VanDerWaalsContact O-CD 3.32Å; L18-R23 WeakPolarHBondContact O-CD 3.26Å; L18-L26 HydrophobicContact CD1-CD1 4.33Å; L18-L26 HydrophobicContact CD1-CD2 3.77Å
19	D	56.5	Low	49.2	Very low	85 Å²	85	108.2 Å²	108.2	46%	0.455	52%	0.52	S	S	.	.			trans	-48.7	151.1	176.9	162.5	60.8	0	0	0	113.2	E17 N21 E22 R23	E17-D19 PolarHBondContact O-N 3.36Å; D19-N21 PolarHBondContact O-N 2.83Å; D19-N21 WeakPolarHBondContact OD2-CA 3.4Å; D19-N21 VanDerWaalsContact OD2-CB 3.24Å; D19-N21 WeakPolarHBondContact OD2-CB 3.26Å; D19-N21 PolarHBondContact OD2-N 3.2Å; D19-N21 PolarHBondContact OD2-ND2 3.27Å; D19-E22 HydrophobicContact CB-CB 4.32Å; D19-E22 HydrophobicContact CB-CG 4.15Å; D19-E22 CarbonylContact O-C 3.58Å; D19-E22 WeakPolarHBondContact O-CA 3.24Å; D19-E22 PolarHBondContact O-N 2.7Å; D19-R23 WeakPolarHBondContact O-CB 3.41Å; D19-R23 PolarHBondContact O-N 2.82Å
20	V	52.4	Low	49.2	Very low	96 Å²	96	112.9 Å²	112.9	58%	0.582	53%	0.534	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57	-24.9	-178.3	-178.7	0	0	0	0	113.8	K24	V20-K24 WeakPolarHBondContact O-CB 3.35Å; V20-K24 WeakPolarHBondContact O-CD 3.37Å; V20-K24 WeakPolarHBondContact O-CG 3.24Å
21	N	57.7	Low	49.2	Very low	101 Å²	101	109.8 Å²	109.8	54%	0.54	53%	0.53	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87	-28.8	170.3	-60.2	-62	0	0	0	113.1	D19 K24 R25	D19-N21 PolarHBondContact O-N 2.83Å; D19-N21 WeakPolarHBondContact OD2-CA 3.4Å; D19-N21 VanDerWaalsContact OD2-CB 3.24Å; D19-N21 WeakPolarHBondContact OD2-CB 3.26Å; D19-N21 PolarHBondContact OD2-N 3.2Å; D19-N21 PolarHBondContact OD2-ND2 3.27Å; N21-K24 CarbonylContact O-C 3.48Å; N21-K24 WeakPolarHBondContact O-CB 3.5Å; N21-K24 PolarHBondContact O-N 2.85Å; N21-R25 WeakPolarHBondContact O-CG 3.11Å; N21-R25 PolarHBondContact O-N 2.23Å
22	E	57.3	Low	49.2	Very low	85 Å²	85	106.5 Å²	106.5	40%	0.397	53%	0.53	S	S	.	.	H	α-helix	trans	-80	-44.1	179	-59.1	-125.7	114.8	0	0	111.3	D19 K24 R25 L26	D19-E22 HydrophobicContact CB-CB 4.32Å; D19-E22 HydrophobicContact CB-CG 4.15Å; D19-E22 CarbonylContact O-C 3.58Å; D19-E22 WeakPolarHBondContact O-CA 3.24Å; D19-E22 PolarHBondContact O-N 2.7Å; E22-K24 PolarHBondContact O-N 2.98Å; E22-K24 VanDerWaalsContact O-N 3.17Å; E22-R25 CarbonylContact O-C 3.56Å; E22-R25 WeakPolarHBondContact O-CA 3.42Å; E22-R25 WeakPolarHBondContact O-CB 3.5Å; E22-R25 PolarHBondContact O-N 2.46Å; E22-R25 IonicContact OE1-NH1 3.7Å; E22-R25 PolarHBondContact OE1-NH1 3.34Å; E22-L26 PolarHBondContact O-N 3.06Å
23	R	59.9	Low	49	Very low	79 Å²	79	109.9 Å²	109.9	30%	0.298	55%	0.547	S	S	.	.	H	α-helix	trans	-57.3	-25.8	164.5	-126.4	160.8	176.3	-155.8	-15.6	112.1	E15 E16 L18 D19 K27	E15-R23 PolarHBondContact O-NE 3.1Å; E15-R23 PolarHBondContact O-NH2 3.44Å; E16-R23 PolarHBondContact O-NH1 2.99Å; E16-R23 IonicContact OE1-CZ 2.78Å; E16-R23 IonicContact OE1-NH1 2.77Å; E16-R23 PolarHBondContact OE1-NH1 3.15Å; E16-R23 IonicContact OE1-NH2 2.72Å; E16-R23 PolarHBondContact OE1-NH2 2.93Å; L18-R23 HydrophobicContact CB-CB 4.16Å; L18-R23 HydrophobicContact CB-CG 3.93Å; L18-R23 VanDerWaalsContact O-CD 3.32Å; L18-R23 WeakPolarHBondContact O-CD 3.26Å; D19-R23 WeakPolarHBondContact O-CB 3.41Å; D19-R23 PolarHBondContact O-N 2.82Å; R23-K27 VanDerWaalsContact O-CB 3.25Å; R23-K27 WeakPolarHBondContact O-CB 3.41Å; R23-K27 VanDerWaalsContact O-CG 3.31Å; R23-K27 WeakPolarHBondContact O-CG 3.36Å; R23-K27 PolarHBondContact O-N 2.85Å; R23-K27 VanDerWaalsContact O-N 3.16Å
24	K	58.7	Low	48.6	Very low	124 Å²	124	108.5 Å²	108.5	54%	0.539	55%	0.552	S	S	.	*	H	α-helix	trans	-80.5	-32.7	167.3	-81.2	172.2	-167.2	156.8	0	114	V20 N21 E22 K28	V20-K24 WeakPolarHBondContact O-CB 3.35Å; V20-K24 WeakPolarHBondContact O-CD 3.37Å; V20-K24 WeakPolarHBondContact O-CG 3.24Å; N21-K24 CarbonylContact O-C 3.48Å; N21-K24 WeakPolarHBondContact O-CB 3.5Å; N21-K24 PolarHBondContact O-N 2.85Å; E22-K24 PolarHBondContact O-N 2.98Å; E22-K24 VanDerWaalsContact O-N 3.17Å; K24-K28 WeakPolarHBondContact O-CB 3.23Å; K24-K28 PolarHBondContact O-N 2.95Å
25	R	58.7	Low	48.2	Very low	163 Å²	163	108.4 Å²	108.4	62%	0.615	56%	0.556	S	S	*	*	H	α-helix	trans	-69.6	-48.8	173	-82.1	173.8	161	177.3	-6.2	111	N21 E22 K27 K28 L29	N21-R25 WeakPolarHBondContact O-CG 3.11Å; N21-R25 PolarHBondContact O-N 2.23Å; E22-R25 CarbonylContact O-C 3.56Å; E22-R25 WeakPolarHBondContact O-CA 3.42Å; E22-R25 WeakPolarHBondContact O-CB 3.5Å; E22-R25 PolarHBondContact O-N 2.46Å; E22-R25 IonicContact OE1-NH1 3.7Å; E22-R25 PolarHBondContact OE1-NH1 3.34Å; R25-K27 PolarHBondContact O-N 2.92Å; R25-K28 CarbonylContact O-C 3.56Å; R25-K28 WeakPolarHBondContact O-CA 3.35Å; R25-K28 WeakPolarHBondContact O-CB 3.29Å; R25-K28 PolarHBondContact O-N 3Å; R25-L29 WeakPolarHBondContact O-CD1 3.36Å; R25-L29 PolarHBondContact O-N 2.89Å
26	L	49.9	Very low	47.6	Very low	74 Å²	74	108.3 Å²	108.3	39%	0.387	57%	0.567	S	S	.	*	H	α-helix	trans	-60.7	-42.4	172.6	-93.2	83.8	0	0	0	111.6	L18 E22 K28 L29 K30	L18-L26 HydrophobicContact CD1-CD1 4.33Å; L18-L26 HydrophobicContact CD1-CD2 3.77Å; E22-L26 PolarHBondContact O-N 3.06Å; L26-K28 VanDerWaalsContact C-N 3.29Å; L26-K28 PolarHBondContact O-N 3.45Å; L26-L29 PolarHBondContact O-N 3.13Å; L26-K30 WeakPolarHBondContact O-CB 3.32Å; L26-K30 PolarHBondContact O-N 3.05Å
27	K	54.2	Low	46.9	Very low	145 Å²	145	107.1 Å²	107.1	63%	0.63	57%	0.572	S	S	*	*	H	α-helix	trans	-64.7	-30.8	172.3	-80.4	174.2	175	162.1	0	113	R23 R25 A31	R23-K27 VanDerWaalsContact O-CB 3.25Å; R23-K27 WeakPolarHBondContact O-CB 3.41Å; R23-K27 VanDerWaalsContact O-CG 3.31Å; R23-K27 WeakPolarHBondContact O-CG 3.36Å; R23-K27 PolarHBondContact O-N 2.85Å; R23-K27 VanDerWaalsContact O-N 3.16Å; R25-K27 PolarHBondContact O-N 2.92Å; K27-A31 WeakPolarHBondContact O-CB 3.04Å; K27-A31 PolarHBondContact O-N 2.87Å; K27-A31 VanDerWaalsContact O-N 3.09Å
28	K	49.1	Very low	46.1	Very low	163 Å²	163	111.5 Å²	111.5	71%	0.709	59%	0.593	S	S	*	*	H	α-helix	trans	-71.6	-35.5	169.8	-88.7	-170.6	168.7	-171.3	0	113.5	K24 R25 L26 A32	K24-K28 WeakPolarHBondContact O-CB 3.23Å; K24-K28 PolarHBondContact O-N 2.95Å; R25-K28 CarbonylContact O-C 3.56Å; R25-K28 WeakPolarHBondContact O-CA 3.35Å; R25-K28 WeakPolarHBondContact O-CB 3.29Å; R25-K28 PolarHBondContact O-N 3Å; L26-K28 VanDerWaalsContact C-N 3.29Å; L26-K28 PolarHBondContact O-N 3.45Å; K28-A32 WeakPolarHBondContact O-CB 3.17Å; K28-A32 PolarHBondContact O-N 3Å
29	L	44.3	Very low	45.5	Very low	120 Å²	120	117.9 Å²	117.9	63%	0.628	62%	0.621	S	S	*	*	H	α-helix	trans	-73.2	-53.1	175.7	-94.6	73.5	0	0	0	111.5	R25 L26 A31 A32 V33	R25-L29 WeakPolarHBondContact O-CD1 3.36Å; R25-L29 PolarHBondContact O-N 2.89Å; L26-L29 PolarHBondContact O-N 3.13Å; L29-A31 PolarHBondContact O-N 3.02Å; L29-A32 PolarHBondContact O-N 3.25Å; L29-V33 WeakPolarHBondContact O-CG2 3.14Å; L29-V33 PolarHBondContact O-N 3.33Å
30	K	46.7	Very low	44.3	Very low	130 Å²	130	122 Å²	122	57%	0.565	64%	0.637	S	S	*	*	H	α-helix	trans	-55.8	-34.6	174.9	-77	-174.7	175.5	-179.1	0	111.6	E15 L26 S34	E15-K30 IonicContact OE1-NZ 3.66Å; E15-K30 PolarHBondContact OE1-NZ 3.4Å; L26-K30 WeakPolarHBondContact O-CB 3.32Å; L26-K30 PolarHBondContact O-N 3.05Å; K30-S34 WeakPolarHBondContact O-CB 3.34Å
31	A	42.5	Very low	43.3	Very low	62 Å²	62	127.2 Å²	127.2	51%	0.512	66%	0.655	S	S	.	*	H	α-helix	trans	-78.4	-33.6	174.2	0	0	0	0	0	114.4	K27 L29 V33 S34	K27-A31 WeakPolarHBondContact O-CB 3.04Å; K27-A31 PolarHBondContact O-N 2.87Å; K27-A31 VanDerWaalsContact O-N 3.09Å; L29-A31 PolarHBondContact O-N 3.02Å; A31-V33 PolarHBondContact O-N 3.5Å; A31-S34 PolarHBondContact O-N 3.01Å
32	A	39.7	Very low	42.4	Very low	87 Å²	87	129.9 Å²	129.9	72%	0.719	67%	0.67	S	S	*	*	H	α-helix	trans	-74.4	-7	177.5	0	0	0	0	0	114	K28 L29	K28-A32 WeakPolarHBondContact O-CB 3.17Å; K28-A32 PolarHBondContact O-N 3Å; L29-A32 PolarHBondContact O-N 3.25Å
33	V	38.8	Very low	41.6	Very low	131 Å²	131	129.8 Å²	129.8	79%	0.794	67%	0.672	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.9	3.5	-179.6	177.4	0	0	0	0	111.6	L29 A31	L29-V33 WeakPolarHBondContact O-CG2 3.14Å; L29-V33 PolarHBondContact O-N 3.33Å; A31-V33 PolarHBondContact O-N 3.5Å
34	S	34.5	Very low	40.7	Very low	98 Å²	98	133.7 Å²	133.7	69%	0.685	69%	0.694	S	S	*	*	S	Bend	trans	-135.5	7.9	-169	-172.1	0	0	0	0	115.9	K30 A31	K30-S34 WeakPolarHBondContact O-CB 3.34Å; A31-S34 PolarHBondContact O-N 3.01Å
35	D	30.8	Very low	40	Very low	155 Å²	155	135.6 Å²	135.6	83%	0.829	71%	0.705	S	S	*	*	S	Bend	trans	-148.9	72	-176.7	-159.2	6.7	0	0	0	113.6
36	S	30.4	Very low	39.2	Very low	103 Å²	103	134.7 Å²	134.7	72%	0.72	70%	0.701	S	S	*	*			trans	-160.9	131.6	158.6	-168.7	0	0	0	0	110.3
37	S	32.3	Very low	38.8	Very low	93 Å²	93	136.6 Å²	136.6	65%	0.65	71%	0.711	S	S	*	*			trans	35	102.6	150.2	55.6	0	0	0	0	117.1
38	E	30.6	Very low	38.5	Very low	191 Å²	191	138.9 Å²	138.9	89%	0.893	72%	0.716	S	S	*	*	S	Bend		33	117.4	68.8	-69.8	-165.9	165.1	0	0	113.6
39	E	31	Very low	38.5	Very low	190 Å²	190	137.9 Å²	137.9	89%	0.888	71%	0.713	S	S	*	*			trans	78.1	74	-172.1	-55.6	-171.9	-178.2	0	0	117
40	E	30.1	Very low	38.6	Very low	172 Å²	172	138 Å²	138	80%	0.804	71%	0.711	S	S	*	*			trans	175.3	80.8	142.7	-98.9	166.3	-164.2	0	0	112.5
41	E	31.3	Very low	38.5	Very low	205 Å²	205	138.5 Å²	138.5	96%	0.958	72%	0.719	S	S	*	*			trans	-84.2	-0.7	-174.6	-72.5	-171.3	135.8	0	0	116.4
42	D	40	Very low	38.5	Very low	158 Å²	158	142.8 Å²	142.8	85%	0.845	73%	0.726	S	S	*	*	S	Bend	trans	-101.5	-13.9	-169.1	-100.1	-38.5	0	0	0	116
43	D	41	Very low	38.7	Very low	83 Å²	83	146 Å²	146	44%	0.444	73%	0.731	S	S	.	*	S	Bend	trans	-108.4	-12.8	-171	-88.6	-59.9	0	0	0	116.1	R46 L47	D43-R46 WeakPolarHBondContact O-CB 3.39Å; D43-R46 PolarHBondContact O-N 2.92Å; D43-R46 IonicContact OD1-NH1 3.88Å; D43-R46 PolarHBondContact OD1-NH1 2.79Å; D43-L47 PolarHBondContact O-N 3.43Å
44	E	39.7	Very low	38.8	Very low	161 Å²	161	147 Å²	147	75%	0.752	73%	0.731	S	S	*	*	H	α-helix	trans	-70.5	-36	178.1	-75.1	-149.2	138.7	0	0	113.8	R46 L47 R48	E44-R46 PolarHBondContact O-N 2.89Å; E44-L47 PolarHBondContact O-N 2.94Å; E44-R48 PolarHBondContact O-N 3.31Å; E44-R48 VanDerWaalsContact O-N 3.12Å
45	E	43.5	Very low	39.1	Very low	164 Å²	164	148.9 Å²	148.9	77%	0.766	73%	0.732	S	S	*	*	H	α-helix	trans	-65.2	-28.8	177.2	-172.7	161.2	-140.1	0	0	111.2	R48 E49	E45-R48 CarbonylContact O-C 3.51Å; E45-R48 PolarHBondContact O-N 2.97Å; E45-E49 PolarHBondContact O-N 3.29Å
46	R	43.2	Very low	39.6	Very low	143 Å²	143	148 Å²	148	54%	0.54	73%	0.727	S	S	.	*	H	α-helix	trans	-70	-46.5	176.1	-176.3	-178.6	178.1	177.1	0.9	112.6	D43 E44 R48 E49 E50	D43-R46 WeakPolarHBondContact O-CB 3.39Å; D43-R46 PolarHBondContact O-N 2.92Å; D43-R46 IonicContact OD1-NH1 3.88Å; D43-R46 PolarHBondContact OD1-NH1 2.79Å; E44-R46 PolarHBondContact O-N 2.89Å; R46-R48 PolarHBondContact O-N 3.09Å; R46-E49 PolarHBondContact O-N 3.36Å; R46-E50 IonicContact NE-OE1 3.19Å; R46-E50 PolarHBondContact NE-OE1 3.19Å; R46-E50 PolarHBondContact O-N 2.88Å
47	L	40.6	Very low	39.9	Very low	115 Å²	115	149.9 Å²	149.9	60%	0.602	73%	0.73	S	S	*	*	H	α-helix	trans	-59.6	-31.1	171.5	-84.6	160.8	0	0	0	111.8	D43 E44 L51	D43-L47 PolarHBondContact O-N 3.43Å; E44-L47 PolarHBondContact O-N 2.94Å; L47-L51 WeakPolarHBondContact O-CB 3.21Å; L47-L51 PolarHBondContact O-N 3.28Å
48	R	48.1	Very low	40.6	Very low	193 Å²	193	151 Å²	151	73%	0.728	73%	0.728	S	S	*	*	H	α-helix	trans	-77.7	-14.2	173.6	-101.7	-180	171	-177.5	1.6	115.8	E44 E45 R46 K52	E44-R48 PolarHBondContact O-N 3.31Å; E44-R48 VanDerWaalsContact O-N 3.12Å; E45-R48 CarbonylContact O-C 3.51Å; E45-R48 PolarHBondContact O-N 2.97Å; R46-R48 PolarHBondContact O-N 3.09Å; R48-K52 PolarHBondContact O-NZ 2.94Å
49	E	50	Low	40.9	Very low	141 Å²	141	147.2 Å²	147.2	66%	0.659	72%	0.72	S	S	*	*	H	α-helix	trans	-87.8	-41.1	163.5	-71.9	-148	129.8	0	0	111.3	E45 R46 L51 K52	E45-E49 PolarHBondContact O-N 3.29Å; R46-E49 PolarHBondContact O-N 3.36Å; E49-L51 PolarHBondContact O-N 3.03Å; E49-K52 WeakPolarHBondContact O-CB 3.23Å; E49-K52 PolarHBondContact O-N 2.97Å
50	E	45.5	Very low	41.3	Very low	123 Å²	123	145.5 Å²	145.5	58%	0.575	72%	0.716	S	S	*	*	H	α-helix	trans	-69.5	-28.1	-177.6	-69.3	180	-165.4	0	0	113.2	R46 K52	R46-E50 IonicContact NE-OE1 3.19Å; R46-E50 PolarHBondContact NE-OE1 3.19Å; R46-E50 PolarHBondContact O-N 2.88Å; E50-K52 VanDerWaalsContact C-N 3.29Å; E50-K52 PolarHBondContact O-N 3.34Å
51	L	44.9	Very low	41.6	Very low	141 Å²	141	146.1 Å²	146.1	74%	0.738	72%	0.719	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.5	1.8	174.6	-133.5	78.7	0	0	0	115	L47 E49	L47-L51 WeakPolarHBondContact O-CB 3.21Å; L47-L51 PolarHBondContact O-N 3.28Å; E49-L51 PolarHBondContact O-N 3.03Å
52	K	41.6	Very low	41.7	Very low	151 Å²	151	145.4 Å²	145.4	66%	0.657	72%	0.715	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.5	-11.8	-174.2	-102.8	-171.7	-160.5	81.3	0	116	R48 E49 E50 L54	R48-K52 PolarHBondContact O-NZ 2.94Å; E49-K52 WeakPolarHBondContact O-CB 3.23Å; E49-K52 PolarHBondContact O-N 2.97Å; E50-K52 VanDerWaalsContact C-N 3.29Å; E50-K52 PolarHBondContact O-N 3.34Å; K52-L54 VanDerWaalsContact C-N 3.35Å
53	D	45	Very low	41.5	Very low	156 Å²	156	145.5 Å²	145.5	83%	0.834	72%	0.716	S	S	*	*	S	Bend	trans	-96.9	26.1	-177.9	-72.8	-15.7	0	0	0	112.3
54	L	41.1	Very low	41	Very low	151 Å²	151	147 Å²	147	79%	0.791	72%	0.724	S	S	*	*			trans	-125.6	24.4	-170.8	-146.8	79.3	0	0	0	115.9	K52	K52-L54 VanDerWaalsContact C-N 3.35Å
55	I	40.8	Very low	40.7	Very low	138 Å²	138	141.8 Å²	141.8	71%	0.708	71%	0.713	S	S	*	*			trans	-129.4	120.8	166.2	-58.5	-178.8	0	0	0	108.2	D57	I55-D57 WeakPolarHBondContact CG2-OD1 3.45Å; I55-D57 PolarHBondContact O-N 3.36Å
56	D	40	Very low	40	Very low	135 Å²	135	140.2 Å²	140.2	72%	0.722	72%	0.72	S	S	*	*			trans	-97.8	69.5	-174.9	-172.2	36.6	0	0	0	111.4	N58	D56-N58 PolarHBondContact O-N 2.95Å; D56-N58 PolarHBondContact OD1-ND2 3.07Å; D56-N58 PolarHBondContact OD2-ND2 3.15Å; D56-N58 VanDerWaalsContact OD2-ND2 3.08Å
57	D	37.6	Very low	39.5	Very low	144 Å²	144	136.5 Å²	136.5	77%	0.77	73%	0.726	S	S	*	*			trans	-73.8	63.8	176.9	-69.4	-30.5	0	0	0	111.7	I55 P59	I55-D57 WeakPolarHBondContact CG2-OD1 3.45Å; I55-D57 PolarHBondContact O-N 3.36Å; D57-P59 WeakPolarHBondContact O-CD 3.48Å
58	N	46.1	Very low	39.1	Very low	115 Å²	115	141.2 Å²	141.2	62%	0.615	74%	0.738	S	S	*	*	P	Polyproline II helix	trans	-74	118	165	-81.8	-60.1	0	0	0	109.2	D56 I60	D56-N58 PolarHBondContact O-N 2.95Å; D56-N58 PolarHBondContact OD1-ND2 3.07Å; D56-N58 PolarHBondContact OD2-ND2 3.15Å; D56-N58 VanDerWaalsContact OD2-ND2 3.08Å; N58-I60 PolarHBondContact O-N 3.32Å
59	P	37.8	Very low	38.2	Very low	112 Å²	112	139.1 Å²	139.1	73%	0.727	74%	0.741	S	S	*	*	P	Polyproline II helix	trans	-69.4	130.8	175.2	29.2	-33.5	0	0	0	109.9	D57 E61	D57-P59 WeakPolarHBondContact O-CD 3.48Å; P59-E61 PolarHBondContact O-N 3.19Å
60	I	39.4	Very low	37.3	Very low	155 Å²	155	137.4 Å²	137.4	80%	0.795	75%	0.745	S	S	*	*	P	Polyproline II helix	trans	-72.1	121.2	169.4	-68.3	175.1	0	0	0	108.1	N58 E62	N58-I60 PolarHBondContact O-N 3.32Å; I60-E62 PolarHBondContact O-N 3.22Å
61	E	35.6	Very low	36.6	Very low	185 Å²	185	139.3 Å²	139.3	86%	0.864	76%	0.758	S	S	*	*			trans	-78.2	113.5	171.6	-62.7	178.8	140.1	0	0	108.8	P59	P59-E61 PolarHBondContact O-N 3.19Å
62	E	34.6	Very low	35.9	Very low	189 Å²	189	136.2 Å²	136.2	88%	0.883	76%	0.761	S	S	*	*			trans	-87.4	122.7	166	-67.6	-164.5	142.7	0	0	109.6	I60	I60-E62 PolarHBondContact O-N 3.22Å
63	D	35.7	Very low	35.4	Very low	161 Å²	161	136.2 Å²	136.2	86%	0.861	77%	0.773	S	S	*	*			trans	-107.5	114.3	-168.1	-170.2	19.6	0	0	0	111.9	G65	D63-G65 PolarHBondContact O-N 2.79Å
64	D	30.9	Very low	34.8	Very low	115 Å²	115	132.5 Å²	132.5	62%	0.615	77%	0.772	S	S	*	*			trans	-103.4	83	-165.7	-162.2	21.6	0	0	0	110.9
65	G	32	Very low	34.3	Very low	51 Å²	51	130.9 Å²	130.9	53%	0.526	77%	0.773	S	S	.	*			trans	-119.9	4.5	-142.4	0	0	0	0	0	122.1	D63	D63-G65 PolarHBondContact O-N 2.79Å
66	S	30.4	Very low	33.8	Very low	131 Å²	131	127.2 Å²	127.2	92%	0.916	77%	0.77	S	S	*	*			trans	68	163.8	169.9	83.6	0	0	0	0	120.4
67	G	31.8	Very low	33.3	Very low	65 Å²	65	129.9 Å²	129.9	67%	0.67	78%	0.775	S	S	*	*			trans	138.9	68.3	152.3	0	0	0	0	0	122
68	Y	31.8	Very low	32.8	Very low	214 Å²	214	131.7 Å²	131.7	84%	0.839	78%	0.776	S	S	*	*			trans	45.1	130	146.9	-68.5	-83.6	0	0	0	125
69	D	29.9	Very low	32.2	Very low	149 Å²	149	137.6 Å²	137.6	80%	0.797	79%	0.79	S	S	*	*			trans	78.6	136.6	136.7	-67.6	-20.2	0	0	0	125.5
70	S	31	Very low	31.7	Very low	105 Å²	105	142 Å²	142	73%	0.734	80%	0.797	S	S	*	*			trans	84.3	97.3	145.8	-164.1	0	0	0	0	121.9
71	D	29.7	Very low	31.1	Very low	162 Å²	162	141.7 Å²	141.7	87%	0.866	79%	0.79	S	S	*	*			trans	41.3	113.2	132.7	-62.5	-18.3	0	0	0	121.4
72	G	31.7	Very low	30.7	Very low	77 Å²	77	138.9 Å²	138.9	79%	0.794	78%	0.777	S	S	*	*			trans	-152.3	8.5	179.2	0	0	0	0	0	120.1
73	V	30.4	Very low	30.3	Very low	150 Å²	150	137 Å²	137	91%	0.909	77%	0.768	S	S	*	*			trans	31.1	103	164.9	-171.7	0	0	0	0	118.9
74	G	31.7	Very low	30	Very low	79 Å²	79	135.7 Å²	135.7	81%	0.814	76%	0.761	S	S	*	*			trans	-149.3	22.2	-177	0	0	0	0	0	120.8
75	S	30.5	Very low	29.8	Very low	116 Å²	116	137.5 Å²	137.5	81%	0.811	77%	0.771	S	S	*	*			trans	21.4	119.2	164.6	-169.7	0	0	0	0	120.9
76	G	30.7	Very low	29.8	Very low	62 Å²	62	142.8 Å²	142.8	64%	0.639	79%	0.787	S	S	*	*			cis	120.2	155.6	-5.3	0	0	0	0	0	116.3
77	K	29.6	Very low	29.8	Very low	190 Å²	190	144.4 Å²	144.4	83%	0.826	79%	0.785	S	S	*	*			trans	78	147.2	162.8	-61.7	161.3	-171.7	169.4	0	116.4
78	K	28.1	Very low	30	Very low	182 Å²	182	146.1 Å²	146.1	79%	0.791	78%	0.778	S	S	*	*			cis	-159.3	154.5	-1.7	-103.4	159.9	176.9	-172.1	0	106.4
79	R	32.5	Very low	30.5	Very low	240 Å²	240	143.2 Å²	143.2	91%	0.906	78%	0.777	S	S	*	*			cis	85.8	88.4	27.4	-157.1	-174.9	-165.5	-162.3	5.4	116.8
80	K	27.9	Very low	31.4	Very low	203 Å²	203	144.6 Å²	144.6	88%	0.883	77%	0.771	S	S	*	*			trans	178.2	169.3	155.5	-109.8	-161.5	170.2	-161.8	0	109.4
81	K	26.5	Very low	32.9	Very low	150 Å²	150	143.9 Å²	143.9	65%	0.652	76%	0.759	S	S	*	*				178	135.8	-51.9	-174.6	-137.5	177.2	-137.5	0	108
82	H	27.7	Very low	34.4	Very low	125 Å²	125	142.8 Å²	142.8	58%	0.579	75%	0.748	S	S	*	*			trans	82.7	156.3	156.4	-124.3	-127	0	0	0	119.5
83	E	26.9	Very low	35.8	Very low	151 Å²	151	144 Å²	144	71%	0.706	74%	0.736	S	S	*	*			trans	60.6	147	173.4	-65	120.5	-128	0	0	116.6
84	D	27.6	Very low	37.7	Very low	133 Å²	133	142.8 Å²	142.8	71%	0.711	73%	0.725	S	S	*	*			cis	-167.3	170.6	-34.9	-98.7	-25.8	0	0	0	107.4
85	D	28	Very low	39.6	Very low	152 Å²	152	142 Å²	142	81%	0.813	70%	0.702	S	S	*	*			trans	68.6	159.6	164.1	-59.9	-31.9	0	0	0	121.9
86	D	30.6	Very low	41.6	Very low	162 Å²	162	139.8 Å²	139.8	87%	0.866	68%	0.676	S	S	*	*			trans	64.5	116.8	168.8	-68.1	-16.5	0	0	0	121.2
87	L	32.2	Very low	43.7	Very low	166 Å²	166	140.9 Å²	140.9	87%	0.869	67%	0.668	S	S	*	*			trans	-69.8	136.2	167.2	-59.9	156	0	0	0	110.2
88	D	34.3	Very low	45.7	Very low	101 Å²	101	136.1 Å²	136.1	54%	0.54	65%	0.651	S	S	.	*			trans	-125.4	92.4	173	-159.9	5.5	0	0	0	110.4	R90	D88-R90 VanDerWaalsContact CG-CZ 3.45Å; D88-R90 VanDerWaalsContact CG-NH2 3.34Å; D88-R90 PolarHBondContact O-N 3.16Å; D88-R90 IonicContact OD1-CZ 3.24Å; D88-R90 IonicContact OD1-NE 2.7Å; D88-R90 PolarHBondContact OD1-NE 3.37Å; D88-R90 IonicContact OD1-NH1 2.73Å; D88-R90 PolarHBondContact OD1-NH1 2.85Å; D88-R90 IonicContact OD1-NH2 2.7Å; D88-R90 PolarHBondContact OD1-NH2 2.67Å; D88-R90 IonicContact OD2-CZ 2.79Å; D88-R90 IonicContact OD2-NH1 3.73Å; D88-R90 PolarHBondContact OD2-NH1 2.89Å; D88-R90 IonicContact OD2-NH2 2.82Å; D88-R90 PolarHBondContact OD2-NH2 3.36Å
89	D	42.9	Very low	47.7	Very low	152 Å²	152	130 Å²	130	81%	0.813	63%	0.626	S	S	*	*			trans	-68.6	76.6	179.8	-59.7	-53.2	0	0	0	111.5
90	R	48.9	Very low	49.9	Very low	178 Å²	178	120.4 Å²	120.4	67%	0.672	59%	0.592	S	S	*	*			trans	-133.5	107.9	174.6	-65	-164.3	-162.4	106.2	28.7	111.5	D88 E92	D88-R90 VanDerWaalsContact CG-CZ 3.45Å; D88-R90 VanDerWaalsContact CG-NH2 3.34Å; D88-R90 PolarHBondContact O-N 3.16Å; D88-R90 IonicContact OD1-CZ 3.24Å; D88-R90 IonicContact OD1-NE 2.7Å; D88-R90 PolarHBondContact OD1-NE 3.37Å; D88-R90 IonicContact OD1-NH1 2.73Å; D88-R90 PolarHBondContact OD1-NH1 2.85Å; D88-R90 IonicContact OD1-NH2 2.7Å; D88-R90 PolarHBondContact OD1-NH2 2.67Å; D88-R90 IonicContact OD2-CZ 2.79Å; D88-R90 IonicContact OD2-NH1 3.73Å; D88-R90 PolarHBondContact OD2-NH1 2.89Å; D88-R90 IonicContact OD2-NH2 2.82Å; D88-R90 PolarHBondContact OD2-NH2 3.36Å; R90-E92 PolarHBondContact O-N 2.78Å
91	L	62.4	Low	52	Low	90 Å²	90	117.5 Å²	117.5	47%	0.471	58%	0.581	S	S	.	*			trans	-44	128.3	151.8	-64.7	162.7	0	0	0	109.1	D95 Y96 I99	L91-D95 WeakPolarHBondContact CA-OD2 3.48Å; L91-D95 HydrophobicContact CB-CB 3.74Å; L91-D95 HydrophobicContact CD2-CB 3.83Å; L91-D95 HydrophobicContact CG-CB 4.38Å; L91-Y96 HydrophobicContact CB-CD2 4.38Å; L91-Y96 HydrophobicContact CB-CE2 4.17Å; L91-I99 HydrophobicContact CD1-CD1 3.7Å; L91-I99 HydrophobicContact CD2-CD1 4.14Å; L91-I99 HydrophobicContact CG-CD1 4.46Å
92	E	61.3	Low	53.9	Low	139 Å²	139	115 Å²	115	65%	0.65	58%	0.575	S	S	*	*			trans	-70.8	167.7	179.2	-59.4	-161.5	154.2	0	0	110.5	R90 D94 D95 Y96	R90-E92 PolarHBondContact O-N 2.78Å; E92-D94 PolarHBondContact O-N 3.17Å; E92-D95 PolarHBondContact N-OD2 3.38Å; E92-D95 WeakPolarHBondContact O-CB 3.34Å; E92-D95 PolarHBondContact O-N 2.92Å; E92-Y96 WeakPolarHBondContact O-CD2 3.45Å; E92-Y96 PolarHBondContact O-N 2.88Å
93	D	61.4	Low	55.6	Low	102 Å²	102	114 Å²	114	55%	0.545	57%	0.574	S	S	.	*	H	α-helix	trans	-61.5	-27.4	177.6	-94.6	-57.4	0	0	0	111.4	Y96 D97 R109	D93-Y96 PolarHBondContact O-N 2.85Å; D93-D97 PolarHBondContact O-N 3.41Å; D93-R109 IonicContact OD1-CZ 3.36Å; D93-R109 IonicContact OD1-NH1 3.7Å; D93-R109 PolarHBondContact OD1-NH1 2.94Å
94	D	69.1	Low	56.9	Low	126 Å²	126	109.8 Å²	109.8	67%	0.674	57%	0.571	S	S	*	*	H	α-helix	trans	-69.7	-34.3	172.1	-69	17.6	0	0	0	112.1	E92 D97 L98	E92-D94 PolarHBondContact O-N 3.17Å; D94-D97 PolarHBondContact O-N 3.49Å; D94-L98 WeakPolarHBondContact O-CB 3.5Å; D94-L98 PolarHBondContact O-N 2.82Å
95	D	72.3	Confident	58.5	Low	61 Å²	61	108.3 Å²	108.3	33%	0.326	57%	0.566	S	S	.	*	H	α-helix	trans	-71.6	-35.9	171.9	-66.6	-48	0	0	0	111.2	L91 E92 D97 L98 I99	L91-D95 WeakPolarHBondContact CA-OD2 3.48Å; L91-D95 HydrophobicContact CB-CB 3.74Å; L91-D95 HydrophobicContact CD2-CB 3.83Å; L91-D95 HydrophobicContact CG-CB 4.38Å; E92-D95 PolarHBondContact N-OD2 3.38Å; E92-D95 WeakPolarHBondContact O-CB 3.34Å; E92-D95 PolarHBondContact O-N 2.92Å; D95-D97 VanDerWaalsContact C-N 3.32Å; D95-L98 PolarHBondContact O-N 3.13Å; D95-I99 WeakPolarHBondContact O-CB 3.38Å; D95-I99 WeakPolarHBondContact O-CD1 3.47Å; D95-I99 WeakPolarHBondContact O-CG1 3.19Å; D95-I99 PolarHBondContact O-N 3.09Å
96	Y	73.6	Confident	60.3	Low	70 Å²	70	109.2 Å²	109.2	28%	0.275	56%	0.563	S	S	.	*	H	α-helix	trans	-64.7	-37.4	171.4	-85.9	-75.2	0	0	0	111.8	L91 E92 D93 E100 V107 R109	L91-Y96 HydrophobicContact CB-CD2 4.38Å; L91-Y96 HydrophobicContact CB-CE2 4.17Å; E92-Y96 WeakPolarHBondContact O-CD2 3.45Å; E92-Y96 PolarHBondContact O-N 2.88Å; D93-Y96 PolarHBondContact O-N 2.85Å; Y96-E100 VanDerWaalsContact O-CB 3.32Å; Y96-E100 WeakPolarHBondContact O-CB 3.19Å; Y96-E100 WeakPolarHBondContact O-CG 3.4Å; Y96-E100 PolarHBondContact O-N 3.17Å; Y96-V107 HydrophobicContact CD1-CG1 4.07Å; Y96-V107 HydrophobicContact CE1-CG1 3.98Å; Y96-R109 HydrophobicContact CD1-CG 3.99Å; Y96-R109 HydrophobicContact CE1-CG 4.39Å; Y96-R109 HydrophobicContact CG-CG 4.33Å
97	D	73.8	Confident	61.9	Low	86 Å²	86	103.6 Å²	103.6	46%	0.46	53%	0.534	S	S	.	.	H	α-helix	trans	-65	-43.9	171.4	-76.7	13	0	0	0	110.2	D93 D94 D95 I99 E100 E101 R109	D93-D97 PolarHBondContact O-N 3.41Å; D94-D97 PolarHBondContact O-N 3.49Å; D95-D97 VanDerWaalsContact C-N 3.32Å; D97-I99 VanDerWaalsContact C-N 3.33Å; D97-I99 PolarHBondContact O-N 2.81Å; D97-E100 CarbonylContact O-C 3.54Å; D97-E100 PolarHBondContact O-N 2.86Å; D97-E101 WeakPolarHBondContact O-CB 3.47Å; D97-E101 PolarHBondContact O-N 3.16Å; D97-R109 IonicContact OD1-CZ 3.83Å; D97-R109 IonicContact OD1-NH1 2.9Å; D97-R109 PolarHBondContact OD1-NH1 3.39Å; D97-R109 VanDerWaalsContact OD1-NH1 3.14Å; D97-R109 IonicContact OD1-NH2 2.62Å; D97-R109 PolarHBondContact OD1-NH2 2.75Å
98	L	71.3	Confident	63	Low	89 Å²	89	102.1 Å²	102.1	47%	0.466	52%	0.523	S	S	.	.	H	α-helix	trans	-64.1	-32.6	177.3	-153.3	77.2	0	0	0	113.4	D94 D95 E101 N102	D94-L98 WeakPolarHBondContact O-CB 3.5Å; D94-L98 PolarHBondContact O-N 2.82Å; D95-L98 PolarHBondContact O-N 3.13Å; L98-E101 PolarHBondContact O-N 3.39Å; L98-N102 VanDerWaalsContact O-CB 3.28Å; L98-N102 WeakPolarHBondContact O-CB 3.15Å; L98-N102 VanDerWaalsContact O-CG 3.22Å; L98-N102 PolarHBondContact O-N 2.54Å; L98-N102 PolarHBondContact O-ND2 3.04Å
99	I	71	Confident	64	Low	53 Å²	53	101.9 Å²	101.9	27%	0.272	51%	0.514	S	S	.	.	H	α-helix	trans	-84.3	-29.1	176.3	-63	163.7	0	0	0	111.3	L91 D95 D97 L103 V107	L91-I99 HydrophobicContact CD1-CD1 3.7Å; L91-I99 HydrophobicContact CD2-CD1 4.14Å; L91-I99 HydrophobicContact CG-CD1 4.46Å; D95-I99 WeakPolarHBondContact O-CB 3.38Å; D95-I99 WeakPolarHBondContact O-CD1 3.47Å; D95-I99 WeakPolarHBondContact O-CG1 3.19Å; D95-I99 PolarHBondContact O-N 3.09Å; D97-I99 VanDerWaalsContact C-N 3.33Å; D97-I99 PolarHBondContact O-N 2.81Å; I99-L103 HydrophobicContact CG2-CD1 3.51Å; I99-L103 HydrophobicContact CG2-CG 4.08Å; I99-L103 WeakPolarHBondContact O-CB 3.3Å; I99-L103 WeakPolarHBondContact O-CG 3.35Å; I99-L103 PolarHBondContact O-N 3.03Å; I99-V107 HydrophobicContact CG2-CG2 3.88Å
100	E	77.4	Confident	64	Low	40 Å²	40	104.4 Å²	104.4	19%	0.187	51%	0.512	C	S	.	.	H	α-helix	trans	-68.1	-24.7	165.4	-77.8	-177.4	-137.4	0	0	111.9	Y96 D97 K106 V107 R109	Y96-E100 VanDerWaalsContact O-CB 3.32Å; Y96-E100 WeakPolarHBondContact O-CB 3.19Å; Y96-E100 WeakPolarHBondContact O-CG 3.4Å; Y96-E100 PolarHBondContact O-N 3.17Å; D97-E100 CarbonylContact O-C 3.54Å; D97-E100 PolarHBondContact O-N 2.86Å; E100-K106 HydrophobicContact CG-CG 4.29Å; E100-K106 WeakPolarHBondContact OE2-CE 3.2Å; E100-K106 WeakPolarHBondContact OE2-CG 3.31Å; E100-V107 HydrophobicContact CG-CB 4.05Å; E100-V107 HydrophobicContact CG-CG2 4.05Å; E100-R109 VanDerWaalsContact CD-NH2 3.33Å; E100-R109 IonicContact OE1-CZ 3.67Å; E100-R109 VanDerWaalsContact OE1-CZ 3.24Å; E100-R109 IonicContact OE1-NE 3.32Å; E100-R109 PolarHBondContact OE1-NE 3.12Å; E100-R109 IonicContact OE1-NH2 2.74Å; E100-R109 PolarHBondContact OE1-NH2 3.48Å; E100-R109 IonicContact OE2-NH2 2.78Å
101	E	71.9	Confident	63.4	Low	141 Å²	141	105.4 Å²	105.4	66%	0.659	52%	0.522	S	S	*	.	H	α-helix	trans	-82.9	-43.3	175.3	-164.5	159.7	-128.3	0	0	112.4	D97 L98	D97-E101 WeakPolarHBondContact O-CB 3.47Å; D97-E101 PolarHBondContact O-N 3.16Å; L98-E101 PolarHBondContact O-N 3.39Å
102	N	67.3	Low	62.2	Low	99 Å²	99	112.9 Å²	112.9	53%	0.529	54%	0.543	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.7	5.3	-178	-69.1	-24.7	0	0	0	116.2	L98	L98-N102 VanDerWaalsContact O-CB 3.28Å; L98-N102 WeakPolarHBondContact O-CB 3.15Å; L98-N102 VanDerWaalsContact O-CG 3.22Å; L98-N102 PolarHBondContact O-N 2.54Å; L98-N102 PolarHBondContact O-ND2 3.04Å
103	L	62.7	Low	60.8	Low	104 Å²	104	116 Å²	116	55%	0.545	56%	0.555	S	S	.	*	T	Hydrogen-bonded Turn	trans	-124.6	-3.8	176.6	-67.8	-179.2	0	0	0	113.6	I99 V105 V107	I99-L103 HydrophobicContact CG2-CD1 3.51Å; I99-L103 HydrophobicContact CG2-CG 4.08Å; I99-L103 WeakPolarHBondContact O-CB 3.3Å; I99-L103 WeakPolarHBondContact O-CG 3.35Å; I99-L103 PolarHBondContact O-N 3.03Å; L103-V105 WeakPolarHBondContact O-CG2 3.22Å; L103-V105 PolarHBondContact O-N 2.95Å; L103-V107 HydrophobicContact CD1-CG2 4.5Å
104	G	54	Low	59.4	Low	62 Å²	62	121 Å²	121	64%	0.639	57%	0.572	S	S	*	*	S	Bend	trans	55	6.6	-172	0	0	0	0	0	116.1	E17	E17-G104 PolarHBondContact OE1-N 3.1Å; E17-G104 VanDerWaalsContact OE1-N 3.11Å
105	V	62.5	Low	57.6	Low	101 Å²	101	126.4 Å²	126.4	61%	0.612	58%	0.583	S	S	*	*	S	Bend	trans	-132	128.4	-169.3	173.4	0	0	0	0	109.7	L103 V107	L103-V105 WeakPolarHBondContact O-CG2 3.22Å; L103-V105 PolarHBondContact O-N 2.95Å; V105-V107 PolarHBondContact O-N 3.4Å; V105-V107 VanDerWaalsContact O-N 3.08Å
106	K	66.4	Low	55.6	Low	172 Å²	172	131.5 Å²	131.5	75%	0.748	61%	0.609	S	S	*	*			trans	-71	107.3	-172.1	-147.1	175	-169.5	172.3	0	112.5	E100 E108	E100-K106 HydrophobicContact CG-CG 4.29Å; E100-K106 WeakPolarHBondContact OE2-CE 3.2Å; E100-K106 WeakPolarHBondContact OE2-CG 3.31Å; K106-E108 PolarHBondContact O-N 2.89Å
107	V	62.9	Low	53.6	Low	44 Å²	44	140.3 Å²	140.3	27%	0.267	64%	0.642	S	S	.	*			trans	-65.4	128.4	-177.7	-176.5	0	0	0	0	111	Y96 I99 E100 L103 V105 R109	Y96-V107 HydrophobicContact CD1-CG1 4.07Å; Y96-V107 HydrophobicContact CE1-CG1 3.98Å; I99-V107 HydrophobicContact CG2-CG2 3.88Å; E100-V107 HydrophobicContact CG-CB 4.05Å; E100-V107 HydrophobicContact CG-CG2 4.05Å; L103-V107 HydrophobicContact CD1-CG2 4.5Å; V105-V107 PolarHBondContact O-N 3.4Å; V105-V107 VanDerWaalsContact O-N 3.08Å; V107-R109 PolarHBondContact O-N 3.29Å
108	E	55.3	Low	51.5	Low	134 Å²	134	146.9 Å²	146.9	63%	0.626	66%	0.661	S	S	*	*			trans	-75.6	94.9	-179.7	-166.5	-178.1	-121.2	0	0	110.6	K106 R110	K106-E108 PolarHBondContact O-N 2.89Å; E108-R110 HydrophobicContact CG-CG 4.38Å; E108-R110 WeakPolarHBondContact O-CG 3.34Å; E108-R110 PolarHBondContact O-N 3.41Å; E108-R110 IonicContact OE2-CZ 2.77Å; E108-R110 IonicContact OE2-NE 2.74Å; E108-R110 PolarHBondContact OE2-NE 3.03Å; E108-R110 IonicContact OE2-NH2 3.86Å; E108-R110 PolarHBondContact OE2-NH2 2.97Å
109	R	56.4	Low	49.7	Very low	97 Å²	97	149.2 Å²	149.2	37%	0.366	67%	0.672	S	S	.	*			trans	-63.7	86.9	-178	-56.7	-167.2	-160.3	-162.8	3.6	112.6	D93 Y96 D97 E100 V107 K111	D93-R109 IonicContact OD1-CZ 3.36Å; D93-R109 IonicContact OD1-NH1 3.7Å; D93-R109 PolarHBondContact OD1-NH1 2.94Å; Y96-R109 HydrophobicContact CD1-CG 3.99Å; Y96-R109 HydrophobicContact CE1-CG 4.39Å; Y96-R109 HydrophobicContact CG-CG 4.33Å; D97-R109 IonicContact OD1-CZ 3.83Å; D97-R109 IonicContact OD1-NH1 2.9Å; D97-R109 PolarHBondContact OD1-NH1 3.39Å; D97-R109 VanDerWaalsContact OD1-NH1 3.14Å; D97-R109 IonicContact OD1-NH2 2.62Å; D97-R109 PolarHBondContact OD1-NH2 2.75Å; E100-R109 VanDerWaalsContact CD-NH2 3.33Å; E100-R109 IonicContact OE1-CZ 3.67Å; E100-R109 VanDerWaalsContact OE1-CZ 3.24Å; E100-R109 IonicContact OE1-NE 3.32Å; E100-R109 PolarHBondContact OE1-NE 3.12Å; E100-R109 IonicContact OE1-NH2 2.74Å; E100-R109 PolarHBondContact OE1-NH2 3.48Å; E100-R109 IonicContact OE2-NH2 2.78Å; V107-R109 PolarHBondContact O-N 3.29Å; R109-K111 PolarHBondContact O-N 2.95Å
110	R	42.1	Very low	47.7	Very low	204 Å²	204	154.7 Å²	154.7	77%	0.77	70%	0.696	S	S	*	*			trans	-80.4	104.5	-167.9	-84.2	172.6	177.8	-169.9	1	115.1	E108 R112	E108-R110 HydrophobicContact CG-CG 4.38Å; E108-R110 WeakPolarHBondContact O-CG 3.34Å; E108-R110 PolarHBondContact O-N 3.41Å; E108-R110 IonicContact OE2-CZ 2.77Å; E108-R110 IonicContact OE2-NE 2.74Å; E108-R110 PolarHBondContact OE2-NE 3.03Å; E108-R110 IonicContact OE2-NH2 3.86Å; E108-R110 PolarHBondContact OE2-NH2 2.97Å; R110-R112 PolarHBondContact O-N 3.16Å
111	K	37	Very low	45.6	Very low	200 Å²	200	158.2 Å²	158.2	87%	0.87	72%	0.716	S	S	*	*			trans	-89.8	103.1	172.2	-80.7	173.1	175.9	161.9	0	113.9	R109	R109-K111 PolarHBondContact O-N 2.95Å
112	R	36.1	Very low	43.8	Very low	246 Å²	246	157.1 Å²	157.1	93%	0.928	72%	0.715	S	S	*	*			trans	71.3	140.9	157.1	-86.1	-177.2	164.9	-175.3	-3.7	121.2	R110	R110-R112 PolarHBondContact O-N 3.16Å
113	F	32	Very low	42.2	Very low	204 Å²	204	160.7 Å²	160.7	90%	0.895	73%	0.729	S	S	*	*			trans	-68.1	143.1	-175	-54.3	-100.2	0	0	0	117.2
114	K	33.3	Very low	40.8	Very low	209 Å²	209	160 Å²	160	91%	0.909	73%	0.732	S	S	*	*				-170.6	115.5	125.4	-108.4	163.4	-175.3	168.3	0	115.7
115	R	30.8	Very low	39.7	Very low	239 Å²	239	164.7 Å²	164.7	90%	0.902	74%	0.743	S	S	*	*			trans	10.1	123.1	157.6	-70.1	-179.1	169.4	170.6	-3.2	121.2
116	L	30	Very low	38.3	Very low	167 Å²	167	163.7 Å²	163.7	87%	0.874	75%	0.753	S	S	*	*			trans	22.4	122	142.6	-80.7	73.8	0	0	0	119.6
117	R	31.1	Very low	36.6	Very low	256 Å²	256	164.5 Å²	164.5	97%	0.966	76%	0.759	S	S	*	*				-161.1	154	114.6	-114.4	177.1	178.4	-155.6	-4.4	114.6
118	R	29.8	Very low	35.1	Very low	224 Å²	224	169.9 Å²	169.9	85%	0.845	78%	0.781	S	S	*	*			trans	-61.6	146.8	-173.4	-75.5	176.3	170.8	175	-4.7	116.5
119	I	32.9	Very low	33.9	Very low	137 Å²	137	170.6 Å²	170.6	70%	0.703	79%	0.785	S	S	*	*				53.3	120.4	128.3	-54.7	166.2	0	0	0	118.3
120	H	29.9	Very low	32.7	Very low	168 Å²	168	174.4 Å²	174.4	78%	0.778	81%	0.806	S	S	*	*				-169.6	175.9	102.9	-155.9	13.6	0	0	0	111.4
121	D	33.6	Very low	32	Very low	115 Å²	115	170.3 Å²	170.3	62%	0.615	80%	0.804	S	S	*	*			trans	-123.6	161.5	-152.6	-47.3	-88.1	0	0	0	111.9
122	N	33	Very low	32	Very low	118 Å²	118	168 Å²	168	63%	0.631	80%	0.801	S	S	*	*				158.6	137.2	128	-90.5	36.6	0	0	0	113.4
123	E	33.7	Very low	31.7	Very low	174 Å²	174	165.6 Å²	165.6	81%	0.813	80%	0.8	S	S	*	*				39.6	144.3	126.6	-55.9	172.1	150.7	0	0	121
124	S	33.1	Very low	31.8	Very low	89 Å²	89	158.8 Å²	158.8	62%	0.622	79%	0.787	S	S	*	*			cis	-169.2	165.1	-12.8	-168.6	0	0	0	0	109.1
125	D	32.6	Very low	31.9	Very low	161 Å²	161	156.3 Å²	156.3	86%	0.861	78%	0.783	S	S	*	*			trans	56.6	143	158.5	-61.2	-63.9	0	0	0	121.7
126	G	32.3	Very low	32.4	Very low	80 Å²	80	149.8 Å²	149.8	83%	0.825	77%	0.77	S	S	*	*			trans	148.6	123.2	159.2	0	0	0	0	0	115.5
127	E	31.3	Very low	32.7	Very low	189 Å²	189	153.1 Å²	153.1	88%	0.883	77%	0.771	S	S	*	*			trans	-93.5	166.9	175.2	-61.5	-176.9	118	0	0	113.2
128	E	31	Very low	33.2	Very low	156 Å²	156	148.1 Å²	148.1	73%	0.729	76%	0.758	S	S	*	*			trans	78	118.1	155.9	-60.2	-138.2	107.4	0	0	122
129	Q	29.7	Very low	33.7	Very low	150 Å²	150	144.9 Å²	144.9	70%	0.701	75%	0.753	S	S	*	*			trans	68	98.3	131.7	-60.8	-173.2	44.1	0	0	122
130	H	30.9	Very low	34.1	Very low	176 Å²	176	145.3 Å²	145.3	82%	0.815	76%	0.755	S	S	*	*				81.6	145.3	121.2	-133.7	-68.9	0	0	0	120.9
131	V	28.1	Very low	34.4	Very low	119 Å²	119	141.5 Å²	141.5	72%	0.721	75%	0.753	S	S	*	*			trans	82.7	91.6	167.6	-166.2	0	0	0	0	117.8
132	D	35.9	Very low	34.9	Very low	150 Å²	150	144.2 Å²	144.2	80%	0.802	76%	0.762	S	S	*	*				35.6	98.6	121.1	-168.2	20.3	0	0	0	119.6
133	E	29.8	Very low	35.3	Very low	197 Å²	197	146.5 Å²	146.5	92%	0.921	77%	0.769	S	S	*	*			trans	-154.5	108.6	152.3	-131.1	174.4	-138.8	0	0	111.1
134	G	35.1	Very low	35.8	Very low	60 Å²	60	145.1 Å²	145.1	62%	0.619	77%	0.766	S	S	*	*			trans	-138.3	-12.2	-175.8	0	0	0	0	0	117	V136	G134-V136 PolarHBondContact O-N 2.79Å
135	L	36.2	Very low	36.1	Very low	158 Å²	158	150.6 Å²	150.6	83%	0.827	78%	0.779	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.1	58	-174.8	-76.8	165.6	0	0	0	113.5
136	V	39.7	Very low	36.1	Very low	102 Å²	102	149.7 Å²	149.7	62%	0.618	77%	0.774	S	S	*	*	T	Hydrogen-bonded Turn	trans	-135.2	-33.3	179.6	-174.2	0	0	0	0	113.5	G134 E138	G134-V136 PolarHBondContact O-N 2.79Å; V136-E138 VanDerWaalsContact C-N 3.27Å; V136-E138 PolarHBondContact O-N 2.81Å
137	R	38.1	Very low	36.5	Very low	237 Å²	237	154.7 Å²	154.7	89%	0.894	78%	0.776	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78	-9.8	-170.2	-150.2	167.1	-171.3	154.6	1.2	114.8
138	E	40.6	Very low	36.7	Very low	150 Å²	150	151 Å²	151	70%	0.701	76%	0.763	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.6	-18.4	-177.5	-151.7	162.1	-142.1	0	0	113	V136	V136-E138 VanDerWaalsContact C-N 3.27Å; V136-E138 PolarHBondContact O-N 2.81Å
139	Q	40.7	Very low	36.8	Very low	156 Å²	156	149.2 Å²	149.2	73%	0.729	76%	0.758	S	S	*	*	S	Bend	trans	-97.3	7.2	-171.3	-70.9	-172.4	-11	0	0	116.3
140	I	41	Very low	36.9	Very low	146 Å²	146	150 Å²	150	75%	0.749	76%	0.762	S	S	*	*	S	Bend	trans	-112.9	-12.6	-177.1	-61.4	179.1	0	0	0	112.5
141	A	37.2	Very low	37	Very low	89 Å²	89	145.2 Å²	145.2	74%	0.736	75%	0.748	S	S	*	*	S	Bend	trans	-85.8	-20.4	179.2	0	0	0	0	0	114.4	Q143	A141-Q143 PolarHBondContact O-N 2.88Å
142	E	43.3	Very low	37.1	Very low	171 Å²	171	146.8 Å²	146.8	80%	0.799	75%	0.751	S	S	*	*	S	Bend	trans	-92.3	16.6	-169.6	-59.8	-167.4	128.1	0	0	115.6
143	Q	40.6	Very low	36.8	Very low	167 Å²	167	143 Å²	143	78%	0.78	75%	0.746	S	S	*	*	S	Bend	trans	-132.6	13.4	-169.2	-67.2	-164.3	0.6	0	0	117.4	A141	A141-Q143 PolarHBondContact O-N 2.88Å
144	L	44	Very low	36.7	Very low	145 Å²	145	141.2 Å²	141.2	76%	0.759	74%	0.738	S	S	*	*	S	Bend	trans	-138.1	122.7	174.7	-76	171.4	0	0	0	112.2
145	F	39.3	Very low	36.4	Very low	204 Å²	204	148.3 Å²	148.3	90%	0.895	75%	0.746	S	S	*	*			trans	75	50.9	178.1	-48	-68	0	0	0	116.5
146	D	33.8	Very low	36	Very low	142 Å²	142	145.3 Å²	145.3	76%	0.759	74%	0.738	S	S	*	*			trans	-86	134.4	144.4	-172.2	13.7	0	0	0	109
147	E	39.9	Very low	35.5	Very low	184 Å²	184	147.1 Å²	147.1	86%	0.86	74%	0.74	S	S	*	*			trans	-179.8	91.4	149.4	-107.2	179.6	-161.8	0	0	111
148	N	35.8	Very low	35.1	Very low	113 Å²	113	145 Å²	145	60%	0.604	73%	0.732	S	S	*	*				75.4	137	126.9	-85.5	46.8	0	0	0	124.9
149	D	33.1	Very low	34.7	Very low	117 Å²	117	142.4 Å²	142.4	63%	0.626	73%	0.73	S	S	*	*			trans	78.2	110.6	134.1	-64.7	-7	0	0	0	119.7
150	E	32.4	Very low	34.1	Very low	168 Å²	168	142.9 Å²	142.9	79%	0.785	73%	0.732	S	S	*	*				100.2	151	60.9	-93.3	-148.2	-173.5	0	0	110.6
151	S	31.9	Very low	33.5	Very low	74 Å²	74	144.9 Å²	144.9	52%	0.517	73%	0.73	S	S	.	*			cis	-162.9	169.9	-11.4	43.7	0	0	0	0	111.1
152	I	30.2	Very low	33	Very low	153 Å²	153	148 Å²	148	79%	0.785	73%	0.73	S	S	*	*			trans	33.3	129	144.7	-58.7	157.2	0	0	0	118.7
153	G	29.8	Very low	32.4	Very low	69 Å²	69	143.2 Å²	143.2	71%	0.711	72%	0.72	S	S	*	*			cis	144.2	-177.9	1	0	0	0	0	0	113.8
154	H	28.3	Very low	31.8	Very low	160 Å²	160	142.9 Å²	142.9	74%	0.741	72%	0.723	S	S	*	*			trans	70.2	114.2	160.6	-84.9	-45.7	0	0	0	123.4
155	R	27.7	Very low	31.2	Very low	210 Å²	210	141.2 Å²	141.2	79%	0.792	72%	0.715	S	S	*	*				89.8	115.4	122.1	-96.9	178.6	172.2	165.1	-1.5	122.7
156	S	29.7	Very low	30.8	Very low	94 Å²	94	139.8 Å²	139.8	66%	0.657	71%	0.705	S	S	*	*				51.2	143.7	122.1	66.6	0	0	0	0	121.3
157	E	29.1	Very low	30.7	Very low	141 Å²	141	139.5 Å²	139.5	66%	0.659	70%	0.703	S	S	*	*			cis	-167	163	2.7	-124.4	-165.8	134.1	0	0	111
158	R	29.2	Very low	30.4	Very low	192 Å²	192	137.1 Å²	137.1	73%	0.725	70%	0.697	S	S	*	*			trans	65.9	100.1	147.5	-70.7	179.6	-162.8	-176.2	16.2	123.5
159	S	31.1	Very low	30.3	Very low	96 Å²	96	137.5 Å²	137.5	67%	0.671	70%	0.703	S	S	*	*				80.9	159.1	108.1	76.2	0	0	0	0	123.1
160	H	29.1	Very low	30.3	Very low	165 Å²	165	138.1 Å²	138.1	76%	0.764	71%	0.706	S	S	*	*			trans	70.8	153.5	179.3	-74	-107.4	0	0	0	116.3
161	R	27.1	Very low	30.3	Very low	188 Å²	188	135.3 Å²	135.3	71%	0.709	70%	0.7	S	S	*	*			cis	-179.8	154.8	-34.5	-151.1	169.9	-178.3	-132.1	18.1	106.6
162	E	27.3	Very low	30.4	Very low	155 Å²	155	140 Å²	140	72%	0.724	71%	0.714	S	S	*	*			trans	60.4	173.6	176.1	-64.7	127.4	-133.9	0	0	112.7
163	A	30.3	Very low	30.5	Very low	71 Å²	71	137.4 Å²	137.4	59%	0.587	71%	0.71	S	S	*	*			cis	-169.6	158.5	-48.2	0	0	0	0	0	106.3
164	D	28.2	Very low	30.8	Very low	160 Å²	160	141.5 Å²	141.5	86%	0.856	72%	0.715	S	S	*	*			trans	64.4	163.9	166.3	-51.8	-19	0	0	0	115.3
165	D	31.2	Very low	31.1	Very low	110 Å²	110	138.4 Å²	138.4	59%	0.588	72%	0.717	S	S	*	*			cis	-169.5	172.3	-29.9	-173	11.4	0	0	0	106.5
166	Y	32.6	Very low	31.5	Very low	173 Å²	173	135.9 Å²	135.9	68%	0.678	72%	0.719	S	S	*	*			trans	68.4	118.6	174.5	-55.3	-73	0	0	0	116.6
167	D	30.7	Very low	32.1	Very low	137 Å²	137	138.8 Å²	138.8	73%	0.733	73%	0.727	S	S	*	*				114.7	158.3	80.6	-82.8	-6.5	0	0	0	107.8
168	D	33.7	Very low	32.5	Very low	134 Å²	134	140.2 Å²	140.2	72%	0.717	73%	0.732	S	S	*	*			cis	-148.1	-179.8	13.7	-149.9	-10.6	0	0	0	112.3
169	V	33.4	Very low	33.3	Very low	120 Å²	120	138.7 Å²	138.7	73%	0.727	74%	0.736	S	S	*	*			trans	-60.9	179.2	175.1	-61.8	0	0	0	0	114.3
170	D	32.3	Very low	33.7	Very low	131 Å²	131	138.1 Å²	138.1	70%	0.701	73%	0.729	S	S	*	*			cis	-164.6	-174.3	29.6	-158.8	33.3	0	0	0	108.3
171	T	32.6	Very low	34.5	Very low	108 Å²	108	133.7 Å²	133.7	66%	0.663	71%	0.711	S	S	*	*			cis	-153.4	173	12.6	-44	0	0	0	0	110.7
172	E	34.4	Very low	35.9	Very low	173 Å²	173	132.9 Å²	132.9	81%	0.808	72%	0.72	S	S	*	*			trans	-69.7	-172.5	165.5	-44.7	158.7	131.3	0	0	112.4
173	S	32.5	Very low	36.9	Very low	99 Å²	99	131.8 Å²	131.8	69%	0.692	72%	0.72	S	S	*	*			cis	-164.8	176.9	12.2	51.4	0	0	0	0	110.9
174	D	36.2	Very low	37.7	Very low	155 Å²	155	131 Å²	131	83%	0.829	72%	0.718	S	S	*	*			trans	12.1	147.5	149.8	-62.3	-16.3	0	0	0	121
175	A	34	Very low	38.7	Very low	94 Å²	94	132.5 Å²	132.5	78%	0.777	71%	0.712	S	S	*	*				-167.6	-177.2	55.8	0	0	0	0	0	115.3
176	D	36.7	Very low	39.1	Very low	157 Å²	157	133.2 Å²	133.2	84%	0.84	72%	0.723	S	S	*	*			trans	-51.5	151.9	-179.5	-53.9	-77.3	0	0	0	116.5
177	D	42.9	Very low	39.6	Very low	155 Å²	155	132.5 Å²	132.5	83%	0.829	73%	0.729	S	S	*	*				-150.2	132.2	128.7	-141	-20.7	0	0	0	112.4
178	F	36.7	Very low	40.1	Very low	172 Å²	172	130 Å²	130	75%	0.754	73%	0.728	S	S	*	*			trans	-125.1	83.9	-168.1	-179.7	-105.8	0	0	0	110.7	V180	F178-V180 HydrophobicContact CD1-CG2 3.67Å; F178-V180 HydrophobicContact CE1-CG2 3.3Å; F178-V180 HydrophobicContact CZ-CG2 3.99Å; F178-V180 PolarHBondContact O-N 2.78Å; F178-V180 VanDerWaalsContact O-N 3.08Å
179	I	46.9	Very low	40.3	Very low	159 Å²	159	131.9 Å²	131.9	82%	0.815	73%	0.732	S	S	*	*			trans	-78	98.8	-174.8	-56.4	-179.3	0	0	0	111.1
180	V	38.3	Very low	40.3	Very low	85 Å²	85	135 Å²	135	52%	0.515	74%	0.736	S	S	.	*			trans	-96.6	154.6	156.2	-161.6	0	0	0	0	108.1	F178	F178-V180 HydrophobicContact CD1-CG2 3.67Å; F178-V180 HydrophobicContact CE1-CG2 3.3Å; F178-V180 HydrophobicContact CZ-CG2 3.99Å; F178-V180 PolarHBondContact O-N 2.78Å; F178-V180 VanDerWaalsContact O-N 3.08Å
181	D	47.4	Very low	40.3	Very low	71 Å²	71	138.8 Å²	138.8	38%	0.38	75%	0.746	S	S	.	*			trans	-76.7	157.1	174.8	80.1	-56.6	0	0	0	112.5	N183 G184 R185	D181-N183 PolarHBondContact O-N 2.88Å; D181-N183 WeakPolarHBondContact OD2-CB 3.3Å; D181-N183 PolarHBondContact OD2-N 2.83Å; D181-G184 PolarHBondContact O-N 2.85Å; D181-G184 WeakPolarHBondContact OD1-CA 3.34Å; D181-G184 PolarHBondContact OD1-N 2.78Å; D181-G184 VanDerWaalsContact OD1-N 3.1Å; D181-R185 PolarHBondContact OD1-N 3.07Å
182	D	55.8	Low	40.2	Very low	171 Å²	171	143.8 Å²	143.8	91%	0.914	76%	0.758	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.2	-5	-179.5	-70.2	-44.7	0	0	0	115.1
183	N	47.9	Very low	40.1	Very low	133 Å²	133	145.5 Å²	145.5	71%	0.711	76%	0.763	S	S	*	*	T	Hydrogen-bonded Turn	trans	-119	0.1	177.1	-59.3	-84.7	0	0	0	114.4	D181	D181-N183 PolarHBondContact O-N 2.88Å; D181-N183 WeakPolarHBondContact OD2-CB 3.3Å; D181-N183 PolarHBondContact OD2-N 2.83Å
184	G	47.9	Very low	40.2	Very low	54 Å²	54	152.6 Å²	152.6	56%	0.557	78%	0.775	S	S	*	*			trans	63.7	45.5	176.8	0	0	0	0	0	114.5	D181	D181-G184 PolarHBondContact O-N 2.85Å; D181-G184 WeakPolarHBondContact OD1-CA 3.34Å; D181-G184 PolarHBondContact OD1-N 2.78Å; D181-G184 VanDerWaalsContact OD1-N 3.1Å
185	R	47.6	Very low	40	Very low	191 Å²	191	156.3 Å²	156.3	72%	0.721	78%	0.777	S	S	*	*			trans	-133.1	116.6	-178.5	-70.9	-171.9	174.6	-155.7	-2.6	112.9	D181	D181-R185 PolarHBondContact OD1-N 3.07Å
186	P	41.5	Very low	40	Very low	126 Å²	126	157.9 Å²	157.9	82%	0.818	78%	0.779	S	S	*	*			trans	-72.9	147.4	176	31.4	-35.1	0	0	0	112.2
187	I	41.4	Very low	39.7	Very low	158 Å²	158	157.7 Å²	157.7	81%	0.81	78%	0.777	S	S	*	*			trans	-127.7	96.4	175.4	-56.8	177.5	0	0	0	106.2
188	A	41.4	Very low	39.4	Very low	85 Å²	85	160 Å²	160	70%	0.702	78%	0.78	S	S	*	*				72.9	129.4	71.2	0	0	0	0	0	112.7
189	E	37.7	Very low	39.4	Very low	173 Å²	173	158.3 Å²	158.3	81%	0.808	78%	0.784	S	S	*	*			cis	-169.6	141.5	-8.7	-160.8	-174.9	-118.7	0	0	109.9
190	K	33.3	Very low	39.5	Very low	185 Å²	185	155 Å²	155	80%	0.804	77%	0.768	S	S	*	*			trans	172.1	125.2	135.8	-97	158.6	-172.4	175.4	0	115.5
191	K	33.9	Very low	40.1	Very low	211 Å²	211	154.7 Å²	154.7	92%	0.917	77%	0.774	S	S	*	*			trans	54.6	139.9	157.4	-64.6	-170.4	173.6	-173.6	0	118.9
192	K	29.9	Very low	40.4	Very low	212 Å²	212	155.2 Å²	155.2	92%	0.922	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-103.3	134.1	-164.4	-57.8	170.1	-179.9	175.4	0	111.7
193	K	31.9	Very low	40.5	Very low	210 Å²	210	151.9 Å²	151.9	91%	0.913	77%	0.765	S	S	*	*	P	Polyproline II helix	trans	-85.5	141	149.1	-74.9	-167.3	173.2	-168.6	0	108.6
194	R	33.9	Very low	40.8	Very low	248 Å²	248	150.3 Å²	150.3	94%	0.936	75%	0.753	S	S	*	*	P	Polyproline II helix	trans	-75.8	148.8	161.6	-91.8	-177.7	164	-173.7	-4.2	108.4
195	R	32.8	Very low	41.2	Very low	233 Å²	233	151.2 Å²	151.2	88%	0.879	74%	0.743	S	S	*	*	P	Polyproline II helix	trans	-86.2	133.4	170.1	-70	178.7	169.8	-173.7	-5.6	109.3
196	P	34	Very low	41.8	Very low	126 Å²	126	143.4 Å²	143.4	82%	0.818	72%	0.722	S	S	*	*	P	Polyproline II helix	trans	-72.7	150.2	153.4	32.2	-31	0	0	0	109.5
197	I	31	Very low	42.5	Very low	154 Å²	154	141.5 Å²	141.5	79%	0.79	70%	0.702	S	S	*	*			trans	-121.3	105.9	167.5	-61.8	171.6	0	0	0	105.4
198	F	36.8	Very low	43	Very low	203 Å²	203	139.5 Å²	139.5	89%	0.89	69%	0.693	S	S	*	*			trans	-171.1	151.6	149.3	-116.1	-77.4	0	0	0	109.3
199	T	36.3	Very low	44	Very low	136 Å²	136	140.9 Å²	140.9	83%	0.834	69%	0.687	S	S	*	*			trans	-106.7	104.5	171.9	48.6	0	0	0	0	108.1
200	D	48	Very low	44.7	Very low	91 Å²	91	139 Å²	139	49%	0.487	68%	0.677	S	S	.	*			trans	-101.5	113	176.5	-177.2	3.1	0	0	0	110.2	S202 L203 Q204	D200-S202 VanDerWaalsContact C-N 3.31Å; D200-S202 WeakPolarHBondContact OD1-CB 3.49Å; D200-S202 PolarHBondContact OD1-N 2.72Å; D200-L203 HydrophobicContact CB-CB 3.94Å; D200-L203 PolarHBondContact O-N 3.07Å; D200-Q204 PolarHBondContact O-N 3Å
201	A	51.1	Low	44.9	Very low	77 Å²	77	133.2 Å²	133.2	64%	0.636	67%	0.67	S	S	*	*	H	α-helix	trans	-67.9	-30.1	178	0	0	0	0	0	112.3	L203 Q204 E205	A201-L203 VanDerWaalsContact C-N 3.29Å; A201-L203 PolarHBondContact O-N 3.03Å; A201-Q204 PolarHBondContact O-N 3.21Å; A201-E205 VanDerWaalsContact O-CB 3.24Å; A201-E205 WeakPolarHBondContact O-CB 3.17Å; A201-E205 PolarHBondContact O-N 3.05Å
202	S	55.4	Low	45.2	Very low	82 Å²	82	128.7 Å²	128.7	57%	0.573	66%	0.66	S	S	*	*	H	α-helix	trans	-73.9	-21.5	176.8	-64.1	0	0	0	0	112.7	D200 G206	D200-S202 VanDerWaalsContact C-N 3.31Å; D200-S202 WeakPolarHBondContact OD1-CB 3.49Å; D200-S202 PolarHBondContact OD1-N 2.72Å; S202-G206 PolarHBondContact O-N 2.86Å
203	L	57.5	Low	45.7	Very low	101 Å²	101	125.2 Å²	125.2	53%	0.529	65%	0.651	S	S	.	*	H	α-helix	trans	-78.7	-41.8	173.1	-144.8	168.3	0	0	0	110.5	D200 A201 G206 Q207	D200-L203 HydrophobicContact CB-CB 3.94Å; D200-L203 PolarHBondContact O-N 3.07Å; A201-L203 VanDerWaalsContact C-N 3.29Å; A201-L203 PolarHBondContact O-N 3.03Å; L203-G206 PolarHBondContact O-N 3.3Å; L203-Q207 HydrophobicContact CD2-CG 4.26Å; L203-Q207 WeakPolarHBondContact O-CG 3.27Å; L203-Q207 PolarHBondContact O-N 2.65Å
204	Q	53.9	Low	46.4	Very low	100 Å²	100	120.2 Å²	120.2	47%	0.467	63%	0.63	S	S	.	*	H	α-helix	trans	-62.2	-45.7	170.5	-173	65.9	61.9	0	0	111.4	D200 A201 G206 Q207 D208	D200-Q204 PolarHBondContact O-N 3Å; A201-Q204 PolarHBondContact O-N 3.21Å; Q204-G206 VanDerWaalsContact C-N 3.3Å; Q204-G206 PolarHBondContact O-N 2.68Å; Q204-Q207 CarbonylContact O-C 3.56Å; Q204-Q207 WeakPolarHBondContact O-CA 3.12Å; Q204-Q207 WeakPolarHBondContact O-CB 3.3Å; Q204-Q207 PolarHBondContact O-N 3.44Å; Q204-D208 PolarHBondContact NE2-OD1 2.9Å; Q204-D208 WeakPolarHBondContact O-CB 3.18Å; Q204-D208 PolarHBondContact O-N 2.99Å
205	E	55.5	Low	46.9	Very low	74 Å²	74	113.5 Å²	113.5	35%	0.346	61%	0.613	S	S	.	*	H	α-helix	trans	-62.7	-35.9	176.9	-175.3	166.6	-136.2	0	0	112	A201 D208 I209 K908	A201-E205 VanDerWaalsContact O-CB 3.24Å; A201-E205 WeakPolarHBondContact O-CB 3.17Å; A201-E205 PolarHBondContact O-N 3.05Å; E205-D208 PolarHBondContact O-N 3.33Å; E205-I209 HydrophobicContact CG-CD1 3.96Å; E205-I209 WeakPolarHBondContact O-CB 3.39Å; E205-I209 WeakPolarHBondContact O-CD1 3.45Å; E205-I209 WeakPolarHBondContact O-CG1 3.38Å; E205-I209 PolarHBondContact O-N 3.34Å; E205-K908 IonicContact OE1-NZ 2.74Å; E205-K908 PolarHBondContact OE1-NZ 2.81Å
206	G	60.6	Low	47.7	Very low	27 Å²	27	106.7 Å²	106.7	28%	0.278	59%	0.588	S	S	.	*	H	α-helix	trans	-64.8	-38.2	169.3	0	0	0	0	0	113.5	S202 L203 Q204 F210	S202-G206 PolarHBondContact O-N 2.86Å; L203-G206 PolarHBondContact O-N 3.3Å; Q204-G206 VanDerWaalsContact C-N 3.3Å; Q204-G206 PolarHBondContact O-N 2.68Å; G206-F210 WeakPolarHBondContact O-CB 3.12Å; G206-F210 WeakPolarHBondContact O-CD2 3.41Å; G206-F210 PolarHBondContact O-N 3.38Å
207	Q	55.5	Low	48.5	Very low	86 Å²	86	106 Å²	106	40%	0.402	58%	0.577	S	S	.	*	H	α-helix	trans	-70.1	-38	175.5	-72.9	175.1	-47.7	0	0	112	L203 Q204 I209 G211	L203-Q207 HydrophobicContact CD2-CG 4.26Å; L203-Q207 WeakPolarHBondContact O-CG 3.27Å; L203-Q207 PolarHBondContact O-N 2.65Å; Q204-Q207 CarbonylContact O-C 3.56Å; Q204-Q207 WeakPolarHBondContact O-CA 3.12Å; Q204-Q207 WeakPolarHBondContact O-CB 3.3Å; Q204-Q207 PolarHBondContact O-N 3.44Å; Q207-I209 VanDerWaalsContact C-N 3.34Å; Q207-G211 WeakPolarHBondContact O-CA 3.42Å; Q207-G211 PolarHBondContact O-N 2.73Å
208	D	53.5	Low	49.3	Very low	116 Å²	116	101.5 Å²	101.5	62%	0.62	56%	0.555	S	S	*	*	H	α-helix	trans	-71.7	-27.6	178.2	-63.2	-11.4	0	0	0	112	Q204 E205	Q204-D208 PolarHBondContact NE2-OD1 2.9Å; Q204-D208 WeakPolarHBondContact O-CB 3.18Å; Q204-D208 PolarHBondContact O-N 2.99Å; E205-D208 PolarHBondContact O-N 3.33Å
209	I	62.4	Low	49.9	Very low	114 Å²	114	97.7 Å²	97.7	59%	0.585	54%	0.538	S	S	*	.	H	α-helix	trans	-81.9	-41.7	174.2	-70.5	167.1	0	0	0	112.4	E205 Q207	E205-I209 HydrophobicContact CG-CD1 3.96Å; E205-I209 WeakPolarHBondContact O-CB 3.39Å; E205-I209 WeakPolarHBondContact O-CD1 3.45Å; E205-I209 WeakPolarHBondContact O-CG1 3.38Å; E205-I209 PolarHBondContact O-N 3.34Å; Q207-I209 VanDerWaalsContact C-N 3.34Å
210	F	51.8	Low	50.6	Low	132 Å²	132	94.6 Å²	94.6	58%	0.579	52%	0.522	S	S	*	.	H	α-helix	trans	-103	-6.2	-171.8	-67	-71.1	0	0	0	115.4	G206 V212	G206-F210 WeakPolarHBondContact O-CB 3.12Å; G206-F210 WeakPolarHBondContact O-CD2 3.41Å; G206-F210 PolarHBondContact O-N 3.38Å; F210-V212 VanDerWaalsContact C-N 3.25Å; F210-V212 PolarHBondContact O-N 3.27Å
211	G	36.8	Very low	50.3	Low	65 Å²	65	96.1 Å²	96.1	67%	0.67	52%	0.524	S	S	*	.			trans	67.6	-3.6	158	0	0	0	0	0	119	Q207	Q207-G211 WeakPolarHBondContact O-CA 3.42Å; Q207-G211 PolarHBondContact O-N 2.73Å
212	V	41.3	Very low	50	Low	116 Å²	116	100.3 Å²	100.3	70%	0.703	52%	0.524	S	S	*	.	S	Bend	trans	-142.8	135.4	-175.8	-166.4	0	0	0	0	111.7	F210 F214	F210-V212 VanDerWaalsContact C-N 3.25Å; F210-V212 PolarHBondContact O-N 3.27Å; V212-F214 PolarHBondContact O-N 3.04Å
213	D	40.5	Very low	49.4	Very low	139 Å²	139	103.6 Å²	103.6	74%	0.743	53%	0.531	S	S	*	.			trans	-62	98	168.5	-80.1	-39.2	0	0	0	111	D215	D213-D215 PolarHBondContact O-N 2.67Å
214	F	46.4	Very low	48.4	Very low	104 Å²	104	107 Å²	107	46%	0.456	54%	0.544	S	S	.	.			trans	-89.8	81.8	179.5	-147.9	-67.5	0	0	0	111.1	V212 Y216 F219	V212-F214 PolarHBondContact O-N 3.04Å; F214-Y216 HydrophobicContact CB-CE2 4.13Å; F214-Y216 HydrophobicContact CD1-CD1 4.01Å; F214-Y216 AromaticContact CD1-CD2 3.85Å; F214-Y216 HydrophobicContact CD1-CD2 3.85Å; F214-Y216 AromaticContact CD1-CE1 3.61Å; F214-Y216 HydrophobicContact CD1-CE1 3.61Å; F214-Y216 AromaticContact CD1-CE2 3.45Å; F214-Y216 HydrophobicContact CD1-CE2 3.45Å; F214-Y216 VanDerWaalsContact CD1-CE2 3.45Å; F214-Y216 HydrophobicContact CD1-CG 4.11Å; F214-Y216 AromaticContact CD1-CZ 3.3Å; F214-Y216 AromaticContact CE1-CD1 3.96Å; F214-Y216 HydrophobicContact CE1-CD1 3.96Å; F214-Y216 AromaticContact CE1-CE1 3.45Å; F214-Y216 HydrophobicContact CE1-CE1 3.45Å; F214-Y216 VanDerWaalsContact CE1-CE1 3.45Å; F214-Y216 HydrophobicContact CE1-CE2 4.19Å; F214-Y216 AromaticContact CE1-CZ 3.57Å; F214-Y216 HydrophobicContact CG-CE2 4.04Å; F214-Y216 HydrophobicContact CZ-CE1 4.44Å; F214-Y216 WeakPolarHBondContact O-CD2 3.27Å; F214-Y216 PolarHBondContact O-N 2.67Å; F214-Y216 VanDerWaalsContact O-N 3.15Å; F214-F219 HydrophobicContact CE1-CD2 4.04Å; F214-F219 AromaticContact CE1-CE2 3.61Å; F214-F219 HydrophobicContact CE1-CE2 3.61Å; F214-F219 HydrophobicContact CE1-CZ 4.43Å; F214-F219 AromaticContact CZ-CE2 3.87Å; F214-F219 HydrophobicContact CZ-CE2 3.87Å; F214-F219 HydrophobicContact CZ-CZ 4.33Å
215	D	43.5	Very low	47.3	Very low	108 Å²	108	109.2 Å²	109.2	58%	0.578	56%	0.559	S	S	*	*			trans	-74	99.9	177.6	-165	-8.5	0	0	0	111.3	D213 D217 D218	D213-D215 PolarHBondContact O-N 2.67Å; D215-D217 VanDerWaalsContact C-N 3.28Å; D215-D217 PolarHBondContact O-N 2.87Å; D215-D217 PolarHBondContact OD1-N 3.45Å; D215-D218 WeakPolarHBondContact O-CB 3.35Å; D215-D218 PolarHBondContact O-N 3.29Å
216	Y	49.4	Very low	46.2	Very low	90 Å²	90	112.7 Å²	112.7	35%	0.353	58%	0.58	S	S	.	*	G	3₁₀ helix	trans	-72.4	-17	-179	-75.2	-83.7	0	0	0	113.5	F214 D218 F219 K1006	F214-Y216 HydrophobicContact CB-CE2 4.13Å; F214-Y216 HydrophobicContact CD1-CD1 4.01Å; F214-Y216 AromaticContact CD1-CD2 3.85Å; F214-Y216 HydrophobicContact CD1-CD2 3.85Å; F214-Y216 AromaticContact CD1-CE1 3.61Å; F214-Y216 HydrophobicContact CD1-CE1 3.61Å; F214-Y216 AromaticContact CD1-CE2 3.45Å; F214-Y216 HydrophobicContact CD1-CE2 3.45Å; F214-Y216 VanDerWaalsContact CD1-CE2 3.45Å; F214-Y216 HydrophobicContact CD1-CG 4.11Å; F214-Y216 AromaticContact CD1-CZ 3.3Å; F214-Y216 AromaticContact CE1-CD1 3.96Å; F214-Y216 HydrophobicContact CE1-CD1 3.96Å; F214-Y216 AromaticContact CE1-CE1 3.45Å; F214-Y216 HydrophobicContact CE1-CE1 3.45Å; F214-Y216 VanDerWaalsContact CE1-CE1 3.45Å; F214-Y216 HydrophobicContact CE1-CE2 4.19Å; F214-Y216 AromaticContact CE1-CZ 3.57Å; F214-Y216 HydrophobicContact CG-CE2 4.04Å; F214-Y216 HydrophobicContact CZ-CE1 4.44Å; F214-Y216 WeakPolarHBondContact O-CD2 3.27Å; F214-Y216 PolarHBondContact O-N 2.67Å; F214-Y216 VanDerWaalsContact O-N 3.15Å; Y216-D218 PolarHBondContact O-N 3.26Å; Y216-F219 PolarHBondContact O-N 2.95Å; Y216-K1006 PolarHBondContact OH-NZ 3.46Å
217	D	51.3	Low	45	Very low	112 Å²	112	122.6 Å²	122.6	60%	0.599	61%	0.611	S	S	*	*	G	3₁₀ helix	trans	-70.2	-9.6	174.1	-80.3	-0.1	0	0	0	112.7	D215 K221	D215-D217 VanDerWaalsContact C-N 3.28Å; D215-D217 PolarHBondContact O-N 2.87Å; D215-D217 PolarHBondContact OD1-N 3.45Å; D217-K221 PolarHBondContact O-NZ 3.37Å
218	D	47.9	Very low	43.7	Very low	59 Å²	59	127.5 Å²	127.5	32%	0.316	63%	0.634	S	S	.	*	G	3₁₀ helix	trans	-88	-12.7	172.3	-151.4	48.1	0	0	0	112.1	D215 Y216 Y222 K260	D215-D218 WeakPolarHBondContact O-CB 3.35Å; D215-D218 PolarHBondContact O-N 3.29Å; Y216-D218 PolarHBondContact O-N 3.26Å; D218-Y222 WeakPolarHBondContact O-CD2 3.26Å; D218-Y222 WeakPolarHBondContact O-CE2 3.45Å; D218-K260 IonicContact OD2-NZ 2.84Å; D218-K260 PolarHBondContact OD2-NZ 3.32Å
219	F	49	Very low	42.5	Very low	122 Å²	122	128.9 Å²	128.9	54%	0.535	64%	0.641	S	S	.	*	T	Hydrogen-bonded Turn	trans	-91.9	-38.9	178.1	-93.8	-90.7	0	0	0	113.4	F214 Y216 K221 Y222	F214-F219 HydrophobicContact CE1-CD2 4.04Å; F214-F219 AromaticContact CE1-CE2 3.61Å; F214-F219 HydrophobicContact CE1-CE2 3.61Å; F214-F219 HydrophobicContact CE1-CZ 4.43Å; F214-F219 AromaticContact CZ-CE2 3.87Å; F214-F219 HydrophobicContact CZ-CE2 3.87Å; F214-F219 HydrophobicContact CZ-CZ 4.33Å; Y216-F219 PolarHBondContact O-N 2.95Å; F219-K221 PolarHBondContact O-N 3.4Å; F219-Y222 PolarHBondContact O-N 3.34Å
220	S	51.5	Low	40.9	Very low	72 Å²	72	131.2 Å²	131.2	50%	0.503	66%	0.655	S	S	.	*	G	3₁₀ helix	trans	-64.1	-19	178.9	49.3	0	0	0	0	113.8	Y222	S220-Y222 VanDerWaalsContact C-N 3.32Å; S220-Y222 PolarHBondContact O-N 3.27Å
221	K	42.4	Very low	39.9	Very low	123 Å²	123	130.8 Å²	130.8	54%	0.535	67%	0.668	S	S	.	*	G	3₁₀ helix	trans	-86.6	9	177.3	-62.1	-168	-171.9	73.6	0	115	D217 F219	D217-K221 PolarHBondContact O-NZ 3.37Å; F219-K221 PolarHBondContact O-N 3.4Å
222	Y	44.2	Very low	39.7	Very low	164 Å²	164	136.8 Å²	136.8	64%	0.643	68%	0.678	S	S	*	*	G	3₁₀ helix	trans	-121.8	7.8	178.5	-63.2	-51.7	0	0	0	113.9	D218 F219 S220	D218-Y222 WeakPolarHBondContact O-CD2 3.26Å; D218-Y222 WeakPolarHBondContact O-CE2 3.45Å; F219-Y222 PolarHBondContact O-N 3.34Å; S220-Y222 VanDerWaalsContact C-N 3.32Å; S220-Y222 PolarHBondContact O-N 3.27Å
223	E	43.1	Very low	39.3	Very low	151 Å²	151	134.4 Å²	134.4	71%	0.706	68%	0.678	S	S	*	*	S	Bend	trans	-109.3	-1.2	169.4	-68.2	-170	169.9	0	0	113.3	K286	E223-K286 IonicContact OE1-NZ 2.78Å; E223-K286 PolarHBondContact OE1-NZ 2.87Å; E223-K286 IonicContact OE2-NZ 2.6Å; E223-K286 PolarHBondContact OE2-NZ 2.79Å
224	E	35.9	Very low	38.8	Very low	173 Å²	173	135.9 Å²	135.9	81%	0.808	69%	0.686	S	S	*	*	S	Bend	trans	-112.5	-6.1	-177	-75.5	-172.2	147.5	0	0	115.9
225	D	31.3	Very low	38.1	Very low	146 Å²	146	138.9 Å²	138.9	78%	0.781	70%	0.701	S	S	*	*	S	Bend	trans	-110.8	6.1	-163.2	-114.7	6	0	0	0	115.2
226	D	32.7	Very low	37.7	Very low	147 Å²	147	143.6 Å²	143.6	79%	0.786	71%	0.712	S	S	*	*	S	Bend	trans	-132.7	15.2	-166.6	-106.1	-39	0	0	0	115.8
227	Y	34.4	Very low	37	Very low	235 Å²	235	145.8 Å²	145.8	92%	0.922	73%	0.73	S	S	*	*			trans	-145.1	49.2	175.4	-75.8	-66.2	0	0	0	114.7
228	E	28.6	Very low	36.2	Very low	189 Å²	189	149 Å²	149	88%	0.883	74%	0.741	S	S	*	*			trans	-118.7	134.3	166.4	-74.3	-161.2	146.3	0	0	113.1
229	D	28.3	Very low	35.6	Very low	145 Å²	145	152.5 Å²	152.5	78%	0.775	76%	0.76	S	S	*	*			trans	60.7	104.7	155.6	-149.3	12.6	0	0	0	120.8
230	D	28	Very low	34.9	Very low	164 Å²	164	154.2 Å²	154.2	88%	0.877	77%	0.774	S	S	*	*			trans	-165	49.8	153.8	-125.8	-12.9	0	0	0	111.6
231	S	32.2	Very low	34.1	Very low	122 Å²	122	154 Å²	154	85%	0.853	78%	0.783	S	S	*	*			trans	-157.9	42.1	176.1	-90.6	0	0	0	0	117.4
232	E	32.3	Very low	33.6	Very low	191 Å²	191	155.3 Å²	155.3	89%	0.893	80%	0.801	S	S	*	*			trans	-125.3	144.6	147.4	-63.6	-169.9	175.1	0	0	107.1
233	G	33.2	Very low	33.1	Very low	67 Å²	67	151.1 Å²	151.1	69%	0.691	81%	0.808	S	S	*	*			cis	168.1	144.5	-2.9	0	0	0	0	0	109.2
234	D	29.7	Very low	32.6	Very low	169 Å²	169	151 Å²	151	90%	0.904	81%	0.812	S	S	*	*			trans	60.5	129	164.3	-68	-20.8	0	0	0	122.5
235	E	32.2	Very low	32.5	Very low	167 Å²	167	148.5 Å²	148.5	78%	0.78	80%	0.804	S	S	*	*			trans	84.3	95.7	131.4	-150.4	167	-134.7	0	0	123.5
236	Y	34.2	Very low	32.5	Very low	208 Å²	208	147 Å²	147	82%	0.816	80%	0.8	S	S	*	*			trans	65.1	160.2	141.5	-71.7	-54.8	0	0	0	125
237	D	35.4	Very low	32.3	Very low	136 Å²	136	150.8 Å²	150.8	73%	0.727	80%	0.804	S	S	*	*			trans	72.2	93.6	161.1	-67.5	-0.7	0	0	0	122.9
238	E	33.3	Very low	32.3	Very low	178 Å²	178	145.6 Å²	145.6	83%	0.832	80%	0.796	S	S	*	*				60.6	158.7	119	-67.2	-165.4	149.3	0	0	124.2
239	D	35	Very low	32.4	Very low	134 Å²	134	146.6 Å²	146.6	72%	0.717	80%	0.798	S	S	*	*			trans	75.9	84.5	159.5	-90.2	9	0	0	0	122.8
240	L	35.9	Very low	32.6	Very low	158 Å²	158	148.8 Å²	148.8	83%	0.827	80%	0.8	S	S	*	*				57.4	104.8	114.5	-65.6	175.7	0	0	0	120.5
241	G	34.4	Very low	32.9	Very low	67 Å²	67	150.5 Å²	150.5	69%	0.691	80%	0.8	S	S	*	*				110.4	144.1	85.9	0	0	0	0	0	121
242	V	31.6	Very low	32.8	Very low	150 Å²	150	154.3 Å²	154.3	91%	0.909	80%	0.801	S	S	*	*			trans	59.1	102.2	152.6	-168.4	0	0	0	0	116.8
243	G	34	Very low	32.7	Very low	76 Å²	76	150 Å²	150	78%	0.784	80%	0.798	S	S	*	*				105	170.6	87.5	0	0	0	0	0	111
244	D	32.3	Very low	32.9	Very low	148 Å²	148	155.3 Å²	155.3	79%	0.791	81%	0.81	S	S	*	*			cis	-160.8	167.4	-1.1	-170.1	18.9	0	0	0	110.5
245	D	32.8	Very low	33.1	Very low	121 Å²	121	157 Å²	157	65%	0.647	81%	0.809	S	S	*	*			trans	58.8	94.7	149.7	-125.2	30.4	0	0	0	122.9
246	T	31.4	Very low	33.2	Very low	114 Å²	114	158.8 Å²	158.8	70%	0.699	81%	0.814	S	S	*	*				81.9	148.9	128.1	73.8	0	0	0	0	125.2
247	R	29.1	Very low	33.6	Very low	228 Å²	228	158.5 Å²	158.5	86%	0.86	82%	0.817	S	S	*	*			trans	89.2	87.3	135.6	-128.6	171.4	-174	170.7	3.1	121.4
248	V	34.9	Very low	33.8	Very low	126 Å²	126	158.4 Å²	158.4	76%	0.764	82%	0.821	S	S	*	*			trans	52.6	107.2	132.1	-174.3	0	0	0	0	118.2
249	K	29.9	Very low	34.3	Very low	210 Å²	210	156.3 Å²	156.3	91%	0.913	82%	0.82	S	S	*	*			trans	-154.6	157.5	140.4	-105.2	135.7	-170.5	170.3	0	112.4
250	K	33.1	Very low	35	Very low	191 Å²	191	157 Å²	157	83%	0.83	82%	0.817	S	S	*	*			trans	-95.9	163.1	-173.6	-62.8	-178.3	175.8	-177.3	0	112.4
251	K	33.2	Very low	35.9	Very low	200 Å²	200	156.1 Å²	156.1	87%	0.87	81%	0.806	S	S	*	*			trans	81.8	148.4	170.2	-50.1	178.3	-180	-177.5	0	113.3
252	K	30.9	Very low	37.7	Very low	201 Å²	201	156.3 Å²	156.3	87%	0.874	79%	0.794	S	S	*	*			cis	-122.9	168.3	14.9	-68.1	172.7	179.9	172.4	0	112.9
253	A	31	Very low	39.6	Very low	101 Å²	101	151.7 Å²	151.7	84%	0.835	76%	0.764	S	S	*	*	P	Polyproline II helix	trans	-79.2	142.4	178.9	0	0	0	0	0	112.7
254	L	36.1	Very low	41.4	Very low	178 Å²	178	152.9 Å²	152.9	93%	0.932	75%	0.748	S	S	*	*	P	Polyproline II helix	trans	-100.5	149.4	160.6	-85.2	146.5	0	0	0	109.2
255	K	34.5	Very low	43.4	Very low	204 Å²	204	150.2 Å²	150.2	89%	0.887	73%	0.733	S	S	*	*	P	Polyproline II helix	trans	-75.5	142.6	-173.7	-63	176.4	179.7	178.1	0	110.4	K257	K255-K257 PolarHBondContact O-N 2.93Å
256	K	35.2	Very low	45.6	Very low	206 Å²	206	149.1 Å²	149.1	90%	0.896	73%	0.726	S	S	*	*	P	Polyproline II helix	trans	-59.8	122.4	162.4	-74.6	-177.8	172.2	-177.4	0	108.6
257	K	41	Very low	47.7	Very low	202 Å²	202	147.7 Å²	147.7	88%	0.878	71%	0.709	S	S	*	*	P	Polyproline II helix	trans	-62.4	143	154.1	-78.6	-174.4	173.7	-176.7	0	107.4	K255	K255-K257 PolarHBondContact O-N 2.93Å
258	V	40.3	Very low	50.3	Low	134 Å²	134	142 Å²	142	81%	0.812	69%	0.692	S	S	*	*	P	Polyproline II helix	trans	-75.9	131.7	166.2	177.8	0	0	0	0	106.7	K260	V258-K260 PolarHBondContact O-N 2.94Å
259	V	44.6	Very low	52.4	Low	134 Å²	134	140.7 Å²	140.7	81%	0.812	69%	0.686	S	S	*	*			trans	-72.4	112.8	169.3	179.2	0	0	0	0	106.2	K261	V259-K261 PolarHBondContact O-N 3.21Å
260	K	49	Very low	54.8	Low	147 Å²	147	133.6 Å²	133.6	64%	0.639	66%	0.663	S	S	*	*	P	Polyproline II helix	trans	-59.6	130.8	166.5	-73	-175.3	-179.1	179.1	0	106.7	D218 V258	D218-K260 IonicContact OD2-NZ 2.84Å; D218-K260 PolarHBondContact OD2-NZ 3.32Å; V258-K260 PolarHBondContact O-N 2.94Å
261	K	55.1	Low	57	Low	141 Å²	141	129.2 Å²	129.2	61%	0.613	65%	0.645	S	S	*	*	P	Polyproline II helix	trans	-59	141.5	166.6	-84	-170.1	167.4	-154.6	0	109	V259 D265 I266	V259-K261 PolarHBondContact O-N 3.21Å; K261-D265 HydrophobicContact CB-CB 3.87Å; K261-D265 HydrophobicContact CD-CB 4.05Å; K261-D265 WeakPolarHBondContact CD-O 3.35Å; K261-D265 WeakPolarHBondContact CE-O 3.28Å; K261-D265 HydrophobicContact CG-CB 3.88Å; K261-D265 PolarHBondContact NZ-O 3.45Å; K261-I266 HydrophobicContact CB-CD1 3.95Å; K261-I266 HydrophobicContact CB-CG1 3.95Å; K261-I266 HydrophobicContact CD-CD1 4.37Å; K261-I266 HydrophobicContact CD-CG1 3.71Å
262	T	71.2	Confident	59.3	Low	70 Å²	70	120 Å²	120	43%	0.429	61%	0.605	S	S	.	*	P	Polyproline II helix	trans	-75.6	167.9	166.6	69	0	0	0	0	110.1	F264 D265 I266	T262-F264 PolarHBondContact O-N 3.12Å; T262-F264 PolarHBondContact OG1-N 3.15Å; T262-D265 WeakPolarHBondContact CB-OD2 3.19Å; T262-D265 PolarHBondContact N-OD2 3.21Å; T262-D265 WeakPolarHBondContact O-CB 3.27Å; T262-D265 PolarHBondContact O-N 3.49Å; T262-D265 PolarHBondContact OG1-N 2.99Å; T262-D265 PolarHBondContact OG1-OD2 2.9Å; T262-I266 WeakPolarHBondContact O-CG1 3.39Å
263	I	71.8	Confident	61.6	Low	54 Å²	54	117.8 Å²	117.8	28%	0.277	60%	0.596	S	S	.	*	G	3₁₀ helix	trans	-62	-31.7	175.2	-159.4	177.3	0	0	0	111.5	D265 I266 Y267 L272 F277	I263-D265 VanDerWaalsContact C-N 3.27Å; I263-D265 PolarHBondContact O-N 3.34Å; I263-I266 PolarHBondContact O-N 3.18Å; I263-I266 VanDerWaalsContact O-N 3.14Å; I263-Y267 HydrophobicContact CD1-CD2 4.44Å; I263-Y267 HydrophobicContact CG1-CD2 3.69Å; I263-Y267 HydrophobicContact CG1-CE2 4.14Å; I263-Y267 PolarHBondContact O-N 2.95Å; I263-L272 HydrophobicContact CD1-CD2 3.84Å; I263-L272 HydrophobicContact CG1-CD2 3.91Å; I263-L272 HydrophobicContact CG2-CD2 4.43Å; I263-F277 HydrophobicContact CD1-CB 4.27Å
264	F	72.2	Confident	63.8	Low	101 Å²	101	119.7 Å²	119.7	44%	0.443	58%	0.582	S	S	.	*	G	3₁₀ helix	trans	-71.5	-13.2	174.6	-45.2	-73.6	0	0	0	114.1	T262 L272 D279	T262-F264 PolarHBondContact O-N 3.12Å; T262-F264 PolarHBondContact OG1-N 3.15Å; F264-L272 HydrophobicContact CD1-CD1 3.54Å; F264-L272 HydrophobicContact CE1-CD1 4Å; F264-D279 WeakPolarHBondContact CZ-OD1 3.46Å; F264-D279 WeakPolarHBondContact CZ-OD2 3.46Å
265	D	74.5	Confident	65.7	Low	91 Å²	91	112.4 Å²	112.4	49%	0.487	55%	0.55	S	S	.	.	G	3₁₀ helix	trans	-92.9	4.1	171.1	-63.4	-76.6	0	0	0	112.6	K261 T262 I263	K261-D265 HydrophobicContact CB-CB 3.87Å; K261-D265 HydrophobicContact CD-CB 4.05Å; K261-D265 WeakPolarHBondContact CD-O 3.35Å; K261-D265 WeakPolarHBondContact CE-O 3.28Å; K261-D265 HydrophobicContact CG-CB 3.88Å; K261-D265 PolarHBondContact NZ-O 3.45Å; T262-D265 WeakPolarHBondContact CB-OD2 3.19Å; T262-D265 PolarHBondContact N-OD2 3.21Å; T262-D265 WeakPolarHBondContact O-CB 3.27Å; T262-D265 PolarHBondContact O-N 3.49Å; T262-D265 PolarHBondContact OG1-N 2.99Å; T262-D265 PolarHBondContact OG1-OD2 2.9Å; I263-D265 VanDerWaalsContact C-N 3.27Å; I263-D265 PolarHBondContact O-N 3.34Å
266	I	78.3	Confident	68	Low	98 Å²	98	104.8 Å²	104.8	50%	0.503	52%	0.517	S	S	.	.	T	Hydrogen-bonded Turn	trans	-126.2	-48.8	-170.2	-61.5	171.4	0	0	0	112	K261 T262 I263	K261-I266 HydrophobicContact CB-CD1 3.95Å; K261-I266 HydrophobicContact CB-CG1 3.95Å; K261-I266 HydrophobicContact CD-CD1 4.37Å; K261-I266 HydrophobicContact CD-CG1 3.71Å; T262-I266 WeakPolarHBondContact O-CG1 3.39Å; I263-I266 PolarHBondContact O-N 3.18Å; I263-I266 VanDerWaalsContact O-N 3.14Å
267	Y	76.8	Confident	70.3	Confident	85 Å²	85	99.1 Å²	99.1	33%	0.333	49%	0.493	S	S	.	.	S	Bend	trans	-108.9	154.8	-175.9	-65.9	-84.7	0	0	0	112	I263	I263-Y267 HydrophobicContact CD1-CD2 4.44Å; I263-Y267 HydrophobicContact CG1-CD2 3.69Å; I263-Y267 HydrophobicContact CG1-CE2 4.14Å; I263-Y267 PolarHBondContact O-N 2.95Å
268	E	82.8	Confident	72.5	Confident	107 Å²	107	91 Å²	91	50%	0.5	46%	0.46	S	S	.	.			trans	-71.5	145.8	176.2	-150.3	-150.1	109	0	0	111.1	S270 E271 L272	E268-S270 PolarHBondContact O-N 2.97Å; E268-S270 VanDerWaalsContact O-N 3.13Å; E268-S270 WeakPolarHBondContact OE1-CB 3.49Å; E268-S270 PolarHBondContact OE1-OG 3.27Å; E268-S270 PolarHBondContact OE2-OG 2.82Å; E268-E271 HydrophobicContact CB-CB 4.47Å; E268-E271 HydrophobicContact CB-CG 4.01Å; E268-E271 PolarHBondContact N-OE2 2.84Å; E268-E271 WeakPolarHBondContact O-CB 3.28Å; E268-E271 PolarHBondContact O-N 3.31Å; E268-E271 VanDerWaalsContact O-N 3.08Å; E268-L272 WeakPolarHBondContact O-CG 3.19Å; E268-L272 PolarHBondContact O-N 2.8Å
269	P	80.2	Confident	74.7	Confident	100 Å²	100	89.5 Å²	89.5	65%	0.649	45%	0.447	S	S	*	.	H	α-helix	trans	-54.7	-28	173	-32.4	38.5	0	0	0	115.1	K273	P269-K273 WeakPolarHBondContact O-CB 3.4Å; P269-K273 PolarHBondContact O-N 2.69Å
270	S	79.9	Confident	76.7	Confident	60 Å²	60	88.5 Å²	88.5	42%	0.42	44%	0.435	S	S	.	.	H	α-helix	trans	-69.2	-44	173.6	71.2	0	0	0	0	112.4	E268 K273 R274	E268-S270 PolarHBondContact O-N 2.97Å; E268-S270 VanDerWaalsContact O-N 3.13Å; E268-S270 WeakPolarHBondContact OE1-CB 3.49Å; E268-S270 PolarHBondContact OE1-OG 3.27Å; E268-S270 PolarHBondContact OE2-OG 2.82Å; S270-K273 PolarHBondContact O-N 3.27Å; S270-R274 WeakPolarHBondContact O-CB 3.34Å; S270-R274 PolarHBondContact O-N 2.93Å
271	E	79.3	Confident	78.7	Confident	99 Å²	99	81.7 Å²	81.7	46%	0.463	41%	0.406	S	S	.	.	H	α-helix	trans	-61.8	-43.9	174.2	-61.9	-177.1	113.8	0	0	111.3	E268 K273 R274 G275	E268-E271 HydrophobicContact CB-CB 4.47Å; E268-E271 HydrophobicContact CB-CG 4.01Å; E268-E271 PolarHBondContact N-OE2 2.84Å; E268-E271 WeakPolarHBondContact O-CB 3.28Å; E268-E271 PolarHBondContact O-N 3.31Å; E268-E271 VanDerWaalsContact O-N 3.08Å; E271-K273 VanDerWaalsContact C-N 3.34Å; E271-K273 PolarHBondContact O-N 3.02Å; E271-R274 PolarHBondContact O-N 3.23Å; E271-G275 PolarHBondContact O-N 2.96Å
272	L	80.2	Confident	80.2	Confident	6 Å²	6	77.6 Å²	77.6	3%	0.031	39%	0.391	C	S	.	.	H	α-helix	trans	-62.5	-40	176.7	-67.1	174.7	0	0	0	111.8	I263 F264 E268 H276 F277 T278	I263-L272 HydrophobicContact CD1-CD2 3.84Å; I263-L272 HydrophobicContact CG1-CD2 3.91Å; I263-L272 HydrophobicContact CG2-CD2 4.43Å; F264-L272 HydrophobicContact CD1-CD1 3.54Å; F264-L272 HydrophobicContact CE1-CD1 4Å; E268-L272 WeakPolarHBondContact O-CG 3.19Å; E268-L272 PolarHBondContact O-N 2.8Å; L272-H276 PolarHBondContact O-N 2.58Å; L272-F277 HydrophobicContact CD2-CB 3.84Å; L272-F277 PolarHBondContact O-N 3.47Å; L272-T278 HydrophobicContact CB-CG2 4.23Å
273	K	79.5	Confident	81.2	Confident	156 Å²	156	80.3 Å²	80.3	68%	0.678	40%	0.398	S	S	*	.	H	α-helix	trans	-65.1	-43.7	173.7	-173.2	178.7	179	-176.6	0	111.6	P269 S270 E271 H276 T278	P269-K273 WeakPolarHBondContact O-CB 3.4Å; P269-K273 PolarHBondContact O-N 2.69Å; S270-K273 PolarHBondContact O-N 3.27Å; E271-K273 VanDerWaalsContact C-N 3.34Å; E271-K273 PolarHBondContact O-N 3.02Å; K273-H276 PolarHBondContact O-N 3.36Å; K273-H276 PolarHBondContact O-ND1 3.31Å; K273-H276 VanDerWaalsContact O-ND1 3.11Å; K273-T278 HydrophobicContact CB-CG2 4.3Å
274	R	77.5	Confident	82.1	Confident	141 Å²	141	78.2 Å²	78.2	53%	0.532	39%	0.387	S	S	.	.	H	α-helix	trans	-67.7	-35.1	179.4	-170	170.6	-179.1	-115.7	-3.3	113	S270 E271 D938	S270-R274 WeakPolarHBondContact O-CB 3.34Å; S270-R274 PolarHBondContact O-N 2.93Å; E271-R274 PolarHBondContact O-N 3.23Å; R274-D938 IonicContact CZ-OD1 2.66Å; R274-D938 IonicContact NE-OD1 2.66Å; R274-D938 VanDerWaalsContact NH2-CG 3.3Å; R274-D938 IonicContact NH2-OD1 2.79Å; R274-D938 PolarHBondContact NH2-OD1 3.35Å; R274-D938 IonicContact NH2-OD2 3.71Å; R274-D938 PolarHBondContact NH2-OD2 3.26Å
275	G	76.5	Confident	83	Confident	25 Å²	25	76.6 Å²	76.6	26%	0.258	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.2	-3.5	174.5	0	0	0	0	0	115.1	E271 F277	E271-G275 PolarHBondContact O-N 2.96Å; G275-F277 VanDerWaalsContact O-CD2 3.24Å; G275-F277 WeakPolarHBondContact O-CD2 3.36Å; G275-F277 VanDerWaalsContact O-CE2 3.23Å; G275-F277 WeakPolarHBondContact O-CE2 3.44Å
276	H	83.2	Confident	83.8	Confident	43 Å²	43	79.3 Å²	79.3	20%	0.199	39%	0.386	C	S	.	.	T	Hydrogen-bonded Turn	trans	57.4	46.5	-174.3	-51.4	-26.2	0	0	0	114.3	L272 K273 D281 R285 R999	L272-H276 PolarHBondContact O-N 2.58Å; K273-H276 PolarHBondContact O-N 3.36Å; K273-H276 PolarHBondContact O-ND1 3.31Å; K273-H276 VanDerWaalsContact O-ND1 3.11Å; H276-D281 VanDerWaalsContact C-CB 3.48Å; H276-D281 VanDerWaalsContact CA-OD2 3.27Å; H276-D281 WeakPolarHBondContact CA-OD2 3.06Å; H276-D281 HydrophobicContact CB-CB 4.2Å; H276-D281 WeakPolarHBondContact O-CB 3.15Å; H276-R285 PolarHBondContact O-NH2 3.05Å; H276-R999 HydrophobicContact CB-CG 3.52Å
277	F	82.4	Confident	84.4	Confident	88 Å²	88	76.7 Å²	76.7	39%	0.386	38%	0.375	S	S	.	.			trans	-114.2	14.2	179.4	-65.8	-64.1	0	0	0	114	I263 L272 G275 D281	I263-F277 HydrophobicContact CD1-CB 4.27Å; L272-F277 HydrophobicContact CD2-CB 3.84Å; L272-F277 PolarHBondContact O-N 3.47Å; G275-F277 VanDerWaalsContact O-CD2 3.24Å; G275-F277 WeakPolarHBondContact O-CD2 3.36Å; G275-F277 VanDerWaalsContact O-CE2 3.23Å; G275-F277 WeakPolarHBondContact O-CE2 3.44Å; F277-D281 PolarHBondContact N-OD2 2.95Å
278	T	86.6	Confident	85.2	Confident	32 Å²	32	75 Å²	75	20%	0.196	37%	0.371	C	S	.	.	S	Bend	trans	-72.2	165.6	171.2	73.2	0	0	0	0	111.5	L272 K273 M280 D281 N282	L272-T278 HydrophobicContact CB-CG2 4.23Å; K273-T278 HydrophobicContact CB-CG2 4.3Å; T278-M280 VanDerWaalsContact C-N 3.29Å; T278-M280 PolarHBondContact O-N 3.03Å; T278-D281 VanDerWaalsContact CB-OD2 3.31Å; T278-D281 WeakPolarHBondContact CB-OD2 3.46Å; T278-D281 WeakPolarHBondContact CG2-OD2 3.33Å; T278-D281 PolarHBondContact N-OD2 2.89Å; T278-D281 WeakPolarHBondContact O-CA 3.2Å; T278-D281 WeakPolarHBondContact O-CB 3.41Å; T278-D281 PolarHBondContact O-N 3.48Å; T278-D281 PolarHBondContact OG1-N 3.49Å; T278-D281 PolarHBondContact OG1-OD2 2.87Å; T278-N282 PolarHBondContact O-N 2.99Å; T278-N282 PolarHBondContact O-ND2 2.79Å
279	D	86.5	Confident	85.7	Confident	101 Å²	101	72 Å²	72	54%	0.54	36%	0.358	S	S	.	.	H	α-helix	trans	-63.2	-34.8	176.2	-68.8	-46	0	0	0	113	F264 D281 N282 E283	F264-D279 WeakPolarHBondContact CZ-OD1 3.46Å; F264-D279 WeakPolarHBondContact CZ-OD2 3.46Å; D279-D281 VanDerWaalsContact C-N 3.28Å; D279-D281 PolarHBondContact O-N 3.29Å; D279-N282 WeakPolarHBondContact O-CA 3.27Å; D279-N282 WeakPolarHBondContact O-CB 3.43Å; D279-N282 PolarHBondContact O-N 3.12Å; D279-N282 VanDerWaalsContact O-N 3.11Å; D279-N282 PolarHBondContact OD1-ND2 3Å; D279-E283 PolarHBondContact O-N 2.94Å
280	M	87.8	Confident	86.4	Confident	114 Å²	114	67.2 Å²	67.2	56%	0.562	33%	0.327	S	S	*	.	H	α-helix	trans	-61.5	-37.3	170.7	-173.3	-174.1	70	0	0	111.4	T278 N282 E283 I284	T278-M280 VanDerWaalsContact C-N 3.29Å; T278-M280 PolarHBondContact O-N 3.03Å; M280-N282 VanDerWaalsContact C-N 3.34Å; M280-E283 PolarHBondContact O-N 3.38Å; M280-I284 HydrophobicContact CE-CD1 4.43Å; M280-I284 HydrophobicContact CG-CD1 4.01Å; M280-I284 WeakPolarHBondContact O-CB 3.39Å; M280-I284 WeakPolarHBondContact O-CD1 3.38Å; M280-I284 WeakPolarHBondContact O-CG1 3.19Å; M280-I284 PolarHBondContact O-N 2.88Å
281	D	89.7	Confident	87.1	Confident	4 Å²	4	64.3 Å²	64.3	2%	0.021	31%	0.307	C	S	.	.	H	α-helix	trans	-71	-30	174.9	-55.9	-57.9	0	0	0	112.4	H276 F277 T278 D279 R285 R999	H276-D281 VanDerWaalsContact C-CB 3.48Å; H276-D281 VanDerWaalsContact CA-OD2 3.27Å; H276-D281 WeakPolarHBondContact CA-OD2 3.06Å; H276-D281 HydrophobicContact CB-CB 4.2Å; H276-D281 WeakPolarHBondContact O-CB 3.15Å; F277-D281 PolarHBondContact N-OD2 2.95Å; T278-D281 VanDerWaalsContact CB-OD2 3.31Å; T278-D281 WeakPolarHBondContact CB-OD2 3.46Å; T278-D281 WeakPolarHBondContact CG2-OD2 3.33Å; T278-D281 PolarHBondContact N-OD2 2.89Å; T278-D281 WeakPolarHBondContact O-CA 3.2Å; T278-D281 WeakPolarHBondContact O-CB 3.41Å; T278-D281 PolarHBondContact O-N 3.48Å; T278-D281 PolarHBondContact OG1-N 3.49Å; T278-D281 PolarHBondContact OG1-OD2 2.87Å; D279-D281 VanDerWaalsContact C-N 3.28Å; D279-D281 PolarHBondContact O-N 3.29Å; D281-R285 WeakPolarHBondContact O-CB 3.27Å; D281-R285 WeakPolarHBondContact O-CG 3.48Å; D281-R285 PolarHBondContact O-N 3.2Å; D281-R285 PolarHBondContact O-NE 3.03Å; D281-R999 HydrophobicContact CB-CG 4.32Å; D281-R999 VanDerWaalsContact OD1-CD 3.3Å; D281-R999 WeakPolarHBondContact OD1-CD 3.46Å; D281-R999 IonicContact OD1-CZ 2.71Å; D281-R999 IonicContact OD1-NE 3.56Å; D281-R999 IonicContact OD1-NH1 3.2Å; D281-R999 PolarHBondContact OD1-NH1 3.39Å
282	N	88.2	Confident	87.7	Confident	55 Å²	55	61.6 Å²	61.6	29%	0.294	29%	0.292	S	S	.	.	H	α-helix	trans	-66.8	-44.5	171.6	-64.9	-38.4	0	0	0	111	T278 D279 M280 R285 K286	T278-N282 PolarHBondContact O-N 2.99Å; T278-N282 PolarHBondContact O-ND2 2.79Å; D279-N282 WeakPolarHBondContact O-CA 3.27Å; D279-N282 WeakPolarHBondContact O-CB 3.43Å; D279-N282 PolarHBondContact O-N 3.12Å; D279-N282 VanDerWaalsContact O-N 3.11Å; D279-N282 PolarHBondContact OD1-ND2 3Å; M280-N282 VanDerWaalsContact C-N 3.34Å; N282-R285 PolarHBondContact O-N 2.86Å; N282-R285 VanDerWaalsContact OD1-CZ 3.23Å; N282-R285 PolarHBondContact OD1-NH1 2.88Å; N282-R285 PolarHBondContact OD1-NH2 3.03Å; N282-K286 PolarHBondContact O-N 3.29Å
283	E	91.4	Very high	88.3	Confident	126 Å²	126	61.4 Å²	61.4	59%	0.589	29%	0.291	S	S	*	.	H	α-helix	trans	-60.8	-51.1	173.8	-173.6	179	-179.5	0	0	111.2	D279 M280 R285 K286 T287	D279-E283 PolarHBondContact O-N 2.94Å; M280-E283 PolarHBondContact O-N 3.38Å; E283-R285 PolarHBondContact O-N 2.83Å; E283-K286 PolarHBondContact O-N 3.33Å; E283-T287 WeakPolarHBondContact O-CB 3.31Å; E283-T287 PolarHBondContact O-N 3.12Å; E283-T287 PolarHBondContact O-OG1 3.28Å; E283-T287 VanDerWaalsContact O-OG1 3.13Å
284	I	91.6	Very high	88.9	Confident	10 Å²	10	56.1 Å²	56.1	5%	0.051	27%	0.269	C	S	.	.	H	α-helix	trans	-56.2	-36.1	176.8	-70.6	163.2	0	0	0	111.6	M280 E291 Q294 L295 K1000	M280-I284 HydrophobicContact CE-CD1 4.43Å; M280-I284 HydrophobicContact CG-CD1 4.01Å; M280-I284 WeakPolarHBondContact O-CB 3.39Å; M280-I284 WeakPolarHBondContact O-CD1 3.38Å; M280-I284 WeakPolarHBondContact O-CG1 3.19Å; M280-I284 PolarHBondContact O-N 2.88Å; I284-E291 HydrophobicContact CG2-CG 3.79Å; I284-Q294 PolarHBondContact O-NE2 2.77Å; I284-L295 HydrophobicContact CD1-CD2 3.93Å; I284-K1000 VanDerWaalsContact O-CE 3.24Å; I284-K1000 WeakPolarHBondContact O-CE 3.27Å; I284-K1000 PolarHBondContact O-NZ 3.17Å
285	R	90.6	Very high	89.4	Confident	68 Å²	68	53.3 Å²	53.3	26%	0.257	26%	0.264	S	S	.	.	H	α-helix	trans	-67.7	-50.6	173.4	-77.1	-175.7	-96.9	97.2	1.1	112.1	H276 D281 N282 E283 R999 K1000	H276-R285 PolarHBondContact O-NH2 3.05Å; D281-R285 WeakPolarHBondContact O-CB 3.27Å; D281-R285 WeakPolarHBondContact O-CG 3.48Å; D281-R285 PolarHBondContact O-N 3.2Å; D281-R285 PolarHBondContact O-NE 3.03Å; N282-R285 PolarHBondContact O-N 2.86Å; N282-R285 VanDerWaalsContact OD1-CZ 3.23Å; N282-R285 PolarHBondContact OD1-NH1 2.88Å; N282-R285 PolarHBondContact OD1-NH2 3.03Å; E283-R285 PolarHBondContact O-N 2.83Å; R285-R999 HydrophobicContact CG-CB 3.74Å; R285-R999 HydrophobicContact CG-CG 4.39Å; R285-K1000 PolarHBondContact O-NZ 3.4Å
286	K	90.2	Very high	90	Very high	147 Å²	147	53.7 Å²	53.7	64%	0.639	26%	0.258	S	S	*	.	H	α-helix	trans	-68.4	-34.8	-177.8	-71.6	-168	179.4	-170.5	0	113.9	E223 N282 E283	E223-K286 IonicContact OE1-NZ 2.78Å; E223-K286 PolarHBondContact OE1-NZ 2.87Å; E223-K286 IonicContact OE2-NZ 2.6Å; E223-K286 PolarHBondContact OE2-NZ 2.79Å; N282-K286 PolarHBondContact O-N 3.29Å; E283-K286 PolarHBondContact O-N 3.33Å
287	T	92.6	Very high	90.1	Very high	44 Å²	44	60.1 Å²	60.1	27%	0.27	29%	0.288	S	S	.	.	S	Bend	trans	-72	128.6	-173.3	-66.9	0	0	0	0	114.1	E283 I289 K1000	E283-T287 WeakPolarHBondContact O-CB 3.31Å; E283-T287 PolarHBondContact O-N 3.12Å; E283-T287 PolarHBondContact O-OG1 3.28Å; E283-T287 VanDerWaalsContact O-OG1 3.13Å; T287-I289 HydrophobicContact CG2-CB 4.07Å; T287-I289 HydrophobicContact CG2-CD1 3.92Å; T287-I289 HydrophobicContact CG2-CG1 3.81Å; T287-I289 PolarHBondContact O-N 3.25Å; T287-K1000 PolarHBondContact O-NZ 3.17Å
288	D	93.8	Very high	90.2	Very high	49 Å²	49	57.2 Å²	57.2	26%	0.262	28%	0.278	S	S	.	.	S	Bend	trans	-79.6	61.1	177.3	-173	35.8	0	0	0	113.2	G1028 P1029 R1030 V1031	D288-G1028 VanDerWaalsContact CG-C 3.47Å; D288-G1028 VanDerWaalsContact CG-CA 3.46Å; D288-G1028 VanDerWaalsContact OD1-CA 3.3Å; D288-G1028 WeakPolarHBondContact OD1-CA 3.33Å; D288-P1029 VanDerWaalsContact OD2-CD 3.26Å; D288-P1029 WeakPolarHBondContact OD2-CD 3.42Å; D288-P1029 VanDerWaalsContact OD2-N 3.11Å; D288-R1030 WeakPolarHBondContact O-CB 3.34Å; D288-R1030 PolarHBondContact OD1-N 2.93Å; D288-R1030 WeakPolarHBondContact OD2-CB 3.11Å; D288-R1030 WeakPolarHBondContact OD2-CG 3.26Å; D288-R1030 PolarHBondContact OD2-N 2.7Å; D288-V1031 WeakPolarHBondContact OD1-CG2 3.42Å; D288-V1031 PolarHBondContact OD1-N 3.44Å
289	I	93	Very high	90	Very high	43 Å²	43	59.6 Å²	59.6	22%	0.221	29%	0.293	C	S	.	.	S	Bend	trans	-132.6	140.2	171.2	-61.5	178.5	0	0	0	107.2	T287 E291 M293 Q294 K1000	T287-I289 HydrophobicContact CG2-CB 4.07Å; T287-I289 HydrophobicContact CG2-CD1 3.92Å; T287-I289 HydrophobicContact CG2-CG1 3.81Å; T287-I289 PolarHBondContact O-N 3.25Å; I289-E291 PolarHBondContact O-N 3.47Å; I289-M293 HydrophobicContact CG2-CB 3.86Å; I289-Q294 HydrophobicContact CB-CG 3.81Å; I289-Q294 HydrophobicContact CG2-CG 3.71Å; I289-Q294 PolarHBondContact O-NE2 3.26Å; I289-K1000 VanDerWaalsContact O-CE 3.24Å; I289-K1000 WeakPolarHBondContact O-CE 3.39Å
290	P	94.6	Very high	90	Very high	0 Å²	0	55.5 Å²	55.5	0%	0	27%	0.272	C	S	.	.			trans	-50.2	132.1	173.9	-29.9	37.2	0	0	0	112.5	R292 M293 Q294 Q360 E362	P290-R292 VanDerWaalsContact C-N 3.26Å; P290-R292 PolarHBondContact O-N 2.81Å; P290-R292 VanDerWaalsContact O-N 3.14Å; P290-M293 HydrophobicContact CB-CB 4.47Å; P290-M293 HydrophobicContact CB-CG 4.16Å; P290-M293 HydrophobicContact CB-SD 4.25Å; P290-M293 HydrophobicContact CG-SD 3.98Å; P290-M293 WeakPolarHBondContact O-CB 3.48Å; P290-M293 PolarHBondContact O-N 2.76Å; P290-Q294 PolarHBondContact O-N 3.46Å; P290-Q360 WeakPolarHBondContact CG-O 3.37Å; P290-E362 HydrophobicContact CB-CG 3.84Å; P290-E362 HydrophobicContact CG-CG 4.27Å
291	E	93.3	Very high	89.9	Confident	0 Å²	0	53.5 Å²	53.5	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-57.2	-37.7	-169.1	-175.6	169.6	157.9	0	0	112.8	I284 I289 M293 Q294 L295 G997 P998 R999 K1000	I284-E291 HydrophobicContact CG2-CG 3.79Å; I289-E291 PolarHBondContact O-N 3.47Å; E291-M293 VanDerWaalsContact C-N 3.33Å; E291-M293 PolarHBondContact O-N 2.82Å; E291-Q294 PolarHBondContact O-N 3.49Å; E291-L295 HydrophobicContact CG-CD1 3.85Å; E291-L295 HydrophobicContact CG-CG 4.48Å; E291-L295 WeakPolarHBondContact O-CG 3.29Å; E291-L295 PolarHBondContact O-N 2.8Å; E291-L295 VanDerWaalsContact O-N 3.15Å; E291-G997 VanDerWaalsContact CD-CA 3.43Å; E291-G997 WeakPolarHBondContact OE2-CA 3.44Å; E291-G997 PolarHBondContact OE2-N 2.82Å; E291-P998 VanDerWaalsContact OE1-CD 3.22Å; E291-P998 WeakPolarHBondContact OE1-CD 3.42Å; E291-P998 WeakPolarHBondContact OE1-CG 3.29Å; E291-R999 WeakPolarHBondContact OE1-CB 3.34Å; E291-R999 IonicContact OE1-CZ 3.66Å; E291-R999 PolarHBondContact OE1-N 2.81Å; E291-R999 VanDerWaalsContact OE1-N 3.14Å; E291-R999 IonicContact OE1-NE 2.71Å; E291-R999 PolarHBondContact OE1-NE 3.42Å; E291-R999 IonicContact OE1-NH2 3.33Å; E291-R999 PolarHBondContact OE1-NH2 3.33Å; E291-R999 PolarHBondContact OE2-N 2.92Å; E291-K1000 HydrophobicContact CB-CD 4.26Å; E291-K1000 HydrophobicContact CB-CG 4.49Å; E291-K1000 PolarHBondContact OE2-N 2.81Å
292	R	92.2	Very high	89.9	Confident	41 Å²	41	57.5 Å²	57.5	16%	0.155	29%	0.293	C	S	.	.	H	α-helix	trans	-67.7	-24.6	176.1	-75.9	176.9	-71	-82.4	-14.4	114.9	P290 E362 Y387 I967 Q991 I993 L996	P290-R292 VanDerWaalsContact C-N 3.26Å; P290-R292 PolarHBondContact O-N 2.81Å; P290-R292 VanDerWaalsContact O-N 3.14Å; R292-E362 IonicContact CZ-OE1 3.2Å; R292-E362 IonicContact CZ-OE2 2.85Å; R292-E362 IonicContact NE-OE1 2.67Å; R292-E362 IonicContact NE-OE2 2.81Å; R292-E362 PolarHBondContact NE-OE2 3.32Å; R292-E362 IonicContact NH2-OE1 2.64Å; R292-E362 PolarHBondContact NH2-OE1 2.81Å; R292-E362 IonicContact NH2-OE2 3.97Å; R292-E362 PolarHBondContact NH2-OE2 3.23Å; R292-Y387 PolarHBondContact O-OH 2.94Å; R292-I967 VanDerWaalsContact CD-CD1 3.45Å; R292-Q991 PolarHBondContact NH1-O 2.82Å; R292-I993 PolarHBondContact NH2-O 2.89Å; R292-L996 PolarHBondContact NH1-O 2.7Å; R292-L996 PolarHBondContact NH2-O 3.02Å
293	M	93.1	Very high	90	Very high	2 Å²	2	55.3 Å²	55.3	1%	0.01	28%	0.281	C	S	.	.	H	α-helix	trans	-78.3	-26.4	174.1	-68.4	-175.6	169.9	0	0	112.1	I289 P290 E291 V300 I356 Q360 L361 E362 Y387	I289-M293 HydrophobicContact CG2-CB 3.86Å; P290-M293 HydrophobicContact CB-CB 4.47Å; P290-M293 HydrophobicContact CB-CG 4.16Å; P290-M293 HydrophobicContact CB-SD 4.25Å; P290-M293 HydrophobicContact CG-SD 3.98Å; P290-M293 WeakPolarHBondContact O-CB 3.48Å; P290-M293 PolarHBondContact O-N 2.76Å; E291-M293 VanDerWaalsContact C-N 3.33Å; E291-M293 PolarHBondContact O-N 2.82Å; M293-V300 HydrophobicContact CB-CB 4.39Å; M293-V300 HydrophobicContact CB-CG2 3.87Å; M293-V300 HydrophobicContact CG-CG2 3.98Å; M293-V300 HydrophobicContact SD-CG2 4.4Å; M293-I356 HydrophobicContact CE-CG2 4.23Å; M293-Q360 HydrophobicContact SD-CB 4.21Å; M293-L361 VanDerWaalsContact CE-C 3.46Å; M293-L361 VanDerWaalsContact CE-O 3.27Å; M293-L361 WeakPolarHBondContact CE-O 2.81Å; M293-E362 HydrophobicContact CE-CG 4.05Å; M293-Y387 HydrophobicContact CG-CE2 4.45Å
294	Q	91.3	Very high	89.9	Confident	45 Å²	45	53.6 Å²	53.6	21%	0.21	28%	0.281	C	S	.	.	H	α-helix	trans	-77.4	-35.1	175	-57.3	-171.8	55	0	0	111.9	I284 I289 P290 E291 R296	I284-Q294 PolarHBondContact O-NE2 2.77Å; I289-Q294 HydrophobicContact CB-CG 3.81Å; I289-Q294 HydrophobicContact CG2-CG 3.71Å; I289-Q294 PolarHBondContact O-NE2 3.26Å; P290-Q294 PolarHBondContact O-N 3.46Å; E291-Q294 PolarHBondContact O-N 3.49Å; Q294-R296 VanDerWaalsContact C-N 3.35Å
295	L	89.1	Confident	89.4	Confident	82 Å²	82	62.6 Å²	62.6	43%	0.429	32%	0.323	S	S	.	.	S	Bend	trans	-83.6	-1.8	-178.2	-65	167.7	0	0	0	114.7	I284 E291	I284-L295 HydrophobicContact CD1-CD2 3.93Å; E291-L295 HydrophobicContact CG-CD1 3.85Å; E291-L295 HydrophobicContact CG-CG 4.48Å; E291-L295 WeakPolarHBondContact O-CG 3.29Å; E291-L295 PolarHBondContact O-N 2.8Å; E291-L295 VanDerWaalsContact O-N 3.15Å
296	R	88.1	Confident	89.1	Confident	33 Å²	33	63.4 Å²	63.4	13%	0.125	35%	0.352	C	S	.	.	S	Bend	trans	-73	133.7	-178.7	-165.1	175.6	77.3	161.9	5.5	110.1	Q294 V298 Y387 D390	Q294-R296 VanDerWaalsContact C-N 3.35Å; R296-V298 PolarHBondContact NE-O 3.27Å; R296-V298 PolarHBondContact NH2-O 2.77Å; R296-V298 VanDerWaalsContact NH2-O 3.16Å; R296-V298 CarbonylContact O-C 3.53Å; R296-V298 PolarHBondContact O-N 3.42Å; R296-Y387 PolarHBondContact NH1-O 3.32Å; R296-D390 IonicContact CZ-OD2 3.75Å; R296-D390 IonicContact NH1-OD2 2.73Å; R296-D390 PolarHBondContact NH1-OD2 2.74Å; R296-D390 IonicContact NH2-OD2 2.77Å; R296-D390 PolarHBondContact NH2-OD2 3.01Å
297	E	85.1	Confident	89	Confident	178 Å²	178	58.8 Å²	58.8	83%	0.832	34%	0.338	S	S	*	.	S	Bend	trans	-44.5	-36.1	179.8	-67.5	-174.8	-178.6	0	0	114.1
298	V	85.9	Confident	89	Confident	28 Å²	28	62.3 Å²	62.3	17%	0.17	36%	0.356	C	S	.	.	S	Bend	trans	-115.6	104.8	174.8	-176.4	0	0	0	0	107.3	R296 C394 Q395	R296-V298 PolarHBondContact NE-O 3.27Å; R296-V298 PolarHBondContact NH2-O 2.77Å; R296-V298 VanDerWaalsContact NH2-O 3.16Å; R296-V298 CarbonylContact O-C 3.53Å; R296-V298 PolarHBondContact O-N 3.42Å; V298-C394 HydrophobicContact CG1-CB 3.62Å; V298-Q395 HydrophobicContact CG2-CB 3.96Å; V298-Q395 HydrophobicContact CG2-CG 4.09Å
299	P	82.3	Confident	88.9	Confident	81 Å²	81	61.9 Å²	61.9	53%	0.526	35%	0.352	S	S	.	.			trans	-53.7	145.1	-177	-30.2	36.4	0	0	0	113.2	T301	P299-T301 PolarHBondContact O-N 3.38Å
300	V	86.8	Confident	88.9	Confident	15 Å²	15	60.5 Å²	60.5	9%	0.091	35%	0.345	C	S	.	.			trans	-72.5	108.5	176.3	179.5	0	0	0	0	109.3	M293 I356 R357	M293-V300 HydrophobicContact CB-CB 4.39Å; M293-V300 HydrophobicContact CB-CG2 3.87Å; M293-V300 HydrophobicContact CG-CG2 3.98Å; M293-V300 HydrophobicContact SD-CG2 4.4Å; V300-I356 HydrophobicContact CG1-CG2 4.27Å; V300-R357 HydrophobicContact CG1-CG 4.39Å
301	T	86	Confident	88.9	Confident	72 Å²	72	63.5 Å²	63.5	44%	0.442	36%	0.361	S	S	.	.	P	Polyproline II helix	trans	-102.3	136.2	177.5	56.7	0	0	0	0	111.6	P299 R357	P299-T301 PolarHBondContact O-N 3.38Å; T301-R357 PolarHBondContact O-NE 3.36Å; T301-R357 PolarHBondContact O-NH2 3.46Å; T301-R357 PolarHBondContact OG1-NH2 3.24Å
302	P	89.8	Confident	88.9	Confident	88 Å²	88	68.6 Å²	68.6	57%	0.571	39%	0.388	S	S	*	.	P	Polyproline II helix	trans	-70.1	142.9	174.7	30.4	-34.8	0	0	0	110.8	R357	P302-R357 WeakPolarHBondContact CA-O 3.39Å
303	V	89.7	Confident	89	Confident	10 Å²	10	66.6 Å²	66.6	6%	0.061	38%	0.38	C	S	.	.	P	Polyproline II helix	trans	-86.5	131.2	178	178.7	0	0	0	0	109.8	E309 L310 N358	V303-E309 HydrophobicContact CG1-CB 3.87Å; V303-E309 HydrophobicContact CG1-CG 4.01Å; V303-E309 HydrophobicContact CG2-CG 3.94Å; V303-L310 HydrophobicContact CB-CD1 4.37Å; V303-L310 HydrophobicContact CB-CD2 4.46Å; V303-L310 HydrophobicContact CB-CG 4.17Å; V303-L310 HydrophobicContact CG1-CG 4.17Å; V303-L310 HydrophobicContact CG2-CD2 3.75Å; V303-L310 HydrophobicContact CG2-CG 3.93Å; V303-N358 PolarHBondContact N-OD1 2.88Å
304	P	88.3	Confident	89.2	Confident	89 Å²	89	66.5 Å²	66.5	58%	0.578	38%	0.38	S	S	*	.	P	Polyproline II helix	trans	-57.3	140	175.5	-25.3	34.7	0	0	0	113.1	G306 S307	P304-G306 PolarHBondContact O-N 3.46Å; P304-S307 VanDerWaalsContact O-CB 3.29Å; P304-S307 WeakPolarHBondContact O-CB 3.38Å; P304-S307 PolarHBondContact O-N 2.91Å; P304-S307 VanDerWaalsContact O-N 3.11Å
305	E	81.8	Confident	89.4	Confident	200 Å²	200	70.4 Å²	70.4	94%	0.935	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.7	129.6	175.9	-65.1	-175.2	177.5	0	0	111.1
306	G	84.2	Confident	89.7	Confident	85 Å²	85	67.2 Å²	67.2	88%	0.876	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	83	9.6	-176.7	0	0	0	0	0	115.6	P304	P304-G306 PolarHBondContact O-N 3.46Å
307	S	88.9	Confident	90.1	Very high	49 Å²	49	65.7 Å²	65.7	34%	0.343	37%	0.374	S	S	.	.			trans	-85	129.9	170	-172.6	0	0	0	0	112	P304 E309	P304-S307 VanDerWaalsContact O-CB 3.29Å; P304-S307 WeakPolarHBondContact O-CB 3.38Å; P304-S307 PolarHBondContact O-N 2.91Å; P304-S307 VanDerWaalsContact O-N 3.11Å; S307-E309 PolarHBondContact O-N 3.39Å; S307-E309 VanDerWaalsContact O-N 3.11Å; S307-E309 VanDerWaalsContact OG-CB 3.23Å; S307-E309 WeakPolarHBondContact OG-CB 3.37Å; S307-E309 PolarHBondContact OG-N 2.99Å
308	D	91.1	Very high	90.5	Very high	119 Å²	119	58.8 Å²	58.8	64%	0.636	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70	1.5	172.6	-58.5	-39.4	0	0	0	113.1	L310 D311 L312	D308-L310 VanDerWaalsContact C-N 3.34Å; D308-L310 PolarHBondContact O-N 2.96Å; D308-D311 PolarHBondContact O-N 3.42Å; D308-D311 VanDerWaalsContact O-N 3.07Å; D308-L312 PolarHBondContact O-N 3.19Å; D308-L312 VanDerWaalsContact O-N 3.1Å
309	E	92.1	Very high	90.8	Very high	39 Å²	39	62 Å²	62	18%	0.182	35%	0.353	C	S	.	.	H	α-helix	trans	-51.1	-45.7	-179	165	161.7	-170.2	0	0	113.3	V303 S307 D311 L312 E313 R357 W393	V303-E309 HydrophobicContact CG1-CB 3.87Å; V303-E309 HydrophobicContact CG1-CG 4.01Å; V303-E309 HydrophobicContact CG2-CG 3.94Å; S307-E309 PolarHBondContact O-N 3.39Å; S307-E309 VanDerWaalsContact O-N 3.11Å; S307-E309 VanDerWaalsContact OG-CB 3.23Å; S307-E309 WeakPolarHBondContact OG-CB 3.37Å; S307-E309 PolarHBondContact OG-N 2.99Å; E309-D311 VanDerWaalsContact C-N 3.3Å; E309-D311 PolarHBondContact O-N 3.04Å; E309-L312 PolarHBondContact O-N 2.69Å; E309-E313 WeakPolarHBondContact O-CB 3.42Å; E309-E313 PolarHBondContact O-N 2.96Å; E309-R357 IonicContact OE1-CZ 3.21Å; E309-R357 VanDerWaalsContact OE1-CZ 3.28Å; E309-R357 IonicContact OE1-NH1 3.49Å; E309-R357 PolarHBondContact OE1-NH1 2.84Å; E309-R357 IonicContact OE1-NH2 3.24Å; E309-R357 PolarHBondContact OE1-NH2 3.31Å; E309-W393 HydrophobicContact CG-CH2 3.6Å; E309-W393 HydrophobicContact CG-CZ3 3.93Å; E309-W393 VanDerWaalsContact OE1-CZ3 3.31Å; E309-W393 WeakPolarHBondContact OE1-CZ3 3.46Å
310	L	93.1	Very high	91.3	Very high	14 Å²	14	60 Å²	60	7%	0.073	34%	0.335	C	S	.	.	H	α-helix	trans	-68.5	-26.4	180	-68	174.4	0	0	0	113.3	V303 D308 A314 K350 L353 E354	V303-L310 HydrophobicContact CB-CD1 4.37Å; V303-L310 HydrophobicContact CB-CD2 4.46Å; V303-L310 HydrophobicContact CB-CG 4.17Å; V303-L310 HydrophobicContact CG1-CG 4.17Å; V303-L310 HydrophobicContact CG2-CD2 3.75Å; V303-L310 HydrophobicContact CG2-CG 3.93Å; D308-L310 VanDerWaalsContact C-N 3.34Å; D308-L310 PolarHBondContact O-N 2.96Å; L310-A314 WeakPolarHBondContact O-CB 3.26Å; L310-A314 PolarHBondContact O-N 3.01Å; L310-K350 HydrophobicContact CB-CG 4.2Å; L310-L353 HydrophobicContact CD2-CB 3.74Å; L310-E354 HydrophobicContact CD1-CB 4.4Å
311	D	94.2	Very high	91.4	Very high	64 Å²	64	59.5 Å²	59.5	34%	0.342	33%	0.332	S	S	.	.	H	α-helix	trans	-75.5	-47.4	175.2	-66.6	-83.5	0	0	0	110.7	D308 E309 E313 A314 E315 K350	D308-D311 PolarHBondContact O-N 3.42Å; D308-D311 VanDerWaalsContact O-N 3.07Å; E309-D311 VanDerWaalsContact C-N 3.3Å; E309-D311 PolarHBondContact O-N 3.04Å; D311-E313 VanDerWaalsContact C-N 3.32Å; D311-E313 PolarHBondContact O-N 3.43Å; D311-A314 PolarHBondContact O-N 3.01Å; D311-E315 PolarHBondContact O-N 3.45Å; D311-K350 WeakPolarHBondContact OD1-CD 3.42Å; D311-K350 WeakPolarHBondContact OD1-CE 3.45Å; D311-K350 IonicContact OD1-NZ 3.42Å; D311-K350 PolarHBondContact OD1-NZ 2.98Å; D311-K350 VanDerWaalsContact OD2-CE 3.3Å; D311-K350 WeakPolarHBondContact OD2-CE 3.43Å; D311-K350 IonicContact OD2-NZ 2.7Å; D311-K350 PolarHBondContact OD2-NZ 3.16Å
312	L	93.9	Very high	91.6	Very high	106 Å²	106	57.2 Å²	57.2	56%	0.555	32%	0.316	S	S	*	.	H	α-helix	trans	-63.8	-37.9	176.9	-62.6	176.1	0	0	0	112	D308 E309 W316	D308-L312 PolarHBondContact O-N 3.19Å; D308-L312 VanDerWaalsContact O-N 3.1Å; E309-L312 PolarHBondContact O-N 2.69Å; L312-W316 VanDerWaalsContact O-CB 3.24Å; L312-W316 WeakPolarHBondContact O-CB 3.27Å; L312-W316 PolarHBondContact O-N 2.68Å
313	E	94.9	Very high	91.5	Very high	0 Å²	0	55.1 Å²	55.1	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-65.5	-48.1	172.4	-173.2	168.6	-146.3	0	0	110.9	E309 D311 E315 W316 I317 L353 R357 D390 W393	E309-E313 WeakPolarHBondContact O-CB 3.42Å; E309-E313 PolarHBondContact O-N 2.96Å; D311-E313 VanDerWaalsContact C-N 3.32Å; D311-E313 PolarHBondContact O-N 3.43Å; E313-E315 PolarHBondContact O-N 3.17Å; E313-W316 PolarHBondContact O-N 2.99Å; E313-I317 HydrophobicContact CG-CD1 3.94Å; E313-I317 HydrophobicContact CG-CG1 4.33Å; E313-I317 WeakPolarHBondContact O-CB 3.46Å; E313-I317 VanDerWaalsContact O-CG1 3.29Å; E313-I317 WeakPolarHBondContact O-CG1 3.5Å; E313-I317 PolarHBondContact O-N 2.82Å; E313-L353 HydrophobicContact CB-CD1 3.99Å; E313-L353 HydrophobicContact CG-CD1 3.64Å; E313-L353 HydrophobicContact CG-CD2 4.23Å; E313-R357 IonicContact OE1-NH1 2.75Å; E313-R357 IonicContact OE2-CZ 2.76Å; E313-R357 IonicContact OE2-NH1 3.61Å; E313-R357 PolarHBondContact OE2-NH1 3.16Å; E313-D390 WeakPolarHBondContact OE1-CA 3.4Å; E313-W393 HydrophobicContact CB-CD2 3.87Å; E313-W393 HydrophobicContact CB-CE3 4.26Å; E313-W393 HydrophobicContact CB-CG 4.21Å; E313-W393 HydrophobicContact CB-CZ2 4.29Å; E313-W393 HydrophobicContact CG-CB 4.14Å; E313-W393 HydrophobicContact CG-CD2 3.68Å; E313-W393 HydrophobicContact CG-CE3 3.98Å; E313-W393 HydrophobicContact CG-CG 3.71Å
314	A	96.3	Very high	91.3	Very high	0 Å²	0	60.7 Å²	60.7	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-62.6	-41.2	179.3	0	0	0	0	0	113.6	L310 D311 Y318 V346 I349 K350 L353	L310-A314 WeakPolarHBondContact O-CB 3.26Å; L310-A314 PolarHBondContact O-N 3.01Å; D311-A314 PolarHBondContact O-N 3.01Å; A314-Y318 WeakPolarHBondContact O-CB 3.21Å; A314-Y318 PolarHBondContact O-N 2.84Å; A314-V346 HydrophobicContact CB-CG1 4.03Å; A314-I349 HydrophobicContact CB-CB 4.24Å; A314-I349 HydrophobicContact CB-CG2 3.95Å; A314-K350 HydrophobicContact CB-CB 3.84Å; A314-L353 HydrophobicContact CB-CD1 4.14Å
315	E	95.6	Very high	91.1	Very high	126 Å²	126	62.4 Å²	62.4	59%	0.589	33%	0.327	S	S	*	.	H	α-helix	trans	-64.7	-42.1	173.2	-74.5	-162.7	166.9	0	0	111.9	D311 E313 Y318 K319 V346	D311-E315 PolarHBondContact O-N 3.45Å; E313-E315 PolarHBondContact O-N 3.17Å; E315-Y318 PolarHBondContact O-N 3.48Å; E315-K319 VanDerWaalsContact O-CB 3.31Å; E315-K319 WeakPolarHBondContact O-CB 3.35Å; E315-K319 PolarHBondContact O-N 3.44Å; E315-V346 HydrophobicContact CG-CG1 3.98Å
316	W	95.6	Very high	91.3	Very high	16 Å²	16	56.2 Å²	56.2	6%	0.061	30%	0.303	C	S	.	.	H	α-helix	trans	-64.6	-46.3	177.6	-175.8	94.8	0	0	0	111.6	L312 E313 Y318 K319 Y320 Y389 I392 W393 L396 Q445	L312-W316 VanDerWaalsContact O-CB 3.24Å; L312-W316 WeakPolarHBondContact O-CB 3.27Å; L312-W316 PolarHBondContact O-N 2.68Å; E313-W316 PolarHBondContact O-N 2.99Å; W316-Y318 PolarHBondContact O-N 3.1Å; W316-K319 PolarHBondContact O-N 2.88Å; W316-Y320 AromaticContact CD1-CD2 3.55Å; W316-Y320 AromaticContact CD1-CE2 3.63Å; W316-Y320 AromaticContact CD2-CD2 3.9Å; W316-Y320 HydrophobicContact CD2-CD2 3.9Å; W316-Y320 HydrophobicContact CD2-CG 4.32Å; W316-Y320 AromaticContact CE2-CD2 3.55Å; W316-Y320 AromaticContact CE2-CG 3.81Å; W316-Y320 AromaticContact CG-CD2 3.89Å; W316-Y320 HydrophobicContact CG-CD2 3.89Å; W316-Y320 HydrophobicContact CG-CE2 4.39Å; W316-Y320 HydrophobicContact CZ2-CD1 4.36Å; W316-Y320 HydrophobicContact CZ2-CD2 4.17Å; W316-Y320 AromaticContact CZ2-CG 3.96Å; W316-Y320 HydrophobicContact CZ2-CG 3.96Å; W316-Y320 AromaticContact NE1-CD2 3.31Å; W316-Y320 VanDerWaalsContact NE1-CD2 3.31Å; W316-Y320 AromaticContact NE1-CE2 3.4Å; W316-Y320 AromaticContact NE1-CG 3.98Å; W316-Y320 WeakPolarHBondContact O-CB 3.36Å; W316-Y320 WeakPolarHBondContact O-CD2 3.36Å; W316-Y320 PolarHBondContact O-N 2.86Å; W316-Y389 HydrophobicContact CH2-CD1 4.05Å; W316-Y389 AromaticContact CZ3-CD1 3.75Å; W316-Y389 HydrophobicContact CZ3-CD1 3.75Å; W316-Y389 HydrophobicContact CZ3-CG 4.44Å; W316-I392 HydrophobicContact CH2-CB 4.2Å; W316-I392 HydrophobicContact CH2-CG2 3.73Å; W316-I392 HydrophobicContact CZ2-CG2 4.47Å; W316-W393 AromaticContact CD2-CD1 3.65Å; W316-W393 HydrophobicContact CE3-CB 3.9Å; W316-W393 AromaticContact CE3-CD1 3.66Å; W316-W393 HydrophobicContact CE3-CG 4.18Å; W316-W393 AromaticContact CG-CD1 3.71Å; W316-W393 HydrophobicContact CZ3-CB 3.9Å; W316-L396 HydrophobicContact CZ2-CD2 4.27Å; W316-Q445 PolarHBondContact NE1-O 2.86Å
317	I	95.9	Very high	91.6	Very high	0 Å²	0	53.4 Å²	53.4	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-62.4	-43.9	176.4	-65.1	-176.4	0	0	0	110.4	E313 K319 Y320 A321 F322 I349 L353 V386 D390	E313-I317 HydrophobicContact CG-CD1 3.94Å; E313-I317 HydrophobicContact CG-CG1 4.33Å; E313-I317 WeakPolarHBondContact O-CB 3.46Å; E313-I317 VanDerWaalsContact O-CG1 3.29Å; E313-I317 WeakPolarHBondContact O-CG1 3.5Å; E313-I317 PolarHBondContact O-N 2.82Å; I317-K319 VanDerWaalsContact C-N 3.3Å; I317-K319 PolarHBondContact O-N 2.78Å; I317-Y320 PolarHBondContact O-N 2.77Å; I317-A321 HydrophobicContact CG2-CB 4.07Å; I317-A321 WeakPolarHBondContact O-CA 3.29Å; I317-A321 WeakPolarHBondContact O-CB 3.49Å; I317-A321 PolarHBondContact O-N 2.99Å; I317-F322 HydrophobicContact CG2-CE2 4.29Å; I317-I349 HydrophobicContact CB-CG2 4.04Å; I317-I349 HydrophobicContact CD1-CG2 4.42Å; I317-I349 HydrophobicContact CG2-CD1 4.4Å; I317-I349 HydrophobicContact CG2-CG2 3.97Å; I317-L353 HydrophobicContact CD1-CD1 4.21Å; I317-L353 HydrophobicContact CD1-CD2 3.85Å; I317-L353 HydrophobicContact CD1-CG 4.5Å; I317-V386 HydrophobicContact CD1-CG1 4.25Å; I317-V386 HydrophobicContact CG2-CG2 4.23Å; I317-D390 HydrophobicContact CD1-CB 4.44Å
318	Y	95	Very high	91.7	Very high	34 Å²	34	51.3 Å²	51.3	13%	0.133	25%	0.254	C	S	.	.	I	π-helix	trans	-57.6	-43.4	174.6	177.1	-101.4	0	0	0	112.3	A314 E315 W316 F322 C323 K341 P342 P343 V346 I349	A314-Y318 WeakPolarHBondContact O-CB 3.21Å; A314-Y318 PolarHBondContact O-N 2.84Å; E315-Y318 PolarHBondContact O-N 3.48Å; W316-Y318 PolarHBondContact O-N 3.1Å; Y318-F322 WeakPolarHBondContact O-CB 3.32Å; Y318-F322 PolarHBondContact O-N 2.79Å; Y318-C323 VanDerWaalsContact CE1-SG 3.52Å; Y318-C323 PolarHBondContact O-N 3.41Å; Y318-C323 PolarHBondContact O-SG 3.11Å; Y318-K341 HydrophobicContact CE2-CB 4.19Å; Y318-K341 PolarHBondContact OH-O 3.25Å; Y318-P342 WeakPolarHBondContact CE2-O 3.47Å; Y318-P343 WeakPolarHBondContact OH-CA 3.47Å; Y318-V346 HydrophobicContact CD1-CG2 3.81Å; Y318-V346 HydrophobicContact CD2-CG2 4.06Å; Y318-V346 HydrophobicContact CE1-CG2 4.49Å; Y318-V346 HydrophobicContact CG-CG2 3.57Å; Y318-I349 HydrophobicContact CD2-CD1 4.34Å
319	K	92.4	Very high	91.4	Very high	95 Å²	95	48.3 Å²	48.3	41%	0.413	24%	0.236	S	C	.	.	I	π-helix	trans	-67.4	-50.1	178.2	-179.6	-179.7	168	-167.2	0	112.5	E315 W316 I317 C323 K324	E315-K319 VanDerWaalsContact O-CB 3.31Å; E315-K319 WeakPolarHBondContact O-CB 3.35Å; E315-K319 PolarHBondContact O-N 3.44Å; W316-K319 PolarHBondContact O-N 2.88Å; I317-K319 VanDerWaalsContact C-N 3.3Å; I317-K319 PolarHBondContact O-N 2.78Å; K319-C323 CarbonylContact O-C 3.59Å; K319-C323 WeakPolarHBondContact O-CB 3.31Å; K319-C323 PolarHBondContact O-N 2.78Å; K319-K324 PolarHBondContact O-N 3.18Å
320	Y	91.2	Very high	91	Very high	38 Å²	38	46.8 Å²	46.8	15%	0.149	23%	0.229	C	C	.	.	I	π-helix	trans	-88.2	-30.4	-171.3	-78.5	-92.6	0	0	0	114.2	W316 I317 K324 Q445	W316-Y320 AromaticContact CD1-CD2 3.55Å; W316-Y320 AromaticContact CD1-CE2 3.63Å; W316-Y320 AromaticContact CD2-CD2 3.9Å; W316-Y320 HydrophobicContact CD2-CD2 3.9Å; W316-Y320 HydrophobicContact CD2-CG 4.32Å; W316-Y320 AromaticContact CE2-CD2 3.55Å; W316-Y320 AromaticContact CE2-CG 3.81Å; W316-Y320 AromaticContact CG-CD2 3.89Å; W316-Y320 HydrophobicContact CG-CD2 3.89Å; W316-Y320 HydrophobicContact CG-CE2 4.39Å; W316-Y320 HydrophobicContact CZ2-CD1 4.36Å; W316-Y320 HydrophobicContact CZ2-CD2 4.17Å; W316-Y320 AromaticContact CZ2-CG 3.96Å; W316-Y320 HydrophobicContact CZ2-CG 3.96Å; W316-Y320 AromaticContact NE1-CD2 3.31Å; W316-Y320 VanDerWaalsContact NE1-CD2 3.31Å; W316-Y320 AromaticContact NE1-CE2 3.4Å; W316-Y320 AromaticContact NE1-CG 3.98Å; W316-Y320 WeakPolarHBondContact O-CB 3.36Å; W316-Y320 WeakPolarHBondContact O-CD2 3.36Å; W316-Y320 PolarHBondContact O-N 2.86Å; I317-Y320 PolarHBondContact O-N 2.77Å; Y320-K324 HydrophobicContact CD1-CD 4.05Å; Y320-K324 HydrophobicContact CE1-CD 4.44Å; Y320-Q445 HydrophobicContact CE2-CB 3.99Å; Y320-Q445 WeakPolarHBondContact OH-CB 3.38Å
321	A	89.5	Confident	90	Very high	5 Å²	5	48.5 Å²	48.5	4%	0.041	24%	0.237	C	C	.	.	I	π-helix	trans	-91.4	-31.7	178.5	0	0	0	0	0	113.7	I317 K385 Y389	I317-A321 HydrophobicContact CG2-CB 4.07Å; I317-A321 WeakPolarHBondContact O-CA 3.29Å; I317-A321 WeakPolarHBondContact O-CB 3.49Å; I317-A321 PolarHBondContact O-N 2.99Å; A321-K385 HydrophobicContact CB-CD 4.13Å; A321-K385 HydrophobicContact CB-CG 4.26Å; A321-K385 WeakPolarHBondContact O-CE 3.44Å; A321-K385 PolarHBondContact O-NZ 3.18Å; A321-Y389 HydrophobicContact CB-CD1 3.71Å; A321-Y389 HydrophobicContact CB-CD2 3.86Å; A321-Y389 HydrophobicContact CB-CE1 3.66Å; A321-Y389 HydrophobicContact CB-CE2 3.84Å; A321-Y389 HydrophobicContact CB-CG 3.8Å
322	F	89.3	Confident	88.6	Confident	24 Å²	24	48.2 Å²	48.2	11%	0.105	23%	0.233	C	C	.	.	I	π-helix	trans	-118.6	-15.5	-172	-59.4	-81.2	0	0	0	115	I317 Y318 K341 I349 L378 D382 K385 V386	I317-F322 HydrophobicContact CG2-CE2 4.29Å; Y318-F322 WeakPolarHBondContact O-CB 3.32Å; Y318-F322 PolarHBondContact O-N 2.79Å; F322-K341 HydrophobicContact CB-CG 4.11Å; F322-K341 HydrophobicContact CD1-CD 4.35Å; F322-K341 HydrophobicContact CD1-CG 3.49Å; F322-K341 VanDerWaalsContact CD1-CG 3.49Å; F322-K341 HydrophobicContact CE1-CG 4.11Å; F322-K341 HydrophobicContact CG-CG 3.92Å; F322-I349 HydrophobicContact CD2-CD1 4.04Å; F322-I349 HydrophobicContact CE2-CD1 3.89Å; F322-L378 HydrophobicContact CZ-CD2 4.15Å; F322-D382 HydrophobicContact CE1-CB 4.19Å; F322-D382 WeakPolarHBondContact CE1-OD1 3.49Å; F322-D382 HydrophobicContact CZ-CB 4.17Å; F322-K385 HydrophobicContact CE1-CD 4.32Å; F322-K385 HydrophobicContact CZ-CD 4.38Å; F322-V386 HydrophobicContact CE2-CG2 4.35Å
323	C	87.9	Confident	86.8	Confident	44 Å²	44	46.3 Å²	46.3	30%	0.297	23%	0.227	S	C	.	.	I	π-helix	trans	-115	-32.1	179.1	-61.2	0	0	0	0	114.9	Y318 K319 H325	Y318-C323 VanDerWaalsContact CE1-SG 3.52Å; Y318-C323 PolarHBondContact O-N 3.41Å; Y318-C323 PolarHBondContact O-SG 3.11Å; K319-C323 CarbonylContact O-C 3.59Å; K319-C323 WeakPolarHBondContact O-CB 3.31Å; K319-C323 PolarHBondContact O-N 2.78Å; C323-H325 PolarHBondContact O-CE1 2.67Å; C323-H325 PolarHBondContact O-N 2.82Å; C323-H325 PolarHBondContact O-ND1 2.69Å
324	K	85.7	Confident	84.9	Confident	128 Å²	128	53.4 Å²	53.4	56%	0.557	26%	0.259	S	S	*	.	P	Polyproline II helix	trans	-61.9	128	172.3	-172.3	-176.7	176.3	-170.8	0	108.6	K319 Y320	K319-K324 PolarHBondContact O-N 3.18Å; Y320-K324 HydrophobicContact CD1-CD 4.05Å; Y320-K324 HydrophobicContact CE1-CD 4.44Å
325	H	84.1	Confident	83.2	Confident	124 Å²	124	55.1 Å²	55.1	57%	0.574	27%	0.272	S	S	*	.	P	Polyproline II helix	trans	-88.3	150.3	174	-67.5	48.6	0	0	0	109.1	C323	C323-H325 PolarHBondContact O-CE1 2.67Å; C323-H325 PolarHBondContact O-N 2.82Å; C323-H325 PolarHBondContact O-ND1 2.69Å
326	T	86.8	Confident	81.5	Confident	71 Å²	71	56.1 Å²	56.1	44%	0.436	27%	0.27	S	S	.	.	P	Polyproline II helix	trans	-64.5	151.2	165.5	47.8	0	0	0	0	110.2	S328 Q330 E742	T326-S328 VanDerWaalsContact C-N 3.3Å; T326-S328 WeakPolarHBondContact CB-O 3.34Å; T326-S328 PolarHBondContact OG1-O 2.83Å; T326-Q330 HydrophobicContact CG2-CB 4.2Å; T326-Q330 HydrophobicContact CG2-CG 4.09Å; T326-E742 WeakPolarHBondContact CA-OE1 3.34Å; T326-E742 VanDerWaalsContact CB-CD 3.47Å; T326-E742 VanDerWaalsContact CB-OE1 3.28Å; T326-E742 WeakPolarHBondContact CB-OE1 3.17Å; T326-E742 HydrophobicContact CG2-CG 3.98Å
327	V	89.8	Confident	79.7	Confident	25 Å²	25	63.9 Å²	63.9	15%	0.152	31%	0.307	C	S	.	.	S	Bend	trans	-69.7	-33.6	176	-165.6	0	0	0	0	110.2	F616 V650 S651 L735 T738 L739 E742	V327-F616 HydrophobicContact CG1-CB 4.32Å; V327-F616 HydrophobicContact CG2-CD2 3.92Å; V327-V650 HydrophobicContact CG1-CG1 3.84Å; V327-S651 WeakPolarHBondContact O-CA 3.42Å; V327-S651 WeakPolarHBondContact O-CB 3.35Å; V327-L735 HydrophobicContact CG1-CD1 3.95Å; V327-T738 HydrophobicContact CG2-CG2 3.74Å; V327-L739 HydrophobicContact CB-CD2 4.29Å; V327-E742 PolarHBondContact N-OE1 2.85Å; V327-E742 PolarHBondContact N-OE2 3.42Å
328	S	91	Very high	78.1	Confident	6 Å²	6	70.7 Å²	70.7	4%	0.042	34%	0.336	C	S	.	.	S	Bend	trans	-102.7	162.1	175.7	61.2	0	0	0	0	113.7	T326 Q330 L653 E742	T326-S328 VanDerWaalsContact C-N 3.3Å; T326-S328 WeakPolarHBondContact CB-O 3.34Å; T326-S328 PolarHBondContact OG1-O 2.83Å; S328-Q330 VanDerWaalsContact C-N 3.35Å; S328-Q330 PolarHBondContact O-N 3.47Å; S328-Q330 WeakPolarHBondContact OG-CG 3.49Å; S328-Q330 PolarHBondContact OG-NE2 2.8Å; S328-L653 WeakPolarHBondContact CB-O 3.41Å; S328-E742 WeakPolarHBondContact CB-OE2 3.22Å; S328-E742 PolarHBondContact N-OE2 2.82Å; S328-E742 PolarHBondContact OG-OE2 2.7Å
329	E	86	Confident	76.6	Confident	56 Å²	56	73.1 Å²	73.1	26%	0.262	35%	0.35	S	S	.	.	B	Isolated β-bridge	trans	-75.8	81.1	176.4	-168.2	-172.4	-161.5	0	0	110.5	E331 P333 L653 F654 G655	E329-E331 VanDerWaalsContact C-N 3.31Å; E329-E331 WeakPolarHBondContact CG-O 3.41Å; E329-E331 PolarHBondContact O-N 3.1Å; E329-P333 WeakPolarHBondContact OE1-CD 3.44Å; E329-L653 PolarHBondContact N-O 2.73Å; E329-F654 HydrophobicContact CB-CD2 4.09Å; E329-F654 HydrophobicContact CG-CD2 3.88Å; E329-F654 HydrophobicContact CG-CE2 4.35Å; E329-F654 WeakPolarHBondContact O-CA 3.24Å; E329-F654 WeakPolarHBondContact O-CD2 3.5Å; E329-G655 PolarHBondContact O-N 2.72Å
330	Q	81.8	Confident	75.6	Confident	7 Å²	7	78 Å²	78	3%	0.033	37%	0.366	C	S	.	.			trans	-83.2	-0.9	-179.4	-67.5	-58.9	-21.6	0	0	114.9	T326 S328 G655 E742 R749	T326-Q330 HydrophobicContact CG2-CB 4.2Å; T326-Q330 HydrophobicContact CG2-CG 4.09Å; S328-Q330 VanDerWaalsContact C-N 3.35Å; S328-Q330 PolarHBondContact O-N 3.47Å; S328-Q330 WeakPolarHBondContact OG-CG 3.49Å; S328-Q330 PolarHBondContact OG-NE2 2.8Å; Q330-G655 PolarHBondContact NE2-O 2.85Å; Q330-G655 VanDerWaalsContact OE1-CA 3.28Å; Q330-E742 HydrophobicContact CG-CB 3.97Å; Q330-E742 HydrophobicContact CG-CG 4.49Å; Q330-E742 PolarHBondContact OE1-O 3.11Å; Q330-R749 PolarHBondContact O-NH2 3.27Å
331	E	72.6	Confident	75.2	Confident	50 Å²	50	77.5 Å²	77.5	23%	0.234	37%	0.365	C	S	.	.	S	Bend	trans	-149.8	147.1	-178.3	-66.8	-179	-175.7	0	0	112.1	E329 M339 R749	E329-E331 VanDerWaalsContact C-N 3.31Å; E329-E331 WeakPolarHBondContact CG-O 3.41Å; E329-E331 PolarHBondContact O-N 3.1Å; E331-M339 VanDerWaalsContact OE1-CE 3.24Å; E331-M339 WeakPolarHBondContact OE1-CE 3.24Å; E331-R749 IonicContact OE1-CZ 2.8Å; E331-R749 IonicContact OE1-NH1 3.31Å; E331-R749 PolarHBondContact OE1-NH1 2.81Å
332	K	65.6	Low	75.2	Confident	58 Å²	58	80 Å²	80	25%	0.252	38%	0.38	S	S	.	.			trans	-59.1	142.9	171.1	-65.9	176.1	-179.7	173.1	0	110.1	E334 S335 R336 L1724	K332-E334 PolarHBondContact O-N 2.89Å; K332-E334 VanDerWaalsContact O-N 3.13Å; K332-S335 WeakPolarHBondContact O-CB 3.35Å; K332-S335 PolarHBondContact O-N 3.33Å; K332-R336 PolarHBondContact O-N 3.06Å; K332-L1724 PolarHBondContact NZ-O 2.84Å
333	P	56.5	Low	75.1	Confident	66 Å²	66	83.5 Å²	83.5	43%	0.429	41%	0.406	S	S	.	.	H	α-helix	trans	-61.8	-28.7	-176.7	23.1	-33.8	0	0	0	113.6	E329 S335 R336 E337	E329-P333 WeakPolarHBondContact OE1-CD 3.44Å; P333-S335 PolarHBondContact O-N 3.37Å; P333-R336 PolarHBondContact O-N 2.87Å; P333-E337 PolarHBondContact O-N 2.93Å
334	E	53.6	Low	75.2	Confident	148 Å²	148	85.3 Å²	85.3	69%	0.692	42%	0.415	S	S	*	.	H	α-helix	trans	-68.2	-17.7	174.1	-64.1	-176.9	-159.9	0	0	114.2	K332 K338	K332-E334 PolarHBondContact O-N 2.89Å; K332-E334 VanDerWaalsContact O-N 3.13Å; E334-K338 WeakPolarHBondContact O-CD 3.34Å; E334-K338 WeakPolarHBondContact O-CE 3.34Å; E334-K338 PolarHBondContact O-NZ 2.99Å
335	S	61.9	Low	75.6	Confident	37 Å²	37	79.2 Å²	79.2	26%	0.259	39%	0.389	S	S	.	.	H	α-helix	trans	-86.6	-39.1	171	-61.4	0	0	0	0	110.8	K332 P333 E337 K338 M339	K332-S335 WeakPolarHBondContact O-CB 3.35Å; K332-S335 PolarHBondContact O-N 3.33Å; P333-S335 PolarHBondContact O-N 3.37Å; S335-E337 VanDerWaalsContact C-N 3.31Å; S335-E337 PolarHBondContact O-N 2.89Å; S335-K338 WeakPolarHBondContact O-CA 3.24Å; S335-K338 WeakPolarHBondContact O-CB 3.29Å; S335-K338 PolarHBondContact O-N 3.47Å; S335-M339 PolarHBondContact O-N 3.41Å; S335-M339 VanDerWaalsContact O-N 3.09Å
336	R	59.7	Low	76.1	Confident	147 Å²	147	74.5 Å²	74.5	56%	0.555	37%	0.369	S	S	*	.	H	α-helix	trans	-58.8	-37	-176.7	-157.1	174.9	76.6	-176	7.3	113.6	K332 P333 K338	K332-R336 PolarHBondContact O-N 3.06Å; P333-R336 PolarHBondContact O-N 2.87Å; R336-K338 VanDerWaalsContact C-N 3.33Å; R336-K338 PolarHBondContact O-N 3.25Å
337	E	57.9	Low	76.4	Confident	178 Å²	178	76.3 Å²	76.3	83%	0.832	38%	0.376	S	S	*	.	H	α-helix	trans	-68	-28.9	173.6	-70.2	-165.9	157.1	0	0	113.5	P333 S335	P333-E337 PolarHBondContact O-N 2.93Å; S335-E337 VanDerWaalsContact C-N 3.31Å; S335-E337 PolarHBondContact O-N 2.89Å
338	K	60.7	Low	76.7	Confident	143 Å²	143	77 Å²	77	62%	0.622	38%	0.377	S	S	*	.	H	α-helix	trans	-80.8	-27.9	179.6	-56.6	169.2	-171.4	134.5	0	112.6	E334 S335 R336	E334-K338 WeakPolarHBondContact O-CD 3.34Å; E334-K338 WeakPolarHBondContact O-CE 3.34Å; E334-K338 PolarHBondContact O-NZ 2.99Å; S335-K338 WeakPolarHBondContact O-CA 3.24Å; S335-K338 WeakPolarHBondContact O-CB 3.29Å; S335-K338 PolarHBondContact O-N 3.47Å; R336-K338 VanDerWaalsContact C-N 3.33Å; R336-K338 PolarHBondContact O-N 3.25Å
339	M	63.8	Low	76.9	Confident	85 Å²	85	76.7 Å²	76.7	42%	0.419	38%	0.375	S	S	.	.	H	α-helix	trans	-88.2	-13.5	-174.4	-74.6	176.7	54.1	0	0	114.1	E331 S335 K341	E331-M339 VanDerWaalsContact OE1-CE 3.24Å; E331-M339 WeakPolarHBondContact OE1-CE 3.24Å; S335-M339 PolarHBondContact O-N 3.41Å; S335-M339 VanDerWaalsContact O-N 3.09Å; M339-K341 PolarHBondContact O-N 3.22Å
340	R	71.5	Confident	77.4	Confident	197 Å²	197	77 Å²	77	74%	0.743	38%	0.375	S	S	*	.			trans	-69.4	101.5	174	-172.3	178.6	-175.3	173.6	4.6	111
341	K	84	Confident	77.9	Confident	29 Å²	29	79.9 Å²	79.9	13%	0.126	39%	0.388	C	S	.	.			trans	-66.4	151.7	175.4	-52.8	-59.4	-175.8	170.5	0	111.9	Y318 F322 M339 T345 E377 D382	Y318-K341 HydrophobicContact CE2-CB 4.19Å; Y318-K341 PolarHBondContact OH-O 3.25Å; F322-K341 HydrophobicContact CB-CG 4.11Å; F322-K341 HydrophobicContact CD1-CD 4.35Å; F322-K341 HydrophobicContact CD1-CG 3.49Å; F322-K341 VanDerWaalsContact CD1-CG 3.49Å; F322-K341 HydrophobicContact CE1-CG 4.11Å; F322-K341 HydrophobicContact CG-CG 3.92Å; M339-K341 PolarHBondContact O-N 3.22Å; K341-T345 HydrophobicContact CB-CG2 4.22Å; K341-T345 HydrophobicContact CG-CG2 4.39Å; K341-E377 WeakPolarHBondContact CE-O 3.28Å; K341-E377 PolarHBondContact NZ-O 2.89Å; K341-D382 WeakPolarHBondContact CE-OD1 3.48Å; K341-D382 IonicContact NZ-OD1 3.58Å; K341-D382 PolarHBondContact NZ-OD1 3.19Å; K341-D382 IonicContact NZ-OD2 2.71Å; K341-D382 PolarHBondContact NZ-OD2 3.24Å
342	P	88.2	Confident	79	Confident	57 Å²	57	77.5 Å²	77.5	37%	0.37	38%	0.377	S	S	.	.			trans	-75.9	158.8	170.7	32.4	-36.3	0	0	0	112.2	Y318 T344 T345 E377	Y318-P342 WeakPolarHBondContact CE2-O 3.47Å; P342-T344 VanDerWaalsContact CG-OG1 3.31Å; P342-T344 WeakPolarHBondContact CG-OG1 2.77Å; P342-T344 PolarHBondContact O-N 3.24Å; P342-T344 VanDerWaalsContact O-N 3.12Å; P342-T345 WeakPolarHBondContact CD-OG1 3.32Å; P342-T345 VanDerWaalsContact O-CB 3.28Å; P342-T345 WeakPolarHBondContact O-CB 3.49Å; P342-T345 PolarHBondContact O-N 3.43Å; P342-T345 PolarHBondContact O-OG1 3.42Å; P342-T345 VanDerWaalsContact O-OG1 3.08Å; P342-E377 HydrophobicContact CG-CG 4.09Å; P342-E377 WeakPolarHBondContact CG-OE2 3.34Å
343	P	88.5	Confident	80.5	Confident	98 Å²	98	74.7 Å²	74.7	64%	0.636	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.2	-22.2	177.6	-25.6	35.3	0	0	0	115.1	Y318 T345 V346	Y318-P343 WeakPolarHBondContact OH-CA 3.47Å; P343-T345 PolarHBondContact O-N 3.46Å; P343-T345 VanDerWaalsContact O-N 3.16Å; P343-V346 WeakPolarHBondContact O-CG2 3.36Å; P343-V346 PolarHBondContact O-N 3.39Å
344	T	90.3	Very high	82.3	Confident	82 Å²	82	75.2 Å²	75.2	50%	0.503	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-21.9	173.5	47.3	0	0	0	0	113.3	P342 V346 N347 E377	P342-T344 VanDerWaalsContact CG-OG1 3.31Å; P342-T344 WeakPolarHBondContact CG-OG1 2.77Å; P342-T344 PolarHBondContact O-N 3.24Å; P342-T344 VanDerWaalsContact O-N 3.12Å; T344-V346 PolarHBondContact O-N 3.18Å; T344-N347 PolarHBondContact O-N 3.22Å; T344-E377 WeakPolarHBondContact CB-OE2 3.37Å; T344-E377 PolarHBondContact OG1-OE2 2.96Å
345	T	92.7	Very high	84.3	Confident	0 Å²	0	68.6 Å²	68.6	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-67.9	-20.1	-178	-56.3	0	0	0	0	112.6	K341 P342 P343 N347 K348 I349 E377 L378	K341-T345 HydrophobicContact CB-CG2 4.22Å; K341-T345 HydrophobicContact CG-CG2 4.39Å; P342-T345 WeakPolarHBondContact CD-OG1 3.32Å; P342-T345 VanDerWaalsContact O-CB 3.28Å; P342-T345 WeakPolarHBondContact O-CB 3.49Å; P342-T345 PolarHBondContact O-N 3.43Å; P342-T345 PolarHBondContact O-OG1 3.42Å; P342-T345 VanDerWaalsContact O-OG1 3.08Å; P343-T345 PolarHBondContact O-N 3.46Å; P343-T345 VanDerWaalsContact O-N 3.16Å; T345-N347 VanDerWaalsContact C-N 3.31Å; T345-N347 PolarHBondContact O-N 2.87Å; T345-K348 PolarHBondContact O-N 3.35Å; T345-I349 HydrophobicContact CG2-CD1 4.13Å; T345-I349 HydrophobicContact CG2-CG1 4.23Å; T345-I349 WeakPolarHBondContact O-CG1 3.26Å; T345-I349 PolarHBondContact O-N 2.95Å; T345-E377 WeakPolarHBondContact CA-OE2 3.47Å; T345-E377 HydrophobicContact CG2-CB 4.29Å; T345-E377 PolarHBondContact N-OE2 3.14Å; T345-E377 PolarHBondContact OG1-OE2 3.12Å; T345-L378 HydrophobicContact CG2-CD2 3.63Å; T345-L378 HydrophobicContact CG2-CG 4.06Å
346	V	95.2	Very high	85.8	Confident	25 Å²	25	66.9 Å²	66.9	15%	0.152	32%	0.319	C	S	.	.	H	α-helix	trans	-53.8	-47	173.1	177	0	0	0	0	111.1	A314 E315 Y318 P343 T344 K348 I349 K350	A314-V346 HydrophobicContact CB-CG1 4.03Å; E315-V346 HydrophobicContact CG-CG1 3.98Å; Y318-V346 HydrophobicContact CD1-CG2 3.81Å; Y318-V346 HydrophobicContact CD2-CG2 4.06Å; Y318-V346 HydrophobicContact CE1-CG2 4.49Å; Y318-V346 HydrophobicContact CG-CG2 3.57Å; P343-V346 WeakPolarHBondContact O-CG2 3.36Å; P343-V346 PolarHBondContact O-N 3.39Å; T344-V346 PolarHBondContact O-N 3.18Å; V346-K348 PolarHBondContact O-N 3.02Å; V346-I349 PolarHBondContact O-N 2.88Å; V346-K350 PolarHBondContact O-N 3.2Å
347	N	94	Very high	87.4	Confident	109 Å²	109	60 Å²	60	58%	0.583	29%	0.293	S	S	*	.	H	α-helix	trans	-61.5	-31.4	179.7	-65.3	0.3	0	0	0	112.4	T344 T345 Q351	T344-N347 PolarHBondContact O-N 3.22Å; T345-N347 VanDerWaalsContact C-N 3.31Å; T345-N347 PolarHBondContact O-N 2.87Å; N347-Q351 WeakPolarHBondContact O-CG 3.43Å; N347-Q351 PolarHBondContact O-N 3.38Å; N347-Q351 VanDerWaalsContact O-N 3.09Å
348	K	94.7	Very high	89	Confident	38 Å²	38	54.1 Å²	54.1	17%	0.165	27%	0.267	C	S	.	.	H	α-helix	trans	-83.4	-30.1	-179.8	-59.4	-167.6	164.7	168.5	0	112.4	T345 V346 T352 Y373 K375 E377 L378	T345-K348 PolarHBondContact O-N 3.35Å; V346-K348 PolarHBondContact O-N 3.02Å; K348-T352 WeakPolarHBondContact O-CB 3.4Å; K348-T352 PolarHBondContact O-N 2.87Å; K348-T352 PolarHBondContact O-OG1 2.84Å; K348-Y373 WeakPolarHBondContact CD-O 3.1Å; K348-Y373 WeakPolarHBondContact CE-O 3.47Å; K348-Y373 WeakPolarHBondContact CG-O 3.47Å; K348-K375 PolarHBondContact NZ-O 3.33Å; K348-E377 HydrophobicContact CD-CB 4.23Å; K348-E377 WeakPolarHBondContact CD-OE1 3.25Å; K348-E377 VanDerWaalsContact CE-OE1 3.3Å; K348-E377 WeakPolarHBondContact CE-OE1 3.29Å; K348-E377 IonicContact NZ-OE1 3.81Å; K348-E377 PolarHBondContact NZ-OE1 3.26Å; K348-L378 HydrophobicContact CB-CD1 3.97Å
349	I	96	Very high	90.6	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-64.3	-47.5	166.5	-65.5	164.2	0	0	0	109.1	A314 I317 Y318 F322 T345 V346 Q351 T352 L353 L378 V386	A314-I349 HydrophobicContact CB-CB 4.24Å; A314-I349 HydrophobicContact CB-CG2 3.95Å; I317-I349 HydrophobicContact CB-CG2 4.04Å; I317-I349 HydrophobicContact CD1-CG2 4.42Å; I317-I349 HydrophobicContact CG2-CD1 4.4Å; I317-I349 HydrophobicContact CG2-CG2 3.97Å; Y318-I349 HydrophobicContact CD2-CD1 4.34Å; F322-I349 HydrophobicContact CD2-CD1 4.04Å; F322-I349 HydrophobicContact CE2-CD1 3.89Å; T345-I349 HydrophobicContact CG2-CD1 4.13Å; T345-I349 HydrophobicContact CG2-CG1 4.23Å; T345-I349 WeakPolarHBondContact O-CG1 3.26Å; T345-I349 PolarHBondContact O-N 2.95Å; V346-I349 PolarHBondContact O-N 2.88Å; I349-Q351 PolarHBondContact O-N 2.99Å; I349-T352 CarbonylContact O-C 3.6Å; I349-T352 WeakPolarHBondContact O-CA 3.39Å; I349-T352 WeakPolarHBondContact O-CB 3.36Å; I349-T352 PolarHBondContact O-N 2.63Å; I349-L353 HydrophobicContact CG2-CD1 4.01Å; I349-L353 HydrophobicContact CG2-CG 4.35Å; I349-L353 WeakPolarHBondContact O-CG 3.37Å; I349-L353 PolarHBondContact O-N 2.66Å; I349-L378 HydrophobicContact CG1-CD1 4.33Å; I349-V386 HydrophobicContact CG1-CG2 4.04Å; I349-V386 HydrophobicContact CG2-CG1 4.1Å; I349-V386 HydrophobicContact CG2-CG2 4.17Å
350	K	95.5	Very high	92	Very high	62 Å²	62	47.3 Å²	47.3	27%	0.27	24%	0.236	S	C	.	.	H	α-helix	trans	-54.7	-50.4	175	-175.2	179.5	-177.3	175.3	0	112.5	L310 D311 A314 V346 T352 L353 E354	L310-K350 HydrophobicContact CB-CG 4.2Å; D311-K350 WeakPolarHBondContact OD1-CD 3.42Å; D311-K350 WeakPolarHBondContact OD1-CE 3.45Å; D311-K350 IonicContact OD1-NZ 3.42Å; D311-K350 PolarHBondContact OD1-NZ 2.98Å; D311-K350 VanDerWaalsContact OD2-CE 3.3Å; D311-K350 WeakPolarHBondContact OD2-CE 3.43Å; D311-K350 IonicContact OD2-NZ 2.7Å; D311-K350 PolarHBondContact OD2-NZ 3.16Å; A314-K350 HydrophobicContact CB-CB 3.84Å; V346-K350 PolarHBondContact O-N 3.2Å; K350-T352 VanDerWaalsContact C-N 3.28Å; K350-T352 PolarHBondContact O-N 3.03Å; K350-L353 PolarHBondContact O-N 3.25Å; K350-E354 PolarHBondContact O-N 3.35Å
351	Q	93.7	Very high	93.2	Very high	68 Å²	68	38.1 Å²	38.1	32%	0.318	20%	0.202	S	C	.	.	H	α-helix	trans	-61.7	-35	176.4	-72.2	170.5	-1.5	0	0	112.4	N347 I349 F355 Y373	N347-Q351 WeakPolarHBondContact O-CG 3.43Å; N347-Q351 PolarHBondContact O-N 3.38Å; N347-Q351 VanDerWaalsContact O-N 3.09Å; I349-Q351 PolarHBondContact O-N 2.99Å; Q351-F355 WeakPolarHBondContact O-CD2 3.13Å; Q351-F355 VanDerWaalsContact O-CG 3.26Å; Q351-F355 WeakPolarHBondContact O-CG 3.39Å; Q351-F355 PolarHBondContact O-N 3.31Å; Q351-F355 VanDerWaalsContact O-N 3.09Å; Q351-Y373 PolarHBondContact OE1-O 3.24Å
352	T	95.8	Very high	93.7	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-65.9	-44.2	173.7	-58.7	0	0	0	0	111.9	K348 I349 K350 F355 I356 I366 L383 V386	K348-T352 WeakPolarHBondContact O-CB 3.4Å; K348-T352 PolarHBondContact O-N 2.87Å; K348-T352 PolarHBondContact O-OG1 2.84Å; I349-T352 CarbonylContact O-C 3.6Å; I349-T352 WeakPolarHBondContact O-CA 3.39Å; I349-T352 WeakPolarHBondContact O-CB 3.36Å; I349-T352 PolarHBondContact O-N 2.63Å; K350-T352 VanDerWaalsContact C-N 3.28Å; K350-T352 PolarHBondContact O-N 3.03Å; T352-F355 PolarHBondContact O-N 3.26Å; T352-I356 HydrophobicContact CG2-CD1 3.81Å; T352-I356 WeakPolarHBondContact O-CG1 3.18Å; T352-I356 PolarHBondContact O-N 3.23Å; T352-I366 HydrophobicContact CG2-CD1 4.4Å; T352-L383 HydrophobicContact CG2-CD2 3.54Å; T352-L383 WeakPolarHBondContact OG1-CD2 3.49Å; T352-V386 HydrophobicContact CG2-CB 4.25Å; T352-V386 HydrophobicContact CG2-CG1 3.85Å
353	L	95.5	Very high	94.1	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-64.6	-39	176.6	-65.7	165.8	0	0	0	111.6	L310 E313 A314 I317 I349 K350 F355 I356 R357 V386 D390	L310-L353 HydrophobicContact CD2-CB 3.74Å; E313-L353 HydrophobicContact CB-CD1 3.99Å; E313-L353 HydrophobicContact CG-CD1 3.64Å; E313-L353 HydrophobicContact CG-CD2 4.23Å; A314-L353 HydrophobicContact CB-CD1 4.14Å; I317-L353 HydrophobicContact CD1-CD1 4.21Å; I317-L353 HydrophobicContact CD1-CD2 3.85Å; I317-L353 HydrophobicContact CD1-CG 4.5Å; I349-L353 HydrophobicContact CG2-CD1 4.01Å; I349-L353 HydrophobicContact CG2-CG 4.35Å; I349-L353 WeakPolarHBondContact O-CG 3.37Å; I349-L353 PolarHBondContact O-N 2.66Å; K350-L353 PolarHBondContact O-N 3.25Å; L353-F355 VanDerWaalsContact C-N 3.34Å; L353-F355 PolarHBondContact O-N 3.48Å; L353-I356 PolarHBondContact O-N 3.11Å; L353-R357 WeakPolarHBondContact O-CB 3.32Å; L353-R357 PolarHBondContact O-N 2.96Å; L353-V386 HydrophobicContact CD2-CG1 3.84Å; L353-V386 HydrophobicContact CG-CG1 4.13Å; L353-D390 HydrophobicContact CD2-CB 3.78Å; L353-D390 WeakPolarHBondContact CD2-OD1 3.33Å
354	E	94.6	Very high	94.4	Very high	76 Å²	76	29.5 Å²	29.5	36%	0.355	15%	0.149	S	C	.	.	I	π-helix	trans	-60.4	-42.8	173.2	-167.9	-169.1	147.5	0	0	111.6	L310 K350 N358 Q359	L310-E354 HydrophobicContact CD1-CB 4.4Å; K350-E354 PolarHBondContact O-N 3.35Å; E354-N358 WeakPolarHBondContact O-CB 3.25Å; E354-N358 PolarHBondContact O-N 3.37Å; E354-N358 VanDerWaalsContact O-N 3.08Å; E354-Q359 PolarHBondContact O-N 2.87Å; E354-Q359 VanDerWaalsContact O-N 3.08Å
355	F	95.4	Very high	94.7	Very high	10 Å²	10	25.6 Å²	25.6	4%	0.044	13%	0.125	C	C	.	.	I	π-helix	trans	-64	-40.8	174	-64.7	-36.9	0	0	0	112.7	Q351 T352 L353 Q359 Q360 L361 I366 R370 Y373	Q351-F355 WeakPolarHBondContact O-CD2 3.13Å; Q351-F355 VanDerWaalsContact O-CG 3.26Å; Q351-F355 WeakPolarHBondContact O-CG 3.39Å; Q351-F355 PolarHBondContact O-N 3.31Å; Q351-F355 VanDerWaalsContact O-N 3.09Å; T352-F355 PolarHBondContact O-N 3.26Å; L353-F355 VanDerWaalsContact C-N 3.34Å; L353-F355 PolarHBondContact O-N 3.48Å; F355-Q359 HydrophobicContact CD1-CG 4.48Å; F355-Q359 CarbonylContact O-C 3.52Å; F355-Q359 WeakPolarHBondContact O-CB 3.46Å; F355-Q359 PolarHBondContact O-N 3.24Å; F355-Q360 PolarHBondContact O-N 2.85Å; F355-Q360 VanDerWaalsContact O-N 3.07Å; F355-L361 HydrophobicContact CB-CB 4.32Å; F355-L361 HydrophobicContact CB-CD1 4.1Å; F355-L361 HydrophobicContact CD1-CD1 4.06Å; F355-L361 HydrophobicContact CG-CD1 4.28Å; F355-L361 WeakPolarHBondContact O-CB 3.36Å; F355-L361 PolarHBondContact O-N 3.21Å; F355-I366 HydrophobicContact CB-CD1 3.59Å; F355-I366 HydrophobicContact CB-CG1 3.86Å; F355-I366 HydrophobicContact CD2-CD1 4.44Å; F355-I366 HydrophobicContact CD2-CG1 4.2Å; F355-I366 HydrophobicContact CD2-CG2 4.06Å; F355-I366 HydrophobicContact CG-CD1 4.48Å; F355-I366 HydrophobicContact CG-CG1 4.36Å; F355-R370 HydrophobicContact CD2-CB 4.26Å; F355-R370 HydrophobicContact CE1-CG 4.5Å; F355-R370 HydrophobicContact CE2-CB 3.76Å; F355-R370 HydrophobicContact CE2-CG 4.26Å; F355-R370 HydrophobicContact CZ-CB 4.08Å; F355-R370 HydrophobicContact CZ-CG 4.23Å; F355-Y373 HydrophobicContact CE2-CD2 4.02Å; F355-Y373 HydrophobicContact CE2-CG 4.04Å; F355-Y373 HydrophobicContact CZ-CD1 4.37Å; F355-Y373 AromaticContact CZ-CD2 3.67Å; F355-Y373 HydrophobicContact CZ-CD2 3.67Å; F355-Y373 HydrophobicContact CZ-CE2 4.15Å; F355-Y373 AromaticContact CZ-CG 3.81Å; F355-Y373 HydrophobicContact CZ-CG 3.81Å
356	I	94.6	Very high	94.9	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	13%	0.125	C	C	.	.	I	π-helix	trans	-71.1	-59.3	179.7	-68.1	165.2	0	0	0	111.1	M293 V300 T352 L353 Q360 I366 Y387	M293-I356 HydrophobicContact CE-CG2 4.23Å; V300-I356 HydrophobicContact CG1-CG2 4.27Å; T352-I356 HydrophobicContact CG2-CD1 3.81Å; T352-I356 WeakPolarHBondContact O-CG1 3.18Å; T352-I356 PolarHBondContact O-N 3.23Å; L353-I356 PolarHBondContact O-N 3.11Å; I356-Q360 VanDerWaalsContact O-CA 3.26Å; I356-Q360 WeakPolarHBondContact O-CA 3.49Å; I356-Q360 PolarHBondContact O-N 3.4Å; I356-I366 HydrophobicContact CG1-CD1 3.82Å; I356-Y387 HydrophobicContact CD1-CD2 4.2Å; I356-Y387 HydrophobicContact CG2-CD2 4.06Å; I356-Y387 HydrophobicContact CG2-CE2 4.4Å
357	R	92.4	Very high	94.8	Very high	4 Å²	4	25 Å²	25	2%	0.015	12%	0.122	C	C	.	.	I	π-helix	trans	-78.1	-41.4	-169.2	-62.8	-173.2	65.5	-175.7	-1.6	113.1	V300 T301 P302 E309 E313 L353 D390	V300-R357 HydrophobicContact CG1-CG 4.39Å; T301-R357 PolarHBondContact O-NE 3.36Å; T301-R357 PolarHBondContact O-NH2 3.46Å; T301-R357 PolarHBondContact OG1-NH2 3.24Å; P302-R357 WeakPolarHBondContact CA-O 3.39Å; E309-R357 IonicContact OE1-CZ 3.21Å; E309-R357 VanDerWaalsContact OE1-CZ 3.28Å; E309-R357 IonicContact OE1-NH1 3.49Å; E309-R357 PolarHBondContact OE1-NH1 2.84Å; E309-R357 IonicContact OE1-NH2 3.24Å; E309-R357 PolarHBondContact OE1-NH2 3.31Å; E313-R357 IonicContact OE1-NH1 2.75Å; E313-R357 IonicContact OE2-CZ 2.76Å; E313-R357 IonicContact OE2-NH1 3.61Å; E313-R357 PolarHBondContact OE2-NH1 3.16Å; L353-R357 WeakPolarHBondContact O-CB 3.32Å; L353-R357 PolarHBondContact O-N 2.96Å; R357-D390 WeakPolarHBondContact CD-OD1 3.45Å; R357-D390 WeakPolarHBondContact CG-OD1 3.32Å
358	N	92.5	Very high	94.8	Very high	53 Å²	53	21.8 Å²	21.8	28%	0.283	10%	0.103	S	C	.	.	I	π-helix	trans	-100.7	-32.8	-173.1	-66.2	4.6	0	0	0	113.1	V303 E354	V303-N358 PolarHBondContact N-OD1 2.88Å; E354-N358 WeakPolarHBondContact O-CB 3.25Å; E354-N358 PolarHBondContact O-N 3.37Å; E354-N358 VanDerWaalsContact O-N 3.08Å
359	Q	93.1	Very high	94.8	Very high	53 Å²	53	21.2 Å²	21.2	25%	0.248	10%	0.1	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.8	-11.2	177.1	-54	-173.6	21.6	0	0	113.9	E354 F355 L361 R1030	E354-Q359 PolarHBondContact O-N 2.87Å; E354-Q359 VanDerWaalsContact O-N 3.08Å; F355-Q359 HydrophobicContact CD1-CG 4.48Å; F355-Q359 CarbonylContact O-C 3.52Å; F355-Q359 WeakPolarHBondContact O-CB 3.46Å; F355-Q359 PolarHBondContact O-N 3.24Å; Q359-L361 VanDerWaalsContact C-N 3.31Å; Q359-L361 HydrophobicContact CB-CD1 3.79Å; Q359-L361 HydrophobicContact CB-CG 3.78Å; Q359-L361 PolarHBondContact O-N 3.29Å; Q359-R1030 PolarHBondContact O-NH1 2.97Å
360	Q	94.6	Very high	94.6	Very high	32 Å²	32	22.7 Å²	22.7	15%	0.15	11%	0.106	C	C	.	.			trans	55.5	43.7	-178.4	-65	173.3	-31.6	0	0	112.6	P290 M293 F355 I356 N1034	P290-Q360 WeakPolarHBondContact CG-O 3.37Å; M293-Q360 HydrophobicContact SD-CB 4.21Å; F355-Q360 PolarHBondContact O-N 2.85Å; F355-Q360 VanDerWaalsContact O-N 3.07Å; I356-Q360 VanDerWaalsContact O-CA 3.26Å; I356-Q360 WeakPolarHBondContact O-CA 3.49Å; I356-Q360 PolarHBondContact O-N 3.4Å; Q360-N1034 PolarHBondContact O-ND2 3.36Å
361	L	95.8	Very high	94.5	Very high	5 Å²	5	20.6 Å²	20.6	3%	0.026	10%	0.097	C	C	.	.			trans	-99.6	126.3	178	-56.9	175.1	0	0	0	110	M293 F355 Q359 F365 I366 I1033 N1034	M293-L361 VanDerWaalsContact CE-C 3.46Å; M293-L361 VanDerWaalsContact CE-O 3.27Å; M293-L361 WeakPolarHBondContact CE-O 2.81Å; F355-L361 HydrophobicContact CB-CB 4.32Å; F355-L361 HydrophobicContact CB-CD1 4.1Å; F355-L361 HydrophobicContact CD1-CD1 4.06Å; F355-L361 HydrophobicContact CG-CD1 4.28Å; F355-L361 WeakPolarHBondContact O-CB 3.36Å; F355-L361 PolarHBondContact O-N 3.21Å; Q359-L361 VanDerWaalsContact C-N 3.31Å; Q359-L361 HydrophobicContact CB-CD1 3.79Å; Q359-L361 HydrophobicContact CB-CG 3.78Å; Q359-L361 PolarHBondContact O-N 3.29Å; L361-F365 HydrophobicContact CB-CD1 4Å; L361-F365 HydrophobicContact CD1-CD1 3.82Å; L361-F365 HydrophobicContact CD1-CE1 3.74Å; L361-F365 HydrophobicContact CD2-CD1 3.76Å; L361-F365 HydrophobicContact CD2-CE1 3.86Å; L361-F365 HydrophobicContact CD2-CG 4.26Å; L361-F365 HydrophobicContact CD2-CZ 4.43Å; L361-F365 HydrophobicContact CG-CD1 4.06Å; L361-F365 HydrophobicContact CG-CE1 4.3Å; L361-I366 HydrophobicContact CB-CD1 4.37Å; L361-I366 HydrophobicContact CB-CG1 4.05Å; L361-I366 WeakPolarHBondContact O-CD1 3.4Å; L361-I1033 HydrophobicContact CD2-CG2 3.76Å; L361-N1034 WeakPolarHBondContact CA-OD1 3.48Å
362	E	95.5	Very high	94.3	Very high	2 Å²	2	18.8 Å²	18.8	1%	0.009	9%	0.088	C	C	.	.			trans	-75.6	160.8	175.6	-72.9	-166.9	-107.7	0	0	112.6	P290 R292 M293 P364 F365 I366 G995 N1034	P290-E362 HydrophobicContact CB-CG 3.84Å; P290-E362 HydrophobicContact CG-CG 4.27Å; R292-E362 IonicContact CZ-OE1 3.2Å; R292-E362 IonicContact CZ-OE2 2.85Å; R292-E362 IonicContact NE-OE1 2.67Å; R292-E362 IonicContact NE-OE2 2.81Å; R292-E362 PolarHBondContact NE-OE2 3.32Å; R292-E362 IonicContact NH2-OE1 2.64Å; R292-E362 PolarHBondContact NH2-OE1 2.81Å; R292-E362 IonicContact NH2-OE2 3.97Å; R292-E362 PolarHBondContact NH2-OE2 3.23Å; M293-E362 HydrophobicContact CE-CG 4.05Å; E362-P364 VanDerWaalsContact C-CD 3.47Å; E362-F365 WeakPolarHBondContact O-CB 3.4Å; E362-F365 PolarHBondContact O-N 3.43Å; E362-I366 PolarHBondContact O-N 3.48Å; E362-I366 VanDerWaalsContact O-N 3.08Å; E362-G995 WeakPolarHBondContact OE1-CA 3.45Å; E362-G995 PolarHBondContact OE1-N 3.37Å; E362-N1034 PolarHBondContact N-OD1 3.48Å
363	V	95.7	Very high	94.1	Very high	0 Å²	0	21.9 Å²	21.9	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-51.1	-41.4	-179.2	169.8	0	0	0	0	114.3	I366 A367 I380 L383 W384 Y387	V363-I366 PolarHBondContact O-N 2.84Å; V363-A367 VanDerWaalsContact O-CB 3.25Å; V363-A367 WeakPolarHBondContact O-CB 3.43Å; V363-A367 PolarHBondContact O-N 3.14Å; V363-I380 HydrophobicContact CG1-CG1 3.92Å; V363-L383 HydrophobicContact CB-CB 4.49Å; V363-L383 HydrophobicContact CG1-CB 3.6Å; V363-L383 HydrophobicContact CG2-CB 4.26Å; V363-W384 HydrophobicContact CB-CD2 3.8Å; V363-W384 HydrophobicContact CB-CE3 4.07Å; V363-W384 HydrophobicContact CB-CG 4.35Å; V363-W384 HydrophobicContact CB-CH2 4.07Å; V363-W384 HydrophobicContact CB-CZ2 3.82Å; V363-W384 HydrophobicContact CB-CZ3 4.19Å; V363-W384 HydrophobicContact CG1-CD2 3.78Å; V363-W384 HydrophobicContact CG1-CG 3.82Å; V363-W384 HydrophobicContact CG1-CZ2 4.19Å; V363-W384 HydrophobicContact CG2-CD2 3.89Å; V363-W384 HydrophobicContact CG2-CE3 3.79Å; V363-W384 HydrophobicContact CG2-CG 4.39Å; V363-W384 HydrophobicContact CG2-CH2 4.46Å; V363-W384 HydrophobicContact CG2-CZ3 4.08Å; V363-Y387 HydrophobicContact CG2-CG 4.47Å
364	P	95.5	Very high	93.9	Very high	0 Å²	0	22 Å²	22	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-63.6	-44	176	-21	33.6	0	0	0	112.4	E362 I366 A367 F368 W384 I967 C994 F1038	E362-P364 VanDerWaalsContact C-CD 3.47Å; P364-I366 VanDerWaalsContact C-N 3.32Å; P364-I366 PolarHBondContact O-N 2.94Å; P364-A367 PolarHBondContact O-N 3.22Å; P364-F368 WeakPolarHBondContact O-CB 3.27Å; P364-F368 VanDerWaalsContact O-CD2 3.32Å; P364-F368 WeakPolarHBondContact O-CD2 3.39Å; P364-F368 PolarHBondContact O-N 2.96Å; P364-W384 HydrophobicContact CG-CZ2 4.16Å; P364-I967 HydrophobicContact CG-CG2 3.56Å; P364-C994 HydrophobicContact CB-CB 4.1Å; P364-C994 HydrophobicContact CG-CB 4.34Å; P364-F1038 HydrophobicContact CB-CE2 4.48Å; P364-F1038 HydrophobicContact CB-CZ 4.17Å
365	F	96.3	Very high	93.6	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-58.7	-45.6	176.3	-176.3	-83.1	0	0	0	111.1	L361 E362 A367 F368 Y369 R370 I1033 H1063	L361-F365 HydrophobicContact CB-CD1 4Å; L361-F365 HydrophobicContact CD1-CD1 3.82Å; L361-F365 HydrophobicContact CD1-CE1 3.74Å; L361-F365 HydrophobicContact CD2-CD1 3.76Å; L361-F365 HydrophobicContact CD2-CE1 3.86Å; L361-F365 HydrophobicContact CD2-CG 4.26Å; L361-F365 HydrophobicContact CD2-CZ 4.43Å; L361-F365 HydrophobicContact CG-CD1 4.06Å; L361-F365 HydrophobicContact CG-CE1 4.3Å; E362-F365 WeakPolarHBondContact O-CB 3.4Å; E362-F365 PolarHBondContact O-N 3.43Å; F365-A367 PolarHBondContact O-N 3.17Å; F365-F368 PolarHBondContact O-N 3.21Å; F365-Y369 AromaticContact CD2-CD2 3.54Å; F365-Y369 HydrophobicContact CD2-CD2 3.54Å; F365-Y369 HydrophobicContact CD2-CE2 4.19Å; F365-Y369 HydrophobicContact CD2-CG 4.5Å; F365-Y369 AromaticContact CE2-CD2 3.63Å; F365-Y369 HydrophobicContact CE2-CD2 3.63Å; F365-Y369 HydrophobicContact CE2-CE2 4.42Å; F365-Y369 HydrophobicContact CE2-CG 4.24Å; F365-Y369 HydrophobicContact CG-CD2 4.07Å; F365-Y369 HydrophobicContact CZ-CD2 4.24Å; F365-Y369 HydrophobicContact CZ-CG 4.47Å; F365-Y369 PolarHBondContact O-N 3.32Å; F365-R370 HydrophobicContact CD1-CG 4.29Å; F365-R370 HydrophobicContact CE1-CG 3.88Å; F365-I1033 HydrophobicContact CD2-CG2 4.32Å; F365-I1033 VanDerWaalsContact CD2-O 3.24Å; F365-I1033 WeakPolarHBondContact CD2-O 3.45Å; F365-I1033 HydrophobicContact CE1-CG2 4.39Å; F365-I1033 HydrophobicContact CE2-CG2 3.64Å; F365-I1033 WeakPolarHBondContact CE2-O 3.35Å; F365-I1033 HydrophobicContact CZ-CG2 3.68Å; F365-H1063 AromaticContact CE2-CD2 3.94Å; F365-H1063 AromaticContact CE2-CE1 3.97Å; F365-H1063 AromaticContact CE2-NE2 3.64Å
366	I	96.1	Very high	93.1	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-61.6	-46.2	177.6	-62	168.1	0	0	0	110.8	T352 F355 I356 L361 E362 V363 P364 F368 R370 V374 L383	T352-I366 HydrophobicContact CG2-CD1 4.4Å; F355-I366 HydrophobicContact CB-CD1 3.59Å; F355-I366 HydrophobicContact CB-CG1 3.86Å; F355-I366 HydrophobicContact CD2-CD1 4.44Å; F355-I366 HydrophobicContact CD2-CG1 4.2Å; F355-I366 HydrophobicContact CD2-CG2 4.06Å; F355-I366 HydrophobicContact CG-CD1 4.48Å; F355-I366 HydrophobicContact CG-CG1 4.36Å; I356-I366 HydrophobicContact CG1-CD1 3.82Å; L361-I366 HydrophobicContact CB-CD1 4.37Å; L361-I366 HydrophobicContact CB-CG1 4.05Å; L361-I366 WeakPolarHBondContact O-CD1 3.4Å; E362-I366 PolarHBondContact O-N 3.48Å; E362-I366 VanDerWaalsContact O-N 3.08Å; V363-I366 PolarHBondContact O-N 2.84Å; P364-I366 VanDerWaalsContact C-N 3.32Å; P364-I366 PolarHBondContact O-N 2.94Å; I366-F368 PolarHBondContact O-N 3.11Å; I366-R370 HydrophobicContact CG2-CB 4.44Å; I366-R370 CarbonylContact O-C 3.59Å; I366-R370 WeakPolarHBondContact O-CA 3.28Å; I366-R370 PolarHBondContact O-N 2.59Å; I366-R370 VanDerWaalsContact O-N 3.1Å; I366-V374 HydrophobicContact CG2-CG1 3.88Å; I366-L383 HydrophobicContact CG2-CD1 4.03Å; I366-L383 HydrophobicContact CG2-CD2 4.22Å
367	A	94.6	Very high	92.7	Very high	12 Å²	12	29.5 Å²	29.5	10%	0.099	15%	0.146	C	C	.	.	H	α-helix	trans	-68	-28.9	-178.3	0	0	0	0	0	114.2	V363 P364 F365 K371 I380 L383	V363-A367 VanDerWaalsContact O-CB 3.25Å; V363-A367 WeakPolarHBondContact O-CB 3.43Å; V363-A367 PolarHBondContact O-N 3.14Å; P364-A367 PolarHBondContact O-N 3.22Å; F365-A367 PolarHBondContact O-N 3.17Å; A367-K371 WeakPolarHBondContact O-CE 3.41Å; A367-K371 WeakPolarHBondContact O-CG 3.46Å; A367-I380 HydrophobicContact CB-CB 4.2Å; A367-I380 HydrophobicContact CB-CD1 3.82Å; A367-I380 HydrophobicContact CB-CG1 3.83Å; A367-L383 HydrophobicContact CB-CD1 3.89Å
368	F	93.1	Very high	92.7	Very high	42 Å²	42	29.5 Å²	29.5	18%	0.184	15%	0.146	C	C	.	.	H	α-helix	trans	-95.7	-40.2	-178.7	-81.2	-84.7	0	0	0	114	P364 F365 I366 K371 E972 F1038	P364-F368 WeakPolarHBondContact O-CB 3.27Å; P364-F368 VanDerWaalsContact O-CD2 3.32Å; P364-F368 WeakPolarHBondContact O-CD2 3.39Å; P364-F368 PolarHBondContact O-N 2.96Å; F365-F368 PolarHBondContact O-N 3.21Å; I366-F368 PolarHBondContact O-N 3.11Å; F368-K371 VanDerWaalsContact O-CD 3.32Å; F368-K371 WeakPolarHBondContact O-CD 3.2Å; F368-K371 WeakPolarHBondContact O-CE 3.32Å; F368-K371 PolarHBondContact O-NZ 3.13Å; F368-E972 HydrophobicContact CZ-CB 3.86Å; F368-E972 HydrophobicContact CZ-CG 4.29Å; F368-F1038 HydrophobicContact CB-CE1 3.99Å; F368-F1038 HydrophobicContact CB-CZ 4.01Å; F368-F1038 AromaticContact CD2-CE1 3.87Å; F368-F1038 HydrophobicContact CD2-CE1 3.87Å; F368-F1038 HydrophobicContact CD2-CZ 4.12Å; F368-F1038 AromaticContact CG-CE1 3.88Å; F368-F1038 HydrophobicContact CG-CE1 3.88Å; F368-F1038 HydrophobicContact CG-CZ 4.25Å
369	Y	93.9	Very high	92.6	Very high	26 Å²	26	30.6 Å²	30.6	10%	0.102	15%	0.152	C	C	.	.	H	α-helix	trans	-113.1	-22.2	-171.8	-55	-62.2	0	0	0	114.7	F365 G1037 F1038 R1061 H1063	F365-Y369 AromaticContact CD2-CD2 3.54Å; F365-Y369 HydrophobicContact CD2-CD2 3.54Å; F365-Y369 HydrophobicContact CD2-CE2 4.19Å; F365-Y369 HydrophobicContact CD2-CG 4.5Å; F365-Y369 AromaticContact CE2-CD2 3.63Å; F365-Y369 HydrophobicContact CE2-CD2 3.63Å; F365-Y369 HydrophobicContact CE2-CE2 4.42Å; F365-Y369 HydrophobicContact CE2-CG 4.24Å; F365-Y369 HydrophobicContact CG-CD2 4.07Å; F365-Y369 HydrophobicContact CZ-CD2 4.24Å; F365-Y369 HydrophobicContact CZ-CG 4.47Å; F365-Y369 PolarHBondContact O-N 3.32Å; Y369-G1037 VanDerWaalsContact OH-C 3.3Å; Y369-G1037 PolarHBondContact OH-O 2.88Å; Y369-G1037 VanDerWaalsContact OH-O 3.09Å; Y369-F1038 HydrophobicContact CD2-CZ 4.23Å; Y369-F1038 HydrophobicContact CE2-CD1 4.5Å; Y369-F1038 HydrophobicContact CE2-CD2 4.49Å; Y369-F1038 AromaticContact CE2-CE1 3.82Å; Y369-F1038 HydrophobicContact CE2-CE1 3.82Å; Y369-F1038 AromaticContact CE2-CE2 3.8Å; Y369-F1038 HydrophobicContact CE2-CE2 3.8Å; Y369-F1038 AromaticContact CE2-CZ 3.44Å; Y369-F1038 HydrophobicContact CE2-CZ 3.44Å; Y369-F1038 VanDerWaalsContact CE2-CZ 3.44Å; Y369-R1061 WeakPolarHBondContact CE1-O 3.5Å; Y369-H1063 HydrophobicContact CD1-CB 3.85Å; Y369-H1063 HydrophobicContact CE1-CB 3.89Å; Y369-H1063 HydrophobicContact CG-CB 4.32Å
370	R	93.5	Very high	92.6	Very high	32 Å²	32	29.4 Å²	29.4	12%	0.121	15%	0.147	C	C	.	.			trans	-107	30.8	177.6	-54.1	-60.3	174.4	81.3	-6.9	112.6	F355 F365 I366 E372 Y373 E1065	F355-R370 HydrophobicContact CD2-CB 4.26Å; F355-R370 HydrophobicContact CE1-CG 4.5Å; F355-R370 HydrophobicContact CE2-CB 3.76Å; F355-R370 HydrophobicContact CE2-CG 4.26Å; F355-R370 HydrophobicContact CZ-CB 4.08Å; F355-R370 HydrophobicContact CZ-CG 4.23Å; F365-R370 HydrophobicContact CD1-CG 4.29Å; F365-R370 HydrophobicContact CE1-CG 3.88Å; I366-R370 HydrophobicContact CG2-CB 4.44Å; I366-R370 CarbonylContact O-C 3.59Å; I366-R370 WeakPolarHBondContact O-CA 3.28Å; I366-R370 PolarHBondContact O-N 2.59Å; I366-R370 VanDerWaalsContact O-N 3.1Å; R370-E372 VanDerWaalsContact C-N 3.31Å; R370-E372 PolarHBondContact O-N 3.03Å; R370-Y373 HydrophobicContact CB-CD2 4Å; R370-Y373 WeakPolarHBondContact O-CD2 3.26Å; R370-Y373 PolarHBondContact O-N 3.48Å; R370-E1065 IonicContact CZ-OE1 3.76Å; R370-E1065 IonicContact CZ-OE2 2.72Å; R370-E1065 IonicContact NE-OE1 2.68Å; R370-E1065 PolarHBondContact NE-OE1 3.35Å; R370-E1065 IonicContact NH2-OE1 3.68Å; R370-E1065 PolarHBondContact NH2-OE1 3.15Å; R370-E1065 IonicContact NH2-OE2 3.43Å; R370-E1065 PolarHBondContact NH2-OE2 3.44Å
371	K	92	Very high	92.4	Very high	18 Å²	18	32.1 Å²	32.1	8%	0.078	16%	0.162	C	C	.	.	H	α-helix	trans	-51.1	-40	-179.3	-72.9	166.3	177.2	144.8	0	114.5	A367 F368 Y373 V374 K375 I1123 D1127	A367-K371 WeakPolarHBondContact O-CE 3.41Å; A367-K371 WeakPolarHBondContact O-CG 3.46Å; F368-K371 VanDerWaalsContact O-CD 3.32Å; F368-K371 WeakPolarHBondContact O-CD 3.2Å; F368-K371 WeakPolarHBondContact O-CE 3.32Å; F368-K371 PolarHBondContact O-NZ 3.13Å; K371-Y373 PolarHBondContact O-N 2.63Å; K371-V374 PolarHBondContact O-N 2.87Å; K371-K375 HydrophobicContact CB-CD 4.29Å; K371-K375 HydrophobicContact CG-CD 4.35Å; K371-K375 WeakPolarHBondContact O-CB 3.22Å; K371-K375 PolarHBondContact O-N 3.17Å; K371-I1123 HydrophobicContact CB-CB 4.39Å; K371-I1123 HydrophobicContact CB-CD1 4.2Å; K371-I1123 HydrophobicContact CB-CG2 4.03Å; K371-I1123 HydrophobicContact CD-CG2 3.82Å; K371-D1127 WeakPolarHBondContact CD-OD2 3.48Å; K371-D1127 WeakPolarHBondContact CE-OD2 3.43Å; K371-D1127 IonicContact NZ-OD1 3.78Å; K371-D1127 PolarHBondContact NZ-OD1 3.46Å; K371-D1127 IonicContact NZ-OD2 2.76Å; K371-D1127 PolarHBondContact NZ-OD2 2.67Å
372	E	90	Very high	92.3	Very high	29 Å²	29	32.9 Å²	32.9	14%	0.136	17%	0.166	C	C	.	.	H	α-helix	trans	-50.5	-44	-179.4	-51.3	-74.6	137.9	0	0	112.1	R370 S1120 K1121 S1122 I1123 T1124	R370-E372 VanDerWaalsContact C-N 3.31Å; R370-E372 PolarHBondContact O-N 3.03Å; E372-S1120 WeakPolarHBondContact CG-O 3.21Å; E372-S1120 PolarHBondContact OE2-OG 3.32Å; E372-K1121 WeakPolarHBondContact OE1-CA 3.44Å; E372-S1122 PolarHBondContact OE1-N 3.49Å; E372-S1122 VanDerWaalsContact OE1-N 3.14Å; E372-S1122 PolarHBondContact OE2-N 3.06Å; E372-S1122 VanDerWaalsContact OE2-N 3.16Å; E372-S1122 PolarHBondContact OE2-OG 2.93Å; E372-I1123 VanDerWaalsContact OE1-CA 3.32Å; E372-I1123 WeakPolarHBondContact OE1-CA 3.47Å; E372-I1123 VanDerWaalsContact OE1-CB 3.23Å; E372-I1123 WeakPolarHBondContact OE1-CB 3.33Å; E372-I1123 PolarHBondContact OE1-N 3.37Å; E372-T1124 PolarHBondContact OE1-N 2.93Å; E372-T1124 VanDerWaalsContact OE1-N 3.12Å
373	Y	90.9	Very high	92.3	Very high	66 Å²	66	32.8 Å²	32.8	26%	0.259	17%	0.166	S	C	.	.	H	α-helix	trans	-79.8	-27.4	-170.4	-55.7	-80.5	0	0	0	112.4	K348 Q351 F355 R370 K371 K1121	K348-Y373 WeakPolarHBondContact CD-O 3.1Å; K348-Y373 WeakPolarHBondContact CE-O 3.47Å; K348-Y373 WeakPolarHBondContact CG-O 3.47Å; Q351-Y373 PolarHBondContact OE1-O 3.24Å; F355-Y373 HydrophobicContact CE2-CD2 4.02Å; F355-Y373 HydrophobicContact CE2-CG 4.04Å; F355-Y373 HydrophobicContact CZ-CD1 4.37Å; F355-Y373 AromaticContact CZ-CD2 3.67Å; F355-Y373 HydrophobicContact CZ-CD2 3.67Å; F355-Y373 HydrophobicContact CZ-CE2 4.15Å; F355-Y373 AromaticContact CZ-CG 3.81Å; F355-Y373 HydrophobicContact CZ-CG 3.81Å; R370-Y373 HydrophobicContact CB-CD2 4Å; R370-Y373 WeakPolarHBondContact O-CD2 3.26Å; R370-Y373 PolarHBondContact O-N 3.48Å; K371-Y373 PolarHBondContact O-N 2.63Å; Y373-K1121 PolarHBondContact OH-NZ 2.77Å; Y373-K1121 VanDerWaalsContact OH-NZ 3.14Å
374	V	91.4	Very high	92.3	Very high	1 Å²	1	33.8 Å²	33.8	1%	0.006	17%	0.17	C	C	.	.	H	α-helix	trans	-108	-32.3	-169.6	-59.6	0	0	0	0	113.8	I366 K371 E377 L378 L383	I366-V374 HydrophobicContact CG2-CG1 3.88Å; K371-V374 PolarHBondContact O-N 2.87Å; V374-E377 PolarHBondContact O-N 3.06Å; V374-L378 HydrophobicContact CB-CB 4.26Å; V374-L378 PolarHBondContact O-N 3.32Å; V374-L383 HydrophobicContact CB-CD2 4.25Å; V374-L383 HydrophobicContact CG1-CD2 3.94Å; V374-L383 HydrophobicContact CG2-CD1 4.37Å
375	K	87.9	Confident	92.1	Very high	87 Å²	87	37.1 Å²	37.1	38%	0.378	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81	159.9	179.3	-67.9	-172.8	-180	176.6	0	111.5	K348 K371 E377 I1123	K348-K375 PolarHBondContact NZ-O 3.33Å; K371-K375 HydrophobicContact CB-CD 4.29Å; K371-K375 HydrophobicContact CG-CD 4.35Å; K371-K375 WeakPolarHBondContact O-CB 3.22Å; K371-K375 PolarHBondContact O-N 3.17Å; K375-E377 VanDerWaalsContact C-N 3.28Å; K375-I1123 HydrophobicContact CB-CD1 4.46Å
376	P	86.8	Confident	92.1	Very high	124 Å²	124	37.1 Å²	37.1	81%	0.805	18%	0.184	S	C	*	.	T	Hydrogen-bonded Turn	cis	-82.3	6.2	-9.2	37.1	-36.7	0	0	0	113.7
377	E	85.9	Confident	92	Very high	34 Å²	34	38.2 Å²	38.2	16%	0.159	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.5	-36.9	-168.7	-74.6	160.4	-95.4	0	0	113.9	K341 P342 T344 T345 K348 V374 K375	K341-E377 WeakPolarHBondContact CE-O 3.28Å; K341-E377 PolarHBondContact NZ-O 2.89Å; P342-E377 HydrophobicContact CG-CG 4.09Å; P342-E377 WeakPolarHBondContact CG-OE2 3.34Å; T344-E377 WeakPolarHBondContact CB-OE2 3.37Å; T344-E377 PolarHBondContact OG1-OE2 2.96Å; T345-E377 WeakPolarHBondContact CA-OE2 3.47Å; T345-E377 HydrophobicContact CG2-CB 4.29Å; T345-E377 PolarHBondContact N-OE2 3.14Å; T345-E377 PolarHBondContact OG1-OE2 3.12Å; K348-E377 HydrophobicContact CD-CB 4.23Å; K348-E377 WeakPolarHBondContact CD-OE1 3.25Å; K348-E377 VanDerWaalsContact CE-OE1 3.3Å; K348-E377 WeakPolarHBondContact CE-OE1 3.29Å; K348-E377 IonicContact NZ-OE1 3.81Å; K348-E377 PolarHBondContact NZ-OE1 3.26Å; V374-E377 PolarHBondContact O-N 3.06Å; K375-E377 VanDerWaalsContact C-N 3.28Å
378	L	91.4	Very high	91.9	Very high	3 Å²	3	43 Å²	43	2%	0.016	21%	0.205	C	C	.	.			trans	-109.2	131.7	177.1	-58.2	172.7	0	0	0	110.6	F322 T345 K348 I349 V374 D382 L383	F322-L378 HydrophobicContact CZ-CD2 4.15Å; T345-L378 HydrophobicContact CG2-CD2 3.63Å; T345-L378 HydrophobicContact CG2-CG 4.06Å; K348-L378 HydrophobicContact CB-CD1 3.97Å; I349-L378 HydrophobicContact CG1-CD1 4.33Å; V374-L378 HydrophobicContact CB-CB 4.26Å; V374-L378 PolarHBondContact O-N 3.32Å; L378-D382 HydrophobicContact CB-CB 4.17Å; L378-D382 HydrophobicContact CD2-CB 3.77Å; L378-L383 HydrophobicContact CB-CD2 4.19Å; L378-L383 HydrophobicContact CB-CG 4.42Å; L378-L383 HydrophobicContact CD1-CD2 4.03Å
379	N	91.5	Very high	92	Very high	76 Å²	76	43.4 Å²	43.4	41%	0.406	21%	0.206	S	C	.	.			trans	-100.5	179.6	167.1	74.1	32.9	0	0	0	110.6	D381 D382 L383	N379-D381 VanDerWaalsContact C-N 3.31Å; N379-D381 PolarHBondContact O-N 2.79Å; N379-D381 WeakPolarHBondContact OD1-CA 3.45Å; N379-D381 WeakPolarHBondContact OD1-CB 3.22Å; N379-D381 PolarHBondContact OD1-N 3.43Å; N379-D382 PolarHBondContact N-OD2 2.86Å; N379-D382 PolarHBondContact ND2-OD2 3.15Å; N379-D382 WeakPolarHBondContact O-CB 3.23Å; N379-D382 PolarHBondContact O-N 2.78Å; N379-D382 PolarHBondContact OD1-N 2.9Å; N379-D382 PolarHBondContact OD1-OD2 2.98Å; N379-L383 WeakPolarHBondContact O-CG 3.48Å; N379-L383 PolarHBondContact O-N 2.83Å
380	I	92.8	Very high	92.1	Very high	29 Å²	29	42.2 Å²	42.2	15%	0.149	20%	0.201	C	C	.	.	H	α-helix	trans	-64.5	-32.4	-176.1	-163.4	164.5	0	0	0	113.5	V363 A367 L383 W384 N968	V363-I380 HydrophobicContact CG1-CG1 3.92Å; A367-I380 HydrophobicContact CB-CB 4.2Å; A367-I380 HydrophobicContact CB-CD1 3.82Å; A367-I380 HydrophobicContact CB-CG1 3.83Å; I380-L383 PolarHBondContact O-N 3.01Å; I380-W384 PolarHBondContact O-N 2.99Å; I380-N968 HydrophobicContact CD1-CB 4.3Å; I380-N968 WeakPolarHBondContact CD1-OD1 3.41Å
381	D	90.7	Very high	92	Very high	89 Å²	89	41.2 Å²	41.2	48%	0.476	20%	0.2	S	C	.	.	H	α-helix	trans	-75.7	-34.6	177.3	-47.9	-56.7	0	0	0	111	N379 L383 W384 K385	N379-D381 VanDerWaalsContact C-N 3.31Å; N379-D381 PolarHBondContact O-N 2.79Å; N379-D381 WeakPolarHBondContact OD1-CA 3.45Å; N379-D381 WeakPolarHBondContact OD1-CB 3.22Å; N379-D381 PolarHBondContact OD1-N 3.43Å; D381-L383 VanDerWaalsContact C-N 3.32Å; D381-W384 PolarHBondContact O-N 3.46Å; D381-K385 WeakPolarHBondContact O-CB 3.43Å; D381-K385 PolarHBondContact O-N 3.33Å
382	D	93	Very high	92.1	Very high	20 Å²	20	42.8 Å²	42.8	11%	0.107	21%	0.209	C	C	.	.	H	α-helix	trans	-63.7	-36.8	170	-58.1	-62.9	0	0	0	111.5	F322 K341 L378 N379 K385 V386	F322-D382 HydrophobicContact CE1-CB 4.19Å; F322-D382 WeakPolarHBondContact CE1-OD1 3.49Å; F322-D382 HydrophobicContact CZ-CB 4.17Å; K341-D382 WeakPolarHBondContact CE-OD1 3.48Å; K341-D382 IonicContact NZ-OD1 3.58Å; K341-D382 PolarHBondContact NZ-OD1 3.19Å; K341-D382 IonicContact NZ-OD2 2.71Å; K341-D382 PolarHBondContact NZ-OD2 3.24Å; L378-D382 HydrophobicContact CB-CB 4.17Å; L378-D382 HydrophobicContact CD2-CB 3.77Å; N379-D382 PolarHBondContact N-OD2 2.86Å; N379-D382 PolarHBondContact ND2-OD2 3.15Å; N379-D382 WeakPolarHBondContact O-CB 3.23Å; N379-D382 PolarHBondContact O-N 2.78Å; N379-D382 PolarHBondContact OD1-N 2.9Å; N379-D382 PolarHBondContact OD1-OD2 2.98Å; D382-K385 WeakPolarHBondContact O-CB 3.42Å; D382-K385 PolarHBondContact O-N 3.03Å; D382-V386 WeakPolarHBondContact O-CG2 3.46Å; D382-V386 PolarHBondContact O-N 2.83Å
383	L	95.5	Very high	92.3	Very high	1 Å²	1	42.6 Å²	42.6	1%	0.005	21%	0.207	C	C	.	.	H	α-helix	trans	-69.9	-41.3	177.3	-67.7	171.8	0	0	0	111.9	T352 V363 I366 A367 V374 L378 N379 I380 D381 K385 V386 Y387	T352-L383 HydrophobicContact CG2-CD2 3.54Å; T352-L383 WeakPolarHBondContact OG1-CD2 3.49Å; V363-L383 HydrophobicContact CB-CB 4.49Å; V363-L383 HydrophobicContact CG1-CB 3.6Å; V363-L383 HydrophobicContact CG2-CB 4.26Å; I366-L383 HydrophobicContact CG2-CD1 4.03Å; I366-L383 HydrophobicContact CG2-CD2 4.22Å; A367-L383 HydrophobicContact CB-CD1 3.89Å; V374-L383 HydrophobicContact CB-CD2 4.25Å; V374-L383 HydrophobicContact CG1-CD2 3.94Å; V374-L383 HydrophobicContact CG2-CD1 4.37Å; L378-L383 HydrophobicContact CB-CD2 4.19Å; L378-L383 HydrophobicContact CB-CG 4.42Å; L378-L383 HydrophobicContact CD1-CD2 4.03Å; N379-L383 WeakPolarHBondContact O-CG 3.48Å; N379-L383 PolarHBondContact O-N 2.83Å; I380-L383 PolarHBondContact O-N 3.01Å; D381-L383 VanDerWaalsContact C-N 3.32Å; L383-K385 PolarHBondContact O-N 2.97Å; L383-V386 PolarHBondContact O-N 3.48Å; L383-Y387 PolarHBondContact O-N 1.78Å
384	W	94.6	Very high	92.4	Very high	20 Å²	20	40 Å²	40	8%	0.076	20%	0.199	C	C	.	.	H	α-helix	trans	-61.2	-35.1	168.8	-76.7	116.7	0	0	0	111.8	V363 P364 I380 D381 Y387 Y388 L964 I967 N968	V363-W384 HydrophobicContact CB-CD2 3.8Å; V363-W384 HydrophobicContact CB-CE3 4.07Å; V363-W384 HydrophobicContact CB-CG 4.35Å; V363-W384 HydrophobicContact CB-CH2 4.07Å; V363-W384 HydrophobicContact CB-CZ2 3.82Å; V363-W384 HydrophobicContact CB-CZ3 4.19Å; V363-W384 HydrophobicContact CG1-CD2 3.78Å; V363-W384 HydrophobicContact CG1-CG 3.82Å; V363-W384 HydrophobicContact CG1-CZ2 4.19Å; V363-W384 HydrophobicContact CG2-CD2 3.89Å; V363-W384 HydrophobicContact CG2-CE3 3.79Å; V363-W384 HydrophobicContact CG2-CG 4.39Å; V363-W384 HydrophobicContact CG2-CH2 4.46Å; V363-W384 HydrophobicContact CG2-CZ3 4.08Å; P364-W384 HydrophobicContact CG-CZ2 4.16Å; I380-W384 PolarHBondContact O-N 2.99Å; D381-W384 PolarHBondContact O-N 3.46Å; W384-Y387 AromaticContact CE3-CD1 3.91Å; W384-Y387 HydrophobicContact CE3-CD1 3.91Å; W384-Y387 HydrophobicContact CE3-CG 4.32Å; W384-Y387 AromaticContact CZ3-CD1 3.92Å; W384-Y387 HydrophobicContact CZ3-CD1 3.92Å; W384-Y387 HydrophobicContact CZ3-CE1 4.1Å; W384-Y387 HydrophobicContact CZ3-CG 4.39Å; W384-Y387 PolarHBondContact O-N 3.3Å; W384-Y388 PolarHBondContact O-N 2.81Å; W384-L964 HydrophobicContact CD2-CD1 4.13Å; W384-L964 HydrophobicContact CD2-CD2 3.99Å; W384-L964 HydrophobicContact CE3-CD1 4.26Å; W384-L964 HydrophobicContact CE3-CD2 3.81Å; W384-L964 HydrophobicContact CG-CD1 4.27Å; W384-L964 HydrophobicContact CH2-CD2 3.73Å; W384-L964 HydrophobicContact CZ2-CD2 3.89Å; W384-L964 HydrophobicContact CZ3-CD2 3.69Å; W384-I967 HydrophobicContact CZ2-CG2 4.08Å; W384-N968 PolarHBondContact NE1-ND2 2.84Å; W384-N968 PolarHBondContact NE1-OD1 2.7Å
385	K	92.7	Very high	92.5	Very high	71 Å²	71	42.3 Å²	42.3	31%	0.309	21%	0.21	S	C	.	.	H	α-helix	trans	-64.8	-39.8	173	-158.9	178	-165.6	179.3	0	112.5	A321 F322 D381 D382 L383 Y388 Y389	A321-K385 HydrophobicContact CB-CD 4.13Å; A321-K385 HydrophobicContact CB-CG 4.26Å; A321-K385 WeakPolarHBondContact O-CE 3.44Å; A321-K385 PolarHBondContact O-NZ 3.18Å; F322-K385 HydrophobicContact CE1-CD 4.32Å; F322-K385 HydrophobicContact CZ-CD 4.38Å; D381-K385 WeakPolarHBondContact O-CB 3.43Å; D381-K385 PolarHBondContact O-N 3.33Å; D382-K385 WeakPolarHBondContact O-CB 3.42Å; D382-K385 PolarHBondContact O-N 3.03Å; L383-K385 PolarHBondContact O-N 2.97Å; K385-Y388 PolarHBondContact O-N 3.08Å; K385-Y389 HydrophobicContact CD-CE2 4.49Å; K385-Y389 HydrophobicContact CG-CD2 3.95Å; K385-Y389 HydrophobicContact CG-CE2 3.89Å; K385-Y389 VanDerWaalsContact O-CD2 3.25Å; K385-Y389 WeakPolarHBondContact O-CD2 3.38Å; K385-Y389 PolarHBondContact O-N 2.88Å
386	V	95.4	Very high	92.7	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-61.7	-48.1	172.1	173.6	0	0	0	0	110.6	I317 F322 I349 T352 L353 D382 L383 Y388 Y389 D390	I317-V386 HydrophobicContact CD1-CG1 4.25Å; I317-V386 HydrophobicContact CG2-CG2 4.23Å; F322-V386 HydrophobicContact CE2-CG2 4.35Å; I349-V386 HydrophobicContact CG1-CG2 4.04Å; I349-V386 HydrophobicContact CG2-CG1 4.1Å; I349-V386 HydrophobicContact CG2-CG2 4.17Å; T352-V386 HydrophobicContact CG2-CB 4.25Å; T352-V386 HydrophobicContact CG2-CG1 3.85Å; L353-V386 HydrophobicContact CD2-CG1 3.84Å; L353-V386 HydrophobicContact CG-CG1 4.13Å; D382-V386 WeakPolarHBondContact O-CG2 3.46Å; D382-V386 PolarHBondContact O-N 2.83Å; L383-V386 PolarHBondContact O-N 3.48Å; V386-Y388 VanDerWaalsContact C-N 3.3Å; V386-Y388 PolarHBondContact O-N 3.17Å; V386-Y389 PolarHBondContact O-N 2.46Å; V386-D390 WeakPolarHBondContact O-CB 3.25Å; V386-D390 PolarHBondContact O-N 3.33Å
387	Y	94.8	Very high	93	Very high	22 Å²	22	35.4 Å²	35.4	9%	0.086	17%	0.17	C	C	.	.	H	α-helix	trans	-58.7	-35.7	178.6	178.3	-97.7	0	0	0	113.9	R292 M293 R296 I356 V363 L383 W384	R292-Y387 PolarHBondContact O-OH 2.94Å; M293-Y387 HydrophobicContact CG-CE2 4.45Å; R296-Y387 PolarHBondContact NH1-O 3.32Å; I356-Y387 HydrophobicContact CD1-CD2 4.2Å; I356-Y387 HydrophobicContact CG2-CD2 4.06Å; I356-Y387 HydrophobicContact CG2-CE2 4.4Å; V363-Y387 HydrophobicContact CG2-CG 4.47Å; L383-Y387 PolarHBondContact O-N 1.78Å; W384-Y387 AromaticContact CE3-CD1 3.91Å; W384-Y387 HydrophobicContact CE3-CD1 3.91Å; W384-Y387 HydrophobicContact CE3-CG 4.32Å; W384-Y387 AromaticContact CZ3-CD1 3.92Å; W384-Y387 HydrophobicContact CZ3-CD1 3.92Å; W384-Y387 HydrophobicContact CZ3-CE1 4.1Å; W384-Y387 HydrophobicContact CZ3-CG 4.39Å; W384-Y387 PolarHBondContact O-N 3.3Å
388	Y	93	Very high	93.3	Very high	113 Å²	113	37 Å²	37	44%	0.443	18%	0.177	S	C	.	.	H	α-helix	trans	-72.8	-44.7	175.1	178.4	-110.6	0	0	0	112.4	W384 K385 V386 G391 I392	W384-Y388 PolarHBondContact O-N 2.81Å; K385-Y388 PolarHBondContact O-N 3.08Å; V386-Y388 VanDerWaalsContact C-N 3.3Å; V386-Y388 PolarHBondContact O-N 3.17Å; Y388-G391 PolarHBondContact O-N 2.89Å; Y388-I392 HydrophobicContact CD1-CD1 4.05Å; Y388-I392 HydrophobicContact CE1-CD1 3.51Å; Y388-I392 HydrophobicContact CE1-CG1 4.46Å; Y388-I392 PolarHBondContact O-N 3.13Å
389	Y	94.2	Very high	93.4	Very high	51 Å²	51	42.2 Å²	42.2	20%	0.2	20%	0.197	C	C	.	.	H	α-helix	trans	-72.6	-26.1	-179.9	-83.3	-110.5	0	0	0	113.1	W316 A321 K385 V386 I392 W393	W316-Y389 HydrophobicContact CH2-CD1 4.05Å; W316-Y389 AromaticContact CZ3-CD1 3.75Å; W316-Y389 HydrophobicContact CZ3-CD1 3.75Å; W316-Y389 HydrophobicContact CZ3-CG 4.44Å; A321-Y389 HydrophobicContact CB-CD1 3.71Å; A321-Y389 HydrophobicContact CB-CD2 3.86Å; A321-Y389 HydrophobicContact CB-CE1 3.66Å; A321-Y389 HydrophobicContact CB-CE2 3.84Å; A321-Y389 HydrophobicContact CB-CG 3.8Å; K385-Y389 HydrophobicContact CD-CE2 4.49Å; K385-Y389 HydrophobicContact CG-CD2 3.95Å; K385-Y389 HydrophobicContact CG-CE2 3.89Å; K385-Y389 VanDerWaalsContact O-CD2 3.25Å; K385-Y389 WeakPolarHBondContact O-CD2 3.38Å; K385-Y389 PolarHBondContact O-N 2.88Å; V386-Y389 PolarHBondContact O-N 2.46Å; Y389-I392 PolarHBondContact O-N 3.3Å; Y389-W393 WeakPolarHBondContact O-CB 3.49Å; Y389-W393 PolarHBondContact O-N 2.78Å
390	D	95.4	Very high	93.5	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-55.6	-47.8	165.2	167.1	139.1	0	0	0	110.8	R296 E313 I317 L353 R357 V386 I392 W393 C394	R296-D390 IonicContact CZ-OD2 3.75Å; R296-D390 IonicContact NH1-OD2 2.73Å; R296-D390 PolarHBondContact NH1-OD2 2.74Å; R296-D390 IonicContact NH2-OD2 2.77Å; R296-D390 PolarHBondContact NH2-OD2 3.01Å; E313-D390 WeakPolarHBondContact OE1-CA 3.4Å; I317-D390 HydrophobicContact CD1-CB 4.44Å; L353-D390 HydrophobicContact CD2-CB 3.78Å; L353-D390 WeakPolarHBondContact CD2-OD1 3.33Å; R357-D390 WeakPolarHBondContact CD-OD1 3.45Å; R357-D390 WeakPolarHBondContact CG-OD1 3.32Å; V386-D390 WeakPolarHBondContact O-CB 3.25Å; V386-D390 PolarHBondContact O-N 3.33Å; D390-I392 PolarHBondContact O-N 2.86Å; D390-W393 PolarHBondContact O-N 2.77Å; D390-C394 WeakPolarHBondContact O-CB 3.18Å; D390-C394 PolarHBondContact O-N 2.87Å; D390-C394 PolarHBondContact O-SG 3.4Å; D390-C394 VanDerWaalsContact O-SG 3.34Å
391	G	92.8	Very high	93.5	Very high	11 Å²	11	45.5 Å²	45.5	11%	0.113	20%	0.203	C	C	.	.	H	α-helix	trans	-59.6	-43.8	175.5	0	0	0	0	0	113.1	Y388 Q395	Y388-G391 PolarHBondContact O-N 2.89Å; G391-Q395 WeakPolarHBondContact O-CB 3.14Å; G391-Q395 PolarHBondContact O-N 3.38Å
392	I	93.3	Very high	93.6	Very high	51 Å²	51	47.4 Å²	47.4	26%	0.262	21%	0.207	S	C	.	.	H	α-helix	trans	-65.9	-44.3	176.1	-60.6	173.8	0	0	0	111.1	W316 Y388 Y389 D390 Q395 L396	W316-I392 HydrophobicContact CH2-CB 4.2Å; W316-I392 HydrophobicContact CH2-CG2 3.73Å; W316-I392 HydrophobicContact CZ2-CG2 4.47Å; Y388-I392 HydrophobicContact CD1-CD1 4.05Å; Y388-I392 HydrophobicContact CE1-CD1 3.51Å; Y388-I392 HydrophobicContact CE1-CG1 4.46Å; Y388-I392 PolarHBondContact O-N 3.13Å; Y389-I392 PolarHBondContact O-N 3.3Å; D390-I392 PolarHBondContact O-N 2.86Å; I392-Q395 PolarHBondContact O-N 3.04Å; I392-L396 WeakPolarHBondContact O-CB 3.48Å; I392-L396 PolarHBondContact O-N 2.73Å
393	W	94.6	Very high	93.7	Very high	25 Å²	25	47.2 Å²	47.2	10%	0.095	21%	0.205	C	C	.	.	H	α-helix	trans	-63	-45.6	179.6	-175.3	96.2	0	0	0	110.9	E309 E313 W316 Y389 D390 Q395 L396 N397	E309-W393 HydrophobicContact CG-CH2 3.6Å; E309-W393 HydrophobicContact CG-CZ3 3.93Å; E309-W393 VanDerWaalsContact OE1-CZ3 3.31Å; E309-W393 WeakPolarHBondContact OE1-CZ3 3.46Å; E313-W393 HydrophobicContact CB-CD2 3.87Å; E313-W393 HydrophobicContact CB-CE3 4.26Å; E313-W393 HydrophobicContact CB-CG 4.21Å; E313-W393 HydrophobicContact CB-CZ2 4.29Å; E313-W393 HydrophobicContact CG-CB 4.14Å; E313-W393 HydrophobicContact CG-CD2 3.68Å; E313-W393 HydrophobicContact CG-CE3 3.98Å; E313-W393 HydrophobicContact CG-CG 3.71Å; W316-W393 AromaticContact CD2-CD1 3.65Å; W316-W393 HydrophobicContact CE3-CB 3.9Å; W316-W393 AromaticContact CE3-CD1 3.66Å; W316-W393 HydrophobicContact CE3-CG 4.18Å; W316-W393 AromaticContact CG-CD1 3.71Å; W316-W393 HydrophobicContact CZ3-CB 3.9Å; Y389-W393 WeakPolarHBondContact O-CB 3.49Å; Y389-W393 PolarHBondContact O-N 2.78Å; D390-W393 PolarHBondContact O-N 2.77Å; W393-Q395 VanDerWaalsContact C-N 3.35Å; W393-Q395 PolarHBondContact O-N 3.42Å; W393-L396 PolarHBondContact O-N 3.3Å; W393-N397 HydrophobicContact CD2-CB 4.47Å; W393-N397 HydrophobicContact CE3-CB 4.17Å; W393-N397 HydrophobicContact CH2-CB 3.84Å; W393-N397 WeakPolarHBondContact CH2-ND2 3.41Å; W393-N397 HydrophobicContact CZ2-CB 4.2Å; W393-N397 HydrophobicContact CZ3-CB 3.83Å; W393-N397 WeakPolarHBondContact CZ3-ND2 3.46Å; W393-N397 WeakPolarHBondContact O-CB 3.48Å; W393-N397 PolarHBondContact O-N 3.48Å
394	C	92.9	Very high	93.6	Very high	12 Å²	12	51.8 Å²	51.8	8%	0.081	23%	0.225	C	C	.	.	H	α-helix	trans	-59.2	-43.4	174	-73.6	0	0	0	0	111.6	V298 D390 L396 N397 E398	V298-C394 HydrophobicContact CG1-CB 3.62Å; D390-C394 WeakPolarHBondContact O-CB 3.18Å; D390-C394 PolarHBondContact O-N 2.87Å; D390-C394 PolarHBondContact O-SG 3.4Å; D390-C394 VanDerWaalsContact O-SG 3.34Å; C394-L396 PolarHBondContact O-N 3.3Å; C394-N397 PolarHBondContact O-N 3.12Å; C394-E398 WeakPolarHBondContact O-CB 3.07Å; C394-E398 PolarHBondContact O-N 3.49Å
395	Q	92.8	Very high	93.6	Very high	50 Å²	50	53.2 Å²	53.2	23%	0.234	24%	0.236	C	C	.	.	H	α-helix	trans	-63	-42.1	175.9	-155.1	-171	83.7	0	0	112	V298 G391 I392 W393 R399 M447	V298-Q395 HydrophobicContact CG2-CB 3.96Å; V298-Q395 HydrophobicContact CG2-CG 4.09Å; G391-Q395 WeakPolarHBondContact O-CB 3.14Å; G391-Q395 PolarHBondContact O-N 3.38Å; I392-Q395 PolarHBondContact O-N 3.04Å; W393-Q395 VanDerWaalsContact C-N 3.35Å; W393-Q395 PolarHBondContact O-N 3.42Å; Q395-R399 WeakPolarHBondContact O-CB 3.37Å; Q395-R399 VanDerWaalsContact O-CG 3.29Å; Q395-R399 WeakPolarHBondContact O-CG 3.31Å; Q395-R399 PolarHBondContact O-N 3.06Å; Q395-R399 VanDerWaalsContact OE1-CZ 3.28Å; Q395-M447 HydrophobicContact CB-CE 3.75Å; Q395-M447 HydrophobicContact CG-CE 3.87Å
396	L	93.7	Very high	93.6	Very high	8 Å²	8	52 Å²	52	4%	0.042	23%	0.233	C	C	.	.	H	α-helix	trans	-64.8	-49.6	178.4	179.1	63.3	0	0	0	110.6	W316 I392 W393 C394 R399 K400 V444 Q445 M447 L450	W316-L396 HydrophobicContact CZ2-CD2 4.27Å; I392-L396 WeakPolarHBondContact O-CB 3.48Å; I392-L396 PolarHBondContact O-N 2.73Å; W393-L396 PolarHBondContact O-N 3.3Å; C394-L396 PolarHBondContact O-N 3.3Å; L396-R399 PolarHBondContact O-N 3.41Å; L396-K400 WeakPolarHBondContact O-CB 3.4Å; L396-K400 PolarHBondContact O-N 3.15Å; L396-V444 HydrophobicContact CD1-CG1 4.35Å; L396-Q445 WeakPolarHBondContact CD2-O 3.5Å; L396-M447 HydrophobicContact CB-CE 3.94Å; L396-M447 HydrophobicContact CD1-CE 4.44Å; L396-M447 HydrophobicContact CD1-SD 4.11Å; L396-L450 HydrophobicContact CD1-CB 4.43Å; L396-L450 HydrophobicContact CD1-CD2 4.31Å
397	N	92.2	Very high	93.5	Very high	58 Å²	58	52.1 Å²	52.1	31%	0.31	23%	0.233	S	C	.	.	H	α-helix	trans	-63	-42.8	-179.5	-170	32.6	0	0	0	111.4	W393 C394 K400 R401	W393-N397 HydrophobicContact CD2-CB 4.47Å; W393-N397 HydrophobicContact CE3-CB 4.17Å; W393-N397 HydrophobicContact CH2-CB 3.84Å; W393-N397 WeakPolarHBondContact CH2-ND2 3.41Å; W393-N397 HydrophobicContact CZ2-CB 4.2Å; W393-N397 HydrophobicContact CZ3-CB 3.83Å; W393-N397 WeakPolarHBondContact CZ3-ND2 3.46Å; W393-N397 WeakPolarHBondContact O-CB 3.48Å; W393-N397 PolarHBondContact O-N 3.48Å; C394-N397 PolarHBondContact O-N 3.12Å; N397-K400 PolarHBondContact O-N 3.4Å; N397-R401 VanDerWaalsContact O-CB 3.27Å; N397-R401 WeakPolarHBondContact O-CB 3.39Å; N397-R401 PolarHBondContact O-N 3.12Å
398	E	91.3	Very high	93.5	Very high	66 Å²	66	54.7 Å²	54.7	31%	0.308	25%	0.246	S	C	.	.	H	α-helix	trans	-66	-43.5	177.3	175.2	57.8	-173.4	0	0	112.3	C394 R401 K402	C394-E398 WeakPolarHBondContact O-CB 3.07Å; C394-E398 PolarHBondContact O-N 3.49Å; E398-R401 PolarHBondContact O-N 3.46Å; E398-R401 IonicContact OE1-CZ 3.26Å; E398-R401 IonicContact OE1-NH2 2.78Å; E398-R401 PolarHBondContact OE1-NH2 3.45Å; E398-R401 IonicContact OE2-CZ 3.87Å; E398-R401 IonicContact OE2-NE 2.76Å; E398-R401 PolarHBondContact OE2-NE 2.89Å; E398-R401 IonicContact OE2-NH2 3.11Å; E398-R401 PolarHBondContact OE2-NH2 3.5Å; E398-K402 WeakPolarHBondContact O-CG 3.21Å; E398-K402 PolarHBondContact O-N 2.71Å; E398-K402 WeakPolarHBondContact OE1-CE 3.36Å; E398-K402 IonicContact OE1-NZ 2.93Å
399	R	93.8	Very high	93.4	Very high	114 Å²	114	54 Å²	54	43%	0.43	25%	0.245	S	C	.	.	H	α-helix	trans	-65.3	-40.2	175.3	-70.6	175.3	172.7	179.2	-0.8	111.6	Q395 L396 K402 L403 M447 L450	Q395-R399 WeakPolarHBondContact O-CB 3.37Å; Q395-R399 VanDerWaalsContact O-CG 3.29Å; Q395-R399 WeakPolarHBondContact O-CG 3.31Å; Q395-R399 PolarHBondContact O-N 3.06Å; Q395-R399 VanDerWaalsContact OE1-CZ 3.28Å; L396-R399 PolarHBondContact O-N 3.41Å; R399-K402 PolarHBondContact O-N 3.12Å; R399-L403 PolarHBondContact O-N 2.97Å; R399-M447 PolarHBondContact NH1-SD 2.88Å; R399-L450 HydrophobicContact CB-CD2 3.47Å; R399-L450 VanDerWaalsContact CB-CD2 3.47Å
400	K	94	Very high	93.4	Very high	40 Å²	40	51.6 Å²	51.6	17%	0.174	24%	0.236	C	C	.	.	H	α-helix	trans	-61.7	-42	174	179.1	173.6	174.3	168.6	0	111.7	L396 N397 L403 K404 L441 A442 V444 L450	L396-K400 WeakPolarHBondContact O-CB 3.4Å; L396-K400 PolarHBondContact O-N 3.15Å; N397-K400 PolarHBondContact O-N 3.4Å; K400-L403 PolarHBondContact O-N 3.08Å; K400-K404 WeakPolarHBondContact O-CB 3.37Å; K400-K404 PolarHBondContact O-N 2.75Å; K400-L441 WeakPolarHBondContact CE-O 3.41Å; K400-L441 HydrophobicContact CG-CD1 4.25Å; K400-A442 WeakPolarHBondContact CE-O 3.29Å; K400-A442 PolarHBondContact NZ-O 3.24Å; K400-V444 PolarHBondContact NZ-O 3.36Å; K400-L450 HydrophobicContact CB-CD1 4.22Å
401	R	92.6	Very high	93.2	Very high	133 Å²	133	55.2 Å²	55.2	50%	0.502	25%	0.25	S	C	.	.	H	α-helix	trans	-63.6	-46.7	173.4	-170.4	-173.5	70.5	91.7	1.2	112	N397 E398 L403 K404 V405	N397-R401 VanDerWaalsContact O-CB 3.27Å; N397-R401 WeakPolarHBondContact O-CB 3.39Å; N397-R401 PolarHBondContact O-N 3.12Å; E398-R401 PolarHBondContact O-N 3.46Å; E398-R401 IonicContact OE1-CZ 3.26Å; E398-R401 IonicContact OE1-NH2 2.78Å; E398-R401 PolarHBondContact OE1-NH2 3.45Å; E398-R401 IonicContact OE2-CZ 3.87Å; E398-R401 IonicContact OE2-NE 2.76Å; E398-R401 PolarHBondContact OE2-NE 2.89Å; E398-R401 IonicContact OE2-NH2 3.11Å; E398-R401 PolarHBondContact OE2-NH2 3.5Å; R401-L403 VanDerWaalsContact C-N 3.33Å; R401-L403 PolarHBondContact O-N 3.16Å; R401-K404 WeakPolarHBondContact O-CB 3.43Å; R401-K404 PolarHBondContact O-N 3.19Å; R401-V405 WeakPolarHBondContact O-CG2 3.34Å; R401-V405 PolarHBondContact O-N 2.98Å
402	K	93.8	Very high	93.1	Very high	130 Å²	130	59.6 Å²	59.6	57%	0.565	27%	0.267	S	S	*	.	H	α-helix	trans	-59	-42.9	174.6	-71.1	-177.3	-166.9	-174.2	0	111.8	E398 R399 V405 L406	E398-K402 WeakPolarHBondContact O-CG 3.21Å; E398-K402 PolarHBondContact O-N 2.71Å; E398-K402 WeakPolarHBondContact OE1-CE 3.36Å; E398-K402 IonicContact OE1-NZ 2.93Å; R399-K402 PolarHBondContact O-N 3.12Å; K402-V405 PolarHBondContact O-N 3.09Å; K402-L406 PolarHBondContact O-N 3.04Å; K402-L406 VanDerWaalsContact O-N 3.15Å
403	L	93.4	Very high	93	Very high	15 Å²	15	57.7 Å²	57.7	8%	0.079	26%	0.257	C	S	.	.	H	α-helix	trans	-67.3	-36.8	176.6	-169.7	56.9	0	0	0	112.1	R399 K400 R401 L406 F407 L441 L450 V453 H454	R399-L403 PolarHBondContact O-N 2.97Å; K400-L403 PolarHBondContact O-N 3.08Å; R401-L403 VanDerWaalsContact C-N 3.33Å; R401-L403 PolarHBondContact O-N 3.16Å; L403-L406 HydrophobicContact CD1-CD2 4.24Å; L403-L406 WeakPolarHBondContact O-CB 3.22Å; L403-L406 PolarHBondContact O-N 3.23Å; L403-L406 VanDerWaalsContact O-N 3.14Å; L403-F407 HydrophobicContact CD1-CD2 4.15Å; L403-F407 HydrophobicContact CD1-CE2 3.76Å; L403-F407 HydrophobicContact CD2-CE2 4.35Å; L403-F407 HydrophobicContact CG-CD2 4.17Å; L403-F407 HydrophobicContact CG-CE2 3.76Å; L403-F407 VanDerWaalsContact O-CD2 3.24Å; L403-F407 WeakPolarHBondContact O-CD2 2.94Å; L403-F407 PolarHBondContact O-N 3.42Å; L403-L441 HydrophobicContact CB-CD1 4.39Å; L403-L441 HydrophobicContact CB-CD2 4.37Å; L403-L441 HydrophobicContact CD2-CD1 3.85Å; L403-L441 HydrophobicContact CG-CD1 4.22Å; L403-L441 HydrophobicContact CG-CD2 4.26Å; L403-L450 HydrophobicContact CD2-CD1 3.71Å; L403-L450 HydrophobicContact CD2-CG 4.37Å; L403-V453 HydrophobicContact CD2-CG1 4.24Å; L403-H454 HydrophobicContact CD2-CB 4.11Å
404	K	94.4	Very high	92.8	Very high	98 Å²	98	56.9 Å²	56.9	43%	0.426	25%	0.254	S	S	.	.	H	α-helix	trans	-62.7	-45.4	175.3	-165.9	-166.1	179.9	-124.1	0	111.6	K400 R401 L406 F407 E408 F438 L441	K400-K404 WeakPolarHBondContact O-CB 3.37Å; K400-K404 PolarHBondContact O-N 2.75Å; R401-K404 WeakPolarHBondContact O-CB 3.43Å; R401-K404 PolarHBondContact O-N 3.19Å; K404-L406 PolarHBondContact O-N 2.69Å; K404-F407 WeakPolarHBondContact O-CB 3.46Å; K404-F407 PolarHBondContact O-N 2.82Å; K404-F407 VanDerWaalsContact O-N 3.09Å; K404-E408 WeakPolarHBondContact CE-OE1 3.41Å; K404-E408 IonicContact NZ-OE1 3.19Å; K404-E408 PolarHBondContact NZ-OE1 3.29Å; K404-E408 WeakPolarHBondContact O-CG 3.39Å; K404-E408 PolarHBondContact O-N 3.38Å; K404-F438 HydrophobicContact CG-CD1 4.21Å; K404-F438 HydrophobicContact CG-CE1 4.49Å; K404-L441 VanDerWaalsContact CA-CD2 3.49Å; K404-L441 HydrophobicContact CB-CD2 3.78Å; K404-L441 HydrophobicContact CG-CD2 4.25Å
405	V	94.4	Very high	92.6	Very high	50 Å²	50	60 Å²	60	30%	0.303	27%	0.27	S	S	.	.	H	α-helix	trans	-60.8	-32.1	174.7	171.6	0	0	0	0	111.6	R401 K402 K409	R401-V405 WeakPolarHBondContact O-CG2 3.34Å; R401-V405 PolarHBondContact O-N 2.98Å; K402-V405 PolarHBondContact O-N 3.09Å; V405-K409 HydrophobicContact CG1-CD 4.22Å; V405-K409 VanDerWaalsContact O-CB 3.29Å; V405-K409 WeakPolarHBondContact O-CB 3.45Å; V405-K409 VanDerWaalsContact O-CG 3.24Å; V405-K409 WeakPolarHBondContact O-CG 3.24Å; V405-K409 PolarHBondContact O-N 3.38Å
406	L	92.4	Very high	92.3	Very high	46 Å²	46	60 Å²	60	24%	0.241	27%	0.271	C	S	.	.	H	α-helix	trans	-70.5	-39.2	173.7	-175	60.2	0	0	0	112.5	K402 L403 K404 M410 F457 L465 M468	K402-L406 PolarHBondContact O-N 3.04Å; K402-L406 VanDerWaalsContact O-N 3.15Å; L403-L406 HydrophobicContact CD1-CD2 4.24Å; L403-L406 WeakPolarHBondContact O-CB 3.22Å; L403-L406 PolarHBondContact O-N 3.23Å; L403-L406 VanDerWaalsContact O-N 3.14Å; K404-L406 PolarHBondContact O-N 2.69Å; L406-M410 WeakPolarHBondContact O-CB 3.4Å; L406-M410 PolarHBondContact O-N 3.46Å; L406-F457 HydrophobicContact CD1-CZ 4.35Å; L406-F457 HydrophobicContact CD2-CD1 4.18Å; L406-F457 HydrophobicContact CD2-CE1 3.58Å; L406-F457 HydrophobicContact CD2-CZ 4Å; L406-F457 HydrophobicContact CG-CE1 3.84Å; L406-F457 HydrophobicContact CG-CE2 4.47Å; L406-F457 HydrophobicContact CG-CZ 3.7Å; L406-L465 HydrophobicContact CD1-CD2 4.04Å; L406-M468 HydrophobicContact CD1-CE 4.09Å
407	F	93.5	Very high	91.9	Very high	2 Å²	2	62.2 Å²	62.2	1%	0.009	29%	0.285	C	S	.	.	H	α-helix	trans	-65.4	-43.3	172.7	-80	-138.8	0	0	0	111.1	L403 K404 M410 R411 I433 D437 F438 L441 V453 F457	L403-F407 HydrophobicContact CD1-CD2 4.15Å; L403-F407 HydrophobicContact CD1-CE2 3.76Å; L403-F407 HydrophobicContact CD2-CE2 4.35Å; L403-F407 HydrophobicContact CG-CD2 4.17Å; L403-F407 HydrophobicContact CG-CE2 3.76Å; L403-F407 VanDerWaalsContact O-CD2 3.24Å; L403-F407 WeakPolarHBondContact O-CD2 2.94Å; L403-F407 PolarHBondContact O-N 3.42Å; K404-F407 WeakPolarHBondContact O-CB 3.46Å; K404-F407 PolarHBondContact O-N 2.82Å; K404-F407 VanDerWaalsContact O-N 3.09Å; F407-M410 PolarHBondContact O-N 2.86Å; F407-R411 WeakPolarHBondContact O-CB 3.29Å; F407-R411 PolarHBondContact O-N 3.1Å; F407-I433 HydrophobicContact CB-CD1 4.39Å; F407-I433 HydrophobicContact CD1-CG2 4.43Å; F407-I433 WeakPolarHBondContact O-CD1 3.31Å; F407-D437 HydrophobicContact CD1-CB 4.24Å; F407-D437 HydrophobicContact CE1-CB 4.06Å; F407-F438 HydrophobicContact CB-CD1 4.28Å; F407-F438 HydrophobicContact CB-CE1 3.5Å; F407-F438 VanDerWaalsContact CB-CE1 3.5Å; F407-F438 HydrophobicContact CB-CZ 3.85Å; F407-L441 HydrophobicContact CD2-CD2 4.48Å; F407-L441 HydrophobicContact CG-CD2 4.45Å; F407-V453 HydrophobicContact CZ-CG1 3.87Å; F407-F457 AromaticContact CD2-CD2 3.45Å; F407-F457 HydrophobicContact CD2-CD2 3.45Å; F407-F457 VanDerWaalsContact CD2-CD2 3.45Å; F407-F457 AromaticContact CD2-CE2 3.8Å; F407-F457 HydrophobicContact CD2-CE2 3.8Å; F407-F457 HydrophobicContact CD2-CG 4.18Å; F407-F457 HydrophobicContact CE2-CB 3.67Å; F407-F457 AromaticContact CE2-CD2 3.25Å; F407-F457 HydrophobicContact CE2-CD2 3.25Å; F407-F457 HydrophobicContact CE2-CE2 4.08Å; F407-F457 AromaticContact CE2-CG 3.63Å; F407-F457 HydrophobicContact CE2-CG 3.63Å; F407-F457 HydrophobicContact CG-CD2 4.2Å; F407-F457 HydrophobicContact CG-CE2 4.41Å; F407-F457 HydrophobicContact CZ-CB 3.94Å; F407-F457 AromaticContact CZ-CD2 3.86Å; F407-F457 HydrophobicContact CZ-CD2 3.86Å; F407-F457 HydrophobicContact CZ-CG 4.27Å
408	E	94	Very high	91.5	Very high	76 Å²	76	62.2 Å²	62.2	36%	0.355	29%	0.285	S	S	.	.	H	α-helix	trans	-59.9	-47.1	175.6	-71	166.3	174.8	0	0	111.2	K404 M410 R411 Q412 F438	K404-E408 WeakPolarHBondContact CE-OE1 3.41Å; K404-E408 IonicContact NZ-OE1 3.19Å; K404-E408 PolarHBondContact NZ-OE1 3.29Å; K404-E408 WeakPolarHBondContact O-CG 3.39Å; K404-E408 PolarHBondContact O-N 3.38Å; E408-M410 PolarHBondContact O-N 2.95Å; E408-R411 PolarHBondContact O-N 2.94Å; E408-Q412 PolarHBondContact O-N 2.97Å; E408-F438 HydrophobicContact CG-CE1 3.84Å; E408-F438 HydrophobicContact CG-CZ 4.35Å
409	K	92.5	Very high	91.1	Very high	98 Å²	98	63.6 Å²	63.6	43%	0.426	30%	0.301	S	S	.	.	H	α-helix	trans	-59.4	-41.7	175.3	-82.4	177.6	179.6	-172.2	0	113.2	V405 F413 M468	V405-K409 HydrophobicContact CG1-CD 4.22Å; V405-K409 VanDerWaalsContact O-CB 3.29Å; V405-K409 WeakPolarHBondContact O-CB 3.45Å; V405-K409 VanDerWaalsContact O-CG 3.24Å; V405-K409 WeakPolarHBondContact O-CG 3.24Å; V405-K409 PolarHBondContact O-N 3.38Å; K409-F413 PolarHBondContact O-N 2.99Å; K409-F413 VanDerWaalsContact O-N 3.14Å; K409-M468 HydrophobicContact CB-SD 4.04Å
410	M	92.6	Very high	90.5	Very high	0 Å²	0	61.8 Å²	61.8	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-71.7	-41.3	177.7	-177.5	57.3	69.2	0	0	111.6	L406 F407 E408 Q412 F413 Q414 I433 F457 Y461 E464 L465 M468	L406-M410 WeakPolarHBondContact O-CB 3.4Å; L406-M410 PolarHBondContact O-N 3.46Å; F407-M410 PolarHBondContact O-N 2.86Å; E408-M410 PolarHBondContact O-N 2.95Å; M410-Q412 VanDerWaalsContact C-N 3.32Å; M410-Q412 PolarHBondContact O-N 3.44Å; M410-F413 PolarHBondContact O-N 3.4Å; M410-F413 HydrophobicContact SD-CD1 3.97Å; M410-Q414 WeakPolarHBondContact O-CG 3.46Å; M410-Q414 PolarHBondContact O-N 2.91Å; M410-Q414 HydrophobicContact SD-CG 4.38Å; M410-I433 HydrophobicContact CB-CD1 3.62Å; M410-I433 HydrophobicContact CG-CD1 3.64Å; M410-I433 HydrophobicContact CG-CG1 4.5Å; M410-F457 HydrophobicContact CB-CE2 4.15Å; M410-F457 HydrophobicContact CB-CZ 4.23Å; M410-F457 HydrophobicContact CE-CZ 4.5Å; M410-F457 HydrophobicContact CG-CE2 4.32Å; M410-F457 HydrophobicContact CG-CZ 4.45Å; M410-Y461 HydrophobicContact CG-CD1 3.92Å; M410-Y461 HydrophobicContact CG-CG 4.16Å; M410-E464 HydrophobicContact CE-CB 3.83Å; M410-E464 HydrophobicContact SD-CB 3.78Å; M410-L465 HydrophobicContact CE-CD2 3.67Å; M410-L465 HydrophobicContact CE-CG 4.02Å; M410-M468 HydrophobicContact CB-SD 4.12Å; M410-M468 HydrophobicContact CE-CB 4.02Å; M410-M468 HydrophobicContact CE-CG 4.32Å; M410-M468 HydrophobicContact CE-SD 3.66Å; M410-M468 HydrophobicContact SD-SD 4.35Å
411	R	92.6	Very high	89.6	Confident	77 Å²	77	65.1 Å²	65.1	29%	0.291	33%	0.33	S	S	.	.	H	α-helix	trans	-58.6	-44.4	174.7	-171.6	-171.1	-168.6	154.3	3.4	110.8	F407 E408 Q414 L415 I433 D435 F438	F407-R411 WeakPolarHBondContact O-CB 3.29Å; F407-R411 PolarHBondContact O-N 3.1Å; E408-R411 PolarHBondContact O-N 2.94Å; R411-Q414 PolarHBondContact O-N 3.4Å; R411-L415 HydrophobicContact CG-CD1 4.12Å; R411-L415 WeakPolarHBondContact O-CB 3.09Å; R411-L415 VanDerWaalsContact O-CG 3.28Å; R411-L415 WeakPolarHBondContact O-CG 3.47Å; R411-L415 PolarHBondContact O-N 3.25Å; R411-I433 HydrophobicContact CB-CB 4.31Å; R411-I433 HydrophobicContact CB-CD1 4.45Å; R411-D435 IonicContact CZ-OD1 3.18Å; R411-D435 IonicContact NH1-OD1 3.37Å; R411-D435 PolarHBondContact NH1-OD1 2.9Å; R411-D435 IonicContact NH2-OD1 3.82Å; R411-D435 PolarHBondContact NH2-OD1 3.12Å; R411-D435 IonicContact NH2-OD2 3.73Å; R411-D435 PolarHBondContact NH2-OD2 3.37Å; R411-F438 HydrophobicContact CB-CZ 4.39Å; R411-F438 VanDerWaalsContact NH1-CE2 3.3Å
412	Q	91.2	Very high	88.6	Confident	102 Å²	102	64.2 Å²	64.2	48%	0.477	34%	0.34	S	S	.	.	H	α-helix	trans	-63.8	-42.6	176.8	-170.9	61.4	47.5	0	0	111.9	E408 M410 Q414 L415 D416	E408-Q412 PolarHBondContact O-N 2.97Å; M410-Q412 VanDerWaalsContact C-N 3.32Å; M410-Q412 PolarHBondContact O-N 3.44Å; Q412-Q414 PolarHBondContact O-N 3.5Å; Q412-L415 PolarHBondContact O-N 3.07Å; Q412-D416 PolarHBondContact NE2-OD1 3.44Å; Q412-D416 WeakPolarHBondContact O-CB 3.4Å; Q412-D416 PolarHBondContact O-N 2.87Å
413	F	90.8	Very high	87.7	Confident	11 Å²	11	65.8 Å²	65.8	5%	0.048	35%	0.354	C	S	.	.	H	α-helix	trans	-63.3	-40.3	176.2	169.4	-98.4	0	0	0	112.9	K409 M410 T417 E464 R467 M468 E471	K409-F413 PolarHBondContact O-N 2.99Å; K409-F413 VanDerWaalsContact O-N 3.14Å; M410-F413 PolarHBondContact O-N 3.4Å; M410-F413 HydrophobicContact SD-CD1 3.97Å; F413-T417 WeakPolarHBondContact O-CB 3.42Å; F413-T417 PolarHBondContact O-N 3.19Å; F413-T417 PolarHBondContact O-OG1 3.45Å; F413-E464 HydrophobicContact CE1-CB 4.14Å; F413-R467 HydrophobicContact CE1-CB 4.3Å; F413-R467 HydrophobicContact CE2-CB 4.19Å; F413-R467 HydrophobicContact CZ-CB 3.58Å; F413-M468 HydrophobicContact CB-CB 4.16Å; F413-M468 HydrophobicContact CB-CG 3.76Å; F413-M468 HydrophobicContact CD1-CB 3.99Å; F413-M468 HydrophobicContact CD1-CG 4.48Å; F413-M468 HydrophobicContact CD2-CB 4.13Å; F413-M468 HydrophobicContact CD2-CG 4.46Å; F413-M468 HydrophobicContact CE1-CB 4.49Å; F413-M468 HydrophobicContact CG-CB 3.8Å; F413-M468 HydrophobicContact CG-CG 3.97Å; F413-E471 HydrophobicContact CD2-CB 3.94Å; F413-E471 HydrophobicContact CD2-CG 4.03Å; F413-E471 HydrophobicContact CE2-CB 3.99Å; F413-E471 HydrophobicContact CE2-CG 4.29Å
414	Q	89.4	Confident	86.7	Confident	8 Å²	8	71.4 Å²	71.4	4%	0.037	38%	0.38	C	S	.	.	H	α-helix	trans	-64.3	-44.4	173.6	-71.3	-175	-26.3	0	0	111.1	M410 R411 Q412 T417 L418 R431 L432 E464	M410-Q414 WeakPolarHBondContact O-CG 3.46Å; M410-Q414 PolarHBondContact O-N 2.91Å; M410-Q414 HydrophobicContact SD-CG 4.38Å; R411-Q414 PolarHBondContact O-N 3.4Å; Q412-Q414 PolarHBondContact O-N 3.5Å; Q414-T417 PolarHBondContact O-N 3.44Å; Q414-L418 VanDerWaalsContact O-CG 3.27Å; Q414-L418 WeakPolarHBondContact O-CG 3.3Å; Q414-L418 PolarHBondContact O-N 2.59Å; Q414-R431 PolarHBondContact NE2-O 2.97Å; Q414-L432 HydrophobicContact CB-CD2 4.4Å; Q414-E464 PolarHBondContact NE2-OE2 3.44Å
415	L	88.4	Confident	85.6	Confident	78 Å²	78	71.9 Å²	71.9	41%	0.408	39%	0.393	S	S	.	.	H	α-helix	trans	-62	-47.4	175.8	-73.3	169.3	0	0	0	112.3	R411 Q412 T417 L418 C419	R411-L415 HydrophobicContact CG-CD1 4.12Å; R411-L415 WeakPolarHBondContact O-CB 3.09Å; R411-L415 VanDerWaalsContact O-CG 3.28Å; R411-L415 WeakPolarHBondContact O-CG 3.47Å; R411-L415 PolarHBondContact O-N 3.25Å; Q412-L415 PolarHBondContact O-N 3.07Å; L415-T417 VanDerWaalsContact C-N 3.27Å; L415-T417 PolarHBondContact O-N 2.83Å; L415-L418 PolarHBondContact O-N 3.32Å; L415-C419 WeakPolarHBondContact O-CB 3.16Å; L415-C419 PolarHBondContact O-N 3.03Å; L415-C419 PolarHBondContact O-SG 3.28Å; L415-C419 VanDerWaalsContact O-SG 3.35Å
416	D	87.8	Confident	84.6	Confident	49 Å²	49	72.8 Å²	72.8	26%	0.262	40%	0.399	S	S	.	.	H	α-helix	trans	-57	-42.3	176.1	-70	-14.5	0	0	0	111.2	Q412 C419 A420 K475	Q412-D416 PolarHBondContact NE2-OD1 3.44Å; Q412-D416 WeakPolarHBondContact O-CB 3.4Å; Q412-D416 PolarHBondContact O-N 2.87Å; D416-C419 PolarHBondContact O-N 2.77Å; D416-A420 PolarHBondContact O-N 2.54Å; D416-A420 VanDerWaalsContact O-N 3.13Å; D416-K475 IonicContact OD2-NZ 3.39Å; D416-K475 PolarHBondContact OD2-NZ 3.16Å
417	T	85.2	Confident	83.6	Confident	55 Å²	55	73.6 Å²	73.6	34%	0.337	41%	0.407	S	S	.	.	H	α-helix	trans	-67.2	-41.4	178.8	-57.3	0	0	0	0	111.8	F413 Q414 L415 A420	F413-T417 WeakPolarHBondContact O-CB 3.42Å; F413-T417 PolarHBondContact O-N 3.19Å; F413-T417 PolarHBondContact O-OG1 3.45Å; Q414-T417 PolarHBondContact O-N 3.44Å; L415-T417 VanDerWaalsContact C-N 3.27Å; L415-T417 PolarHBondContact O-N 2.83Å; T417-A420 PolarHBondContact O-N 2.9Å
418	L	82.7	Confident	82.3	Confident	58 Å²	58	79 Å²	79	30%	0.304	44%	0.436	S	S	.	.	H	α-helix	trans	-70.3	-32.6	176.3	-68.9	170.6	0	0	0	112.8	Q414 L415 A420 V426 L432	Q414-L418 VanDerWaalsContact O-CG 3.27Å; Q414-L418 WeakPolarHBondContact O-CG 3.3Å; Q414-L418 PolarHBondContact O-N 2.59Å; L415-L418 PolarHBondContact O-N 3.32Å; L418-A420 VanDerWaalsContact C-N 3.3Å; L418-V426 HydrophobicContact CD2-CG2 3.94Å; L418-L432 HydrophobicContact CD1-CD1 3.98Å; L418-L432 HydrophobicContact CD1-CD2 3.88Å
419	C	83.6	Confident	81.1	Confident	95 Å²	95	78.8 Å²	78.8	64%	0.642	44%	0.437	S	S	*	.	H	α-helix	trans	-74.1	-19.2	175.2	-73.4	0	0	0	0	113.4	L415 D416	L415-C419 WeakPolarHBondContact O-CB 3.16Å; L415-C419 PolarHBondContact O-N 3.03Å; L415-C419 PolarHBondContact O-SG 3.28Å; L415-C419 VanDerWaalsContact O-SG 3.35Å; D416-C419 PolarHBondContact O-N 2.77Å
420	A	82.4	Confident	80.4	Confident	77 Å²	77	75.8 Å²	75.8	64%	0.636	43%	0.427	S	S	*	.	H	α-helix	trans	-74.9	-39.3	176.8	0	0	0	0	0	113	D416 T417 L418	D416-A420 PolarHBondContact O-N 2.54Å; D416-A420 VanDerWaalsContact O-N 3.13Å; T417-A420 PolarHBondContact O-N 2.9Å; L418-A420 VanDerWaalsContact C-N 3.3Å
421	D	73.7	Confident	80	Confident	110 Å²	110	78.7 Å²	78.7	59%	0.588	44%	0.438	S	S	*	.	S	Bend	trans	-130.5	69.9	-178.9	-93.3	-55.1	0	0	0	110.8	D423 Q424	D421-D423 PolarHBondContact O-N 2.86Å; D421-Q424 HydrophobicContact CB-CB 4.29Å; D421-Q424 PolarHBondContact O-N 2.88Å
422	T	72.6	Confident	79.8	Confident	114 Å²	114	77.8 Å²	77.8	70%	0.699	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.4	-16.5	-172.8	56.1	0	0	0	0	115.5
423	D	74	Confident	79.7	Confident	162 Å²	162	73.3 Å²	73.3	87%	0.866	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.8	-8.8	177.9	-74.3	-28.2	0	0	0	113.3	D421	D421-D423 PolarHBondContact O-N 2.86Å
424	Q	71.7	Confident	79.7	Confident	133 Å²	133	77.1 Å²	77.1	62%	0.621	44%	0.438	S	S	*	.	S	Bend	trans	-85.9	125.5	-178.8	-167.4	169.1	53.5	0	0	111.3	D421	D421-Q424 HydrophobicContact CB-CB 4.29Å; D421-Q424 PolarHBondContact O-N 2.88Å
425	P	71.7	Confident	79.8	Confident	109 Å²	109	81.3 Å²	81.3	71%	0.708	46%	0.461	S	S	*	.	P	Polyproline II helix	trans	-65.5	138.8	174.4	27.6	-34.4	0	0	0	110.7
426	V	73.8	Confident	79.9	Confident	69 Å²	69	79.3 Å²	79.3	42%	0.418	45%	0.453	S	S	.	.	P	Polyproline II helix	trans	-54.2	124.5	178.3	-171.7	0	0	0	0	109.6	L418 V430 L432	L418-V426 HydrophobicContact CD2-CG2 3.94Å; V426-V430 HydrophobicContact CG1-CB 4.2Å; V426-V430 HydrophobicContact CG1-CG1 4.22Å; V426-L432 HydrophobicContact CG1-CD2 4.29Å; V426-L432 HydrophobicContact CG1-CG 4.43Å; V426-L432 HydrophobicContact CG2-CD1 4.49Å
427	P	71.2	Confident	80	Confident	62 Å²	62	77.1 Å²	77.1	40%	0.403	44%	0.441	S	S	.	.	P	Polyproline II helix	trans	-58.7	143.3	-179.1	-26.3	35.1	0	0	0	112.8	D429 V430	P427-D429 WeakPolarHBondContact CB-OD1 3.47Å; P427-D429 PolarHBondContact O-N 3.07Å; P427-V430 HydrophobicContact CB-CG2 4.04Å; P427-V430 HydrophobicContact CG-CG2 4.21Å; P427-V430 PolarHBondContact O-N 3.14Å
428	D	66.9	Low	80.4	Confident	116 Å²	116	75.9 Å²	75.9	62%	0.62	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.6	-20.6	-174.8	-99	-53	0	0	0	114.5	K542	D428-K542 VanDerWaalsContact O-CE 3.26Å; D428-K542 WeakPolarHBondContact O-CE 3.46Å; D428-K542 PolarHBondContact O-NZ 2.85Å; D428-K542 IonicContact OD1-NZ 3.39Å; D428-K542 PolarHBondContact OD1-NZ 2.66Å
429	D	69.5	Low	80.8	Confident	72 Å²	72	79 Å²	79	39%	0.385	45%	0.445	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.2	-6.6	177.9	65.2	-40.6	0	0	0	114.8	P427 R533	P427-D429 WeakPolarHBondContact CB-OD1 3.47Å; P427-D429 PolarHBondContact O-N 3.07Å; D429-R533 HydrophobicContact CB-CG 4.09Å
430	V	76.2	Confident	81.1	Confident	34 Å²	34	76.6 Å²	76.6	21%	0.206	42%	0.422	C	S	.	.			trans	-93.8	113.7	177.2	176.4	0	0	0	0	110.3	V426 P427 L432	V426-V430 HydrophobicContact CG1-CB 4.2Å; V426-V430 HydrophobicContact CG1-CG1 4.22Å; P427-V430 HydrophobicContact CB-CG2 4.04Å; P427-V430 HydrophobicContact CG-CG2 4.21Å; P427-V430 PolarHBondContact O-N 3.14Å; V430-L432 HydrophobicContact CG1-CD2 4.18Å
431	R	84.7	Confident	81.6	Confident	61 Å²	61	73.1 Å²	73.1	23%	0.23	39%	0.392	C	S	.	.	P	Polyproline II helix	trans	-88	125.5	166.9	-177.7	178.8	-175.6	-105.8	0.2	108.4	Q414 D437 Y456 N460 Y461	Q414-R431 PolarHBondContact NE2-O 2.97Å; R431-D437 IonicContact CZ-OD1 3.37Å; R431-D437 VanDerWaalsContact CZ-OD1 3.24Å; R431-D437 IonicContact CZ-OD2 3.93Å; R431-D437 VanDerWaalsContact NH1-CG 3.29Å; R431-D437 IonicContact NH1-OD1 2.65Å; R431-D437 PolarHBondContact NH1-OD1 3.04Å; R431-D437 IonicContact NH1-OD2 2.67Å; R431-D437 PolarHBondContact NH1-OD2 2.76Å; R431-D437 VanDerWaalsContact NH1-OD2 3.16Å; R431-D437 IonicContact NH2-OD1 3.51Å; R431-D437 PolarHBondContact NH2-OD1 3.15Å; R431-D437 IonicContact NH2-OD2 3.74Å; R431-D437 PolarHBondContact NH2-OD2 3.16Å; R431-Y456 PolarHBondContact NH2-OH 2.85Å; R431-N460 WeakPolarHBondContact CD-OD1 3.23Å; R431-Y461 PolarHBondContact NH1-OH 2.74Å; R431-Y461 WeakPolarHBondContact O-CE1 3.35Å
432	L	88	Confident	82.4	Confident	58 Å²	58	70.7 Å²	70.7	30%	0.304	39%	0.388	S	S	.	.	P	Polyproline II helix	trans	-76.6	147.6	170.3	-57.1	-177.6	0	0	0	110.5	Q414 L418 V426 V430 L434	Q414-L432 HydrophobicContact CB-CD2 4.4Å; L418-L432 HydrophobicContact CD1-CD1 3.98Å; L418-L432 HydrophobicContact CD1-CD2 3.88Å; V426-L432 HydrophobicContact CG1-CD2 4.29Å; V426-L432 HydrophobicContact CG1-CG 4.43Å; V426-L432 HydrophobicContact CG2-CD1 4.49Å; V430-L432 HydrophobicContact CG1-CD2 4.18Å; L432-L434 PolarHBondContact O-N 3Å
433	I	90.3	Very high	83.3	Confident	8 Å²	8	71 Å²	71	4%	0.041	39%	0.385	C	S	.	.	P	Polyproline II helix	trans	-72.3	122.9	168.8	-62.3	-178.5	0	0	0	109.1	F407 M410 R411 D437 F438 F457 Y461	F407-I433 HydrophobicContact CB-CD1 4.39Å; F407-I433 HydrophobicContact CD1-CG2 4.43Å; F407-I433 WeakPolarHBondContact O-CD1 3.31Å; M410-I433 HydrophobicContact CB-CD1 3.62Å; M410-I433 HydrophobicContact CG-CD1 3.64Å; M410-I433 HydrophobicContact CG-CG1 4.5Å; R411-I433 HydrophobicContact CB-CB 4.31Å; R411-I433 HydrophobicContact CB-CD1 4.45Å; I433-D437 HydrophobicContact CG2-CB 3.97Å; I433-F438 HydrophobicContact CG2-CD2 4.17Å; I433-F438 HydrophobicContact CG2-CE2 3.4Å; I433-F438 VanDerWaalsContact CG2-CE2 3.4Å; I433-F438 HydrophobicContact CG2-CZ 3.84Å; I433-F457 HydrophobicContact CD1-CE2 4.34Å; I433-Y461 HydrophobicContact CD1-CD1 4.41Å; I433-Y461 HydrophobicContact CD1-CE1 4.13Å; I433-Y461 HydrophobicContact CG1-CD1 4.13Å; I433-Y461 HydrophobicContact CG1-CE1 3.39Å; I433-Y461 HydrophobicContact CG1-CE2 4.12Å; I433-Y461 VanDerWaalsContact CG1-CZ 3.42Å
434	L	90	Very high	84.3	Confident	91 Å²	91	63.4 Å²	63.4	48%	0.476	35%	0.345	S	S	.	.	P	Polyproline II helix	trans	-98.7	163.8	179	-57.3	-179	0	0	0	111.1	L432 S436 D437 F438	L432-L434 PolarHBondContact O-N 3Å; L434-S436 PolarHBondContact O-N 3.31Å; L434-D437 PolarHBondContact N-OD2 3.24Å; L434-D437 WeakPolarHBondContact O-CB 3.45Å; L434-D437 PolarHBondContact O-N 2.92Å; L434-F438 WeakPolarHBondContact O-CD2 3.28Å
435	D	91.5	Very high	85.3	Confident	97 Å²	97	59.4 Å²	59.4	52%	0.519	33%	0.326	S	S	.	.	H	α-helix	trans	-61.6	-31	174.3	-63	-57.9	0	0	0	112	R411 D437 F438 E439	R411-D435 IonicContact CZ-OD1 3.18Å; R411-D435 IonicContact NH1-OD1 3.37Å; R411-D435 PolarHBondContact NH1-OD1 2.9Å; R411-D435 IonicContact NH2-OD1 3.82Å; R411-D435 PolarHBondContact NH2-OD1 3.12Å; R411-D435 IonicContact NH2-OD2 3.73Å; R411-D435 PolarHBondContact NH2-OD2 3.37Å; D435-D437 VanDerWaalsContact C-N 3.26Å; D435-D437 PolarHBondContact O-N 2.66Å; D435-F438 WeakPolarHBondContact O-CA 3.46Å; D435-F438 WeakPolarHBondContact O-CB 3.44Å; D435-F438 PolarHBondContact O-N 2.91Å; D435-E439 PolarHBondContact O-N 2.96Å
436	S	90	Very high	86.2	Confident	36 Å²	36	55 Å²	55	25%	0.252	30%	0.298	S	S	.	.	H	α-helix	trans	-64.7	-23	172.4	58	0	0	0	0	114.3	L434 F438 E439 R440	L434-S436 PolarHBondContact O-N 3.31Å; S436-F438 VanDerWaalsContact C-N 3.31Å; S436-E439 WeakPolarHBondContact CA-OE2 3.31Å; S436-R440 WeakPolarHBondContact O-CB 3.19Å; S436-R440 VanDerWaalsContact O-CD 3.27Å; S436-R440 WeakPolarHBondContact O-CD 3.4Å; S436-R440 WeakPolarHBondContact O-CG 3.33Å; S436-R440 PolarHBondContact O-N 3.04Å
437	D	91	Very high	87.1	Confident	2 Å²	2	53.1 Å²	53.1	1%	0.011	29%	0.285	C	S	.	.	H	α-helix	trans	-71	-29.9	171.3	-68.2	-59.9	0	0	0	111.6	F407 R431 I433 L434 D435 L441	F407-D437 HydrophobicContact CD1-CB 4.24Å; F407-D437 HydrophobicContact CE1-CB 4.06Å; R431-D437 IonicContact CZ-OD1 3.37Å; R431-D437 VanDerWaalsContact CZ-OD1 3.24Å; R431-D437 IonicContact CZ-OD2 3.93Å; R431-D437 VanDerWaalsContact NH1-CG 3.29Å; R431-D437 IonicContact NH1-OD1 2.65Å; R431-D437 PolarHBondContact NH1-OD1 3.04Å; R431-D437 IonicContact NH1-OD2 2.67Å; R431-D437 PolarHBondContact NH1-OD2 2.76Å; R431-D437 VanDerWaalsContact NH1-OD2 3.16Å; R431-D437 IonicContact NH2-OD1 3.51Å; R431-D437 PolarHBondContact NH2-OD1 3.15Å; R431-D437 IonicContact NH2-OD2 3.74Å; R431-D437 PolarHBondContact NH2-OD2 3.16Å; I433-D437 HydrophobicContact CG2-CB 3.97Å; L434-D437 PolarHBondContact N-OD2 3.24Å; L434-D437 WeakPolarHBondContact O-CB 3.45Å; L434-D437 PolarHBondContact O-N 2.92Å; D435-D437 VanDerWaalsContact C-N 3.26Å; D435-D437 PolarHBondContact O-N 2.66Å; D437-L441 PolarHBondContact O-N 3.27Å
438	F	92.7	Very high	88.2	Confident	30 Å²	30	53 Å²	53	13%	0.132	28%	0.279	C	S	.	.	H	α-helix	trans	-78.1	-37.1	172.3	-64.6	-83	0	0	0	112	K404 F407 E408 R411 I433 L434 D435 S436 L441 A442	K404-F438 HydrophobicContact CG-CD1 4.21Å; K404-F438 HydrophobicContact CG-CE1 4.49Å; F407-F438 HydrophobicContact CB-CD1 4.28Å; F407-F438 HydrophobicContact CB-CE1 3.5Å; F407-F438 VanDerWaalsContact CB-CE1 3.5Å; F407-F438 HydrophobicContact CB-CZ 3.85Å; E408-F438 HydrophobicContact CG-CE1 3.84Å; E408-F438 HydrophobicContact CG-CZ 4.35Å; R411-F438 HydrophobicContact CB-CZ 4.39Å; R411-F438 VanDerWaalsContact NH1-CE2 3.3Å; I433-F438 HydrophobicContact CG2-CD2 4.17Å; I433-F438 HydrophobicContact CG2-CE2 3.4Å; I433-F438 VanDerWaalsContact CG2-CE2 3.4Å; I433-F438 HydrophobicContact CG2-CZ 3.84Å; L434-F438 WeakPolarHBondContact O-CD2 3.28Å; D435-F438 WeakPolarHBondContact O-CA 3.46Å; D435-F438 WeakPolarHBondContact O-CB 3.44Å; D435-F438 PolarHBondContact O-N 2.91Å; S436-F438 VanDerWaalsContact C-N 3.31Å; F438-L441 PolarHBondContact O-N 3.06Å; F438-A442 WeakPolarHBondContact O-CB 3.34Å; F438-A442 PolarHBondContact O-N 2.89Å
439	E	91.6	Very high	89.5	Confident	124 Å²	124	48.6 Å²	48.6	58%	0.579	26%	0.255	S	S	*	.	H	α-helix	trans	-59.7	-49.7	171.6	-65.8	172.9	160.5	0	0	110.6	D435 S436 L441 A442 D443	D435-E439 PolarHBondContact O-N 2.96Å; S436-E439 WeakPolarHBondContact CA-OE2 3.31Å; E439-L441 VanDerWaalsContact C-N 3.25Å; E439-L441 PolarHBondContact O-N 3.06Å; E439-A442 WeakPolarHBondContact O-CB 3.42Å; E439-A442 PolarHBondContact O-N 2.94Å; E439-D443 PolarHBondContact O-N 3.42Å
440	R	89.7	Confident	90.7	Very high	43 Å²	43	45.9 Å²	45.9	16%	0.162	24%	0.24	C	C	.	.	H	α-helix	trans	-52.7	-40.8	173.8	-77.5	161.3	163.7	-105.2	-10.3	112.9	S436 Y456 E549 E604	S436-R440 WeakPolarHBondContact O-CB 3.19Å; S436-R440 VanDerWaalsContact O-CD 3.27Å; S436-R440 WeakPolarHBondContact O-CD 3.4Å; S436-R440 WeakPolarHBondContact O-CG 3.33Å; S436-R440 PolarHBondContact O-N 3.04Å; R440-Y456 PolarHBondContact NH1-OH 2.81Å; R440-E549 IonicContact CZ-OE1 3.76Å; R440-E549 IonicContact NE-OE1 3.03Å; R440-E549 PolarHBondContact NE-OE1 3.21Å; R440-E549 VanDerWaalsContact NH2-CD 3.25Å; R440-E549 IonicContact NH2-OE1 2.68Å; R440-E549 PolarHBondContact NH2-OE1 3.14Å; R440-E604 IonicContact CZ-OE1 3.72Å; R440-E604 IonicContact NH1-OE1 3.59Å; R440-E604 PolarHBondContact NH1-OE1 3.11Å; R440-E604 IonicContact NH1-OE2 2.73Å; R440-E604 IonicContact NH2-OE1 2.78Å; R440-E604 PolarHBondContact NH2-OE1 3.31Å
441	L	92.6	Very high	91.6	Very high	4 Å²	4	50.8 Å²	50.8	2%	0.021	26%	0.259	C	S	.	.	H	α-helix	trans	-74.6	-36.3	177.2	179.8	58.4	0	0	0	112.3	K400 L403 K404 F407 D437 F438 E439 D443 V444 L450 V453	K400-L441 WeakPolarHBondContact CE-O 3.41Å; K400-L441 HydrophobicContact CG-CD1 4.25Å; L403-L441 HydrophobicContact CB-CD1 4.39Å; L403-L441 HydrophobicContact CB-CD2 4.37Å; L403-L441 HydrophobicContact CD2-CD1 3.85Å; L403-L441 HydrophobicContact CG-CD1 4.22Å; L403-L441 HydrophobicContact CG-CD2 4.26Å; K404-L441 VanDerWaalsContact CA-CD2 3.49Å; K404-L441 HydrophobicContact CB-CD2 3.78Å; K404-L441 HydrophobicContact CG-CD2 4.25Å; F407-L441 HydrophobicContact CD2-CD2 4.48Å; F407-L441 HydrophobicContact CG-CD2 4.45Å; D437-L441 PolarHBondContact O-N 3.27Å; F438-L441 PolarHBondContact O-N 3.06Å; E439-L441 VanDerWaalsContact C-N 3.25Å; E439-L441 PolarHBondContact O-N 3.06Å; L441-D443 VanDerWaalsContact C-N 3.32Å; L441-V444 HydrophobicContact CD1-CG2 4.34Å; L441-V444 WeakPolarHBondContact O-CB 3.2Å; L441-V444 PolarHBondContact O-N 3.41Å; L441-L450 HydrophobicContact CD1-CD1 3.77Å; L441-V453 HydrophobicContact CB-CG1 4.47Å; L441-V453 HydrophobicContact CD1-CG1 4.09Å
442	A	91.5	Very high	92.1	Very high	60 Å²	60	48 Å²	48	50%	0.496	25%	0.248	S	C	.	.	H	α-helix	trans	-65.5	-35.1	174.9	0	0	0	0	0	112.1	K400 F438 E439 V444	K400-A442 WeakPolarHBondContact CE-O 3.29Å; K400-A442 PolarHBondContact NZ-O 3.24Å; F438-A442 WeakPolarHBondContact O-CB 3.34Å; F438-A442 PolarHBondContact O-N 2.89Å; E439-A442 WeakPolarHBondContact O-CB 3.42Å; E439-A442 PolarHBondContact O-N 2.94Å; A442-V444 VanDerWaalsContact C-N 3.31Å; A442-V444 PolarHBondContact O-N 2.91Å
443	D	91.9	Very high	92.5	Very high	119 Å²	119	45.6 Å²	45.6	64%	0.636	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.2	-18.3	177.8	-82.5	-9.6	0	0	0	114	E439 L441 Q445	E439-D443 PolarHBondContact O-N 3.42Å; L441-D443 VanDerWaalsContact C-N 3.32Å; D443-Q445 VanDerWaalsContact O-CG 3.28Å; D443-Q445 WeakPolarHBondContact O-CG 3.35Å; D443-Q445 PolarHBondContact O-N 3.39Å; D443-Q445 PolarHBondContact O-NE2 3.48Å
444	V	93.4	Very high	92.7	Very high	4 Å²	4	48.9 Å²	48.9	2%	0.024	25%	0.251	C	S	.	.			trans	-54.9	127	-179.3	170.3	0	0	0	0	112.3	L396 K400 L441 A442 S446 E449 L450 V453	L396-V444 HydrophobicContact CD1-CG1 4.35Å; K400-V444 PolarHBondContact NZ-O 3.36Å; L441-V444 HydrophobicContact CD1-CG2 4.34Å; L441-V444 WeakPolarHBondContact O-CB 3.2Å; L441-V444 PolarHBondContact O-N 3.41Å; A442-V444 VanDerWaalsContact C-N 3.31Å; A442-V444 PolarHBondContact O-N 2.91Å; V444-S446 WeakPolarHBondContact CG1-O 3.32Å; V444-E449 HydrophobicContact CG1-CB 3.99Å; V444-E449 HydrophobicContact CG2-CB 4.5Å; V444-L450 HydrophobicContact CG1-CB 3.82Å; V444-L450 HydrophobicContact CG1-CD1 4.08Å; V444-V453 HydrophobicContact CG2-CB 4.42Å; V444-V453 HydrophobicContact CG2-CG2 3.78Å
445	Q	92.4	Very high	92.8	Very high	49 Å²	49	46.8 Å²	46.8	23%	0.229	24%	0.239	C	C	.	.			trans	-117.6	-7.2	-177.1	-53.9	-65.2	-69	0	0	114.6	W316 Y320 L396 D443 E449	W316-Q445 PolarHBondContact NE1-O 2.86Å; Y320-Q445 HydrophobicContact CE2-CB 3.99Å; Y320-Q445 WeakPolarHBondContact OH-CB 3.38Å; L396-Q445 WeakPolarHBondContact CD2-O 3.5Å; D443-Q445 VanDerWaalsContact O-CG 3.28Å; D443-Q445 WeakPolarHBondContact O-CG 3.35Å; D443-Q445 PolarHBondContact O-N 3.39Å; D443-Q445 PolarHBondContact O-NE2 3.48Å; Q445-E449 PolarHBondContact N-OE2 3.29Å
446	S	92.6	Very high	92.9	Very high	15 Å²	15	43 Å²	43	11%	0.105	22%	0.218	C	C	.	.	S	Bend	trans	-147.1	169.3	179.3	82.3	0	0	0	0	113.3	V444 E448 E449 L450	V444-S446 WeakPolarHBondContact CG1-O 3.32Å; S446-E448 VanDerWaalsContact C-N 3.31Å; S446-E448 WeakPolarHBondContact CB-OE2 3.38Å; S446-E448 PolarHBondContact O-N 2.78Å; S446-E448 PolarHBondContact OG-N 2.8Å; S446-E448 PolarHBondContact OG-OE2 2.93Å; S446-E449 PolarHBondContact O-N 2.85Å; S446-E449 PolarHBondContact OG-N 3.42Å; S446-L450 WeakPolarHBondContact O-CB 3.3Å; S446-L450 PolarHBondContact O-N 3.39Å
447	M	92.5	Very high	93	Very high	31 Å²	31	41.2 Å²	41.2	15%	0.153	21%	0.206	C	C	.	.	H	α-helix	trans	-68.3	-31.9	179.4	-67.9	-69.3	179.8	0	0	112.1	Q395 L396 R399 L450 K451	Q395-M447 HydrophobicContact CB-CE 3.75Å; Q395-M447 HydrophobicContact CG-CE 3.87Å; L396-M447 HydrophobicContact CB-CE 3.94Å; L396-M447 HydrophobicContact CD1-CE 4.44Å; L396-M447 HydrophobicContact CD1-SD 4.11Å; R399-M447 PolarHBondContact NH1-SD 2.88Å; M447-L450 PolarHBondContact O-N 3.27Å; M447-K451 WeakPolarHBondContact O-CB 3.31Å; M447-K451 PolarHBondContact O-N 2.68Å
448	E	92.8	Very high	93	Very high	60 Å²	60	44.2 Å²	44.2	28%	0.28	22%	0.221	S	C	.	.	H	α-helix	trans	-70.2	-43.6	177.6	-46.1	70.6	-117.9	0	0	110.3	S446 L450 K451 D452 E734	S446-E448 VanDerWaalsContact C-N 3.31Å; S446-E448 WeakPolarHBondContact CB-OE2 3.38Å; S446-E448 PolarHBondContact O-N 2.78Å; S446-E448 PolarHBondContact OG-N 2.8Å; S446-E448 PolarHBondContact OG-OE2 2.93Å; E448-L450 VanDerWaalsContact C-N 3.32Å; E448-L450 PolarHBondContact O-N 3.37Å; E448-K451 WeakPolarHBondContact O-CB 3.49Å; E448-K451 PolarHBondContact O-N 3.08Å; E448-D452 VanDerWaalsContact O-CG 3.22Å; E448-D452 PolarHBondContact O-N 3.5Å; E448-E734 HydrophobicContact CG-CG 4.3Å
449	E	94.7	Very high	92.9	Very high	23 Å²	23	43.4 Å²	43.4	11%	0.107	22%	0.218	C	C	.	.	H	α-helix	trans	-62.9	-37.9	171.4	-70	-179	172.3	0	0	111.9	V444 Q445 S446 D452 V453 K609	V444-E449 HydrophobicContact CG1-CB 3.99Å; V444-E449 HydrophobicContact CG2-CB 4.5Å; Q445-E449 PolarHBondContact N-OE2 3.29Å; S446-E449 PolarHBondContact O-N 2.85Å; S446-E449 PolarHBondContact OG-N 3.42Å; E449-D452 PolarHBondContact O-N 3.19Å; E449-V453 WeakPolarHBondContact O-CG2 3.4Å; E449-V453 PolarHBondContact O-N 2.79Å; E449-K609 WeakPolarHBondContact OE1-CD 2.97Å; E449-K609 WeakPolarHBondContact OE1-CE 3.49Å; E449-K609 IonicContact OE1-NZ 3.37Å; E449-K609 PolarHBondContact OE1-NZ 3.04Å; E449-K609 IonicContact OE2-NZ 3.19Å
450	L	95.2	Very high	92.7	Very high	15 Å²	15	38.9 Å²	38.9	8%	0.079	20%	0.198	C	C	.	.	H	α-helix	trans	-66.7	-38.5	175	-167.2	66.1	0	0	0	111.8	L396 R399 K400 L403 L441 V444 S446 M447 E448 V453 H454	L396-L450 HydrophobicContact CD1-CB 4.43Å; L396-L450 HydrophobicContact CD1-CD2 4.31Å; R399-L450 HydrophobicContact CB-CD2 3.47Å; R399-L450 VanDerWaalsContact CB-CD2 3.47Å; K400-L450 HydrophobicContact CB-CD1 4.22Å; L403-L450 HydrophobicContact CD2-CD1 3.71Å; L403-L450 HydrophobicContact CD2-CG 4.37Å; L441-L450 HydrophobicContact CD1-CD1 3.77Å; V444-L450 HydrophobicContact CG1-CB 3.82Å; V444-L450 HydrophobicContact CG1-CD1 4.08Å; S446-L450 WeakPolarHBondContact O-CB 3.3Å; S446-L450 PolarHBondContact O-N 3.39Å; M447-L450 PolarHBondContact O-N 3.27Å; E448-L450 VanDerWaalsContact C-N 3.32Å; E448-L450 PolarHBondContact O-N 3.37Å; L450-V453 PolarHBondContact O-N 3.3Å; L450-H454 WeakPolarHBondContact O-CB 3.39Å; L450-H454 PolarHBondContact O-N 3.21Å
451	K	95	Very high	92.7	Very high	137 Å²	137	36.9 Å²	36.9	60%	0.596	19%	0.19	S	C	*	.	H	α-helix	trans	-63.2	-43.2	173.2	-174.7	176.4	-179.3	176.2	0	110.7	M447 E448 H454 M455	M447-K451 WeakPolarHBondContact O-CB 3.31Å; M447-K451 PolarHBondContact O-N 2.68Å; E448-K451 WeakPolarHBondContact O-CB 3.49Å; E448-K451 PolarHBondContact O-N 3.08Å; K451-H454 PolarHBondContact O-N 2.86Å; K451-M455 HydrophobicContact CG-SD 4.36Å; K451-M455 WeakPolarHBondContact O-CB 3.14Å; K451-M455 VanDerWaalsContact O-CG 3.31Å; K451-M455 WeakPolarHBondContact O-CG 3.16Å; K451-M455 PolarHBondContact O-N 3.32Å
452	D	95.7	Very high	92.4	Very high	2 Å²	2	37.8 Å²	37.8	1%	0.011	20%	0.197	C	C	.	.	H	α-helix	trans	-60.9	-46.9	175.8	-67	-22.5	0	0	0	111.5	E448 E449 M455 Y456 P605 R608 R612	E448-D452 VanDerWaalsContact O-CG 3.22Å; E448-D452 PolarHBondContact O-N 3.5Å; E449-D452 PolarHBondContact O-N 3.19Å; D452-M455 PolarHBondContact O-N 3.36Å; D452-Y456 WeakPolarHBondContact O-CB 3.28Å; D452-Y456 PolarHBondContact O-N 3Å; D452-P605 HydrophobicContact CB-CB 4.22Å; D452-R608 WeakPolarHBondContact OD1-CD 3.31Å; D452-R608 IonicContact OD1-CZ 2.83Å; D452-R608 IonicContact OD1-NE 3.76Å; D452-R608 PolarHBondContact OD1-NE 2.98Å; D452-R608 IonicContact OD1-NH2 3.6Å; D452-R608 WeakPolarHBondContact OD2-CB 3.39Å; D452-R612 IonicContact OD1-NH2 2.66Å; D452-R612 PolarHBondContact OD1-NH2 3.42Å; D452-R612 IonicContact OD2-CZ 3.29Å; D452-R612 VanDerWaalsContact OD2-CZ 3.3Å; D452-R612 IonicContact OD2-NH1 3.07Å; D452-R612 PolarHBondContact OD2-NH1 3.28Å; D452-R612 IonicContact OD2-NH2 3.88Å; D452-R612 PolarHBondContact OD2-NH2 2.96Å
453	V	95.1	Very high	92.1	Very high	7 Å²	7	37.5 Å²	37.5	4%	0.042	19%	0.185	C	C	.	.	H	α-helix	trans	-66.6	-35.5	176.7	174.5	0	0	0	0	112.1	L403 F407 L441 V444 E449 L450 Y456 F457 P605	L403-V453 HydrophobicContact CD2-CG1 4.24Å; F407-V453 HydrophobicContact CZ-CG1 3.87Å; L441-V453 HydrophobicContact CB-CG1 4.47Å; L441-V453 HydrophobicContact CD1-CG1 4.09Å; V444-V453 HydrophobicContact CG2-CB 4.42Å; V444-V453 HydrophobicContact CG2-CG2 3.78Å; E449-V453 WeakPolarHBondContact O-CG2 3.4Å; E449-V453 PolarHBondContact O-N 2.79Å; L450-V453 PolarHBondContact O-N 3.3Å; V453-Y456 WeakPolarHBondContact O-CB 3.23Å; V453-Y456 PolarHBondContact O-N 2.94Å; V453-F457 PolarHBondContact O-N 3.12Å; V453-P605 HydrophobicContact CG2-CB 4.08Å; V453-P605 HydrophobicContact CG2-CG 4.03Å
454	H	94.4	Very high	91.9	Very high	78 Å²	78	32.4 Å²	32.4	36%	0.361	16%	0.158	S	C	.	.	H	α-helix	trans	-67.2	-41.8	173.2	-177.5	-143.1	0	0	0	112	L403 L450 K451 Y456 F457 L458	L403-H454 HydrophobicContact CD2-CB 4.11Å; L450-H454 WeakPolarHBondContact O-CB 3.39Å; L450-H454 PolarHBondContact O-N 3.21Å; K451-H454 PolarHBondContact O-N 2.86Å; H454-Y456 VanDerWaalsContact C-N 3.31Å; H454-Y456 PolarHBondContact O-N 2.92Å; H454-F457 WeakPolarHBondContact O-CB 3.32Å; H454-F457 PolarHBondContact O-N 3.39Å; H454-L458 WeakPolarHBondContact O-CG 3.26Å; H454-L458 PolarHBondContact O-N 3.08Å
455	M	92.9	Very high	91.6	Very high	46 Å²	46	33.3 Å²	33.3	23%	0.227	16%	0.162	C	C	.	.	H	α-helix	trans	-63.5	-36.6	174.6	-74.4	-177.7	88.2	0	0	112.2	K451 D452 L458 L459	K451-M455 HydrophobicContact CG-SD 4.36Å; K451-M455 WeakPolarHBondContact O-CB 3.14Å; K451-M455 VanDerWaalsContact O-CG 3.31Å; K451-M455 WeakPolarHBondContact O-CG 3.16Å; K451-M455 PolarHBondContact O-N 3.32Å; D452-M455 PolarHBondContact O-N 3.36Å; M455-L458 PolarHBondContact O-N 3.13Å; M455-L459 PolarHBondContact O-N 3.32Å
456	Y	93.3	Very high	91.3	Very high	17 Å²	17	34 Å²	34	7%	0.067	17%	0.171	C	C	.	.	H	α-helix	trans	-64.4	-42.9	172.1	-175.6	-113.2	0	0	0	112.4	R431 R440 D452 V453 H454 L459 N460 Q603 E604 P605	R431-Y456 PolarHBondContact NH2-OH 2.85Å; R440-Y456 PolarHBondContact NH1-OH 2.81Å; D452-Y456 WeakPolarHBondContact O-CB 3.28Å; D452-Y456 PolarHBondContact O-N 3Å; V453-Y456 WeakPolarHBondContact O-CB 3.23Å; V453-Y456 PolarHBondContact O-N 2.94Å; H454-Y456 VanDerWaalsContact C-N 3.31Å; H454-Y456 PolarHBondContact O-N 2.92Å; Y456-L459 PolarHBondContact O-N 3.27Å; Y456-N460 PolarHBondContact O-N 3.41Å; Y456-N460 PolarHBondContact O-ND2 2.8Å; Y456-Q603 WeakPolarHBondContact CD2-O 3.3Å; Y456-E604 VanDerWaalsContact CE2-OE2 3.22Å; Y456-E604 WeakPolarHBondContact CE2-OE2 3.4Å; Y456-E604 PolarHBondContact OH-OE2 2.88Å; Y456-P605 HydrophobicContact CD1-CG 4.32Å; Y456-P605 HydrophobicContact CD2-CG 4.3Å; Y456-P605 HydrophobicContact CG-CG 3.91Å
457	F	92.9	Very high	91	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-61.1	-46.9	173.1	178.2	-92.4	0	0	0	111.3	L406 F407 M410 I433 V453 H454 L459 N460 Y461 L465	L406-F457 HydrophobicContact CD1-CZ 4.35Å; L406-F457 HydrophobicContact CD2-CD1 4.18Å; L406-F457 HydrophobicContact CD2-CE1 3.58Å; L406-F457 HydrophobicContact CD2-CZ 4Å; L406-F457 HydrophobicContact CG-CE1 3.84Å; L406-F457 HydrophobicContact CG-CE2 4.47Å; L406-F457 HydrophobicContact CG-CZ 3.7Å; F407-F457 AromaticContact CD2-CD2 3.45Å; F407-F457 HydrophobicContact CD2-CD2 3.45Å; F407-F457 VanDerWaalsContact CD2-CD2 3.45Å; F407-F457 AromaticContact CD2-CE2 3.8Å; F407-F457 HydrophobicContact CD2-CE2 3.8Å; F407-F457 HydrophobicContact CD2-CG 4.18Å; F407-F457 HydrophobicContact CE2-CB 3.67Å; F407-F457 AromaticContact CE2-CD2 3.25Å; F407-F457 HydrophobicContact CE2-CD2 3.25Å; F407-F457 HydrophobicContact CE2-CE2 4.08Å; F407-F457 AromaticContact CE2-CG 3.63Å; F407-F457 HydrophobicContact CE2-CG 3.63Å; F407-F457 HydrophobicContact CG-CD2 4.2Å; F407-F457 HydrophobicContact CG-CE2 4.41Å; F407-F457 HydrophobicContact CZ-CB 3.94Å; F407-F457 AromaticContact CZ-CD2 3.86Å; F407-F457 HydrophobicContact CZ-CD2 3.86Å; F407-F457 HydrophobicContact CZ-CG 4.27Å; M410-F457 HydrophobicContact CB-CE2 4.15Å; M410-F457 HydrophobicContact CB-CZ 4.23Å; M410-F457 HydrophobicContact CE-CZ 4.5Å; M410-F457 HydrophobicContact CG-CE2 4.32Å; M410-F457 HydrophobicContact CG-CZ 4.45Å; I433-F457 HydrophobicContact CD1-CE2 4.34Å; V453-F457 PolarHBondContact O-N 3.12Å; H454-F457 WeakPolarHBondContact O-CB 3.32Å; H454-F457 PolarHBondContact O-N 3.39Å; F457-L459 VanDerWaalsContact C-N 3.34Å; F457-L459 PolarHBondContact O-N 3.07Å; F457-N460 PolarHBondContact O-N 3.14Å; F457-Y461 HydrophobicContact CB-CD2 4.39Å; F457-Y461 AromaticContact CD2-CD2 3.33Å; F457-Y461 HydrophobicContact CD2-CD2 3.33Å; F457-Y461 AromaticContact CD2-CE2 3.99Å; F457-Y461 HydrophobicContact CD2-CE2 3.99Å; F457-Y461 HydrophobicContact CD2-CG 4.09Å; F457-Y461 AromaticContact CE2-CD2 3.64Å; F457-Y461 HydrophobicContact CE2-CD2 3.64Å; F457-Y461 HydrophobicContact CE2-CE2 4.48Å; F457-Y461 AromaticContact CE2-CG 3.93Å; F457-Y461 HydrophobicContact CE2-CG 3.93Å; F457-Y461 AromaticContact CG-CD2 3.92Å; F457-Y461 HydrophobicContact CG-CD2 3.92Å; F457-Y461 HydrophobicContact CZ-CD2 4.44Å; F457-Y461 HydrophobicContact CZ-CG 4.44Å; F457-Y461 VanDerWaalsContact O-CD2 3.28Å; F457-Y461 WeakPolarHBondContact O-CD2 3.4Å; F457-Y461 PolarHBondContact O-N 2.99Å; F457-L465 HydrophobicContact CE1-CD1 4.22Å; F457-L465 HydrophobicContact CE1-CD2 4.07Å; F457-L465 HydrophobicContact CE1-CG 4.4Å; F457-L465 HydrophobicContact CZ-CD2 4.16Å
458	L	91.1	Very high	90.8	Very high	64 Å²	64	39 Å²	39	34%	0.335	19%	0.186	S	C	.	.	H	α-helix	trans	-63.9	-35	178.1	-69.4	175.4	0	0	0	112.9	H454 M455 N460 S462 L465	H454-L458 WeakPolarHBondContact O-CG 3.26Å; H454-L458 PolarHBondContact O-N 3.08Å; M455-L458 PolarHBondContact O-N 3.13Å; L458-N460 PolarHBondContact O-N 3.15Å; L458-S462 WeakPolarHBondContact O-CB 3.36Å; L458-S462 PolarHBondContact O-N 3Å; L458-S462 PolarHBondContact O-OG 3.41Å; L458-L465 HydrophobicContact CD2-CD1 4.32Å
459	L	89.3	Confident	90.6	Very high	13 Å²	13	38.7 Å²	38.7	7%	0.068	19%	0.185	C	C	.	.	H	α-helix	trans	-61.8	-44.7	176.7	-179.5	61.1	0	0	0	112.1	M455 Y456 F457 Y529 R599 Q600 Q603	M455-L459 PolarHBondContact O-N 3.32Å; Y456-L459 PolarHBondContact O-N 3.27Å; F457-L459 VanDerWaalsContact C-N 3.34Å; F457-L459 PolarHBondContact O-N 3.07Å; L459-Y529 HydrophobicContact CD1-CD1 3.44Å; L459-Y529 VanDerWaalsContact CD1-CD1 3.44Å; L459-Y529 HydrophobicContact CD1-CD2 3.97Å; L459-Y529 HydrophobicContact CD1-CE1 3.28Å; L459-Y529 HydrophobicContact CD1-CE2 3.83Å; L459-Y529 HydrophobicContact CD1-CG 3.78Å; L459-Y529 VanDerWaalsContact CD1-CZ 3.48Å; L459-Y529 HydrophobicContact CG-CE1 4.06Å; L459-R599 HydrophobicContact CD1-CG 4.29Å; L459-Q600 HydrophobicContact CD2-CB 4.5Å; L459-Q600 HydrophobicContact CD2-CG 4.11Å; L459-Q603 HydrophobicContact CD2-CB 4Å
460	N	87.9	Confident	90.2	Very high	29 Å²	29	39.9 Å²	39.9	16%	0.155	20%	0.198	C	C	.	.	H	α-helix	trans	-81.5	-59.1	-176	-68.2	-72.5	0	0	0	111.5	R431 Y456 F457 L458 H463	R431-N460 WeakPolarHBondContact CD-OD1 3.23Å; Y456-N460 PolarHBondContact O-N 3.41Å; Y456-N460 PolarHBondContact O-ND2 2.8Å; F457-N460 PolarHBondContact O-N 3.14Å; L458-N460 PolarHBondContact O-N 3.15Å; N460-H463 PolarHBondContact O-CE1 3.41Å; N460-H463 VanDerWaalsContact O-CE1 3.24Å; N460-H463 PolarHBondContact O-ND1 3.27Å
461	Y	89.7	Confident	89.7	Confident	1 Å²	1	41.1 Å²	41.1	0%	0.004	20%	0.204	C	C	.	.	H	α-helix	trans	-98.9	-6.1	-161.7	-49.8	-78	0	0	0	115.2	M410 R431 I433 F457 H463 E464 L465	M410-Y461 HydrophobicContact CG-CD1 3.92Å; M410-Y461 HydrophobicContact CG-CG 4.16Å; R431-Y461 PolarHBondContact NH1-OH 2.74Å; R431-Y461 WeakPolarHBondContact O-CE1 3.35Å; I433-Y461 HydrophobicContact CD1-CD1 4.41Å; I433-Y461 HydrophobicContact CD1-CE1 4.13Å; I433-Y461 HydrophobicContact CG1-CD1 4.13Å; I433-Y461 HydrophobicContact CG1-CE1 3.39Å; I433-Y461 HydrophobicContact CG1-CE2 4.12Å; I433-Y461 VanDerWaalsContact CG1-CZ 3.42Å; F457-Y461 HydrophobicContact CB-CD2 4.39Å; F457-Y461 AromaticContact CD2-CD2 3.33Å; F457-Y461 HydrophobicContact CD2-CD2 3.33Å; F457-Y461 AromaticContact CD2-CE2 3.99Å; F457-Y461 HydrophobicContact CD2-CE2 3.99Å; F457-Y461 HydrophobicContact CD2-CG 4.09Å; F457-Y461 AromaticContact CE2-CD2 3.64Å; F457-Y461 HydrophobicContact CE2-CD2 3.64Å; F457-Y461 HydrophobicContact CE2-CE2 4.48Å; F457-Y461 AromaticContact CE2-CG 3.93Å; F457-Y461 HydrophobicContact CE2-CG 3.93Å; F457-Y461 AromaticContact CG-CD2 3.92Å; F457-Y461 HydrophobicContact CG-CD2 3.92Å; F457-Y461 HydrophobicContact CZ-CD2 4.44Å; F457-Y461 HydrophobicContact CZ-CG 4.44Å; F457-Y461 VanDerWaalsContact O-CD2 3.28Å; F457-Y461 WeakPolarHBondContact O-CD2 3.4Å; F457-Y461 PolarHBondContact O-N 2.99Å; Y461-H463 PolarHBondContact O-N 3.14Å; Y461-E464 PolarHBondContact O-N 3.12Å; Y461-L465 PolarHBondContact O-N 3.18Å
462	S	86	Confident	89.2	Confident	23 Å²	23	37.6 Å²	37.6	16%	0.161	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-20.7	-177.3	55.4	0	0	0	0	115.3	L458	L458-S462 WeakPolarHBondContact O-CB 3.36Å; L458-S462 PolarHBondContact O-N 3Å; L458-S462 PolarHBondContact O-OG 3.41Å
463	H	84.6	Confident	88.7	Confident	55 Å²	55	43.9 Å²	43.9	26%	0.255	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.4	-18.4	179.4	76.1	-78.3	0	0	0	113.7	N460 Y461 R533	N460-H463 PolarHBondContact O-CE1 3.41Å; N460-H463 VanDerWaalsContact O-CE1 3.24Å; N460-H463 PolarHBondContact O-ND1 3.27Å; Y461-H463 PolarHBondContact O-N 3.14Å; H463-R533 VanDerWaalsContact CB-NH2 3.29Å
464	E	87.4	Confident	88.2	Confident	11 Å²	11	50.6 Å²	50.6	5%	0.051	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.8	-26.1	173.5	-60.1	-166.6	91.2	0	0	111.5	M410 F413 Q414 Y461 R467 M468	M410-E464 HydrophobicContact CE-CB 3.83Å; M410-E464 HydrophobicContact SD-CB 3.78Å; F413-E464 HydrophobicContact CE1-CB 4.14Å; Q414-E464 PolarHBondContact NE2-OE2 3.44Å; Y461-E464 PolarHBondContact O-N 3.12Å; E464-R467 CarbonylContact O-C 3.55Å; E464-R467 WeakPolarHBondContact O-CA 3.31Å; E464-R467 WeakPolarHBondContact O-CB 3.43Å; E464-R467 PolarHBondContact O-N 3.28Å; E464-M468 PolarHBondContact O-N 2.89Å
465	L	87.5	Confident	87.8	Confident	23 Å²	23	50.7 Å²	50.7	12%	0.12	24%	0.237	C	C	.	.	H	α-helix	trans	-46.7	-46.8	179.8	-77.3	177.3	0	0	0	114.5	L406 M410 F457 L458 Y461 R467 M468 Q469	L406-L465 HydrophobicContact CD1-CD2 4.04Å; M410-L465 HydrophobicContact CE-CD2 3.67Å; M410-L465 HydrophobicContact CE-CG 4.02Å; F457-L465 HydrophobicContact CE1-CD1 4.22Å; F457-L465 HydrophobicContact CE1-CD2 4.07Å; F457-L465 HydrophobicContact CE1-CG 4.4Å; F457-L465 HydrophobicContact CZ-CD2 4.16Å; L458-L465 HydrophobicContact CD2-CD1 4.32Å; Y461-L465 PolarHBondContact O-N 3.18Å; L465-R467 VanDerWaalsContact C-N 3.31Å; L465-R467 PolarHBondContact O-N 2.88Å; L465-M468 HydrophobicContact CD2-CE 3.68Å; L465-M468 HydrophobicContact CD2-SD 4.34Å; L465-M468 PolarHBondContact O-N 3.31Å; L465-Q469 WeakPolarHBondContact O-CB 3.47Å; L465-Q469 VanDerWaalsContact O-CG 3.28Å; L465-Q469 WeakPolarHBondContact O-CG 3.5Å; L465-Q469 PolarHBondContact O-N 2.96Å
466	P	86.1	Confident	87.4	Confident	63 Å²	63	51.1 Å²	51.1	41%	0.409	25%	0.247	S	C	.	.	H	α-helix	trans	-66.6	-31.8	178.5	-22	35.1	0	0	0	113.2	A470	P466-A470 VanDerWaalsContact O-CB 3.31Å; P466-A470 WeakPolarHBondContact O-CB 3.35Å; P466-A470 PolarHBondContact O-N 3.39Å
467	R	86.7	Confident	86.9	Confident	150 Å²	150	54 Å²	54	57%	0.566	26%	0.263	S	S	*	.	H	α-helix	trans	-72.9	-45.2	175.4	-63	179	66.7	-162.9	-1.1	110.7	F413 E464 L465 Q469 A470 E471	F413-R467 HydrophobicContact CE1-CB 4.3Å; F413-R467 HydrophobicContact CE2-CB 4.19Å; F413-R467 HydrophobicContact CZ-CB 3.58Å; E464-R467 CarbonylContact O-C 3.55Å; E464-R467 WeakPolarHBondContact O-CA 3.31Å; E464-R467 WeakPolarHBondContact O-CB 3.43Å; E464-R467 PolarHBondContact O-N 3.28Å; L465-R467 VanDerWaalsContact C-N 3.31Å; L465-R467 PolarHBondContact O-N 2.88Å; R467-Q469 VanDerWaalsContact C-N 3.35Å; R467-Q469 PolarHBondContact O-N 3.41Å; R467-A470 PolarHBondContact O-N 3.36Å; R467-E471 WeakPolarHBondContact O-CB 3.47Å; R467-E471 PolarHBondContact O-N 2.95Å
468	M	89.2	Confident	86.5	Confident	3 Å²	3	58.5 Å²	58.5	2%	0.015	28%	0.284	C	S	.	.	H	α-helix	trans	-57.2	-45.4	173.9	-178	-158.3	73.9	0	0	111.5	L406 K409 M410 F413 E464 L465 E471 Q472	L406-M468 HydrophobicContact CD1-CE 4.09Å; K409-M468 HydrophobicContact CB-SD 4.04Å; M410-M468 HydrophobicContact CB-SD 4.12Å; M410-M468 HydrophobicContact CE-CB 4.02Å; M410-M468 HydrophobicContact CE-CG 4.32Å; M410-M468 HydrophobicContact CE-SD 3.66Å; M410-M468 HydrophobicContact SD-SD 4.35Å; F413-M468 HydrophobicContact CB-CB 4.16Å; F413-M468 HydrophobicContact CB-CG 3.76Å; F413-M468 HydrophobicContact CD1-CB 3.99Å; F413-M468 HydrophobicContact CD1-CG 4.48Å; F413-M468 HydrophobicContact CD2-CB 4.13Å; F413-M468 HydrophobicContact CD2-CG 4.46Å; F413-M468 HydrophobicContact CE1-CB 4.49Å; F413-M468 HydrophobicContact CG-CB 3.8Å; F413-M468 HydrophobicContact CG-CG 3.97Å; E464-M468 PolarHBondContact O-N 2.89Å; L465-M468 HydrophobicContact CD2-CE 3.68Å; L465-M468 HydrophobicContact CD2-SD 4.34Å; L465-M468 PolarHBondContact O-N 3.31Å; M468-E471 PolarHBondContact O-N 3.21Å; M468-Q472 WeakPolarHBondContact O-CB 3.46Å; M468-Q472 VanDerWaalsContact O-CG 3.29Å; M468-Q472 WeakPolarHBondContact O-CG 3.46Å; M468-Q472 PolarHBondContact O-N 2.94Å
469	Q	87.1	Confident	86.1	Confident	53 Å²	53	61.7 Å²	61.7	25%	0.248	30%	0.298	C	S	.	.	H	α-helix	trans	-68.4	-38.3	177.8	-72.2	173.5	-3.4	0	0	112.4	L465 R467 R473	L465-Q469 WeakPolarHBondContact O-CB 3.47Å; L465-Q469 VanDerWaalsContact O-CG 3.28Å; L465-Q469 WeakPolarHBondContact O-CG 3.5Å; L465-Q469 PolarHBondContact O-N 2.96Å; R467-Q469 VanDerWaalsContact C-N 3.35Å; R467-Q469 PolarHBondContact O-N 3.41Å; Q469-R473 WeakPolarHBondContact O-CB 3.3Å; Q469-R473 WeakPolarHBondContact O-CG 3.46Å; Q469-R473 PolarHBondContact O-N 3.01Å
470	A	86.3	Confident	85.7	Confident	48 Å²	48	67.7 Å²	67.7	40%	0.397	32%	0.319	S	S	.	.	H	α-helix	trans	-66.5	-38.7	173.6	0	0	0	0	0	112.5	P466 R467 R474	P466-A470 VanDerWaalsContact O-CB 3.31Å; P466-A470 WeakPolarHBondContact O-CB 3.35Å; P466-A470 PolarHBondContact O-N 3.39Å; R467-A470 PolarHBondContact O-N 3.36Å; A470-R474 WeakPolarHBondContact O-CB 3.42Å; A470-R474 PolarHBondContact O-N 3.37Å
471	E	86	Confident	85.3	Confident	41 Å²	41	72.4 Å²	72.4	19%	0.192	34%	0.335	C	S	.	.	H	α-helix	trans	-63.3	-48	173.8	-174.4	60.9	-141.2	0	0	111.2	F413 R467 M468 R473 R474 K475	F413-E471 HydrophobicContact CD2-CB 3.94Å; F413-E471 HydrophobicContact CD2-CG 4.03Å; F413-E471 HydrophobicContact CE2-CB 3.99Å; F413-E471 HydrophobicContact CE2-CG 4.29Å; R467-E471 WeakPolarHBondContact O-CB 3.47Å; R467-E471 PolarHBondContact O-N 2.95Å; M468-E471 PolarHBondContact O-N 3.21Å; E471-R473 PolarHBondContact O-N 2.98Å; E471-R474 PolarHBondContact O-N 2.71Å; E471-R474 IonicContact OE1-CZ 3.08Å; E471-R474 IonicContact OE1-NH1 3.36Å; E471-R474 IonicContact OE1-NH2 3.29Å; E471-R474 PolarHBondContact OE1-NH2 3.24Å; E471-R474 IonicContact OE2-CZ 3.18Å; E471-R474 IonicContact OE2-NH1 2.68Å; E471-R474 PolarHBondContact OE2-NH1 2.89Å; E471-R474 IonicContact OE2-NH2 2.73Å; E471-R474 PolarHBondContact OE2-NH2 3.25Å; E471-K475 WeakPolarHBondContact O-CG 3.39Å; E471-K475 PolarHBondContact O-N 2.93Å; E471-K475 WeakPolarHBondContact OE1-CE 3.29Å
472	Q	85.1	Confident	85.1	Confident	63 Å²	63	75.9 Å²	75.9	29%	0.294	35%	0.351	S	S	.	.	H	α-helix	trans	-62.5	-41.7	177.2	-74.7	171.1	9.5	0	0	112.2	M468 K475 A476	M468-Q472 WeakPolarHBondContact O-CB 3.46Å; M468-Q472 VanDerWaalsContact O-CG 3.29Å; M468-Q472 WeakPolarHBondContact O-CG 3.46Å; M468-Q472 PolarHBondContact O-N 2.94Å; Q472-K475 PolarHBondContact O-N 3.19Å; Q472-A476 WeakPolarHBondContact O-CB 3.43Å; Q472-A476 PolarHBondContact O-N 2.94Å
473	R	83.2	Confident	84.9	Confident	133 Å²	133	77.1 Å²	77.1	50%	0.502	36%	0.363	S	S	.	.	H	α-helix	trans	-61.4	-44	171.7	-76.9	-174.8	-67.2	-111.5	-2.2	112	Q469 E471 K475 A476 I477	Q469-R473 WeakPolarHBondContact O-CB 3.3Å; Q469-R473 WeakPolarHBondContact O-CG 3.46Å; Q469-R473 PolarHBondContact O-N 3.01Å; E471-R473 PolarHBondContact O-N 2.98Å; R473-K475 VanDerWaalsContact C-N 3.35Å; R473-K475 PolarHBondContact O-N 3.19Å; R473-A476 PolarHBondContact O-N 2.83Å; R473-I477 WeakPolarHBondContact O-CB 3.25Å; R473-I477 WeakPolarHBondContact O-CD1 3.35Å; R473-I477 VanDerWaalsContact O-CG1 3.27Å; R473-I477 WeakPolarHBondContact O-CG1 3.3Å; R473-I477 PolarHBondContact O-N 2.98Å
474	R	85.6	Confident	84.7	Confident	148 Å²	148	79.3 Å²	79.3	56%	0.558	37%	0.371	S	S	*	.	H	α-helix	trans	-62.3	-41.2	177.6	-165.4	176	77.4	-102.5	-3	111.9	A470 E471 Q478	A470-R474 WeakPolarHBondContact O-CB 3.42Å; A470-R474 PolarHBondContact O-N 3.37Å; E471-R474 PolarHBondContact O-N 2.71Å; E471-R474 IonicContact OE1-CZ 3.08Å; E471-R474 IonicContact OE1-NH1 3.36Å; E471-R474 IonicContact OE1-NH2 3.29Å; E471-R474 PolarHBondContact OE1-NH2 3.24Å; E471-R474 IonicContact OE2-CZ 3.18Å; E471-R474 IonicContact OE2-NH1 2.68Å; E471-R474 PolarHBondContact OE2-NH1 2.89Å; E471-R474 IonicContact OE2-NH2 2.73Å; E471-R474 PolarHBondContact OE2-NH2 3.25Å; R474-Q478 WeakPolarHBondContact O-CB 3.42Å; R474-Q478 PolarHBondContact O-N 2.88Å
475	K	85.4	Confident	84.4	Confident	81 Å²	81	81.1 Å²	81.1	35%	0.352	39%	0.389	S	S	.	.	H	α-helix	trans	-64.3	-47.1	174.5	-70.3	-174.1	-177.4	-173.1	0	112	D416 E471 Q472 R473 I477 Q478 E479	D416-K475 IonicContact OD2-NZ 3.39Å; D416-K475 PolarHBondContact OD2-NZ 3.16Å; E471-K475 WeakPolarHBondContact O-CG 3.39Å; E471-K475 PolarHBondContact O-N 2.93Å; E471-K475 WeakPolarHBondContact OE1-CE 3.29Å; Q472-K475 PolarHBondContact O-N 3.19Å; R473-K475 VanDerWaalsContact C-N 3.35Å; R473-K475 PolarHBondContact O-N 3.19Å; K475-I477 PolarHBondContact O-N 3.26Å; K475-Q478 WeakPolarHBondContact O-CB 3.47Å; K475-Q478 PolarHBondContact O-N 3.07Å; K475-Q478 VanDerWaalsContact O-N 3.17Å; K475-E479 WeakPolarHBondContact O-CB 3.36Å; K475-E479 WeakPolarHBondContact O-CG 3.42Å; K475-E479 PolarHBondContact O-N 2.89Å
476	A	84.7	Confident	84	Confident	54 Å²	54	88.1 Å²	88.1	45%	0.446	41%	0.414	S	S	.	.	H	α-helix	trans	-61.8	-39.6	178.1	0	0	0	0	0	113	Q472 R473 E479 R480	Q472-A476 WeakPolarHBondContact O-CB 3.43Å; Q472-A476 PolarHBondContact O-N 2.94Å; R473-A476 PolarHBondContact O-N 2.83Å; A476-E479 PolarHBondContact O-N 2.95Å; A476-R480 WeakPolarHBondContact O-CB 3.47Å; A476-R480 PolarHBondContact O-N 2.83Å
477	I	83.4	Confident	83.5	Confident	78 Å²	78	95 Å²	95	40%	0.4	43%	0.431	S	S	.	.	H	α-helix	trans	-64.9	-44.3	173.9	-67.9	163.6	0	0	0	110.6	R473 K475 R480 R481	R473-I477 WeakPolarHBondContact O-CB 3.25Å; R473-I477 WeakPolarHBondContact O-CD1 3.35Å; R473-I477 VanDerWaalsContact O-CG1 3.27Å; R473-I477 WeakPolarHBondContact O-CG1 3.3Å; R473-I477 PolarHBondContact O-N 2.98Å; K475-I477 PolarHBondContact O-N 3.26Å; I477-R480 PolarHBondContact O-N 2.83Å; I477-R481 WeakPolarHBondContact O-CB 3.25Å; I477-R481 WeakPolarHBondContact O-CG 3.41Å; I477-R481 PolarHBondContact O-N 3.23Å
478	Q	83.4	Confident	82.9	Confident	95 Å²	95	93.6 Å²	93.6	44%	0.444	43%	0.431	S	S	.	.	H	α-helix	trans	-61.6	-43.6	175.7	178.8	62.4	24.5	0	0	111.8	R474 K475 R481 E482	R474-Q478 WeakPolarHBondContact O-CB 3.42Å; R474-Q478 PolarHBondContact O-N 2.88Å; K475-Q478 WeakPolarHBondContact O-CB 3.47Å; K475-Q478 PolarHBondContact O-N 3.07Å; K475-Q478 VanDerWaalsContact O-N 3.17Å; Q478-R481 PolarHBondContact O-N 3.24Å; Q478-E482 PolarHBondContact NE2-OE1 3.31Å; Q478-E482 WeakPolarHBondContact O-CB 3.24Å; Q478-E482 WeakPolarHBondContact O-CG 3.39Å; Q478-E482 PolarHBondContact O-N 2.9Å
479	E	84.3	Confident	82.3	Confident	131 Å²	131	95.8 Å²	95.8	61%	0.612	45%	0.45	S	S	*	.	H	α-helix	trans	-64.7	-41	176.5	-74.1	170.4	-176.5	0	0	112	K475 A476 E482 A483	K475-E479 WeakPolarHBondContact O-CB 3.36Å; K475-E479 WeakPolarHBondContact O-CG 3.42Å; K475-E479 PolarHBondContact O-N 2.89Å; A476-E479 PolarHBondContact O-N 2.95Å; E479-E482 PolarHBondContact O-N 2.94Å; E479-A483 VanDerWaalsContact O-CB 3.3Å; E479-A483 WeakPolarHBondContact O-CB 3.15Å; E479-A483 PolarHBondContact O-N 2.98Å
480	R	80.3	Confident	81.8	Confident	138 Å²	138	95.7 Å²	95.7	52%	0.521	46%	0.458	S	S	.	.	H	α-helix	trans	-63.5	-42	173.9	-168.3	-178.9	-174.4	-177.9	5.2	111.6	A476 I477 A483 K484 D512 L515	A476-R480 WeakPolarHBondContact O-CB 3.47Å; A476-R480 PolarHBondContact O-N 2.83Å; I477-R480 PolarHBondContact O-N 2.83Å; R480-A483 PolarHBondContact O-N 3.19Å; R480-K484 PolarHBondContact O-N 3.13Å; R480-D512 IonicContact CZ-OD2 2.76Å; R480-D512 IonicContact NH1-OD2 2.84Å; R480-D512 PolarHBondContact NH1-OD2 3.31Å; R480-D512 IonicContact NH2-OD2 3.86Å; R480-D512 PolarHBondContact NH2-OD2 3.46Å; R480-L515 VanDerWaalsContact NH1-CD1 3.28Å
481	R	79.9	Confident	80.8	Confident	128 Å²	128	96.9 Å²	96.9	48%	0.483	47%	0.468	S	S	.	.	H	α-helix	trans	-64.8	-44.4	174.9	-74.3	175.7	174.5	-160.2	2	111.9	I477 Q478 A483 K484 A485 D510	I477-R481 WeakPolarHBondContact O-CB 3.25Å; I477-R481 WeakPolarHBondContact O-CG 3.41Å; I477-R481 PolarHBondContact O-N 3.23Å; Q478-R481 PolarHBondContact O-N 3.24Å; R481-A483 VanDerWaalsContact C-N 3.33Å; R481-A483 PolarHBondContact O-N 2.82Å; R481-K484 PolarHBondContact O-N 2.73Å; R481-A485 WeakPolarHBondContact O-CB 3.45Å; R481-A485 PolarHBondContact O-N 3.08Å; R481-D510 IonicContact CZ-OD1 3.13Å; R481-D510 IonicContact CZ-OD2 2.71Å; R481-D510 IonicContact NE-OD1 2.71Å; R481-D510 PolarHBondContact NE-OD1 3.01Å; R481-D510 IonicContact NH2-OD1 2.71Å; R481-D510 PolarHBondContact NH2-OD1 3.09Å; R481-D510 IonicContact NH2-OD2 2.69Å; R481-D510 PolarHBondContact NH2-OD2 3.21Å
482	E	84	Confident	79.9	Confident	74 Å²	74	98.7 Å²	98.7	35%	0.346	49%	0.49	S	S	.	.	H	α-helix	trans	-64.9	-35	174.1	-78.9	-173.6	-144	0	0	112.6	Q478 E479 A485 R486	Q478-E482 PolarHBondContact NE2-OE1 3.31Å; Q478-E482 WeakPolarHBondContact O-CB 3.24Å; Q478-E482 WeakPolarHBondContact O-CG 3.39Å; Q478-E482 PolarHBondContact O-N 2.9Å; E479-E482 PolarHBondContact O-N 2.94Å; E482-A485 PolarHBondContact O-N 3.07Å; E482-R486 WeakPolarHBondContact O-CB 3.28Å; E482-R486 VanDerWaalsContact O-CG 3.22Å; E482-R486 WeakPolarHBondContact O-CG 3.4Å; E482-R486 PolarHBondContact O-N 3.46Å; E482-R486 IonicContact OE2-CZ 3.63Å; E482-R486 IonicContact OE2-NH2 3.7Å; E482-R486 PolarHBondContact OE2-NH2 2.8Å
483	A	82.2	Confident	78.8	Confident	49 Å²	49	103.9 Å²	103.9	41%	0.405	51%	0.514	S	S	.	.	H	α-helix	trans	-67.9	-41.8	173.9	0	0	0	0	0	112	E479 R480 R481 R486 R487	E479-A483 VanDerWaalsContact O-CB 3.3Å; E479-A483 WeakPolarHBondContact O-CB 3.15Å; E479-A483 PolarHBondContact O-N 2.98Å; R480-A483 PolarHBondContact O-N 3.19Å; R481-A483 VanDerWaalsContact C-N 3.33Å; R481-A483 PolarHBondContact O-N 2.82Å; A483-R486 PolarHBondContact O-N 2.75Å; A483-R487 WeakPolarHBondContact O-CG 3.41Å; A483-R487 PolarHBondContact O-N 2.8Å
484	K	80.4	Confident	77.4	Confident	101 Å²	101	104 Å²	104	44%	0.439	53%	0.525	S	S	.	.	H	α-helix	trans	-62	-44.2	172.7	-164.5	166.7	-174.1	171.1	0	110.4	R480 R481 R487 Q488 E506	R480-K484 PolarHBondContact O-N 3.13Å; R481-K484 PolarHBondContact O-N 2.73Å; K484-R487 PolarHBondContact O-N 2.54Å; K484-Q488 WeakPolarHBondContact O-CB 3.19Å; K484-Q488 WeakPolarHBondContact O-CG 3.38Å; K484-Q488 PolarHBondContact O-N 3.31Å; K484-E506 WeakPolarHBondContact CE-OE2 3.3Å; K484-E506 IonicContact NZ-OE2 3.99Å; K484-E506 PolarHBondContact NZ-OE2 3.41Å
485	A	80.9	Confident	75.4	Confident	50 Å²	50	99.8 Å²	99.8	41%	0.413	53%	0.527	S	S	.	.	H	α-helix	trans	-64.4	-40.7	176.1	0	0	0	0	0	113.6	R481 E482 Q488 A489	R481-A485 WeakPolarHBondContact O-CB 3.45Å; R481-A485 PolarHBondContact O-N 3.08Å; E482-A485 PolarHBondContact O-N 3.07Å; A485-Q488 PolarHBondContact O-N 2.72Å; A485-A489 WeakPolarHBondContact O-CB 3.24Å; A485-A489 PolarHBondContact O-N 3.19Å
486	R	79.9	Confident	73.2	Confident	170 Å²	170	103.2 Å²	103.2	64%	0.642	55%	0.549	S	S	*	.	H	α-helix	trans	-67.3	-38.1	175.4	-73	175.2	-152.6	-161.5	9.5	112	E482 A483 A489 A490	E482-R486 WeakPolarHBondContact O-CB 3.28Å; E482-R486 VanDerWaalsContact O-CG 3.22Å; E482-R486 WeakPolarHBondContact O-CG 3.4Å; E482-R486 PolarHBondContact O-N 3.46Å; E482-R486 IonicContact OE2-CZ 3.63Å; E482-R486 IonicContact OE2-NH2 3.7Å; E482-R486 PolarHBondContact OE2-NH2 2.8Å; A483-R486 PolarHBondContact O-N 2.75Å; R486-A489 PolarHBondContact O-N 2.85Å; R486-A490 WeakPolarHBondContact O-CB 3.42Å; R486-A490 PolarHBondContact O-N 3.03Å
487	R	75.7	Confident	71.1	Confident	206 Å²	206	108.5 Å²	108.5	78%	0.777	57%	0.57	S	S	*	*	H	α-helix	trans	-62.9	-44.3	171.7	-76.6	-178.9	174.4	-173.6	-1.5	111.6	A483 K484 A490 A491	A483-R487 WeakPolarHBondContact O-CG 3.41Å; A483-R487 PolarHBondContact O-N 2.8Å; K484-R487 PolarHBondContact O-N 2.54Å; R487-A490 PolarHBondContact O-N 3.39Å; R487-A491 WeakPolarHBondContact O-CB 3.42Å; R487-A491 PolarHBondContact O-N 3.35Å
488	Q	74	Confident	69.1	Low	121 Å²	121	108.9 Å²	108.9	57%	0.565	59%	0.585	S	S	*	*	H	α-helix	trans	-64.5	-40.1	175.9	-73.8	172.2	-19	0	0	112.5	K484 A485 A491 A492	K484-Q488 WeakPolarHBondContact O-CB 3.19Å; K484-Q488 WeakPolarHBondContact O-CG 3.38Å; K484-Q488 PolarHBondContact O-N 3.31Å; A485-Q488 PolarHBondContact O-N 2.72Å; Q488-A491 PolarHBondContact O-N 3.26Å; Q488-A492 WeakPolarHBondContact O-CB 3.32Å; Q488-A492 PolarHBondContact O-N 3.15Å
489	A	76.8	Confident	67	Low	50 Å²	50	109.3 Å²	109.3	41%	0.413	61%	0.605	S	S	.	*	H	α-helix	trans	-65.6	-45.2	175.6	0	0	0	0	0	112.1	A485 R486 A491 A492 E493	A485-A489 WeakPolarHBondContact O-CB 3.24Å; A485-A489 PolarHBondContact O-N 3.19Å; R486-A489 PolarHBondContact O-N 2.85Å; A489-A491 VanDerWaalsContact C-N 3.3Å; A489-A491 PolarHBondContact O-N 3Å; A489-A492 CarbonylContact O-C 3.55Å; A489-A492 WeakPolarHBondContact O-CA 3.23Å; A489-A492 PolarHBondContact O-N 2.88Å; A489-E493 PolarHBondContact O-N 2.85Å
490	A	75.7	Confident	65	Low	50 Å²	50	112.1 Å²	112.1	41%	0.413	62%	0.618	S	S	.	*	H	α-helix	trans	-62.6	-36.2	175.7	0	0	0	0	0	112.5	R486 R487 A492 N494	R486-A490 WeakPolarHBondContact O-CB 3.42Å; R486-A490 PolarHBondContact O-N 3.03Å; R487-A490 PolarHBondContact O-N 3.39Å; A490-A492 VanDerWaalsContact C-N 3.29Å; A490-A492 PolarHBondContact O-N 3.43Å; A490-N494 WeakPolarHBondContact O-CB 3.18Å; A490-N494 PolarHBondContact O-N 3.06Å
491	A	66.9	Low	63.1	Low	74 Å²	74	109 Å²	109	61%	0.612	62%	0.622	S	S	*	*	H	α-helix	trans	-70.2	-22.5	172.2	0	0	0	0	0	113.5	R487 Q488 A489	R487-A491 WeakPolarHBondContact O-CB 3.42Å; R487-A491 PolarHBondContact O-N 3.35Å; Q488-A491 PolarHBondContact O-N 3.26Å; A489-A491 VanDerWaalsContact C-N 3.3Å; A489-A491 PolarHBondContact O-N 3Å
492	A	65.6	Low	61.3	Low	79 Å²	79	110.1 Å²	110.1	65%	0.653	64%	0.636	S	S	*	*	H	α-helix	trans	-90.2	-24.5	177.5	0	0	0	0	0	113.8	Q488 A489 A490	Q488-A492 WeakPolarHBondContact O-CB 3.32Å; Q488-A492 PolarHBondContact O-N 3.15Å; A489-A492 CarbonylContact O-C 3.55Å; A489-A492 WeakPolarHBondContact O-CA 3.23Å; A489-A492 PolarHBondContact O-N 2.88Å; A490-A492 VanDerWaalsContact C-N 3.29Å; A490-A492 PolarHBondContact O-N 3.43Å
493	E	63.1	Low	59.1	Low	171 Å²	171	112.7 Å²	112.7	80%	0.799	66%	0.656	S	S	*	*	H	α-helix	trans	-81.8	-30.3	172.6	-69.8	-170.8	137	0	0	112.3	A489 G495	A489-E493 PolarHBondContact O-N 2.85Å; E493-G495 PolarHBondContact O-N 2.78Å
494	N	53.5	Low	56.9	Low	137 Å²	137	115.6 Å²	115.6	73%	0.733	67%	0.669	S	S	*	*	S	Bend	trans	-82.1	60.6	172.4	-70.8	-19.1	0	0	0	111.9	A490 D496	A490-N494 WeakPolarHBondContact O-CB 3.18Å; A490-N494 PolarHBondContact O-N 3.06Å; N494-D496 PolarHBondContact O-N 3.04Å
495	G	43.8	Very low	55	Low	58 Å²	58	115.7 Å²	115.7	60%	0.598	68%	0.68	S	S	*	*			trans	-87.2	98.2	-176.2	0	0	0	0	0	114.6	E493	E493-G495 PolarHBondContact O-N 2.78Å
496	D	39.2	Very low	53.1	Low	154 Å²	154	119.3 Å²	119.3	82%	0.824	69%	0.688	S	S	*	*	S	Bend	trans	-154.8	156.2	146.5	-97.3	-37.5	0	0	0	110.1	N494	N494-D496 PolarHBondContact O-N 3.04Å
497	D	41.4	Very low	51.3	Low	164 Å²	164	115.4 Å²	115.4	88%	0.877	69%	0.685	S	S	*	*			trans	45.8	81.6	173.3	-69.5	-29.9	0	0	0	119.9
498	A	41	Very low	49.7	Very low	87 Å²	87	114.7 Å²	114.7	72%	0.719	69%	0.69	S	S	*	*			trans	-137	57.5	169.1	0	0	0	0	0	113.6
499	A	38.7	Very low	48.3	Very low	104 Å²	104	113.5 Å²	113.5	86%	0.86	69%	0.688	S	S	*	*	S	Bend	trans	-88.6	-13.7	-175.9	0	0	0	0	0	116
500	E	41.8	Very low	46.9	Very low	189 Å²	189	116.1 Å²	116.1	88%	0.883	70%	0.695	S	S	*	*	S	Bend	trans	-117.3	7.6	-178.6	-66.5	-159.2	131.1	0	0	114.5	I502	E500-I502 PolarHBondContact O-N 3.41Å
501	A	41.6	Very low	45.4	Very low	74 Å²	74	119.7 Å²	119.7	61%	0.612	71%	0.707	S	S	*	*			trans	-69.2	95.8	173.7	0	0	0	0	0	110.5	V503	A501-V503 PolarHBondContact O-N 3.21Å
502	I	40.5	Very low	44.6	Very low	151 Å²	151	117.8 Å²	117.8	77%	0.774	69%	0.687	S	S	*	*			trans	-62.3	105.7	166.6	-63	178	0	0	0	107.3	E500 V504	E500-I502 PolarHBondContact O-N 3.41Å; I502-V504 HydrophobicContact CG2-CG2 4.23Å; I502-V504 PolarHBondContact O-N 3.25Å
503	V	37.9	Very low	43.6	Very low	127 Å²	127	118.7 Å²	118.7	77%	0.77	69%	0.686	S	S	*	*			trans	-68.5	83.6	168.5	-176.3	0	0	0	0	107.9	A501 P505	A501-V503 PolarHBondContact O-N 3.21Å; V503-P505 WeakPolarHBondContact O-CD 3.25Å
504	V	36.9	Very low	43	Very low	111 Å²	111	118.3 Å²	118.3	67%	0.673	68%	0.684	S	S	*	*			trans	-61.5	121.7	151	-178.7	0	0	0	0	105.2	I502 E506	I502-V504 HydrophobicContact CG2-CG2 4.23Å; I502-V504 PolarHBondContact O-N 3.25Å; V504-E506 PolarHBondContact O-N 2.81Å; V504-E506 VanDerWaalsContact O-N 3.09Å
505	P	40.3	Very low	42.8	Very low	103 Å²	103	116.7 Å²	116.7	67%	0.669	68%	0.675	S	S	*	*			trans	-63.6	113.9	165.5	-12.3	27.7	0	0	0	106.5	V503	V503-P505 WeakPolarHBondContact O-CD 3.25Å
506	E	40.6	Very low	43	Very low	126 Å²	126	117.6 Å²	117.6	59%	0.589	67%	0.665	S	S	*	*			trans	-54.6	130.7	150.6	-73.3	-174.7	161.2	0	0	106	K484 V504	K484-E506 WeakPolarHBondContact CE-OE2 3.3Å; K484-E506 IonicContact NZ-OE2 3.99Å; K484-E506 PolarHBondContact NZ-OE2 3.41Å; V504-E506 PolarHBondContact O-N 2.81Å; V504-E506 VanDerWaalsContact O-N 3.09Å
507	P	42.9	Very low	43.4	Very low	87 Å²	87	117.2 Å²	117.2	57%	0.565	66%	0.663	S	S	*	*			trans	-58	166.1	168.7	23.5	-29.1	0	0	0	110.2	D509	P507-D509 PolarHBondContact O-N 3Å
508	E	41.4	Very low	43.6	Very low	191 Å²	191	118.3 Å²	118.3	89%	0.893	66%	0.656	S	S	*	*			trans	-75.5	71.5	-179.6	-62.9	-172.1	141.7	0	0	110.1	D510	E508-D510 PolarHBondContact O-N 2.93Å
509	D	45.3	Very low	43.8	Very low	96 Å²	96	121.6 Å²	121.6	51%	0.513	66%	0.656	S	S	.	*			trans	-68.9	64.6	-175.7	-67.6	-36.4	0	0	0	112.9	P507 D511	P507-D509 PolarHBondContact O-N 3Å; D509-D511 VanDerWaalsContact C-N 3.28Å
510	D	45.8	Very low	44.2	Very low	106 Å²	106	124.1 Å²	124.1	57%	0.567	66%	0.655	S	S	*	*			trans	-78.4	-16.3	152.8	-87.9	-36.4	0	0	0	111.4	R481 E508 D512	R481-D510 IonicContact CZ-OD1 3.13Å; R481-D510 IonicContact CZ-OD2 2.71Å; R481-D510 IonicContact NE-OD1 2.71Å; R481-D510 PolarHBondContact NE-OD1 3.01Å; R481-D510 IonicContact NH2-OD1 2.71Å; R481-D510 PolarHBondContact NH2-OD1 3.09Å; R481-D510 IonicContact NH2-OD2 2.69Å; R481-D510 PolarHBondContact NH2-OD2 3.21Å; E508-D510 PolarHBondContact O-N 2.93Å; D510-D512 PolarHBondContact O-N 3.08Å
511	D	45.7	Very low	44.2	Very low	124 Å²	124	124.8 Å²	124.8	66%	0.663	66%	0.655	S	S	*	*			trans	-94	46	-179.2	-71.1	-53.8	0	0	0	113.4	D509 P513	D509-D511 VanDerWaalsContact C-N 3.28Å; D511-P513 WeakPolarHBondContact O-CD 3.44Å
512	D	49.1	Very low	44.6	Very low	35 Å²	35	126.8 Å²	126.8	19%	0.187	65%	0.652	C	S	.	*			trans	-63.5	111.3	174.4	-174.8	-21	0	0	0	111	R480 D510 E514 L515	R480-D512 IonicContact CZ-OD2 2.76Å; R480-D512 IonicContact NH1-OD2 2.84Å; R480-D512 PolarHBondContact NH1-OD2 3.31Å; R480-D512 IonicContact NH2-OD2 3.86Å; R480-D512 PolarHBondContact NH2-OD2 3.46Å; D510-D512 PolarHBondContact O-N 3.08Å; D512-E514 VanDerWaalsContact C-N 3.27Å; D512-E514 PolarHBondContact O-N 3.21Å; D512-E514 PolarHBondContact OD1-N 3.22Å; D512-L515 HydrophobicContact CB-CB 4.47Å; D512-L515 HydrophobicContact CB-CD1 4.26Å; D512-L515 HydrophobicContact CB-CG 4.47Å; D512-L515 PolarHBondContact O-N 3.41Å
513	P	45.6	Very low	45.1	Very low	97 Å²	97	124.2 Å²	124.2	63%	0.63	65%	0.653	S	S	*	*	H	α-helix	trans	-63.5	-30.3	-170.9	-22.9	34.9	0	0	0	113.6	D511 L515 I516	D511-P513 WeakPolarHBondContact O-CD 3.44Å; P513-L515 PolarHBondContact O-N 3.47Å; P513-I516 PolarHBondContact O-N 3.18Å; P513-I516 VanDerWaalsContact O-N 3.08Å
514	E	50.8	Low	46	Very low	163 Å²	163	123.5 Å²	123.5	76%	0.762	65%	0.653	S	S	*	*	H	α-helix	trans	-71.1	-15.4	179.8	-61.7	-171.8	166.2	0	0	112.4	D512	D512-E514 VanDerWaalsContact C-N 3.27Å; D512-E514 PolarHBondContact O-N 3.21Å; D512-E514 PolarHBondContact OD1-N 3.22Å
515	L	49.5	Very low	47.1	Very low	103 Å²	103	122.1 Å²	122.1	54%	0.539	64%	0.642	S	S	.	*	H	α-helix	trans	-90.1	-17.2	170.3	-74.4	178.3	0	0	0	113.8	R480 D512 P513	R480-L515 VanDerWaalsContact NH1-CD1 3.28Å; D512-L515 HydrophobicContact CB-CB 4.47Å; D512-L515 HydrophobicContact CB-CD1 4.26Å; D512-L515 HydrophobicContact CB-CG 4.47Å; D512-L515 PolarHBondContact O-N 3.41Å; P513-L515 PolarHBondContact O-N 3.47Å
516	I	47.6	Very low	48.3	Very low	78 Å²	78	121.6 Å²	121.6	40%	0.4	64%	0.641	S	S	.	*	H	α-helix	trans	-83.3	-32.3	-175.3	-64.6	174.5	0	0	0	111.5	P513 Y518 Q519	P513-I516 PolarHBondContact O-N 3.18Å; P513-I516 VanDerWaalsContact O-N 3.08Å; I516-Y518 PolarHBondContact O-N 3.19Å; I516-Q519 WeakPolarHBondContact O-CG 3.35Å; I516-Q519 PolarHBondContact O-N 2.95Å
517	D	47	Very low	50.2	Low	146 Å²	146	117.7 Å²	117.7	78%	0.781	63%	0.627	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.9	-12.7	-172.2	-152.5	31.1	0	0	0	114.4	Q519	D517-Q519 PolarHBondContact O-N 3.36Å
518	Y	46.6	Very low	52.3	Low	187 Å²	187	116.3 Å²	116.3	73%	0.733	62%	0.618	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.7	16.7	170.4	-73.8	-83	0	0	0	114.2	I516 L520	I516-Y518 PolarHBondContact O-N 3.19Å; Y518-L520 PolarHBondContact O-N 3.05Å; Y518-L520 VanDerWaalsContact O-N 3.13Å
519	Q	45.2	Very low	54.5	Low	155 Å²	155	108 Å²	108	72%	0.724	58%	0.579	S	S	*	*			trans	-80.3	35.4	171.1	-76.7	-169.8	71	0	0	113.9	I516 D517 K521	I516-Q519 WeakPolarHBondContact O-CG 3.35Å; I516-Q519 PolarHBondContact O-N 2.95Å; D517-Q519 PolarHBondContact O-N 3.36Å; Q519-K521 PolarHBondContact O-N 2.85Å
520	L	45.4	Very low	56.4	Low	157 Å²	157	103.5 Å²	103.5	82%	0.822	56%	0.556	S	S	*	*			trans	-53.9	111.5	162.7	-112.1	164.6	0	0	0	109	Y518 Q522	Y518-L520 PolarHBondContact O-N 3.05Å; Y518-L520 VanDerWaalsContact O-N 3.13Å; L520-Q522 VanDerWaalsContact C-N 3.25Å; L520-Q522 PolarHBondContact O-N 3.04Å
521	K	42.4	Very low	58.4	Low	204 Å²	204	100.7 Å²	100.7	89%	0.887	54%	0.542	S	S	*	.			trans	-79.9	66.4	-157.2	-163	178.5	-169.6	173	0	111.7	Q519 A523	Q519-K521 PolarHBondContact O-N 2.85Å; K521-A523 PolarHBondContact O-N 3.33Å; K521-A523 VanDerWaalsContact O-N 3.12Å
522	Q	50	Low	60.5	Low	116 Å²	116	96.2 Å²	96.2	54%	0.542	52%	0.517	S	S	.	.			trans	-37.7	115	-170.8	-72.1	179	17.7	0	0	112.5	L520 S524	L520-Q522 VanDerWaalsContact C-N 3.25Å; L520-Q522 PolarHBondContact O-N 3.04Å; Q522-S524 PolarHBondContact O-N 3.39Å; Q522-S524 VanDerWaalsContact O-N 3.12Å
523	A	51.7	Low	62.3	Low	97 Å²	97	95.4 Å²	95.4	80%	0.802	51%	0.511	S	S	*	.			trans	-51.4	119.5	-176.6	0	0	0	0	0	110.4	K521 N525	K521-A523 PolarHBondContact O-N 3.33Å; K521-A523 VanDerWaalsContact O-N 3.12Å; A523-N525 PolarHBondContact O-N 3.12Å
524	S	55.4	Low	64.2	Low	111 Å²	111	98.3 Å²	98.3	78%	0.776	51%	0.514	S	S	*	.			trans	-65.3	106.7	-173.5	67.3	0	0	0	0	109.3	Q522 S526	Q522-S524 PolarHBondContact O-N 3.39Å; Q522-S524 VanDerWaalsContact O-N 3.12Å; S524-S526 PolarHBondContact O-N 3.04Å
525	N	60.4	Low	65.9	Low	82 Å²	82	91.9 Å²	91.9	44%	0.439	49%	0.488	S	S	.	.			trans	-58.4	97.9	-171.3	-173.5	-23.5	0	0	0	111.1	A523 S527 A530	A523-N525 PolarHBondContact O-N 3.12Å; N525-S527 VanDerWaalsContact OD1-CB 3.31Å; N525-S527 WeakPolarHBondContact OD1-CB 3.42Å; N525-S527 PolarHBondContact OD1-N 3.21Å; N525-S527 PolarHBondContact OD1-OG 3.2Å; N525-A530 WeakPolarHBondContact O-CB 3.3Å
526	S	67	Low	67.6	Low	92 Å²	92	88.9 Å²	88.9	64%	0.643	48%	0.483	S	S	*	.			trans	-103.8	19.2	-176	-171.2	0	0	0	0	111.7	S524	S524-S526 PolarHBondContact O-N 3.04Å
527	S	79.5	Confident	69.7	Low	44 Å²	44	85.2 Å²	85.2	31%	0.308	46%	0.464	S	S	.	.			trans	-55.1	147.5	174.2	60.7	0	0	0	0	110.9	N525 Y529 A530 V531	N525-S527 VanDerWaalsContact OD1-CB 3.31Å; N525-S527 WeakPolarHBondContact OD1-CB 3.42Å; N525-S527 PolarHBondContact OD1-N 3.21Å; N525-S527 PolarHBondContact OD1-OG 3.2Å; S527-Y529 PolarHBondContact O-N 2.67Å; S527-Y529 VanDerWaalsContact O-N 3.13Å; S527-A530 WeakPolarHBondContact O-CB 3.36Å; S527-A530 PolarHBondContact O-N 3.02Å; S527-A530 WeakPolarHBondContact OG-CB 3.22Å; S527-A530 PolarHBondContact OG-N 3.26Å; S527-V531 PolarHBondContact O-N 2.68Å
528	P	86.6	Confident	71.6	Confident	58 Å²	58	78.9 Å²	78.9	38%	0.377	43%	0.431	S	S	.	.	H	α-helix	trans	-55.8	-35	179.4	-25.5	34	0	0	0	112.4	A530 V531 F532 Y595	P528-A530 PolarHBondContact O-N 3.25Å; P528-V531 WeakPolarHBondContact O-CB 3.27Å; P528-V531 PolarHBondContact O-N 3.47Å; P528-F532 HydrophobicContact CB-CE2 4Å; P528-F532 HydrophobicContact CB-CZ 4.06Å; P528-F532 WeakPolarHBondContact O-CB 3.31Å; P528-F532 WeakPolarHBondContact O-CD1 3.35Å; P528-F532 WeakPolarHBondContact O-CD2 3.33Å; P528-F532 WeakPolarHBondContact O-CG 3.46Å; P528-F532 PolarHBondContact O-N 2.83Å; P528-Y595 HydrophobicContact CB-CD1 4.43Å; P528-Y595 HydrophobicContact CB-CE1 3.83Å; P528-Y595 HydrophobicContact CB-CE2 4.29Å
529	Y	88.6	Confident	73.5	Confident	16 Å²	16	70.6 Å²	70.6	6%	0.063	40%	0.402	C	S	.	.	H	α-helix	trans	-57.7	-47.6	172	-172.1	-93.3	0	0	0	112.9	L459 S527 V531 F532 R533 V596 R599 Q600	L459-Y529 HydrophobicContact CD1-CD1 3.44Å; L459-Y529 VanDerWaalsContact CD1-CD1 3.44Å; L459-Y529 HydrophobicContact CD1-CD2 3.97Å; L459-Y529 HydrophobicContact CD1-CE1 3.28Å; L459-Y529 HydrophobicContact CD1-CE2 3.83Å; L459-Y529 HydrophobicContact CD1-CG 3.78Å; L459-Y529 VanDerWaalsContact CD1-CZ 3.48Å; L459-Y529 HydrophobicContact CG-CE1 4.06Å; S527-Y529 PolarHBondContact O-N 2.67Å; S527-Y529 VanDerWaalsContact O-N 3.13Å; Y529-V531 VanDerWaalsContact C-N 3.29Å; Y529-V531 PolarHBondContact O-N 2.66Å; Y529-F532 PolarHBondContact O-N 3.42Å; Y529-R533 WeakPolarHBondContact O-CB 3.27Å; Y529-R533 PolarHBondContact O-N 2.87Å; Y529-V596 HydrophobicContact CD2-CG2 4.24Å; Y529-V596 HydrophobicContact CE2-CB 4.34Å; Y529-V596 HydrophobicContact CE2-CG1 3.91Å; Y529-V596 HydrophobicContact CE2-CG2 4.34Å; Y529-R599 HydrophobicContact CD2-CB 4.09Å; Y529-R599 HydrophobicContact CD2-CG 4.11Å; Y529-Q600 HydrophobicContact CE2-CG 3.95Å; Y529-Q600 PolarHBondContact OH-NE2 2.95Å
530	A	85.8	Confident	75.7	Confident	3 Å²	3	63.2 Å²	63.2	3%	0.025	37%	0.368	C	S	.	.	H	α-helix	trans	-66.1	-31.6	177.5	0	0	0	0	0	112.5	N525 S527 P528 K534	N525-A530 WeakPolarHBondContact O-CB 3.3Å; S527-A530 WeakPolarHBondContact O-CB 3.36Å; S527-A530 PolarHBondContact O-N 3.02Å; S527-A530 WeakPolarHBondContact OG-CB 3.22Å; S527-A530 PolarHBondContact OG-N 3.26Å; P528-A530 PolarHBondContact O-N 3.25Å; A530-K534 WeakPolarHBondContact O-CB 3.48Å; A530-K534 VanDerWaalsContact O-CG 3.24Å; A530-K534 WeakPolarHBondContact O-CG 3.45Å; A530-K534 PolarHBondContact O-N 2.72Å
531	V	86.7	Confident	77.8	Confident	46 Å²	46	56.2 Å²	56.2	28%	0.279	33%	0.333	S	S	.	.	H	α-helix	trans	-69.1	-42.4	173.1	177.3	0	0	0	0	111.5	S527 P528 Y529 A535	S527-V531 PolarHBondContact O-N 2.68Å; P528-V531 WeakPolarHBondContact O-CB 3.27Å; P528-V531 PolarHBondContact O-N 3.47Å; Y529-V531 VanDerWaalsContact C-N 3.29Å; Y529-V531 PolarHBondContact O-N 2.66Å; V531-A535 PolarHBondContact O-N 3.17Å
532	F	89.8	Confident	79.9	Confident	31 Å²	31	52.1 Å²	52.1	14%	0.136	32%	0.315	C	S	.	.	H	α-helix	trans	-74.9	-38.2	-178.3	-59.3	-16.4	0	0	0	112.4	P528 Y529 A535 G536 I537 F583 A592 Y595 V596	P528-F532 HydrophobicContact CB-CE2 4Å; P528-F532 HydrophobicContact CB-CZ 4.06Å; P528-F532 WeakPolarHBondContact O-CB 3.31Å; P528-F532 WeakPolarHBondContact O-CD1 3.35Å; P528-F532 WeakPolarHBondContact O-CD2 3.33Å; P528-F532 WeakPolarHBondContact O-CG 3.46Å; P528-F532 PolarHBondContact O-N 2.83Å; Y529-F532 PolarHBondContact O-N 3.42Å; F532-A535 CarbonylContact O-C 3.56Å; F532-A535 PolarHBondContact O-N 3.05Å; F532-G536 PolarHBondContact O-N 3.33Å; F532-I537 HydrophobicContact CB-CB 4.28Å; F532-I537 HydrophobicContact CB-CG1 4.44Å; F532-I537 PolarHBondContact O-N 2.75Å; F532-F583 HydrophobicContact CD1-CE1 4.24Å; F532-F583 AromaticContact CD1-CZ 3.7Å; F532-F583 HydrophobicContact CD1-CZ 3.7Å; F532-F583 HydrophobicContact CE1-CE1 4.12Å; F532-F583 HydrophobicContact CE1-CZ 4.05Å; F532-A592 HydrophobicContact CD1-CB 4.13Å; F532-A592 HydrophobicContact CD2-CB 3.94Å; F532-A592 HydrophobicContact CE1-CB 4.23Å; F532-A592 HydrophobicContact CE2-CB 4.06Å; F532-A592 HydrophobicContact CG-CB 3.98Å; F532-A592 HydrophobicContact CZ-CB 4.2Å; F532-Y595 AromaticContact CD2-CD1 3.83Å; F532-Y595 HydrophobicContact CD2-CD1 3.83Å; F532-Y595 HydrophobicContact CD2-CG 4.22Å; F532-Y595 AromaticContact CE2-CD1 3.75Å; F532-Y595 HydrophobicContact CE2-CD1 3.75Å; F532-Y595 HydrophobicContact CE2-CD2 4.48Å; F532-Y595 HydrophobicContact CE2-CE1 4.5Å; F532-Y595 AromaticContact CE2-CG 3.76Å; F532-Y595 HydrophobicContact CE2-CG 3.76Å; F532-V596 HydrophobicContact CB-CG2 3.74Å; F532-V596 HydrophobicContact CD2-CG2 4.16Å; F532-V596 HydrophobicContact CG-CG2 4.48Å
533	R	86.8	Confident	81.9	Confident	18 Å²	18	49.3 Å²	49.3	7%	0.068	30%	0.302	C	S	.	.	H	α-helix	trans	-59	-48.6	169.5	-174.2	-173.8	64	-124.1	-20.9	110.9	D429 H463 Y529 A535 G536	D429-R533 HydrophobicContact CB-CG 4.09Å; H463-R533 VanDerWaalsContact CB-NH2 3.29Å; Y529-R533 WeakPolarHBondContact O-CB 3.27Å; Y529-R533 PolarHBondContact O-N 2.87Å; R533-A535 PolarHBondContact O-N 3.1Å; R533-G536 PolarHBondContact O-N 2.66Å
534	K	85.2	Confident	83.9	Confident	158 Å²	158	44.7 Å²	44.7	69%	0.687	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-9.6	174.4	-77.2	176.2	176.9	175.9	0	114.3	A530	A530-K534 WeakPolarHBondContact O-CB 3.48Å; A530-K534 VanDerWaalsContact O-CG 3.24Å; A530-K534 WeakPolarHBondContact O-CG 3.45Å; A530-K534 PolarHBondContact O-N 2.72Å
535	A	86.5	Confident	85.6	Confident	27 Å²	27	39.9 Å²	39.9	22%	0.223	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	-109.9	12.3	175.7	0	0	0	0	0	113.3	V531 F532 R533 I537 F583	V531-A535 PolarHBondContact O-N 3.17Å; F532-A535 CarbonylContact O-C 3.56Å; F532-A535 PolarHBondContact O-N 3.05Å; R533-A535 PolarHBondContact O-N 3.1Å; A535-I537 VanDerWaalsContact C-N 3.31Å; A535-I537 PolarHBondContact O-N 3.28Å; A535-F583 HydrophobicContact CB-CE2 3.62Å; A535-F583 HydrophobicContact CB-CZ 4.29Å
536	G	86.6	Confident	87.1	Confident	41 Å²	41	36.7 Å²	36.7	42%	0.423	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	79.2	2.6	174.2	0	0	0	0	0	115.9	F532 R533 C538 G539	F532-G536 PolarHBondContact O-N 3.33Å; R533-G536 PolarHBondContact O-N 2.66Å; G536-C538 PolarHBondContact O-N 3.42Å; G536-C538 VanDerWaalsContact O-N 3.16Å; G536-G539 PolarHBondContact O-N 3.06Å
537	I	90.9	Very high	88.3	Confident	0 Å²	0	35.3 Å²	35.3	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-64.7	-22.3	-174.6	-61.1	-61.1	0	0	0	112.9	F532 A535 G539 F540 A541 F583 V589 A592 A593 V596	F532-I537 HydrophobicContact CB-CB 4.28Å; F532-I537 HydrophobicContact CB-CG1 4.44Å; F532-I537 PolarHBondContact O-N 2.75Å; A535-I537 VanDerWaalsContact C-N 3.31Å; A535-I537 PolarHBondContact O-N 3.28Å; I537-G539 PolarHBondContact O-N 3.09Å; I537-F540 PolarHBondContact O-N 2.77Å; I537-F540 VanDerWaalsContact O-N 3.12Å; I537-A541 PolarHBondContact O-N 3.44Å; I537-A541 VanDerWaalsContact O-N 3.14Å; I537-F583 HydrophobicContact CD1-CD2 3.81Å; I537-F583 HydrophobicContact CD1-CE2 3.58Å; I537-F583 HydrophobicContact CD1-CZ 4.43Å; I537-F583 HydrophobicContact CG1-CD2 4.21Å; I537-F583 HydrophobicContact CG1-CE2 3.45Å; I537-F583 VanDerWaalsContact CG1-CE2 3.45Å; I537-F583 HydrophobicContact CG1-CZ 4.03Å; I537-V589 HydrophobicContact CD1-CG1 4.27Å; I537-A592 HydrophobicContact CD1-CB 4.5Å; I537-A592 HydrophobicContact CG1-CB 4.17Å; I537-A592 HydrophobicContact CG2-CB 4.09Å; I537-A593 HydrophobicContact CG2-CB 4.05Å; I537-V596 HydrophobicContact CG2-CG2 3.99Å
538	C	87.2	Confident	89	Confident	13 Å²	13	34.7 Å²	34.7	9%	0.088	20%	0.197	C	C	.	.	H	α-helix	trans	-60.6	-21.7	172	-64.7	0	0	0	0	113.5	G536	G536-C538 PolarHBondContact O-N 3.42Å; G536-C538 VanDerWaalsContact O-N 3.16Å
539	G	86.6	Confident	89.2	Confident	13 Å²	13	35.2 Å²	35.2	13%	0.134	19%	0.194	C	C	.	.	H	α-helix	trans	-65.5	-52.1	169.9	0	0	0	0	0	111.8	G536 I537 A541 K542 H543	G536-G539 PolarHBondContact O-N 3.06Å; I537-G539 PolarHBondContact O-N 3.09Å; G539-A541 PolarHBondContact O-N 2.86Å; G539-K542 WeakPolarHBondContact O-CB 3.45Å; G539-K542 PolarHBondContact O-N 3.11Å; G539-K542 VanDerWaalsContact O-N 3.14Å; G539-H543 PolarHBondContact O-CD2 3.47Å
540	F	90.3	Very high	89.5	Confident	0 Å²	0	37.5 Å²	37.5	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-58	-38.5	177.4	-175.1	-75.9	0	0	0	111.7	I537 K542 H543 F544 P571 L574 A575 Y578 V589 I590 A593 W711	I537-F540 PolarHBondContact O-N 2.77Å; I537-F540 VanDerWaalsContact O-N 3.12Å; F540-K542 PolarHBondContact O-N 3.29Å; F540-K542 VanDerWaalsContact O-N 3.15Å; F540-H543 PolarHBondContact O-N 2.81Å; F540-F544 AromaticContact CD1-CE2 3.91Å; F540-F544 HydrophobicContact CD1-CE2 3.91Å; F540-F544 AromaticContact CE1-CE2 3.7Å; F540-F544 HydrophobicContact CE1-CE2 3.7Å; F540-F544 HydrophobicContact CE1-CZ 4.37Å; F540-P571 HydrophobicContact CZ-CB 4.38Å; F540-L574 HydrophobicContact CD2-CB 4.44Å; F540-L574 HydrophobicContact CD2-CD2 3.79Å; F540-L574 HydrophobicContact CD2-CG 3.78Å; F540-L574 HydrophobicContact CE2-CB 3.87Å; F540-L574 HydrophobicContact CE2-CD2 3.69Å; F540-L574 HydrophobicContact CE2-CG 3.69Å; F540-L574 HydrophobicContact CG-CD2 4.42Å; F540-L574 HydrophobicContact CZ-CD2 4.26Å; F540-A575 HydrophobicContact CE2-CB 3.98Å; F540-Y578 HydrophobicContact CB-CD1 4.27Å; F540-Y578 HydrophobicContact CB-CD2 4Å; F540-Y578 HydrophobicContact CB-CE1 4.15Å; F540-Y578 HydrophobicContact CB-CE2 3.86Å; F540-Y578 HydrophobicContact CB-CG 4.21Å; F540-Y578 AromaticContact CD2-CD2 3.71Å; F540-Y578 HydrophobicContact CD2-CD2 3.71Å; F540-Y578 AromaticContact CD2-CE2 3.9Å; F540-Y578 HydrophobicContact CD2-CE2 3.9Å; F540-Y578 HydrophobicContact CD2-CG 4.47Å; F540-Y578 HydrophobicContact CG-CD2 4.35Å; F540-Y578 HydrophobicContact CG-CE2 4.37Å; F540-Y578 PolarHBondContact N-OH 2.79Å; F540-V589 HydrophobicContact CD2-CG1 4.44Å; F540-I590 HydrophobicContact CZ-CG1 4.45Å; F540-A593 HydrophobicContact CD1-CB 3.28Å; F540-A593 HydrophobicContact CE1-CB 3.6Å; F540-A593 HydrophobicContact CG-CB 4.13Å; F540-W711 AromaticContact CE1-CH2 3.83Å; F540-W711 HydrophobicContact CE1-CH2 3.83Å; F540-W711 HydrophobicContact CE1-CZ3 4.13Å; F540-W711 AromaticContact CZ-CH2 3.83Å; F540-W711 HydrophobicContact CZ-CH2 3.83Å; F540-W711 HydrophobicContact CZ-CZ3 4.43Å
541	A	89.6	Confident	90	Very high	11 Å²	11	37.4 Å²	37.4	9%	0.091	20%	0.204	C	C	.	.	H	α-helix	trans	-55.7	-30.8	179.1	0	0	0	0	0	113.6	I537 G539 H543 F544 V596 V597	I537-A541 PolarHBondContact O-N 3.44Å; I537-A541 VanDerWaalsContact O-N 3.14Å; G539-A541 PolarHBondContact O-N 2.86Å; A541-H543 PolarHBondContact O-N 3.44Å; A541-F544 WeakPolarHBondContact O-CD2 3.36Å; A541-F544 PolarHBondContact O-N 3.36Å; A541-V596 HydrophobicContact CB-CG1 3.76Å; A541-V597 HydrophobicContact CB-CG2 3.73Å
542	K	87.8	Confident	90.4	Very high	118 Å²	118	35.2 Å²	35.2	51%	0.513	19%	0.191	S	C	.	.	G	3₁₀ helix	trans	-63.7	-27.1	178.4	-60.1	-174.2	-175.8	-173.6	0	113.2	D428 G539 F540 F544	D428-K542 VanDerWaalsContact O-CE 3.26Å; D428-K542 WeakPolarHBondContact O-CE 3.46Å; D428-K542 PolarHBondContact O-NZ 2.85Å; D428-K542 IonicContact OD1-NZ 3.39Å; D428-K542 PolarHBondContact OD1-NZ 2.66Å; G539-K542 WeakPolarHBondContact O-CB 3.45Å; G539-K542 PolarHBondContact O-N 3.11Å; G539-K542 VanDerWaalsContact O-N 3.14Å; F540-K542 PolarHBondContact O-N 3.29Å; F540-K542 VanDerWaalsContact O-N 3.15Å; K542-F544 PolarHBondContact O-N 2.88Å
543	H	92	Very high	90.6	Very high	56 Å²	56	35.3 Å²	35.3	26%	0.259	19%	0.192	S	C	.	.	G	3₁₀ helix	trans	-77.8	-2.7	-178.2	-62.7	-97.3	0	0	0	114.1	G539 F540 A541 G545 E567 L574 W711	G539-H543 PolarHBondContact O-CD2 3.47Å; F540-H543 PolarHBondContact O-N 2.81Å; A541-H543 PolarHBondContact O-N 3.44Å; H543-G545 VanDerWaalsContact C-N 3.27Å; H543-G545 PolarHBondContact O-N 3.5Å; H543-E567 HydrophobicContact CB-CB 4.4Å; H543-E567 HydrophobicContact CB-CG 4.44Å; H543-E567 IonicContact CE1-OE2 3.16Å; H543-E567 IonicContact CG-OE2 2.69Å; H543-E567 IonicContact ND1-OE2 2.7Å; H543-E567 PolarHBondContact ND1-OE2 3.43Å; H543-L574 HydrophobicContact CB-CD2 3.61Å; H543-W711 HydrophobicContact CB-CH2 3.88Å; H543-W711 HydrophobicContact CB-CZ2 4.16Å
544	F	93.3	Very high	90.9	Very high	1 Å²	1	34.4 Å²	34.4	0%	0.004	19%	0.189	C	C	.	.	G	3₁₀ helix	trans	-67.4	-26.2	173.5	-81.8	-108.5	0	0	0	112.8	F540 A541 K542 A593 V597 Y699 W711 L714 R715 C718	F540-F544 AromaticContact CD1-CE2 3.91Å; F540-F544 HydrophobicContact CD1-CE2 3.91Å; F540-F544 AromaticContact CE1-CE2 3.7Å; F540-F544 HydrophobicContact CE1-CE2 3.7Å; F540-F544 HydrophobicContact CE1-CZ 4.37Å; A541-F544 WeakPolarHBondContact O-CD2 3.36Å; A541-F544 PolarHBondContact O-N 3.36Å; K542-F544 PolarHBondContact O-N 2.88Å; F544-A593 HydrophobicContact CE2-CB 4.25Å; F544-V597 HydrophobicContact CD1-CG1 4.27Å; F544-V597 HydrophobicContact CD1-CG2 4.29Å; F544-V597 HydrophobicContact CD2-CG2 3.65Å; F544-V597 HydrophobicContact CE1-CG2 4.39Å; F544-V597 HydrophobicContact CE2-CG2 3.75Å; F544-V597 HydrophobicContact CG-CG1 4.45Å; F544-V597 HydrophobicContact CG-CG2 3.92Å; F544-V597 HydrophobicContact CZ-CG2 4.13Å; F544-Y699 WeakPolarHBondContact CB-OH 3.22Å; F544-W711 HydrophobicContact CD1-CE3 4.49Å; F544-W711 HydrophobicContact CD1-CZ3 4.31Å; F544-W711 HydrophobicContact CD2-CH2 4.5Å; F544-W711 AromaticContact CD2-CZ3 3.73Å; F544-W711 HydrophobicContact CD2-CZ3 3.73Å; F544-W711 HydrophobicContact CE1-CZ3 4.42Å; F544-W711 AromaticContact CE2-CZ3 3.87Å; F544-W711 HydrophobicContact CE2-CZ3 3.87Å; F544-W711 HydrophobicContact CG-CE3 4.46Å; F544-W711 AromaticContact CG-CZ3 3.98Å; F544-W711 HydrophobicContact CG-CZ3 3.98Å; F544-W711 HydrophobicContact CZ-CZ3 4.22Å; F544-L714 HydrophobicContact CE1-CB 3.97Å; F544-L714 HydrophobicContact CZ-CB 4.45Å; F544-R715 HydrophobicContact CD1-CG 4.06Å; F544-R715 VanDerWaalsContact O-CZ 3.27Å; F544-R715 PolarHBondContact O-NE 2.69Å; F544-R715 PolarHBondContact O-NH2 3.21Å; F544-C718 VanDerWaalsContact CE1-SG 3.52Å
545	G	90.2	Very high	91.3	Very high	10 Å²	10	27 Å²	27	10%	0.103	16%	0.156	C	C	.	.	S	Bend	trans	100.9	-6.2	161.4	0	0	0	0	0	117.9	H543 T565	H543-G545 VanDerWaalsContact C-N 3.27Å; H543-G545 PolarHBondContact O-N 3.5Å; G545-T565 WeakPolarHBondContact CA-O 3.27Å; G545-T565 WeakPolarHBondContact O-CB 3.48Å; G545-T565 PolarHBondContact O-N 2.87Å
546	L	92.9	Very high	91.5	Very high	15 Å²	15	30.9 Å²	30.9	8%	0.079	17%	0.165	C	C	.	.	S	Bend	trans	-128.3	148.9	162.4	-68	177.2	0	0	0	109.2	Q550 N562 E563 I564 Y699	L546-Q550 HydrophobicContact CB-CB 4.29Å; L546-Q550 HydrophobicContact CD2-CB 4.14Å; L546-N562 HydrophobicContact CD2-CB 3.89Å; L546-E563 WeakPolarHBondContact CD2-O 3.4Å; L546-I564 HydrophobicContact CD1-CG1 3.72Å; L546-I564 HydrophobicContact CD2-CG1 4.24Å; L546-I564 HydrophobicContact CG-CB 4.45Å; L546-I564 HydrophobicContact CG-CG1 3.75Å; L546-Y699 HydrophobicContact CB-CE2 3.79Å; L546-Y699 HydrophobicContact CD1-CD2 3.85Å; L546-Y699 HydrophobicContact CD1-CE2 3.96Å; L546-Y699 HydrophobicContact CD1-CG 4.49Å; L546-Y699 HydrophobicContact CG-CD2 4.33Å; L546-Y699 HydrophobicContact CG-CE2 3.96Å; L546-Y699 PolarHBondContact O-OH 3.33Å; L546-Y699 VanDerWaalsContact O-OH 3.13Å
547	T	92.1	Very high	91.7	Very high	62 Å²	62	31.3 Å²	31.3	38%	0.38	16%	0.158	S	C	.	.			trans	-72.6	158.2	164.2	71.7	0	0	0	0	110.5	E549 Q550 Y551	T547-E549 PolarHBondContact O-N 3.48Å; T547-Q550 PolarHBondContact O-N 2.92Å; T547-Q550 VanDerWaalsContact O-N 3.17Å; T547-Q550 WeakPolarHBondContact OG1-CB 3.38Å; T547-Q550 VanDerWaalsContact OG1-CG 3.29Å; T547-Q550 WeakPolarHBondContact OG1-CG 3.48Å; T547-Q550 PolarHBondContact OG1-N 3.29Å; T547-Y551 PolarHBondContact O-N 3.49Å; T547-Y551 VanDerWaalsContact O-N 3.08Å
548	P	93.3	Very high	91.5	Very high	31 Å²	31	33.9 Å²	33.9	20%	0.201	17%	0.172	C	C	.	.	H	α-helix	trans	-55.4	-41.2	174.1	-25.2	34.2	0	0	0	112.4	Y551 A552 Q600 L601 E604	P548-Y551 PolarHBondContact O-N 3.2Å; P548-A552 WeakPolarHBondContact O-CB 3.17Å; P548-A552 PolarHBondContact O-N 3.02Å; P548-Q600 HydrophobicContact CG-CB 3.78Å; P548-L601 HydrophobicContact CB-CD2 4.28Å; P548-E604 HydrophobicContact CB-CB 4.1Å; P548-E604 HydrophobicContact CB-CG 4.17Å
549	E	92.1	Very high	91.6	Very high	70 Å²	70	39 Å²	39	33%	0.327	19%	0.19	S	C	.	.	H	α-helix	trans	-58.5	-49.8	173	172.5	170	-123.1	0	0	112.7	R440 T547 Y551 A552 E553	R440-E549 IonicContact CZ-OE1 3.76Å; R440-E549 IonicContact NE-OE1 3.03Å; R440-E549 PolarHBondContact NE-OE1 3.21Å; R440-E549 VanDerWaalsContact NH2-CD 3.25Å; R440-E549 IonicContact NH2-OE1 2.68Å; R440-E549 PolarHBondContact NH2-OE1 3.14Å; T547-E549 PolarHBondContact O-N 3.48Å; E549-Y551 VanDerWaalsContact C-N 3.28Å; E549-Y551 PolarHBondContact O-N 3.46Å; E549-A552 WeakPolarHBondContact O-CB 3.3Å; E549-A552 PolarHBondContact O-N 2.96Å; E549-A552 VanDerWaalsContact O-N 3.1Å; E549-E553 WeakPolarHBondContact O-CG 3.22Å; E549-E553 PolarHBondContact O-N 3.35Å
550	Q	94.6	Very high	91.7	Very high	63 Å²	63	42.1 Å²	42.1	29%	0.294	20%	0.201	S	C	.	.	H	α-helix	trans	-61.8	-35.8	179.1	-77	172.8	-30.6	0	0	112.8	L546 T547 N554 N562	L546-Q550 HydrophobicContact CB-CB 4.29Å; L546-Q550 HydrophobicContact CD2-CB 4.14Å; T547-Q550 PolarHBondContact O-N 2.92Å; T547-Q550 VanDerWaalsContact O-N 3.17Å; T547-Q550 WeakPolarHBondContact OG1-CB 3.38Å; T547-Q550 VanDerWaalsContact OG1-CG 3.29Å; T547-Q550 WeakPolarHBondContact OG1-CG 3.48Å; T547-Q550 PolarHBondContact OG1-N 3.29Å; Q550-N554 PolarHBondContact O-N 3.37Å; Q550-N554 PolarHBondContact O-OD1 3.45Å; Q550-N562 WeakPolarHBondContact CA-ND2 3.12Å; Q550-N562 HydrophobicContact CB-CB 3.87Å; Q550-N562 HydrophobicContact CG-CB 4.15Å; Q550-N562 PolarHBondContact O-ND2 2.95Å
551	Y	95.5	Very high	91.6	Very high	1 Å²	1	48.1 Å²	48.1	0%	0.004	22%	0.224	C	C	.	.	H	α-helix	trans	-71.9	-39.7	172.6	172.4	-95.2	0	0	0	112	T547 P548 E549 E553 N554 L555 L601 L607 S695 L698 Y699 V719	T547-Y551 PolarHBondContact O-N 3.49Å; T547-Y551 VanDerWaalsContact O-N 3.08Å; P548-Y551 PolarHBondContact O-N 3.2Å; E549-Y551 VanDerWaalsContact C-N 3.28Å; E549-Y551 PolarHBondContact O-N 3.46Å; Y551-E553 VanDerWaalsContact C-N 3.3Å; Y551-E553 PolarHBondContact O-N 2.98Å; Y551-N554 WeakPolarHBondContact O-CB 3.47Å; Y551-N554 PolarHBondContact O-N 3.22Å; Y551-N554 VanDerWaalsContact O-N 3.12Å; Y551-L555 HydrophobicContact CE1-CD2 4.49Å; Y551-L555 PolarHBondContact O-N 3.06Å; Y551-L601 HydrophobicContact CD1-CD2 3.52Å; Y551-L601 HydrophobicContact CE1-CD2 4.23Å; Y551-L601 HydrophobicContact CG-CD2 4.06Å; Y551-L607 HydrophobicContact CD1-CD1 3.87Å; Y551-L607 HydrophobicContact CE1-CD1 3.64Å; Y551-S695 PolarHBondContact OH-O 2.81Å; Y551-L698 HydrophobicContact CE2-CB 4.03Å; Y551-Y699 AromaticContact CD2-CD1 3.75Å; Y551-Y699 HydrophobicContact CD2-CD1 3.75Å; Y551-Y699 AromaticContact CD2-CG 3.87Å; Y551-Y699 HydrophobicContact CD2-CG 3.87Å; Y551-Y699 HydrophobicContact CE2-CD1 4.22Å; Y551-Y699 HydrophobicContact CE2-CG 4.31Å; Y551-Y699 HydrophobicContact CG-CD1 4.1Å; Y551-V719 HydrophobicContact CE1-CG2 4.31Å; Y551-V719 HydrophobicContact CE2-CG2 3.92Å; Y551-V719 VanDerWaalsContact OH-CG1 3.28Å; Y551-V719 WeakPolarHBondContact OH-CG1 3.49Å
552	A	94.5	Very high	91.7	Very high	0 Å²	0	49 Å²	49	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-63.1	-35.4	175.7	0	0	0	0	0	112.4	P548 E549 L555 R556 E604 L606 L607	P548-A552 WeakPolarHBondContact O-CB 3.17Å; P548-A552 PolarHBondContact O-N 3.02Å; E549-A552 WeakPolarHBondContact O-CB 3.3Å; E549-A552 PolarHBondContact O-N 2.96Å; E549-A552 VanDerWaalsContact O-N 3.1Å; A552-L555 PolarHBondContact O-N 3.34Å; A552-R556 WeakPolarHBondContact O-CB 3.29Å; A552-R556 PolarHBondContact O-N 3.03Å; A552-E604 HydrophobicContact CB-CG 3.78Å; A552-L606 HydrophobicContact CB-CB 3.88Å; A552-L606 HydrophobicContact CB-CD2 4.06Å; A552-L606 HydrophobicContact CB-CG 4Å; A552-L607 HydrophobicContact CB-CB 3.89Å
553	E	94.4	Very high	91.8	Very high	33 Å²	33	51.2 Å²	51.2	15%	0.154	24%	0.239	C	C	.	.	H	α-helix	trans	-63.2	-46.3	168.9	-70.8	-166	126.8	0	0	112.3	E549 Y551 L555 R556 D557 R561 N562 L606	E549-E553 WeakPolarHBondContact O-CG 3.22Å; E549-E553 PolarHBondContact O-N 3.35Å; Y551-E553 VanDerWaalsContact C-N 3.3Å; Y551-E553 PolarHBondContact O-N 2.98Å; E553-L555 PolarHBondContact O-N 3.43Å; E553-R556 PolarHBondContact O-N 2.99Å; E553-D557 VanDerWaalsContact O-CB 3.3Å; E553-D557 WeakPolarHBondContact O-CB 3.44Å; E553-D557 PolarHBondContact O-N 3.34Å; E553-R561 IonicContact OE1-CZ 2.84Å; E553-R561 IonicContact OE1-NH1 2.66Å; E553-R561 PolarHBondContact OE1-NH1 3.01Å; E553-R561 IonicContact OE2-CZ 2.63Å; E553-R561 IonicContact OE2-NH1 3.81Å; E553-R561 PolarHBondContact OE2-NH1 3.27Å; E553-N562 PolarHBondContact OE2-ND2 3.16Å; E553-L606 HydrophobicContact CG-CD2 3.97Å
554	N	94.3	Very high	91.8	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-57.8	-38.8	176.3	-71.2	-1.8	0	0	0	111.2	Q550 Y551 N558 Y559 R561 N562 L698	Q550-N554 PolarHBondContact O-N 3.37Å; Q550-N554 PolarHBondContact O-OD1 3.45Å; Y551-N554 WeakPolarHBondContact O-CB 3.47Å; Y551-N554 PolarHBondContact O-N 3.22Å; Y551-N554 VanDerWaalsContact O-N 3.12Å; N554-N558 WeakPolarHBondContact O-CA 3.12Å; N554-N558 PolarHBondContact O-N 2.89Å; N554-Y559 VanDerWaalsContact CA-O 3.29Å; N554-Y559 WeakPolarHBondContact CA-O 3.39Å; N554-Y559 PolarHBondContact O-N 2.84Å; N554-R561 PolarHBondContact OD1-N 3.29Å; N554-N562 PolarHBondContact ND2-O 3.48Å; N554-N562 VanDerWaalsContact ND2-O 3.13Å; N554-N562 PolarHBondContact OD1-N 3.22Å; N554-L698 HydrophobicContact CB-CB 4.28Å; N554-L698 PolarHBondContact ND2-O 2.74Å
555	L	92.4	Very high	91.6	Very high	1 Å²	1	54.2 Å²	54.2	1%	0.005	26%	0.261	C	S	.	.	H	α-helix	trans	-67.7	-50.6	177.8	-171.4	66.4	0	0	0	112.3	Y551 A552 E553 D557 N558 L607 T610 M611 Y691 S695 L698	Y551-L555 HydrophobicContact CE1-CD2 4.49Å; Y551-L555 PolarHBondContact O-N 3.06Å; A552-L555 PolarHBondContact O-N 3.34Å; E553-L555 PolarHBondContact O-N 3.43Å; L555-D557 VanDerWaalsContact C-N 3.32Å; L555-D557 PolarHBondContact O-N 3.25Å; L555-N558 PolarHBondContact O-N 2.86Å; L555-L607 HydrophobicContact CD2-CD1 4.35Å; L555-L607 HydrophobicContact CD2-CG 3.91Å; L555-T610 HydrophobicContact CD2-CG2 4.42Å; L555-T610 HydrophobicContact CG-CG2 4.09Å; L555-M611 HydrophobicContact CD2-CG 4.19Å; L555-M611 HydrophobicContact CD2-SD 4.11Å; L555-Y691 HydrophobicContact CD1-CE1 4.18Å; L555-S695 WeakPolarHBondContact CD1-OG 3.1Å; L555-L698 HydrophobicContact CD1-CD1 4.02Å
556	R	92	Very high	91.6	Very high	110 Å²	110	56 Å²	56	42%	0.415	27%	0.267	S	S	.	.	H	α-helix	trans	-55.2	-47.9	175.6	-179.4	-160.5	65.4	-142.7	-6.5	111.6	A552 E553 N558 T610	A552-R556 WeakPolarHBondContact O-CB 3.29Å; A552-R556 PolarHBondContact O-N 3.03Å; E553-R556 PolarHBondContact O-N 2.99Å; R556-N558 VanDerWaalsContact C-N 3.29Å; R556-N558 PolarHBondContact O-N 3.28Å; R556-T610 HydrophobicContact CB-CG2 4.44Å
557	D	90.5	Very high	91.3	Very high	50 Å²	50	57 Å²	57	27%	0.267	27%	0.271	S	S	.	.	H	α-helix	trans	-76.7	-18.1	-176.6	-84.6	29.6	0	0	0	112.7	E553 L555 Y559	E553-D557 VanDerWaalsContact O-CB 3.3Å; E553-D557 WeakPolarHBondContact O-CB 3.44Å; E553-D557 PolarHBondContact O-N 3.34Å; L555-D557 VanDerWaalsContact C-N 3.32Å; L555-D557 PolarHBondContact O-N 3.25Å; D557-Y559 HydrophobicContact CB-CD1 3.71Å; D557-Y559 HydrophobicContact CB-CE1 3.42Å; D557-Y559 VanDerWaalsContact CB-CE1 3.42Å; D557-Y559 WeakPolarHBondContact O-CD1 3.4Å; D557-Y559 PolarHBondContact O-N 3.35Å; D557-Y559 VanDerWaalsContact OD2-CE1 3.25Å; D557-Y559 WeakPolarHBondContact OD2-CE1 3.09Å; D557-Y559 VanDerWaalsContact OD2-CZ 3.24Å; D557-Y559 PolarHBondContact OD2-OH 2.97Å
558	N	87	Confident	91.1	Very high	54 Å²	54	58.4 Å²	58.4	29%	0.289	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	52	36.4	-171.6	-163.1	97.7	0	0	0	112.9	N554 L555 R556 N681	N554-N558 WeakPolarHBondContact O-CA 3.12Å; N554-N558 PolarHBondContact O-N 2.89Å; L555-N558 PolarHBondContact O-N 2.86Å; R556-N558 VanDerWaalsContact C-N 3.29Å; R556-N558 PolarHBondContact O-N 3.28Å; N558-N681 PolarHBondContact OD1-ND2 3.29Å
559	Y	88.2	Confident	91	Very high	121 Å²	121	59.6 Å²	59.6	48%	0.475	29%	0.287	S	S	.	.	S	Bend	trans	-150.6	158.2	164.2	70.6	-89.2	0	0	0	109.2	N554 D557 R561	N554-Y559 VanDerWaalsContact CA-O 3.29Å; N554-Y559 WeakPolarHBondContact CA-O 3.39Å; N554-Y559 PolarHBondContact O-N 2.84Å; D557-Y559 HydrophobicContact CB-CD1 3.71Å; D557-Y559 HydrophobicContact CB-CE1 3.42Å; D557-Y559 VanDerWaalsContact CB-CE1 3.42Å; D557-Y559 WeakPolarHBondContact O-CD1 3.4Å; D557-Y559 PolarHBondContact O-N 3.35Å; D557-Y559 VanDerWaalsContact OD2-CE1 3.25Å; D557-Y559 WeakPolarHBondContact OD2-CE1 3.09Å; D557-Y559 VanDerWaalsContact OD2-CZ 3.24Å; D557-Y559 PolarHBondContact OD2-OH 2.97Å; Y559-R561 HydrophobicContact CD2-CB 4.32Å; Y559-R561 HydrophobicContact CE2-CB 3.63Å; Y559-R561 HydrophobicContact CE2-CG 4.18Å; Y559-R561 PolarHBondContact O-N 2.97Å
560	Q	88.1	Confident	91	Very high	77 Å²	77	56.6 Å²	56.6	36%	0.36	28%	0.275	S	S	.	.			trans	-72.2	93.1	173.7	-65.9	-174.3	1.6	0	0	109.6	A697 L698 Q700	Q560-A697 PolarHBondContact NE2-O 3.06Å; Q560-L698 HydrophobicContact CG-CD2 4.3Å; Q560-Q700 PolarHBondContact NE2-O 3.01Å
561	R	89.4	Confident	90.8	Very high	126 Å²	126	53.8 Å²	53.8	48%	0.475	26%	0.262	S	S	.	.			trans	-75.7	-40.9	172.2	-177.3	-174.5	-173.2	-116.5	13.6	111	E553 N554 Y559	E553-R561 IonicContact OE1-CZ 2.84Å; E553-R561 IonicContact OE1-NH1 2.66Å; E553-R561 PolarHBondContact OE1-NH1 3.01Å; E553-R561 IonicContact OE2-CZ 2.63Å; E553-R561 IonicContact OE2-NH1 3.81Å; E553-R561 PolarHBondContact OE2-NH1 3.27Å; N554-R561 PolarHBondContact OD1-N 3.29Å; Y559-R561 HydrophobicContact CD2-CB 4.32Å; Y559-R561 HydrophobicContact CE2-CB 3.63Å; Y559-R561 HydrophobicContact CE2-CG 4.18Å; Y559-R561 PolarHBondContact O-N 2.97Å
562	N	91.6	Very high	90.7	Very high	30 Å²	30	56.6 Å²	56.6	16%	0.16	28%	0.28	C	S	.	.	S	Bend	trans	-103.4	118.7	177.6	-60.6	-65.7	0	0	0	109.1	L546 Q550 E553 N554	L546-N562 HydrophobicContact CD2-CB 3.89Å; Q550-N562 WeakPolarHBondContact CA-ND2 3.12Å; Q550-N562 HydrophobicContact CB-CB 3.87Å; Q550-N562 HydrophobicContact CG-CB 4.15Å; Q550-N562 PolarHBondContact O-ND2 2.95Å; E553-N562 PolarHBondContact OE2-ND2 3.16Å; N554-N562 PolarHBondContact ND2-O 3.48Å; N554-N562 VanDerWaalsContact ND2-O 3.13Å; N554-N562 PolarHBondContact OD1-N 3.22Å
563	E	89.3	Confident	90.6	Very high	165 Å²	165	62.1 Å²	62.1	77%	0.771	31%	0.306	S	S	*	.	P	Polyproline II helix	trans	-76.2	146.7	172.9	-66.9	-175.1	-175.1	0	0	111.1	L546	L546-E563 WeakPolarHBondContact CD2-O 3.4Å
564	I	91.5	Very high	90.5	Very high	11 Å²	11	60.8 Å²	60.8	6%	0.056	30%	0.299	C	S	.	.	P	Polyproline II helix	trans	-79.1	123.5	-173.4	-65.5	153.4	0	0	0	111	L546 Q566 Y699 L701 R715	L546-I564 HydrophobicContact CD1-CG1 3.72Å; L546-I564 HydrophobicContact CD2-CG1 4.24Å; L546-I564 HydrophobicContact CG-CB 4.45Å; L546-I564 HydrophobicContact CG-CG1 3.75Å; I564-Q566 PolarHBondContact O-N 2.88Å; I564-Q566 VanDerWaalsContact O-N 3.11Å; I564-Y699 HydrophobicContact CD1-CD2 4.24Å; I564-Y699 HydrophobicContact CG1-CD2 4.3Å; I564-L701 HydrophobicContact CB-CB 4.34Å; I564-L701 HydrophobicContact CD1-CB 4Å; I564-R715 VanDerWaalsContact CG2-CZ 3.43Å; I564-R715 VanDerWaalsContact CG2-NH2 3.33Å
565	T	90.7	Very high	90.4	Very high	108 Å²	108	60.8 Å²	60.8	66%	0.663	30%	0.299	S	S	*	.			trans	-71.9	102.9	172	-58.3	0	0	0	0	109.6	G545	G545-T565 WeakPolarHBondContact CA-O 3.27Å; G545-T565 WeakPolarHBondContact O-CB 3.48Å; G545-T565 PolarHBondContact O-N 2.87Å
566	Q	88.7	Confident	90.4	Very high	48 Å²	48	66.2 Å²	66.2	22%	0.224	32%	0.323	C	S	.	.			trans	-86.9	123.1	-170.8	-178.2	53.1	54.1	0	0	113.2	I564 L701 V708 R715	I564-Q566 PolarHBondContact O-N 2.88Å; I564-Q566 VanDerWaalsContact O-N 3.11Å; Q566-L701 HydrophobicContact CB-CD2 3.68Å; Q566-L701 HydrophobicContact CG-CD2 3.99Å; Q566-V708 HydrophobicContact CG-CG2 3.79Å; Q566-R715 VanDerWaalsContact OE1-CZ 3.31Å
567	E	87.5	Confident	90.4	Very high	36 Å²	36	67.2 Å²	67.2	17%	0.168	33%	0.332	C	S	.	.			trans	-67.6	138.5	170.1	-179.2	50.3	-106	0	0	111.8	H543 I569 W711	H543-E567 HydrophobicContact CB-CB 4.4Å; H543-E567 HydrophobicContact CB-CG 4.44Å; H543-E567 IonicContact CE1-OE2 3.16Å; H543-E567 IonicContact CG-OE2 2.69Å; H543-E567 IonicContact ND1-OE2 2.7Å; H543-E567 PolarHBondContact ND1-OE2 3.43Å; E567-I569 HydrophobicContact CG-CB 4.22Å; E567-I569 PolarHBondContact OE1-N 3.18Å; E567-I569 VanDerWaalsContact OE1-N 3.1Å; E567-W711 HydrophobicContact CB-CZ2 4.18Å; E567-W711 HydrophobicContact CG-CZ2 4.19Å
568	S	88.1	Confident	90.3	Very high	91 Å²	91	67.4 Å²	67.4	64%	0.636	33%	0.33	S	S	*	.	S	Bend	trans	-74.8	-28.3	178.2	65.3	0	0	0	0	114.2
569	I	90.8	Very high	90.5	Very high	56 Å²	56	68.6 Å²	68.6	29%	0.287	34%	0.336	S	S	.	.	S	Bend	trans	-90.3	140.7	-179.5	-56.9	176.9	0	0	0	109.9	E567 E573 L574 W711	E567-I569 HydrophobicContact CG-CB 4.22Å; E567-I569 PolarHBondContact OE1-N 3.18Å; E567-I569 VanDerWaalsContact OE1-N 3.1Å; I569-E573 HydrophobicContact CG2-CB 3.63Å; I569-L574 HydrophobicContact CG2-CB 4.14Å; I569-W711 PolarHBondContact O-NE1 3.38Å
570	G	91	Very high	90.3	Very high	7 Å²	7	64.3 Å²	64.3	7%	0.072	32%	0.324	C	S	.	.			trans	-67.6	145.6	173.2	0	0	0	0	0	111.7	T572 E573 L574	G570-T572 VanDerWaalsContact C-N 3.3Å; G570-T572 PolarHBondContact O-N 3.36Å; G570-E573 WeakPolarHBondContact O-CA 3.46Å; G570-E573 WeakPolarHBondContact O-CB 3.31Å; G570-E573 PolarHBondContact O-N 2.87Å; G570-L574 PolarHBondContact O-N 2.96Å
571	P	92.5	Very high	90.1	Very high	4 Å²	4	67 Å²	67	3%	0.026	35%	0.347	C	S	.	.	H	α-helix	trans	-60.2	-37.1	-170.7	22.1	-32.2	0	0	0	113.2	F540 E573 L574 A575 E710 W711 L714	F540-P571 HydrophobicContact CZ-CB 4.38Å; P571-E573 VanDerWaalsContact C-N 3.25Å; P571-E573 PolarHBondContact O-N 3.2Å; P571-L574 PolarHBondContact O-N 2.93Å; P571-A575 VanDerWaalsContact O-CB 3.28Å; P571-A575 WeakPolarHBondContact O-CB 3.3Å; P571-A575 PolarHBondContact O-N 2.77Å; P571-E710 HydrophobicContact CG-CB 3.82Å; P571-W711 HydrophobicContact CB-CD2 4.15Å; P571-W711 HydrophobicContact CB-CE3 4.34Å; P571-W711 HydrophobicContact CB-CH2 4.16Å; P571-W711 HydrophobicContact CB-CZ2 3.94Å; P571-W711 HydrophobicContact CB-CZ3 4.35Å; P571-W711 HydrophobicContact CG-CD2 4.39Å; P571-L714 HydrophobicContact CB-CD1 3.41Å; P571-L714 VanDerWaalsContact CB-CD1 3.41Å; P571-L714 HydrophobicContact CG-CD1 3.63Å
572	T	92.9	Very high	89.8	Confident	60 Å²	60	68 Å²	68	37%	0.368	35%	0.351	S	S	.	.	H	α-helix	trans	-69.6	-18.3	175.1	-40.7	0	0	0	0	113.6	G570 K576 T586	G570-T572 VanDerWaalsContact C-N 3.3Å; G570-T572 PolarHBondContact O-N 3.36Å; T572-K576 VanDerWaalsContact O-CE 3.26Å; T572-K576 WeakPolarHBondContact O-CE 3.03Å; T572-T586 HydrophobicContact CG2-CG2 4.45Å
573	E	92	Very high	89.5	Confident	117 Å²	117	67.4 Å²	67.4	55%	0.547	35%	0.347	S	S	.	.	H	α-helix	trans	-87.9	-38.6	173.3	-64.3	-171.7	145.6	0	0	111.6	I569 G570 P571 A575	I569-E573 HydrophobicContact CG2-CB 3.63Å; G570-E573 WeakPolarHBondContact O-CA 3.46Å; G570-E573 WeakPolarHBondContact O-CB 3.31Å; G570-E573 PolarHBondContact O-N 2.87Å; P571-E573 VanDerWaalsContact C-N 3.25Å; P571-E573 PolarHBondContact O-N 3.2Å; E573-A575 VanDerWaalsContact C-N 3.33Å
574	L	91.7	Very high	89.5	Confident	4 Å²	4	66.2 Å²	66.2	2%	0.021	34%	0.343	C	S	.	.	H	α-helix	trans	-63.5	-39.1	170.8	-175.2	66.6	0	0	0	111.4	F540 H543 I569 G570 P571 K576 Q577 Y578 W711	F540-L574 HydrophobicContact CD2-CB 4.44Å; F540-L574 HydrophobicContact CD2-CD2 3.79Å; F540-L574 HydrophobicContact CD2-CG 3.78Å; F540-L574 HydrophobicContact CE2-CB 3.87Å; F540-L574 HydrophobicContact CE2-CD2 3.69Å; F540-L574 HydrophobicContact CE2-CG 3.69Å; F540-L574 HydrophobicContact CG-CD2 4.42Å; F540-L574 HydrophobicContact CZ-CD2 4.26Å; H543-L574 HydrophobicContact CB-CD2 3.61Å; I569-L574 HydrophobicContact CG2-CB 4.14Å; G570-L574 PolarHBondContact O-N 2.96Å; P571-L574 PolarHBondContact O-N 2.93Å; L574-K576 PolarHBondContact O-N 3.25Å; L574-K576 VanDerWaalsContact O-N 3.12Å; L574-Q577 VanDerWaalsContact O-CB 3.31Å; L574-Q577 WeakPolarHBondContact O-CB 3.35Å; L574-Q577 WeakPolarHBondContact O-CG 3.47Å; L574-Q577 PolarHBondContact O-N 2.9Å; L574-Y578 HydrophobicContact CD1-CE2 4.37Å; L574-Y578 HydrophobicContact CG-CE2 4.37Å; L574-W711 HydrophobicContact CD2-CH2 3.92Å; L574-W711 HydrophobicContact CD2-CZ2 3.8Å
575	A	92.6	Very high	89.5	Confident	0 Å²	0	68.7 Å²	68.7	0%	0	36%	0.359	C	S	.	.	G	3₁₀ helix	trans	-60.1	-28.1	-177	0	0	0	0	0	113.2	F540 P571 E573 Q577 Y578 T586 V589 I590	F540-A575 HydrophobicContact CE2-CB 3.98Å; P571-A575 VanDerWaalsContact O-CB 3.28Å; P571-A575 WeakPolarHBondContact O-CB 3.3Å; P571-A575 PolarHBondContact O-N 2.77Å; E573-A575 VanDerWaalsContact C-N 3.33Å; A575-Q577 PolarHBondContact O-N 3.12Å; A575-Q577 VanDerWaalsContact O-N 3.16Å; A575-Y578 PolarHBondContact O-N 2.94Å; A575-Y578 VanDerWaalsContact O-N 3.08Å; A575-T586 HydrophobicContact CB-CG2 4.2Å; A575-V589 HydrophobicContact CB-CB 4.2Å; A575-V589 HydrophobicContact CB-CG1 3.86Å; A575-I590 HydrophobicContact CB-CD1 4.19Å; A575-I590 HydrophobicContact CB-CG1 3.92Å
576	K	92.2	Very high	89.6	Confident	116 Å²	116	64.9 Å²	64.9	50%	0.504	34%	0.335	S	S	.	.	G	3₁₀ helix	trans	-61.9	-21.3	176.1	-64.2	165.7	-172	164.4	0	113	T572 L574 Y578 L579 T586	T572-K576 VanDerWaalsContact O-CE 3.26Å; T572-K576 WeakPolarHBondContact O-CE 3.03Å; L574-K576 PolarHBondContact O-N 3.25Å; L574-K576 VanDerWaalsContact O-N 3.12Å; K576-Y578 VanDerWaalsContact C-N 3.35Å; K576-L579 HydrophobicContact CB-CD1 4.46Å; K576-T586 HydrophobicContact CG-CG2 3.65Å
577	Q	91.1	Very high	89.8	Confident	130 Å²	130	67.4 Å²	67.4	61%	0.607	35%	0.351	S	S	*	.	G	3₁₀ helix	trans	-80.2	-16.6	178.4	-53.5	-177.6	33.6	0	0	112.8	L574 A575	L574-Q577 VanDerWaalsContact O-CB 3.31Å; L574-Q577 WeakPolarHBondContact O-CB 3.35Å; L574-Q577 WeakPolarHBondContact O-CG 3.47Å; L574-Q577 PolarHBondContact O-N 2.9Å; A575-Q577 PolarHBondContact O-N 3.12Å; A575-Q577 VanDerWaalsContact O-N 3.16Å
578	Y	90.2	Very high	90	Very high	55 Å²	55	69 Å²	69	22%	0.216	36%	0.358	C	S	.	.	S	Bend	trans	-112.8	11.8	-177	-63.6	-95.1	0	0	0	113.1	F540 L574 A575 K576	F540-Y578 HydrophobicContact CB-CD1 4.27Å; F540-Y578 HydrophobicContact CB-CD2 4Å; F540-Y578 HydrophobicContact CB-CE1 4.15Å; F540-Y578 HydrophobicContact CB-CE2 3.86Å; F540-Y578 HydrophobicContact CB-CG 4.21Å; F540-Y578 AromaticContact CD2-CD2 3.71Å; F540-Y578 HydrophobicContact CD2-CD2 3.71Å; F540-Y578 AromaticContact CD2-CE2 3.9Å; F540-Y578 HydrophobicContact CD2-CE2 3.9Å; F540-Y578 HydrophobicContact CD2-CG 4.47Å; F540-Y578 HydrophobicContact CG-CD2 4.35Å; F540-Y578 HydrophobicContact CG-CE2 4.37Å; F540-Y578 PolarHBondContact N-OH 2.79Å; L574-Y578 HydrophobicContact CD1-CE2 4.37Å; L574-Y578 HydrophobicContact CG-CE2 4.37Å; A575-Y578 PolarHBondContact O-N 2.94Å; A575-Y578 VanDerWaalsContact O-N 3.08Å; K576-Y578 VanDerWaalsContact C-N 3.35Å
579	L	90.2	Very high	90.3	Very high	78 Å²	78	64.7 Å²	64.7	41%	0.408	33%	0.328	S	S	.	.			trans	-61.8	136.6	170.3	-66.8	171.9	0	0	0	110	K576 T585 V589	K576-L579 HydrophobicContact CB-CD1 4.46Å; L579-T585 VanDerWaalsContact CD2-C 3.4Å; L579-T585 WeakPolarHBondContact CD2-O 3.23Å; L579-V589 HydrophobicContact CD2-CG2 4.08Å
580	S	84.4	Confident	90.4	Very high	32 Å²	32	63 Å²	63	22%	0.224	32%	0.319	C	S	.	.	B	Isolated β-bridge	trans	-150.1	170.6	-174.6	74.8	0	0	0	0	111	R582 F583 M584	S580-R582 PolarHBondContact O-N 2.84Å; S580-R582 PolarHBondContact OG-N 3.26Å; S580-F583 PolarHBondContact N-O 2.83Å; S580-F583 CarbonylContact O-C 3.55Å; S580-F583 VanDerWaalsContact O-C 3.24Å; S580-F583 PolarHBondContact O-N 3.36Å; S580-F583 PolarHBondContact OG-N 3.02Å; S580-M584 WeakPolarHBondContact O-CE 3.47Å
581	P	84.6	Confident	90.5	Very high	132 Å²	132	68.2 Å²	68.2	86%	0.857	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.4	-7.3	171.3	-24.7	35.7	0	0	0	115.2
582	R	81.8	Confident	90.5	Very high	149 Å²	149	68.1 Å²	68.1	56%	0.562	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.7	-16.3	171.6	-75.6	-177.2	167.6	-176.3	-4.5	114.5	S580	S580-R582 PolarHBondContact O-N 2.84Å; S580-R582 PolarHBondContact OG-N 3.26Å
583	F	86.7	Confident	90.6	Very high	17 Å²	17	65.2 Å²	65.2	8%	0.075	32%	0.323	C	S	.	.	B	Isolated β-bridge	trans	-134.8	93.8	-178.5	-56	-55.5	0	0	0	108.5	F532 A535 I537 S580 E588 V589 A592	F532-F583 HydrophobicContact CD1-CE1 4.24Å; F532-F583 AromaticContact CD1-CZ 3.7Å; F532-F583 HydrophobicContact CD1-CZ 3.7Å; F532-F583 HydrophobicContact CE1-CE1 4.12Å; F532-F583 HydrophobicContact CE1-CZ 4.05Å; A535-F583 HydrophobicContact CB-CE2 3.62Å; A535-F583 HydrophobicContact CB-CZ 4.29Å; I537-F583 HydrophobicContact CD1-CD2 3.81Å; I537-F583 HydrophobicContact CD1-CE2 3.58Å; I537-F583 HydrophobicContact CD1-CZ 4.43Å; I537-F583 HydrophobicContact CG1-CD2 4.21Å; I537-F583 HydrophobicContact CG1-CE2 3.45Å; I537-F583 VanDerWaalsContact CG1-CE2 3.45Å; I537-F583 HydrophobicContact CG1-CZ 4.03Å; S580-F583 PolarHBondContact N-O 2.83Å; S580-F583 CarbonylContact O-C 3.55Å; S580-F583 VanDerWaalsContact O-C 3.24Å; S580-F583 PolarHBondContact O-N 3.36Å; S580-F583 PolarHBondContact OG-N 3.02Å; F583-E588 VanDerWaalsContact CA-OE2 3.25Å; F583-E588 WeakPolarHBondContact CA-OE2 3.19Å; F583-E588 HydrophobicContact CB-CB 4.27Å; F583-E588 HydrophobicContact CD1-CB 4.11Å; F583-V589 HydrophobicContact CB-CG2 3.64Å; F583-V589 HydrophobicContact CG-CG2 4.28Å; F583-A592 HydrophobicContact CE1-CB 3.88Å; F583-A592 HydrophobicContact CE2-CB 4.47Å; F583-A592 HydrophobicContact CZ-CB 3.79Å
584	M	88.6	Confident	90.7	Very high	140 Å²	140	61.9 Å²	61.9	69%	0.69	31%	0.307	S	S	*	.			trans	-81.9	-30	-172.1	-64.3	-90.4	74	0	0	112.1	S580 E588	S580-M584 WeakPolarHBondContact O-CE 3.47Å; M584-E588 PolarHBondContact N-OE2 3.02Å
585	T	91.4	Very high	90.8	Very high	62 Å²	62	63.6 Å²	63.6	38%	0.38	31%	0.313	S	S	.	.	S	Bend	trans	-109.7	159.7	177.3	66.8	0	0	0	0	112.8	L579 D587 E588 V589	L579-T585 VanDerWaalsContact CD2-C 3.4Å; L579-T585 WeakPolarHBondContact CD2-O 3.23Å; T585-D587 PolarHBondContact O-N 2.76Å; T585-E588 VanDerWaalsContact CB-OE1 3.26Å; T585-E588 WeakPolarHBondContact CB-OE1 3.5Å; T585-E588 VanDerWaalsContact CG2-OE1 3.22Å; T585-E588 WeakPolarHBondContact CG2-OE1 3.47Å; T585-E588 PolarHBondContact N-OE1 2.87Å; T585-E588 VanDerWaalsContact OG1-CD 3.24Å; T585-E588 VanDerWaalsContact OG1-CG 3.31Å; T585-E588 WeakPolarHBondContact OG1-CG 3.41Å; T585-E588 PolarHBondContact OG1-N 2.72Å; T585-E588 PolarHBondContact OG1-OE1 3.21Å; T585-V589 PolarHBondContact O-N 2.71Å
586	T	92.9	Very high	90.9	Very high	28 Å²	28	63.6 Å²	63.6	17%	0.172	31%	0.313	C	S	.	.	H	α-helix	trans	-63.9	-24.7	172.2	45.2	0	0	0	0	112.6	T572 A575 K576 V589 I590	T572-T586 HydrophobicContact CG2-CG2 4.45Å; A575-T586 HydrophobicContact CB-CG2 4.2Å; K576-T586 HydrophobicContact CG-CG2 3.65Å; T586-V589 WeakPolarHBondContact O-CB 3.49Å; T586-V589 PolarHBondContact O-N 3.09Å; T586-I590 VanDerWaalsContact O-CG1 3.29Å; T586-I590 WeakPolarHBondContact O-CG1 3.26Å; T586-I590 PolarHBondContact O-N 2.78Å
587	D	92.8	Very high	91	Very high	102 Å²	102	58.4 Å²	58.4	55%	0.545	29%	0.291	S	S	.	.	H	α-helix	trans	-87.1	-31.9	-170.3	-51.3	-30.7	0	0	0	110.3	T585 I590 H591	T585-D587 PolarHBondContact O-N 2.76Å; D587-I590 PolarHBondContact O-N 2.97Å; D587-H591 VanDerWaalsContact O-CB 3.3Å; D587-H591 WeakPolarHBondContact O-CB 3.35Å; D587-H591 PolarHBondContact O-N 2.89Å
588	E	92.5	Very high	91.2	Very high	70 Å²	70	52.2 Å²	52.2	33%	0.327	26%	0.262	S	S	.	.	H	α-helix	trans	-56.8	-46.2	161.6	-75.1	155.8	-111.4	0	0	112	F583 M584 T585 H591 A592	F583-E588 VanDerWaalsContact CA-OE2 3.25Å; F583-E588 WeakPolarHBondContact CA-OE2 3.19Å; F583-E588 HydrophobicContact CB-CB 4.27Å; F583-E588 HydrophobicContact CD1-CB 4.11Å; M584-E588 PolarHBondContact N-OE2 3.02Å; T585-E588 VanDerWaalsContact CB-OE1 3.26Å; T585-E588 WeakPolarHBondContact CB-OE1 3.5Å; T585-E588 VanDerWaalsContact CG2-OE1 3.22Å; T585-E588 WeakPolarHBondContact CG2-OE1 3.47Å; T585-E588 PolarHBondContact N-OE1 2.87Å; T585-E588 VanDerWaalsContact OG1-CD 3.24Å; T585-E588 VanDerWaalsContact OG1-CG 3.31Å; T585-E588 WeakPolarHBondContact OG1-CG 3.41Å; T585-E588 PolarHBondContact OG1-N 2.72Å; T585-E588 PolarHBondContact OG1-OE1 3.21Å; E588-H591 PolarHBondContact O-N 3.06Å; E588-A592 WeakPolarHBondContact O-CB 3.34Å; E588-A592 PolarHBondContact O-N 3.27Å
589	V	93.3	Very high	91.4	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-61.5	-46.6	177	171.8	0	0	0	0	111	I537 F540 A575 L579 F583 T585 T586 H591 A592 A593	I537-V589 HydrophobicContact CD1-CG1 4.27Å; F540-V589 HydrophobicContact CD2-CG1 4.44Å; A575-V589 HydrophobicContact CB-CB 4.2Å; A575-V589 HydrophobicContact CB-CG1 3.86Å; L579-V589 HydrophobicContact CD2-CG2 4.08Å; F583-V589 HydrophobicContact CB-CG2 3.64Å; F583-V589 HydrophobicContact CG-CG2 4.28Å; T585-V589 PolarHBondContact O-N 2.71Å; T586-V589 WeakPolarHBondContact O-CB 3.49Å; T586-V589 PolarHBondContact O-N 3.09Å; V589-H591 VanDerWaalsContact C-N 3.34Å; V589-H591 PolarHBondContact O-N 3.41Å; V589-A592 PolarHBondContact O-N 3.36Å; V589-A593 VanDerWaalsContact O-CB 3.32Å; V589-A593 WeakPolarHBondContact O-CB 3.36Å; V589-A593 PolarHBondContact O-N 2.94Å
590	I	93.5	Very high	91.6	Very high	19 Å²	19	50.5 Å²	50.5	10%	0.097	25%	0.252	C	S	.	.	H	α-helix	trans	-64.8	-38.5	178	-70.6	165.7	0	0	0	111	F540 A575 T586 D587 A593 K594 L714	F540-I590 HydrophobicContact CZ-CG1 4.45Å; A575-I590 HydrophobicContact CB-CD1 4.19Å; A575-I590 HydrophobicContact CB-CG1 3.92Å; T586-I590 VanDerWaalsContact O-CG1 3.29Å; T586-I590 WeakPolarHBondContact O-CG1 3.26Å; T586-I590 PolarHBondContact O-N 2.78Å; D587-I590 PolarHBondContact O-N 2.97Å; I590-A593 PolarHBondContact O-N 2.96Å; I590-K594 HydrophobicContact CG2-CD 4.22Å; I590-K594 HydrophobicContact CG2-CG 4.49Å; I590-K594 WeakPolarHBondContact O-CB 3.08Å; I590-K594 WeakPolarHBondContact O-CG 3.4Å; I590-K594 PolarHBondContact O-N 3.3Å; I590-L714 HydrophobicContact CG2-CD1 4.2Å; I590-L714 HydrophobicContact CG2-CD2 3.61Å
591	H	93	Very high	92.2	Very high	118 Å²	118	49.1 Å²	49.1	55%	0.546	24%	0.242	S	C	.	.	H	α-helix	trans	-63.9	-48.2	175.3	-173.1	111.5	0	0	0	111.5	D587 E588 V589 A593 K594 Y595	D587-H591 VanDerWaalsContact O-CB 3.3Å; D587-H591 WeakPolarHBondContact O-CB 3.35Å; D587-H591 PolarHBondContact O-N 2.89Å; E588-H591 PolarHBondContact O-N 3.06Å; V589-H591 VanDerWaalsContact C-N 3.34Å; V589-H591 PolarHBondContact O-N 3.41Å; H591-A593 VanDerWaalsContact C-N 3.3Å; H591-A593 PolarHBondContact O-N 2.87Å; H591-K594 PolarHBondContact O-N 3.12Å; H591-Y595 PolarHBondContact O-N 3.11Å
592	A	93	Very high	92.7	Very high	1 Å²	1	42.8 Å²	42.8	1%	0.008	20%	0.201	C	C	.	.	H	α-helix	trans	-60.5	-41.1	176.8	0	0	0	0	0	111.5	F532 I537 F583 E588 V589 Y595 V596	F532-A592 HydrophobicContact CD1-CB 4.13Å; F532-A592 HydrophobicContact CD2-CB 3.94Å; F532-A592 HydrophobicContact CE1-CB 4.23Å; F532-A592 HydrophobicContact CE2-CB 4.06Å; F532-A592 HydrophobicContact CG-CB 3.98Å; F532-A592 HydrophobicContact CZ-CB 4.2Å; I537-A592 HydrophobicContact CD1-CB 4.5Å; I537-A592 HydrophobicContact CG1-CB 4.17Å; I537-A592 HydrophobicContact CG2-CB 4.09Å; F583-A592 HydrophobicContact CE1-CB 3.88Å; F583-A592 HydrophobicContact CE2-CB 4.47Å; F583-A592 HydrophobicContact CZ-CB 3.79Å; E588-A592 WeakPolarHBondContact O-CB 3.34Å; E588-A592 PolarHBondContact O-N 3.27Å; V589-A592 PolarHBondContact O-N 3.36Å; A592-Y595 PolarHBondContact O-N 3.32Å; A592-V596 WeakPolarHBondContact O-CG2 3.46Å; A592-V596 PolarHBondContact O-N 3.31Å
593	A	93.6	Very high	93.3	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-64.3	-46.3	175.6	0	0	0	0	0	112.8	I537 F540 F544 V589 I590 H591 Y595 V596 V597	I537-A593 HydrophobicContact CG2-CB 4.05Å; F540-A593 HydrophobicContact CD1-CB 3.28Å; F540-A593 HydrophobicContact CE1-CB 3.6Å; F540-A593 HydrophobicContact CG-CB 4.13Å; F544-A593 HydrophobicContact CE2-CB 4.25Å; V589-A593 VanDerWaalsContact O-CB 3.32Å; V589-A593 WeakPolarHBondContact O-CB 3.36Å; V589-A593 PolarHBondContact O-N 2.94Å; I590-A593 PolarHBondContact O-N 2.96Å; H591-A593 VanDerWaalsContact C-N 3.3Å; H591-A593 PolarHBondContact O-N 2.87Å; A593-Y595 VanDerWaalsContact C-N 3.29Å; A593-Y595 PolarHBondContact O-N 3.18Å; A593-V596 PolarHBondContact O-N 2.59Å; A593-V597 PolarHBondContact O-N 2.93Å
594	K	94.2	Very high	93.7	Very high	46 Å²	46	35.6 Å²	35.6	20%	0.2	17%	0.174	C	C	.	.	H	α-helix	trans	-55.3	-45	173.1	-80	173.2	55.1	172.6	0	111.4	I590 H591 A598 L714 E717	I590-K594 HydrophobicContact CG2-CD 4.22Å; I590-K594 HydrophobicContact CG2-CG 4.49Å; I590-K594 WeakPolarHBondContact O-CB 3.08Å; I590-K594 WeakPolarHBondContact O-CG 3.4Å; I590-K594 PolarHBondContact O-N 3.3Å; H591-K594 PolarHBondContact O-N 3.12Å; K594-A598 WeakPolarHBondContact O-CB 3.3Å; K594-A598 PolarHBondContact O-N 3.08Å; K594-L714 HydrophobicContact CD-CD2 3.89Å; K594-L714 HydrophobicContact CG-CD2 4.24Å; K594-E717 WeakPolarHBondContact CE-OE2 3.45Å; K594-E717 IonicContact NZ-OE2 3.98Å; K594-E717 PolarHBondContact NZ-OE2 2.79Å
595	Y	94.5	Very high	94	Very high	40 Å²	40	29.7 Å²	29.7	16%	0.157	15%	0.146	C	C	.	.	H	α-helix	trans	-63.1	-44.6	177.7	-174.6	-77.6	0	0	0	111.9	P528 F532 H591 A592 A593 R599 W726	P528-Y595 HydrophobicContact CB-CD1 4.43Å; P528-Y595 HydrophobicContact CB-CE1 3.83Å; P528-Y595 HydrophobicContact CB-CE2 4.29Å; F532-Y595 AromaticContact CD2-CD1 3.83Å; F532-Y595 HydrophobicContact CD2-CD1 3.83Å; F532-Y595 HydrophobicContact CD2-CG 4.22Å; F532-Y595 AromaticContact CE2-CD1 3.75Å; F532-Y595 HydrophobicContact CE2-CD1 3.75Å; F532-Y595 HydrophobicContact CE2-CD2 4.48Å; F532-Y595 HydrophobicContact CE2-CE1 4.5Å; F532-Y595 AromaticContact CE2-CG 3.76Å; F532-Y595 HydrophobicContact CE2-CG 3.76Å; H591-Y595 PolarHBondContact O-N 3.11Å; A592-Y595 PolarHBondContact O-N 3.32Å; A593-Y595 VanDerWaalsContact C-N 3.29Å; A593-Y595 PolarHBondContact O-N 3.18Å; Y595-R599 HydrophobicContact CE1-CB 4.32Å; Y595-R599 WeakPolarHBondContact O-CB 3.43Å; Y595-R599 PolarHBondContact O-N 3.23Å; Y595-W726 HydrophobicContact CD2-CH2 4.09Å; Y595-W726 HydrophobicContact CD2-CZ2 4.39Å; Y595-W726 AromaticContact CE2-CH2 3.84Å; Y595-W726 HydrophobicContact CE2-CH2 3.84Å; Y595-W726 AromaticContact CE2-CZ2 3.71Å; Y595-W726 HydrophobicContact CE2-CZ2 3.71Å; Y595-W726 AromaticContact CZ-CZ2 3.89Å
596	V	93.5	Very high	94.2	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-59	-50.2	177.5	165.4	0	0	0	0	111.1	Y529 F532 I537 A541 A592 A593 R599 Q600	Y529-V596 HydrophobicContact CD2-CG2 4.24Å; Y529-V596 HydrophobicContact CE2-CB 4.34Å; Y529-V596 HydrophobicContact CE2-CG1 3.91Å; Y529-V596 HydrophobicContact CE2-CG2 4.34Å; F532-V596 HydrophobicContact CB-CG2 3.74Å; F532-V596 HydrophobicContact CD2-CG2 4.16Å; F532-V596 HydrophobicContact CG-CG2 4.48Å; I537-V596 HydrophobicContact CG2-CG2 3.99Å; A541-V596 HydrophobicContact CB-CG1 3.76Å; A592-V596 WeakPolarHBondContact O-CG2 3.46Å; A592-V596 PolarHBondContact O-N 3.31Å; A593-V596 PolarHBondContact O-N 2.59Å; V596-R599 PolarHBondContact O-N 3.07Å; V596-Q600 VanDerWaalsContact O-CG 3.28Å; V596-Q600 WeakPolarHBondContact O-CG 3.28Å; V596-Q600 PolarHBondContact O-N 2.92Å
597	V	94.8	Very high	94.3	Very high	7 Å²	7	27.4 Å²	27.4	4%	0.042	13%	0.13	C	C	.	.	H	α-helix	trans	-66.4	-46.5	179.7	175.3	0	0	0	0	111.5	A541 F544 A593 R599 Q600 L601 C718	A541-V597 HydrophobicContact CB-CG2 3.73Å; F544-V597 HydrophobicContact CD1-CG1 4.27Å; F544-V597 HydrophobicContact CD1-CG2 4.29Å; F544-V597 HydrophobicContact CD2-CG2 3.65Å; F544-V597 HydrophobicContact CE1-CG2 4.39Å; F544-V597 HydrophobicContact CE2-CG2 3.75Å; F544-V597 HydrophobicContact CG-CG1 4.45Å; F544-V597 HydrophobicContact CG-CG2 3.92Å; F544-V597 HydrophobicContact CZ-CG2 4.13Å; A593-V597 PolarHBondContact O-N 2.93Å; V597-R599 VanDerWaalsContact C-N 3.28Å; V597-R599 PolarHBondContact O-N 2.78Å; V597-Q600 PolarHBondContact O-N 2.84Å; V597-L601 HydrophobicContact CG1-CD1 4.14Å; V597-L601 HydrophobicContact CG1-CG 4.45Å; V597-L601 WeakPolarHBondContact O-CG 3.41Å; V597-L601 PolarHBondContact O-N 3Å; V597-C718 HydrophobicContact CB-CB 4.49Å; V597-C718 HydrophobicContact CG1-CB 4.02Å
598	A	95.8	Very high	94.5	Very high	0 Å²	0	23 Å²	23	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-62.2	-35.9	178.7	0	0	0	0	0	112.3	K594 A602 C718 L721 A722 W726	K594-A598 WeakPolarHBondContact O-CB 3.3Å; K594-A598 PolarHBondContact O-N 3.08Å; A598-A602 VanDerWaalsContact O-CB 3.31Å; A598-A602 WeakPolarHBondContact O-CB 3.2Å; A598-A602 PolarHBondContact O-N 3.34Å; A598-C718 HydrophobicContact CB-CB 4.41Å; A598-C718 WeakPolarHBondContact CB-O 3.31Å; A598-L721 HydrophobicContact CB-CB 3.92Å; A598-L721 HydrophobicContact CB-CD2 3.76Å; A598-L721 HydrophobicContact CB-CG 3.85Å; A598-A722 HydrophobicContact CB-CB 4.25Å; A598-A722 VanDerWaalsContact O-CB 3.28Å; A598-A722 WeakPolarHBondContact O-CB 3.44Å; A598-W726 HydrophobicContact CB-CZ3 3.85Å
599	R	94.8	Very high	94.6	Very high	58 Å²	58	22.8 Å²	22.8	22%	0.219	10%	0.104	C	C	.	.	H	α-helix	trans	-71.9	-35.6	176.1	-171.2	62.2	-179	-167.3	1.5	112.4	L459 Y529 Y595 V596 V597 A602 Q603 W726	L459-R599 HydrophobicContact CD1-CG 4.29Å; Y529-R599 HydrophobicContact CD2-CB 4.09Å; Y529-R599 HydrophobicContact CD2-CG 4.11Å; Y595-R599 HydrophobicContact CE1-CB 4.32Å; Y595-R599 WeakPolarHBondContact O-CB 3.43Å; Y595-R599 PolarHBondContact O-N 3.23Å; V596-R599 PolarHBondContact O-N 3.07Å; V597-R599 VanDerWaalsContact C-N 3.28Å; V597-R599 PolarHBondContact O-N 2.78Å; R599-A602 PolarHBondContact O-N 2.91Å; R599-Q603 PolarHBondContact O-N 3.08Å; R599-W726 HydrophobicContact CB-CH2 4.23Å; R599-W726 HydrophobicContact CB-CZ3 4.24Å; R599-W726 VanDerWaalsContact NH1-CD1 3.32Å
600	Q	94.6	Very high	94.6	Very high	40 Å²	40	23.4 Å²	23.4	19%	0.187	11%	0.108	C	C	.	.	H	α-helix	trans	-64.1	-44	172.2	-74.2	167.1	-7.2	0	0	111.8	L459 Y529 P548 V596 V597 Q603 E604	L459-Q600 HydrophobicContact CD2-CB 4.5Å; L459-Q600 HydrophobicContact CD2-CG 4.11Å; Y529-Q600 HydrophobicContact CE2-CG 3.95Å; Y529-Q600 PolarHBondContact OH-NE2 2.95Å; P548-Q600 HydrophobicContact CG-CB 3.78Å; V596-Q600 VanDerWaalsContact O-CG 3.28Å; V596-Q600 WeakPolarHBondContact O-CG 3.28Å; V596-Q600 PolarHBondContact O-N 2.92Å; V597-Q600 PolarHBondContact O-N 2.84Å; Q600-Q603 PolarHBondContact O-N 2.79Å; Q600-E604 PolarHBondContact O-N 2.87Å
601	L	96	Very high	94.6	Very high	2 Å²	2	22.5 Å²	22.5	1%	0.01	10%	0.103	C	C	.	.	H	α-helix	trans	-60	-48.4	172.9	-68.7	171	0	0	0	111.7	P548 Y551 V597 Q603 E604 L607 Y699 C718 V719 A722	P548-L601 HydrophobicContact CB-CD2 4.28Å; Y551-L601 HydrophobicContact CD1-CD2 3.52Å; Y551-L601 HydrophobicContact CE1-CD2 4.23Å; Y551-L601 HydrophobicContact CG-CD2 4.06Å; V597-L601 HydrophobicContact CG1-CD1 4.14Å; V597-L601 HydrophobicContact CG1-CG 4.45Å; V597-L601 WeakPolarHBondContact O-CG 3.41Å; V597-L601 PolarHBondContact O-N 3Å; L601-Q603 PolarHBondContact O-N 2.87Å; L601-Q603 VanDerWaalsContact O-N 3.14Å; L601-E604 WeakPolarHBondContact O-CB 3.24Å; L601-E604 PolarHBondContact O-N 3.3Å; L601-L607 HydrophobicContact CB-CD1 4.29Å; L601-L607 HydrophobicContact CD2-CD1 4.44Å; L601-Y699 HydrophobicContact CD1-CE1 4.32Å; L601-C718 HydrophobicContact CD1-CB 4.31Å; L601-V719 HydrophobicContact CD1-CG2 4.35Å; L601-A722 HydrophobicContact CB-CB 3.72Å; L601-A722 HydrophobicContact CD1-CB 4.31Å
602	A	95.6	Very high	94.7	Very high	0 Å²	0	18.1 Å²	18.1	0%	0	8%	0.081	C	C	.	.	H	α-helix	trans	-68.5	-11.9	-175.3	0	0	0	0	0	115.5	A598 R599 R608 A722 W726 V727	A598-A602 VanDerWaalsContact O-CB 3.31Å; A598-A602 WeakPolarHBondContact O-CB 3.2Å; A598-A602 PolarHBondContact O-N 3.34Å; R599-A602 PolarHBondContact O-N 2.91Å; A602-R608 WeakPolarHBondContact O-CD 3.22Å; A602-R608 PolarHBondContact O-NH1 3.05Å; A602-A722 HydrophobicContact CB-CB 4.2Å; A602-W726 HydrophobicContact CB-CB 3.88Å; A602-W726 HydrophobicContact CB-CD2 4.23Å; A602-W726 HydrophobicContact CB-CE3 3.63Å; A602-W726 HydrophobicContact CB-CG 4.37Å; A602-V727 HydrophobicContact CB-CG2 3.82Å
603	Q	94.3	Very high	94.6	Very high	13 Å²	13	23.9 Å²	23.9	6%	0.061	11%	0.108	C	C	.	.	T	Hydrogen-bonded Turn	trans	-117.6	10.8	177.2	-57.1	-167.4	-93.9	0	0	113	Y456 L459 R599 Q600 L601 P605	Y456-Q603 WeakPolarHBondContact CD2-O 3.3Å; L459-Q603 HydrophobicContact CD2-CB 4Å; R599-Q603 PolarHBondContact O-N 3.08Å; Q600-Q603 PolarHBondContact O-N 2.79Å; L601-Q603 PolarHBondContact O-N 2.87Å; L601-Q603 VanDerWaalsContact O-N 3.14Å; Q603-P605 WeakPolarHBondContact O-CD 3.45Å
604	E	95.5	Very high	94.6	Very high	2 Å²	2	25 Å²	25	1%	0.009	12%	0.115	C	C	.	.			trans	-76.9	115.9	172.2	178.3	56.9	-129.9	0	0	109.9	R440 Y456 P548 A552 Q600 L601 L606 L607 R608	R440-E604 IonicContact CZ-OE1 3.72Å; R440-E604 IonicContact NH1-OE1 3.59Å; R440-E604 PolarHBondContact NH1-OE1 3.11Å; R440-E604 IonicContact NH1-OE2 2.73Å; R440-E604 IonicContact NH2-OE1 2.78Å; R440-E604 PolarHBondContact NH2-OE1 3.31Å; Y456-E604 VanDerWaalsContact CE2-OE2 3.22Å; Y456-E604 WeakPolarHBondContact CE2-OE2 3.4Å; Y456-E604 PolarHBondContact OH-OE2 2.88Å; P548-E604 HydrophobicContact CB-CB 4.1Å; P548-E604 HydrophobicContact CB-CG 4.17Å; A552-E604 HydrophobicContact CB-CG 3.78Å; Q600-E604 PolarHBondContact O-N 2.87Å; L601-E604 WeakPolarHBondContact O-CB 3.24Å; L601-E604 PolarHBondContact O-N 3.3Å; E604-L606 VanDerWaalsContact C-N 3.32Å; E604-L606 PolarHBondContact O-N 3.27Å; E604-L607 HydrophobicContact CB-CB 4.13Å; E604-L607 HydrophobicContact CG-CB 4.3Å; E604-L607 WeakPolarHBondContact O-CB 3.18Å; E604-L607 PolarHBondContact O-N 2.84Å; E604-R608 PolarHBondContact O-N 3.35Å; E604-R608 VanDerWaalsContact O-N 3.11Å
605	P	94.9	Very high	94.6	Very high	16 Å²	16	22.8 Å²	22.8	10%	0.104	11%	0.106	C	C	.	.	H	α-helix	trans	-60.1	-37.2	-170.5	-27.4	35.8	0	0	0	114.1	D452 V453 Y456 Q603 L607 R608 K609	D452-P605 HydrophobicContact CB-CB 4.22Å; V453-P605 HydrophobicContact CG2-CB 4.08Å; V453-P605 HydrophobicContact CG2-CG 4.03Å; Y456-P605 HydrophobicContact CD1-CG 4.32Å; Y456-P605 HydrophobicContact CD2-CG 4.3Å; Y456-P605 HydrophobicContact CG-CG 3.91Å; Q603-P605 WeakPolarHBondContact O-CD 3.45Å; P605-L607 VanDerWaalsContact C-N 3.3Å; P605-L607 PolarHBondContact O-N 3.16Å; P605-R608 PolarHBondContact O-N 2.76Å; P605-K609 WeakPolarHBondContact O-CB 3.41Å; P605-K609 PolarHBondContact O-N 3.29Å
606	L	94.4	Very high	94.5	Very high	40 Å²	40	22.2 Å²	22.2	21%	0.209	10%	0.104	C	C	.	.	H	α-helix	trans	-65.5	-34.6	178.6	-176.9	61.6	0	0	0	112.3	A552 E553 E604 T610	A552-L606 HydrophobicContact CB-CB 3.88Å; A552-L606 HydrophobicContact CB-CD2 4.06Å; A552-L606 HydrophobicContact CB-CG 4Å; E553-L606 HydrophobicContact CG-CD2 3.97Å; E604-L606 VanDerWaalsContact C-N 3.32Å; E604-L606 PolarHBondContact O-N 3.27Å; L606-T610 WeakPolarHBondContact O-CB 3.37Å; L606-T610 PolarHBondContact O-N 3.43Å; L606-T610 VanDerWaalsContact O-N 3.09Å; L606-T610 PolarHBondContact O-OG1 2.9Å
607	L	95.9	Very high	94.4	Very high	1 Å²	1	27.9 Å²	27.9	1%	0.005	13%	0.134	C	C	.	.	H	α-helix	trans	-68.8	-48	175.2	-179.1	152.1	0	0	0	110.1	Y551 A552 L555 L601 E604 P605 K609 T610 M611 L723 V727	Y551-L607 HydrophobicContact CD1-CD1 3.87Å; Y551-L607 HydrophobicContact CE1-CD1 3.64Å; A552-L607 HydrophobicContact CB-CB 3.89Å; L555-L607 HydrophobicContact CD2-CD1 4.35Å; L555-L607 HydrophobicContact CD2-CG 3.91Å; L601-L607 HydrophobicContact CB-CD1 4.29Å; L601-L607 HydrophobicContact CD2-CD1 4.44Å; E604-L607 HydrophobicContact CB-CB 4.13Å; E604-L607 HydrophobicContact CG-CB 4.3Å; E604-L607 WeakPolarHBondContact O-CB 3.18Å; E604-L607 PolarHBondContact O-N 2.84Å; P605-L607 VanDerWaalsContact C-N 3.3Å; P605-L607 PolarHBondContact O-N 3.16Å; L607-K609 PolarHBondContact O-N 3.28Å; L607-T610 PolarHBondContact O-N 3.41Å; L607-M611 HydrophobicContact CD2-CG 4Å; L607-M611 HydrophobicContact CG-CG 4.47Å; L607-M611 WeakPolarHBondContact O-CB 3.37Å; L607-M611 VanDerWaalsContact O-CG 3.3Å; L607-M611 WeakPolarHBondContact O-CG 3.31Å; L607-M611 PolarHBondContact O-N 3.03Å; L607-L723 HydrophobicContact CD2-CD2 3.99Å; L607-V727 HydrophobicContact CD2-CG1 4.26Å; L607-V727 HydrophobicContact CD2-CG2 3.87Å
608	R	95.9	Very high	94.2	Very high	10 Å²	10	30.4 Å²	30.4	4%	0.038	14%	0.143	C	C	.	.	H	α-helix	trans	-61.4	-44.6	180	-65.6	-177.6	68.7	88.5	-0	111.7	D452 A602 E604 P605 M611 R612 D730	D452-R608 WeakPolarHBondContact OD1-CD 3.31Å; D452-R608 IonicContact OD1-CZ 2.83Å; D452-R608 IonicContact OD1-NE 3.76Å; D452-R608 PolarHBondContact OD1-NE 2.98Å; D452-R608 IonicContact OD1-NH2 3.6Å; D452-R608 WeakPolarHBondContact OD2-CB 3.39Å; A602-R608 WeakPolarHBondContact O-CD 3.22Å; A602-R608 PolarHBondContact O-NH1 3.05Å; E604-R608 PolarHBondContact O-N 3.35Å; E604-R608 VanDerWaalsContact O-N 3.11Å; P605-R608 PolarHBondContact O-N 2.76Å; R608-M611 PolarHBondContact O-N 3.16Å; R608-R612 VanDerWaalsContact O-CB 3.3Å; R608-R612 WeakPolarHBondContact O-CB 3.35Å; R608-R612 PolarHBondContact O-N 3.19Å; R608-D730 IonicContact CZ-OD2 3.84Å; R608-D730 VanDerWaalsContact CZ-OD2 3.23Å; R608-D730 IonicContact NH1-OD2 2.46Å; R608-D730 PolarHBondContact NH1-OD2 3.29Å; R608-D730 IonicContact NH2-OD2 3.58Å; R608-D730 PolarHBondContact NH2-OD2 3.07Å
609	K	94.6	Very high	94.1	Very high	66 Å²	66	30.5 Å²	30.5	29%	0.287	14%	0.144	S	C	.	.	H	α-helix	trans	-57.9	-49.2	173	178.5	167.8	-178.4	152.3	0	112.9	E449 P605 L607 M611 R612 E613	E449-K609 WeakPolarHBondContact OE1-CD 2.97Å; E449-K609 WeakPolarHBondContact OE1-CE 3.49Å; E449-K609 IonicContact OE1-NZ 3.37Å; E449-K609 PolarHBondContact OE1-NZ 3.04Å; E449-K609 IonicContact OE2-NZ 3.19Å; P605-K609 WeakPolarHBondContact O-CB 3.41Å; P605-K609 PolarHBondContact O-N 3.29Å; L607-K609 PolarHBondContact O-N 3.28Å; K609-M611 PolarHBondContact O-N 2.98Å; K609-R612 WeakPolarHBondContact O-CB 3.38Å; K609-R612 PolarHBondContact O-N 3.26Å; K609-E613 WeakPolarHBondContact CE-OE1 3.49Å; K609-E613 WeakPolarHBondContact O-CG 3.2Å; K609-E613 PolarHBondContact O-N 2.84Å
610	T	94	Very high	94.1	Very high	13 Å²	13	30.8 Å²	30.8	8%	0.08	15%	0.145	C	C	.	.	H	α-helix	trans	-61.4	-45	178.4	-55.5	0	0	0	0	111.3	L555 R556 L606 L607 E613 V614	L555-T610 HydrophobicContact CD2-CG2 4.42Å; L555-T610 HydrophobicContact CG-CG2 4.09Å; R556-T610 HydrophobicContact CB-CG2 4.44Å; L606-T610 WeakPolarHBondContact O-CB 3.37Å; L606-T610 PolarHBondContact O-N 3.43Å; L606-T610 VanDerWaalsContact O-N 3.09Å; L606-T610 PolarHBondContact O-OG1 2.9Å; L607-T610 PolarHBondContact O-N 3.41Å; T610-E613 PolarHBondContact O-N 3.47Å; T610-V614 WeakPolarHBondContact O-CG2 3.32Å; T610-V614 PolarHBondContact O-N 2.93Å; T610-V614 VanDerWaalsContact O-N 3.11Å
611	M	94.5	Very high	94.1	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-64	-39.7	177.6	-72.4	-63.1	-53.1	0	0	112.2	L555 L607 R608 K609 Y615 F678 Y691 L723 V727 I728 L731	L555-M611 HydrophobicContact CD2-CG 4.19Å; L555-M611 HydrophobicContact CD2-SD 4.11Å; L607-M611 HydrophobicContact CD2-CG 4Å; L607-M611 HydrophobicContact CG-CG 4.47Å; L607-M611 WeakPolarHBondContact O-CB 3.37Å; L607-M611 VanDerWaalsContact O-CG 3.3Å; L607-M611 WeakPolarHBondContact O-CG 3.31Å; L607-M611 PolarHBondContact O-N 3.03Å; R608-M611 PolarHBondContact O-N 3.16Å; K609-M611 PolarHBondContact O-N 2.98Å; M611-Y615 WeakPolarHBondContact O-CB 3.43Å; M611-Y615 PolarHBondContact O-N 3.26Å; M611-F678 HydrophobicContact CE-CE1 4.23Å; M611-F678 HydrophobicContact CE-CZ 3.8Å; M611-Y691 HydrophobicContact CE-CD1 4.45Å; M611-Y691 HydrophobicContact CE-CE1 4.48Å; M611-Y691 HydrophobicContact SD-CD1 4.27Å; M611-Y691 HydrophobicContact SD-CE1 3.77Å; M611-L723 HydrophobicContact CE-CD1 4.4Å; M611-L723 HydrophobicContact CE-CD2 3.93Å; M611-L723 HydrophobicContact CG-CD2 3.83Å; M611-L723 HydrophobicContact SD-CD1 4.23Å; M611-L723 HydrophobicContact SD-CD2 3.74Å; M611-V727 HydrophobicContact CB-CG1 3.78Å; M611-V727 HydrophobicContact CG-CG1 3.98Å; M611-I728 HydrophobicContact CE-CD1 4.4Å; M611-I728 HydrophobicContact CE-CG1 4.11Å; M611-L731 HydrophobicContact CB-CD1 3.72Å
612	R	94.5	Very high	94	Very high	25 Å²	25	30.4 Å²	30.4	9%	0.094	14%	0.144	C	C	.	.	H	α-helix	trans	-58.6	-54	175.5	-178.6	-178.3	-71.8	113.3	2.9	111.6	D452 R608 K609 V614 Y615 F616 L731 E734	D452-R612 IonicContact OD1-NH2 2.66Å; D452-R612 PolarHBondContact OD1-NH2 3.42Å; D452-R612 IonicContact OD2-CZ 3.29Å; D452-R612 VanDerWaalsContact OD2-CZ 3.3Å; D452-R612 IonicContact OD2-NH1 3.07Å; D452-R612 PolarHBondContact OD2-NH1 3.28Å; D452-R612 IonicContact OD2-NH2 3.88Å; D452-R612 PolarHBondContact OD2-NH2 2.96Å; R608-R612 VanDerWaalsContact O-CB 3.3Å; R608-R612 WeakPolarHBondContact O-CB 3.35Å; R608-R612 PolarHBondContact O-N 3.19Å; K609-R612 WeakPolarHBondContact O-CB 3.38Å; K609-R612 PolarHBondContact O-N 3.26Å; R612-V614 PolarHBondContact O-N 3.47Å; R612-Y615 PolarHBondContact O-N 3.39Å; R612-F616 HydrophobicContact CG-CD1 4.34Å; R612-F616 HydrophobicContact CG-CE1 4.15Å; R612-F616 HydrophobicContact CG-CZ 4.3Å; R612-F616 WeakPolarHBondContact O-CB 3.05Å; R612-F616 VanDerWaalsContact O-CD1 3.31Å; R612-F616 WeakPolarHBondContact O-CD1 3.5Å; R612-F616 PolarHBondContact O-N 2.79Å; R612-L731 HydrophobicContact CB-CD1 4.47Å; R612-L731 HydrophobicContact CB-CD2 3.64Å; R612-L731 HydrophobicContact CG-CD2 3.93Å; R612-E734 VanDerWaalsContact CD-OE1 3.23Å; R612-E734 WeakPolarHBondContact CD-OE1 3.42Å; R612-E734 IonicContact CZ-OE1 2.66Å; R612-E734 IonicContact CZ-OE2 2.69Å; R612-E734 VanDerWaalsContact NE-CD 3.31Å; R612-E734 IonicContact NE-OE1 2.66Å; R612-E734 PolarHBondContact NE-OE1 3.08Å; R612-E734 IonicContact NE-OE2 3.8Å; R612-E734 PolarHBondContact NE-OE2 3.23Å; R612-E734 VanDerWaalsContact NE-OE2 3.13Å; R612-E734 IonicContact NH2-OE1 3.91Å; R612-E734 IonicContact NH2-OE2 3.18Å; R612-E734 PolarHBondContact NH2-OE2 3.35Å
613	E	91.4	Very high	94.1	Very high	122 Å²	122	30.4 Å²	30.4	57%	0.57	14%	0.144	S	C	*	.	H	α-helix	trans	-60.2	-44.1	-179	-70.6	176	-166.4	0	0	112	K609 T610	K609-E613 WeakPolarHBondContact CE-OE1 3.49Å; K609-E613 WeakPolarHBondContact O-CG 3.2Å; K609-E613 PolarHBondContact O-N 2.84Å; T610-E613 PolarHBondContact O-N 3.47Å
614	V	92.5	Very high	94.1	Very high	24 Å²	24	35.5 Å²	35.5	15%	0.145	16%	0.163	C	C	.	.	H	α-helix	trans	-76.2	-36.3	-179.8	-177	0	0	0	0	112.3	T610 R612 R618 F678 Y691	T610-V614 WeakPolarHBondContact O-CG2 3.32Å; T610-V614 PolarHBondContact O-N 2.93Å; T610-V614 VanDerWaalsContact O-N 3.11Å; R612-V614 PolarHBondContact O-N 3.47Å; V614-R618 WeakPolarHBondContact O-CB 3.44Å; V614-R618 WeakPolarHBondContact O-CG 3.4Å; V614-R618 PolarHBondContact O-N 2.63Å; V614-F678 HydrophobicContact CG1-CE2 3.92Å; V614-Y691 HydrophobicContact CG1-CD2 4.29Å; V614-Y691 HydrophobicContact CG1-CE1 4.28Å; V614-Y691 HydrophobicContact CG1-CE2 4.03Å
615	Y	94.2	Very high	94	Very high	0 Å²	0	36 Å²	36	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-69	-47.9	179.2	-171.7	-111.4	0	0	0	111.1	M611 R612 D617 R618 A619 L675 F678 I728 L731 I732 L735	M611-Y615 WeakPolarHBondContact O-CB 3.43Å; M611-Y615 PolarHBondContact O-N 3.26Å; R612-Y615 PolarHBondContact O-N 3.39Å; Y615-D617 VanDerWaalsContact C-N 3.33Å; Y615-D617 PolarHBondContact O-N 3.12Å; Y615-R618 CarbonylContact O-C 3.21Å; Y615-R618 PolarHBondContact O-N 2.7Å; Y615-A619 HydrophobicContact CD1-CB 4.41Å; Y615-A619 HydrophobicContact CE1-CB 4.12Å; Y615-A619 WeakPolarHBondContact O-CA 3.41Å; Y615-A619 VanDerWaalsContact O-CB 3.24Å; Y615-A619 WeakPolarHBondContact O-CB 3.5Å; Y615-A619 PolarHBondContact O-N 3.26Å; Y615-L675 VanDerWaalsContact CE2-O 3.32Å; Y615-L675 WeakPolarHBondContact CE2-O 3.45Å; Y615-L675 PolarHBondContact OH-O 2.82Å; Y615-F678 AromaticContact CD2-CD1 3.53Å; Y615-F678 HydrophobicContact CD2-CD1 3.53Å; Y615-F678 AromaticContact CD2-CE1 3.6Å; Y615-F678 HydrophobicContact CD2-CE1 3.6Å; Y615-F678 HydrophobicContact CD2-CG 4.03Å; Y615-F678 HydrophobicContact CD2-CZ 4.13Å; Y615-F678 AromaticContact CE2-CD1 3.76Å; Y615-F678 HydrophobicContact CE2-CD1 3.76Å; Y615-F678 HydrophobicContact CE2-CE1 4.16Å; Y615-F678 HydrophobicContact CE2-CG 4.34Å; Y615-I728 HydrophobicContact CE2-CG2 4.46Å; Y615-L731 HydrophobicContact CD1-CB 4.17Å; Y615-I732 HydrophobicContact CE1-CG1 3.8Å; Y615-I732 WeakPolarHBondContact OH-CG1 3.43Å; Y615-L735 HydrophobicContact CD1-CD2 4.24Å; Y615-L735 HydrophobicContact CE1-CD2 3.77Å
616	F	93.9	Very high	94	Very high	28 Å²	28	37 Å²	37	12%	0.123	17%	0.172	C	C	.	.	H	α-helix	trans	-64.9	-35.7	-175	-78.2	36.8	0	0	0	112.3	V327 R612 R618 L731 E734 L735	V327-F616 HydrophobicContact CG1-CB 4.32Å; V327-F616 HydrophobicContact CG2-CD2 3.92Å; R612-F616 HydrophobicContact CG-CD1 4.34Å; R612-F616 HydrophobicContact CG-CE1 4.15Å; R612-F616 HydrophobicContact CG-CZ 4.3Å; R612-F616 WeakPolarHBondContact O-CB 3.05Å; R612-F616 VanDerWaalsContact O-CD1 3.31Å; R612-F616 WeakPolarHBondContact O-CD1 3.5Å; R612-F616 PolarHBondContact O-N 2.79Å; F616-R618 VanDerWaalsContact C-N 3.3Å; F616-R618 PolarHBondContact O-N 3.39Å; F616-L731 HydrophobicContact CE1-CB 4.34Å; F616-L731 HydrophobicContact CE1-CD2 4.15Å; F616-E734 HydrophobicContact CZ-CB 4.15Å; F616-E734 HydrophobicContact CZ-CG 4.15Å; F616-E734 WeakPolarHBondContact CZ-OE1 3.25Å; F616-L735 HydrophobicContact CD1-CB 4.37Å; F616-L735 HydrophobicContact CD1-CD1 4.17Å; F616-L735 HydrophobicContact CD2-CD1 3.85Å; F616-L735 HydrophobicContact CE1-CB 3.82Å; F616-L735 HydrophobicContact CE1-CD1 4.31Å; F616-L735 HydrophobicContact CE2-CB 4.41Å; F616-L735 HydrophobicContact CE2-CD1 4.01Å; F616-L735 HydrophobicContact CG-CD1 3.93Å; F616-L735 HydrophobicContact CZ-CB 3.85Å; F616-L735 HydrophobicContact CZ-CD1 4.24Å
617	D	90.5	Very high	93.8	Very high	119 Å²	119	43.6 Å²	43.6	64%	0.636	20%	0.199	S	C	*	.	H	α-helix	trans	-65.5	-29.6	174.1	177.7	67.3	0	0	0	113.1	Y615	Y615-D617 VanDerWaalsContact C-N 3.33Å; Y615-D617 PolarHBondContact O-N 3.12Å
618	R	91.2	Very high	93.5	Very high	59 Å²	59	47.8 Å²	47.8	22%	0.223	22%	0.222	C	C	.	.	H	α-helix	trans	-114.7	-4.3	-170.4	-57.5	-176.6	-169.1	-175.3	6.9	114.4	V614 Y615 F616 F678 E679 G680 N681	V614-R618 WeakPolarHBondContact O-CB 3.44Å; V614-R618 WeakPolarHBondContact O-CG 3.4Å; V614-R618 PolarHBondContact O-N 2.63Å; Y615-R618 CarbonylContact O-C 3.21Å; Y615-R618 PolarHBondContact O-N 2.7Å; F616-R618 VanDerWaalsContact C-N 3.3Å; F616-R618 PolarHBondContact O-N 3.39Å; R618-F678 HydrophobicContact CB-CD2 4.23Å; R618-E679 VanDerWaalsContact CD-O 3.25Å; R618-E679 WeakPolarHBondContact CD-O 3.25Å; R618-E679 PolarHBondContact NH1-O 2.75Å; R618-G680 PolarHBondContact NH1-O 3.13Å; R618-N681 PolarHBondContact NH1-OD1 3.42Å; R618-N681 PolarHBondContact NH2-OD1 3.39Å
619	A	93.2	Very high	93.3	Very high	2 Å²	2	47.3 Å²	47.3	2%	0.017	22%	0.22	C	C	.	.			trans	-59.9	139.5	-175.8	0	0	0	0	0	110.9	Y615 V650 L735	Y615-A619 HydrophobicContact CD1-CB 4.41Å; Y615-A619 HydrophobicContact CE1-CB 4.12Å; Y615-A619 WeakPolarHBondContact O-CA 3.41Å; Y615-A619 VanDerWaalsContact O-CB 3.24Å; Y615-A619 WeakPolarHBondContact O-CB 3.5Å; Y615-A619 PolarHBondContact O-N 3.26Å; A619-V650 HydrophobicContact CB-CB 4.29Å; A619-V650 HydrophobicContact CB-CG2 3.75Å; A619-V650 WeakPolarHBondContact O-CG2 3.49Å; A619-V650 PolarHBondContact O-N 3.38Å; A619-L735 HydrophobicContact CB-CD2 3.49Å; A619-L735 VanDerWaalsContact CB-CD2 3.49Å
620	R	94.2	Very high	93	Very high	64 Å²	64	46.9 Å²	46.9	24%	0.242	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	141.2	-177.7	-75.2	173.8	-176.6	172.8	6.4	110.1	K647 K648 L675 E679	R620-K647 WeakPolarHBondContact CD-O 3.46Å; R620-K648 CarbonylContact C-O 3.57Å; R620-K648 WeakPolarHBondContact CA-O 3.34Å; R620-L675 HydrophobicContact CB-CD1 4Å; R620-L675 PolarHBondContact O-N 2.78Å; R620-E679 IonicContact CZ-OE1 3.24Å; R620-E679 IonicContact CZ-OE2 2.7Å; R620-E679 IonicContact NH1-OE1 2.72Å; R620-E679 PolarHBondContact NH1-OE1 2.94Å; R620-E679 IonicContact NH1-OE2 3.68Å; R620-E679 IonicContact NH2-OE1 2.88Å; R620-E679 PolarHBondContact NH2-OE1 3.24Å; R620-E679 IonicContact NH2-OE2 2.81Å; R620-E679 PolarHBondContact NH2-OE2 3.26Å
621	I	94.8	Very high	92.7	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	146	177.7	77.5	174.3	0	0	0	111.1	I623 K647 K648 V650 L653 L661 T673 F674	I621-I623 HydrophobicContact CD1-CD1 3.72Å; I621-I623 HydrophobicContact CD1-CG1 3.96Å; I621-I623 HydrophobicContact CG1-CD1 4.41Å; I621-I623 HydrophobicContact CG1-CG1 4.39Å; I621-K647 PolarHBondContact O-N 2.7Å; I621-K647 VanDerWaalsContact O-N 3.16Å; I621-K648 HydrophobicContact CG1-CB 4.25Å; I621-K648 PolarHBondContact N-O 2.78Å; I621-K648 PolarHBondContact O-N 3.5Å; I621-K648 VanDerWaalsContact O-N 3.07Å; I621-V650 HydrophobicContact CG2-CG2 3.77Å; I621-L653 HydrophobicContact CD1-CD1 4.45Å; I621-L653 HydrophobicContact CD1-CD2 4.05Å; I621-L661 HydrophobicContact CD1-CD1 4.4Å; I621-T673 CarbonylContact C-O 3.6Å; I621-T673 WeakPolarHBondContact CA-O 3.05Å; I621-F674 HydrophobicContact CG2-CD1 3.75Å; I621-F674 HydrophobicContact CG2-CE1 3.64Å; I621-F674 HydrophobicContact CG2-CG 4.35Å; I621-F674 HydrophobicContact CG2-CZ 4.16Å
622	N	95.5	Very high	92.5	Very high	34 Å²	34	57.2 Å²	57.2	18%	0.182	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	147	156.3	-64.7	-22.6	0	0	0	108.5	V645 A646 K647 T673	N622-V645 CarbonylContact C-O 3.49Å; N622-V645 VanDerWaalsContact CA-O 3.31Å; N622-V645 WeakPolarHBondContact CA-O 3.45Å; N622-A646 WeakPolarHBondContact OD1-CA 3.39Å; N622-K647 PolarHBondContact OD1-N 3.04Å; N622-T673 PolarHBondContact N-O 3.18Å; N622-T673 PolarHBondContact O-N 3.24Å
623	I	95.8	Very high	92.2	Very high	0 Å²	0	56.1 Å²	56.1	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	126.9	170.4	-59.9	156.3	0	0	0	107	I621 M642 Y644 V645 L661 L670 E671	I621-I623 HydrophobicContact CD1-CD1 3.72Å; I621-I623 HydrophobicContact CD1-CG1 3.96Å; I621-I623 HydrophobicContact CG1-CD1 4.41Å; I621-I623 HydrophobicContact CG1-CG1 4.39Å; I623-M642 HydrophobicContact CD1-CB 4.26Å; I623-M642 WeakPolarHBondContact CG2-O 3.27Å; I623-Y644 WeakPolarHBondContact O-CA 3.46Å; I623-V645 HydrophobicContact CB-CB 4.09Å; I623-V645 HydrophobicContact CD1-CB 3.98Å; I623-V645 HydrophobicContact CD1-CG1 4.34Å; I623-V645 HydrophobicContact CD1-CG2 4.27Å; I623-V645 HydrophobicContact CG1-CB 4.36Å; I623-V645 PolarHBondContact N-O 3.13Å; I623-V645 PolarHBondContact O-N 2.97Å; I623-L661 HydrophobicContact CD1-CD1 3.71Å; I623-L661 HydrophobicContact CD1-CD2 3.56Å; I623-L661 HydrophobicContact CD1-CG 4.28Å; I623-L661 HydrophobicContact CG1-CD2 4.28Å; I623-L661 HydrophobicContact CG2-CD2 4.32Å; I623-L670 HydrophobicContact CG2-CB 4.25Å; I623-L670 HydrophobicContact CG2-CD1 3.75Å; I623-L670 HydrophobicContact CG2-CD2 3.92Å; I623-L670 HydrophobicContact CG2-CG 4.19Å; I623-E671 WeakPolarHBondContact CA-O 3.3Å
624	R	94.3	Very high	91.9	Very high	121 Å²	121	53.7 Å²	53.7	46%	0.457	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	150.7	175	-76.7	-178.9	162.5	177.7	-9.2	111	L670 E671 T1309	R624-L670 CarbonylContact O-C 3.24Å; R624-L670 WeakPolarHBondContact O-CA 3.49Å; R624-E671 PolarHBondContact N-O 2.92Å; R624-E671 PolarHBondContact O-N 2.78Å; R624-T1309 PolarHBondContact NH2-OG1 3.26Å
625	P	94.7	Very high	91.3	Very high	13 Å²	13	53.7 Å²	53.7	8%	0.084	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	136.2	177.6	33.1	-27.6	0	0	0	111	M630 K643 Y644 L669 L670	P625-M630 HydrophobicContact CB-CG 4.05Å; P625-M630 HydrophobicContact CG-CG 3.81Å; P625-K643 HydrophobicContact CB-CG 4.02Å; P625-K643 VanDerWaalsContact CD-O 3.27Å; P625-K643 WeakPolarHBondContact CD-O 3.2Å; P625-K643 HydrophobicContact CG-CG 4.18Å; P625-Y644 VanDerWaalsContact CD-CE1 3.41Å; P625-Y644 HydrophobicContact CG-CD1 4.04Å; P625-Y644 HydrophobicContact CG-CD2 4.32Å; P625-Y644 HydrophobicContact CG-CE1 3.49Å; P625-Y644 VanDerWaalsContact CG-CE1 3.49Å; P625-Y644 HydrophobicContact CG-CE2 3.82Å; P625-Y644 HydrophobicContact CG-CG 4.43Å; P625-L669 WeakPolarHBondContact CA-O 3.38Å; P625-L670 HydrophobicContact CB-CD2 4.16Å
626	T	93.7	Very high	90.5	Very high	36 Å²	36	56.9 Å²	56.9	22%	0.221	28%	0.28	C	S	.	.			trans	-66.8	176.3	169.7	74.9	0	0	0	0	110.7	N628 G629 M630 K668 L669	T626-N628 PolarHBondContact O-N 3.32Å; T626-N628 PolarHBondContact OG1-N 2.73Å; T626-N628 VanDerWaalsContact OG1-N 3.11Å; T626-G629 PolarHBondContact O-N 3.49Å; T626-G629 PolarHBondContact OG1-N 3.43Å; T626-G629 VanDerWaalsContact OG1-N 3.12Å; T626-M630 WeakPolarHBondContact O-CB 2.97Å; T626-M630 WeakPolarHBondContact O-CG 3.28Å; T626-M630 PolarHBondContact O-N 2.98Å; T626-K668 WeakPolarHBondContact CB-O 3.17Å; T626-K668 VanDerWaalsContact CG2-O 3.29Å; T626-K668 WeakPolarHBondContact CG2-O 3.09Å; T626-K668 PolarHBondContact OG1-O 2.97Å; T626-L669 PolarHBondContact N-O 2.82Å; T626-L669 PolarHBondContact OG1-O 2.84Å
627	K	90	Very high	90.1	Very high	178 Å²	178	56.8 Å²	56.8	77%	0.774	28%	0.283	S	S	*	.	H	α-helix	trans	-54.8	-32.2	170.3	-66.9	173.1	-175.8	168	0	112.6	M630	K627-M630 HydrophobicContact CG-CE 4.41Å
628	N	90.9	Very high	89.9	Confident	90 Å²	90	55.3 Å²	55.3	48%	0.481	28%	0.28	S	S	.	.	H	α-helix	trans	-80.5	-49.2	178.6	-65.6	-0	0	0	0	110.8	T626 M630 V631 L632 L669	T626-N628 PolarHBondContact O-N 3.32Å; T626-N628 PolarHBondContact OG1-N 2.73Å; T626-N628 VanDerWaalsContact OG1-N 3.11Å; N628-M630 VanDerWaalsContact C-N 3.27Å; N628-M630 PolarHBondContact O-N 3.41Å; N628-V631 WeakPolarHBondContact O-CA 3.28Å; N628-V631 PolarHBondContact O-N 3.11Å; N628-L632 HydrophobicContact CB-CD1 4.47Å; N628-L632 PolarHBondContact O-N 3.3Å; N628-L669 HydrophobicContact CB-CD2 4.1Å
629	G	90.6	Very high	89.9	Confident	0 Å²	0	52.7 Å²	52.7	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-66	-26.5	179.3	0	0	0	0	0	114	T626 V631 I633 K643 L669	T626-G629 PolarHBondContact O-N 3.49Å; T626-G629 PolarHBondContact OG1-N 3.43Å; T626-G629 VanDerWaalsContact OG1-N 3.12Å; G629-V631 PolarHBondContact O-N 3.03Å; G629-I633 VanDerWaalsContact O-CB 3.28Å; G629-I633 WeakPolarHBondContact O-CB 3.44Å; G629-I633 WeakPolarHBondContact O-CG1 3.45Å; G629-I633 PolarHBondContact O-N 3.06Å; G629-K643 WeakPolarHBondContact O-CE 3.42Å; G629-K643 PolarHBondContact O-NZ 3.3Å; G629-L669 VanDerWaalsContact CA-O 3.28Å; G629-L669 WeakPolarHBondContact CA-O 3.42Å
630	M	89.2	Confident	89.7	Confident	56 Å²	56	54 Å²	54	28%	0.276	28%	0.275	S	S	.	.	H	α-helix	trans	-54.5	-38.4	168	-85.9	-163.8	-77	0	0	111.9	P625 T626 K627 N628 K643 D1313 V1317	P625-M630 HydrophobicContact CB-CG 4.05Å; P625-M630 HydrophobicContact CG-CG 3.81Å; T626-M630 WeakPolarHBondContact O-CB 2.97Å; T626-M630 WeakPolarHBondContact O-CG 3.28Å; T626-M630 PolarHBondContact O-N 2.98Å; K627-M630 HydrophobicContact CG-CE 4.41Å; N628-M630 VanDerWaalsContact C-N 3.27Å; N628-M630 PolarHBondContact O-N 3.41Å; M630-K643 PolarHBondContact O-NZ 3.47Å; M630-D1313 HydrophobicContact SD-CB 4.18Å; M630-V1317 HydrophobicContact CE-CG2 4.41Å; M630-V1317 HydrophobicContact SD-CG2 4.08Å
631	V	87.4	Confident	89.4	Confident	118 Å²	118	52.4 Å²	52.4	72%	0.715	27%	0.273	S	S	*	.	H	α-helix	trans	-88.2	-45.5	-179.9	-178.1	0	0	0	0	112.6	N628 G629	N628-V631 WeakPolarHBondContact O-CA 3.28Å; N628-V631 PolarHBondContact O-N 3.11Å; G629-V631 PolarHBondContact O-N 3.03Å
632	L	89.8	Confident	89.2	Confident	112 Å²	112	52.7 Å²	52.7	59%	0.586	28%	0.275	S	S	*	.	H	α-helix	trans	-88.3	-26.8	-167.9	-64.2	174.5	0	0	0	114.7	N628 D634 L669	N628-L632 HydrophobicContact CB-CD1 4.47Å; N628-L632 PolarHBondContact O-N 3.3Å; L632-D634 PolarHBondContact O-N 2.8Å; L632-L669 HydrophobicContact CB-CD2 4.15Å; L632-L669 HydrophobicContact CD1-CD2 3.75Å
633	I	89.4	Confident	89.1	Confident	3 Å²	3	52 Å²	52	2%	0.015	27%	0.27	C	S	.	.			trans	-77.6	89.8	176.9	-56.7	168.2	0	0	0	108.6	G629 V639 Y640 K643 L669 L670	G629-I633 VanDerWaalsContact O-CB 3.28Å; G629-I633 WeakPolarHBondContact O-CB 3.44Å; G629-I633 WeakPolarHBondContact O-CG1 3.45Å; G629-I633 PolarHBondContact O-N 3.06Å; I633-V639 HydrophobicContact CD1-CG2 4.13Å; I633-V639 HydrophobicContact CG1-CG2 4.32Å; I633-V639 HydrophobicContact CG2-CG2 4.14Å; I633-Y640 HydrophobicContact CG2-CD2 4.44Å; I633-K643 HydrophobicContact CB-CD 3.92Å; I633-K643 HydrophobicContact CB-CG 4.4Å; I633-K643 HydrophobicContact CD1-CG 4.23Å; I633-K643 HydrophobicContact CG2-CB 4.29Å; I633-K643 HydrophobicContact CG2-CD 3.79Å; I633-K643 HydrophobicContact CG2-CG 4.12Å; I633-K643 PolarHBondContact O-NZ 2.91Å; I633-L669 HydrophobicContact CD1-CB 4.02Å; I633-L669 HydrophobicContact CG1-CB 4.21Å; I633-L669 HydrophobicContact CG1-CD1 4.37Å; I633-L670 HydrophobicContact CD1-CD1 4.45Å; I633-L670 HydrophobicContact CD1-CD2 3.38Å; I633-L670 HydrophobicContact CD1-CG 3.76Å
634	D	84.3	Confident	89	Confident	71 Å²	71	52.2 Å²	52.2	38%	0.38	27%	0.271	S	S	.	.			trans	-88.5	-172	174.4	90.4	-34.3	0	0	0	111.9	L632 N636 S637 Y640	L632-D634 PolarHBondContact O-N 2.8Å; D634-N636 VanDerWaalsContact C-N 3.27Å; D634-N636 PolarHBondContact O-N 2.73Å; D634-N636 WeakPolarHBondContact OD1-CA 3.39Å; D634-N636 WeakPolarHBondContact OD1-CB 3.29Å; D634-N636 PolarHBondContact OD1-N 2.92Å; D634-N636 PolarHBondContact OD2-N 3.48Å; D634-N636 PolarHBondContact OD2-ND2 3.37Å; D634-S637 PolarHBondContact O-N 3.02Å; D634-S637 PolarHBondContact OD1-N 3.42Å; D634-Y640 VanDerWaalsContact C-CD2 3.47Å; D634-Y640 VanDerWaalsContact O-CB 3.25Å; D634-Y640 WeakPolarHBondContact O-CB 3.39Å; D634-Y640 WeakPolarHBondContact O-CD2 3.36Å; D634-Y640 VanDerWaalsContact O-CG 3.28Å
635	E	79.5	Confident	88.9	Confident	24 Å²	24	46.6 Å²	46.6	11%	0.112	25%	0.25	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.1	-8.1	179.7	64.7	-174.5	-119.7	0	0	115.6	Y640 R1270 R1298	E635-Y640 HydrophobicContact CB-CD1 4.49Å; E635-Y640 HydrophobicContact CB-CE1 4.28Å; E635-R1270 IonicContact OE1-CZ 2.73Å; E635-R1270 IonicContact OE1-NH1 3.23Å; E635-R1270 PolarHBondContact OE1-NH1 3.36Å; E635-R1270 IonicContact OE1-NH2 3.46Å; E635-R1270 PolarHBondContact OE1-NH2 3.22Å; E635-R1270 IonicContact OE2-NH2 2.63Å; E635-R1298 IonicContact OE2-CZ 3.45Å; E635-R1298 IonicContact OE2-NH1 2.67Å; E635-R1298 PolarHBondContact OE2-NH1 2.97Å; E635-R1298 IonicContact OE2-NH2 2.79Å; E635-R1298 PolarHBondContact OE2-NH2 3.01Å
636	N	78.5	Confident	88.8	Confident	66 Å²	66	47.5 Å²	47.5	35%	0.353	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.3	-21.2	174.5	-61.6	-78.7	0	0	0	112.1	D634 K1167	D634-N636 VanDerWaalsContact C-N 3.27Å; D634-N636 PolarHBondContact O-N 2.73Å; D634-N636 WeakPolarHBondContact OD1-CA 3.39Å; D634-N636 WeakPolarHBondContact OD1-CB 3.29Å; D634-N636 PolarHBondContact OD1-N 2.92Å; D634-N636 PolarHBondContact OD2-N 3.48Å; D634-N636 PolarHBondContact OD2-ND2 3.37Å; N636-K1167 WeakPolarHBondContact OD1-CE 3.37Å
637	S	85.6	Confident	88.8	Confident	26 Å²	26	51.5 Å²	51.5	18%	0.182	27%	0.273	C	S	.	.	S	Bend	trans	-60.7	132.2	176.9	-178.7	0	0	0	0	112.1	D634 V639 Y640	D634-S637 PolarHBondContact O-N 3.02Å; D634-S637 PolarHBondContact OD1-N 3.42Å; S637-V639 PolarHBondContact O-N 2.84Å; S637-V639 VanDerWaalsContact O-N 3.1Å; S637-V639 WeakPolarHBondContact OG-CG2 3.49Å; S637-Y640 VanDerWaalsContact O-CB 3.25Å; S637-Y640 WeakPolarHBondContact O-CB 3.42Å; S637-Y640 PolarHBondContact O-N 3.29Å
638	P	85	Confident	88.9	Confident	89 Å²	89	43.2 Å²	43.2	58%	0.578	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.2	-17.6	-176.6	26.9	-35.6	0	0	0	113.8	K660	P638-K660 HydrophobicContact CB-CD 4.35Å
639	V	90.6	Very high	89.1	Confident	3 Å²	3	40 Å²	40	2%	0.018	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.1	4.5	176.6	-63.1	0	0	0	0	113.7	I633 S637 S641 M642 K643 K660 L661 A664 L670	I633-V639 HydrophobicContact CD1-CG2 4.13Å; I633-V639 HydrophobicContact CG1-CG2 4.32Å; I633-V639 HydrophobicContact CG2-CG2 4.14Å; S637-V639 PolarHBondContact O-N 2.84Å; S637-V639 VanDerWaalsContact O-N 3.1Å; S637-V639 WeakPolarHBondContact OG-CG2 3.49Å; V639-S641 VanDerWaalsContact C-N 3.3Å; V639-S641 PolarHBondContact O-N 3.48Å; V639-M642 HydrophobicContact CG1-CE 4.29Å; V639-M642 CarbonylContact O-C 3.57Å; V639-M642 WeakPolarHBondContact O-CA 3.48Å; V639-M642 PolarHBondContact O-N 2.86Å; V639-K643 PolarHBondContact O-N 3.08Å; V639-K660 HydrophobicContact CG1-CB 4.2Å; V639-K660 WeakPolarHBondContact CG1-O 3.11Å; V639-L661 HydrophobicContact CG1-CD2 4.13Å; V639-A664 HydrophobicContact CG1-CB 4.2Å; V639-A664 HydrophobicContact CG2-CB 4.03Å; V639-L670 HydrophobicContact CB-CD1 3.91Å; V639-L670 HydrophobicContact CG1-CD1 4.28Å; V639-L670 HydrophobicContact CG2-CD1 3.86Å
640	Y	89.1	Confident	89.2	Confident	30 Å²	30	40 Å²	40	12%	0.118	22%	0.221	C	C	.	.	G	3₁₀ helix	trans	-54.4	-42.6	-179.4	179	-108.5	0	0	0	113.8	I633 D634 E635 S637 M642 K643 R1298 P1299	I633-Y640 HydrophobicContact CG2-CD2 4.44Å; D634-Y640 VanDerWaalsContact C-CD2 3.47Å; D634-Y640 VanDerWaalsContact O-CB 3.25Å; D634-Y640 WeakPolarHBondContact O-CB 3.39Å; D634-Y640 WeakPolarHBondContact O-CD2 3.36Å; D634-Y640 VanDerWaalsContact O-CG 3.28Å; E635-Y640 HydrophobicContact CB-CD1 4.49Å; E635-Y640 HydrophobicContact CB-CE1 4.28Å; S637-Y640 VanDerWaalsContact O-CB 3.25Å; S637-Y640 WeakPolarHBondContact O-CB 3.42Å; S637-Y640 PolarHBondContact O-N 3.29Å; Y640-M642 PolarHBondContact O-N 3.31Å; Y640-K643 WeakPolarHBondContact O-CB 3.2Å; Y640-K643 PolarHBondContact O-N 2.97Å; Y640-R1298 PolarHBondContact OH-NH1 2.93Å; Y640-R1298 VanDerWaalsContact OH-NH1 3.08Å; Y640-P1299 HydrophobicContact CD1-CB 4.45Å; Y640-P1299 HydrophobicContact CD1-CG 4.42Å
641	S	89.2	Confident	89.3	Confident	30 Å²	30	40 Å²	40	21%	0.21	23%	0.227	C	C	.	.	G	3₁₀ helix	trans	-64.8	-19.3	176.9	51.7	0	0	0	0	113.3	V639 R1300 D1302 Y1305	V639-S641 VanDerWaalsContact C-N 3.3Å; V639-S641 PolarHBondContact O-N 3.48Å; S641-R1300 WeakPolarHBondContact CB-O 3.38Å; S641-D1302 WeakPolarHBondContact O-CB 3.5Å; S641-D1302 PolarHBondContact O-N 3.28Å; S641-Y1305 VanDerWaalsContact O-CD2 3.27Å; S641-Y1305 WeakPolarHBondContact O-CD2 3.47Å
642	M	90.7	Very high	89.5	Confident	6 Å²	6	37.8 Å²	37.8	3%	0.03	21%	0.211	C	C	.	.	G	3₁₀ helix	trans	-113.6	6	-177.4	-59.8	-175	-69.2	0	0	113.2	I623 V639 Y640 Y644 V645 Q657 L661 D1302	I623-M642 HydrophobicContact CD1-CB 4.26Å; I623-M642 WeakPolarHBondContact CG2-O 3.27Å; V639-M642 HydrophobicContact CG1-CE 4.29Å; V639-M642 CarbonylContact O-C 3.57Å; V639-M642 WeakPolarHBondContact O-CA 3.48Å; V639-M642 PolarHBondContact O-N 2.86Å; Y640-M642 PolarHBondContact O-N 3.31Å; M642-Y644 VanDerWaalsContact C-N 3.26Å; M642-Y644 PolarHBondContact O-N 3.1Å; M642-Y644 VanDerWaalsContact O-N 3.12Å; M642-V645 HydrophobicContact CB-CG2 4.07Å; M642-V645 WeakPolarHBondContact O-CG2 3.45Å; M642-Q657 HydrophobicContact CE-CB 4.46Å; M642-Q657 HydrophobicContact CE-CG 4.32Å; M642-Q657 HydrophobicContact SD-CG 4.4Å; M642-L661 HydrophobicContact CB-CD2 4.19Å; M642-L661 HydrophobicContact CE-CD1 4.24Å; M642-L661 HydrophobicContact CE-CD2 3.86Å; M642-L661 HydrophobicContact CE-CG 3.91Å; M642-L661 HydrophobicContact SD-CD1 4.14Å; M642-L661 HydrophobicContact SD-CD2 4.31Å; M642-L661 HydrophobicContact SD-CG 4.42Å; M642-D1302 HydrophobicContact CG-CB 4.41Å
643	K	92.5	Very high	89.6	Confident	19 Å²	19	32.6 Å²	32.6	8%	0.083	18%	0.183	C	C	.	.	S	Bend	trans	-54.6	-33.5	-172.8	-172.8	176	-172.7	166.4	0	115	P625 G629 M630 I633 V639 Y640 Y1305	P625-K643 HydrophobicContact CB-CG 4.02Å; P625-K643 VanDerWaalsContact CD-O 3.27Å; P625-K643 WeakPolarHBondContact CD-O 3.2Å; P625-K643 HydrophobicContact CG-CG 4.18Å; G629-K643 WeakPolarHBondContact O-CE 3.42Å; G629-K643 PolarHBondContact O-NZ 3.3Å; M630-K643 PolarHBondContact O-NZ 3.47Å; I633-K643 HydrophobicContact CB-CD 3.92Å; I633-K643 HydrophobicContact CB-CG 4.4Å; I633-K643 HydrophobicContact CD1-CG 4.23Å; I633-K643 HydrophobicContact CG2-CB 4.29Å; I633-K643 HydrophobicContact CG2-CD 3.79Å; I633-K643 HydrophobicContact CG2-CG 4.12Å; I633-K643 PolarHBondContact O-NZ 2.91Å; V639-K643 PolarHBondContact O-N 3.08Å; Y640-K643 WeakPolarHBondContact O-CB 3.2Å; Y640-K643 PolarHBondContact O-N 2.97Å; K643-Y1305 HydrophobicContact CB-CE2 4.5Å
644	Y	93.4	Very high	89.6	Confident	6 Å²	6	34 Å²	34	2%	0.024	19%	0.189	C	C	.	.	S	Bend	trans	-132.8	100.1	170.8	-66.9	-92.5	0	0	0	107.6	I623 P625 M642 Y1305 D1306 T1309 E1310 D1313	I623-Y644 WeakPolarHBondContact O-CA 3.46Å; P625-Y644 VanDerWaalsContact CD-CE1 3.41Å; P625-Y644 HydrophobicContact CG-CD1 4.04Å; P625-Y644 HydrophobicContact CG-CD2 4.32Å; P625-Y644 HydrophobicContact CG-CE1 3.49Å; P625-Y644 VanDerWaalsContact CG-CE1 3.49Å; P625-Y644 HydrophobicContact CG-CE2 3.82Å; P625-Y644 HydrophobicContact CG-CG 4.43Å; M642-Y644 VanDerWaalsContact C-N 3.26Å; M642-Y644 PolarHBondContact O-N 3.1Å; M642-Y644 VanDerWaalsContact O-N 3.12Å; Y644-Y1305 HydrophobicContact CD2-CE1 4.3Å; Y644-Y1305 CarbonylContact O-C 3.39Å; Y644-Y1305 WeakPolarHBondContact O-CA 3.47Å; Y644-Y1305 VanDerWaalsContact O-CD2 3.3Å; Y644-Y1305 WeakPolarHBondContact O-CD2 3.42Å; Y644-Y1305 VanDerWaalsContact O-CG 3.27Å; Y644-D1306 PolarHBondContact O-N 3.35Å; Y644-T1309 HydrophobicContact CD1-CG2 3.84Å; Y644-T1309 HydrophobicContact CE1-CG2 3.94Å; Y644-E1310 HydrophobicContact CD1-CB 4.32Å; Y644-E1310 HydrophobicContact CD2-CB 3.74Å; Y644-E1310 HydrophobicContact CD2-CG 3.97Å; Y644-E1310 HydrophobicContact CE1-CB 4.32Å; Y644-E1310 HydrophobicContact CE2-CB 3.74Å; Y644-E1310 HydrophobicContact CE2-CG 3.63Å; Y644-E1310 HydrophobicContact CG-CB 4.03Å; Y644-D1313 HydrophobicContact CE1-CB 4.49Å
645	V	93.6	Very high	89.8	Confident	3 Å²	3	30.6 Å²	30.6	2%	0.018	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	137	176.8	166.7	0	0	0	0	108.9	N622 I623 M642 K648 D1302 Y1304	N622-V645 CarbonylContact C-O 3.49Å; N622-V645 VanDerWaalsContact CA-O 3.31Å; N622-V645 WeakPolarHBondContact CA-O 3.45Å; I623-V645 HydrophobicContact CB-CB 4.09Å; I623-V645 HydrophobicContact CD1-CB 3.98Å; I623-V645 HydrophobicContact CD1-CG1 4.34Å; I623-V645 HydrophobicContact CD1-CG2 4.27Å; I623-V645 HydrophobicContact CG1-CB 4.36Å; I623-V645 PolarHBondContact N-O 3.13Å; I623-V645 PolarHBondContact O-N 2.97Å; M642-V645 HydrophobicContact CB-CG2 4.07Å; M642-V645 WeakPolarHBondContact O-CG2 3.45Å; V645-K648 HydrophobicContact CG1-CB 3.4Å; V645-K648 VanDerWaalsContact CG1-CB 3.4Å; V645-K648 HydrophobicContact CG1-CD 4.13Å; V645-K648 HydrophobicContact CG1-CG 4.37Å; V645-D1302 HydrophobicContact CG2-CB 4.03Å; V645-Y1304 WeakPolarHBondContact CA-O 3.49Å
646	A	92.8	Very high	90.4	Very high	31 Å²	31	29.8 Å²	29.8	26%	0.256	17%	0.168	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	129.3	178.1	0	0	0	0	0	111.3	N622 K648 Y1304 D1306	N622-A646 WeakPolarHBondContact OD1-CA 3.39Å; A646-K648 VanDerWaalsContact C-N 3.26Å; A646-K648 PolarHBondContact O-N 2.7Å; A646-Y1304 PolarHBondContact N-O 3.08Å; A646-D1306 HydrophobicContact CB-CB 3.89Å
647	K	91.7	Very high	91	Very high	120 Å²	120	28.9 Å²	28.9	52%	0.522	16%	0.162	S	C	.	.	E	Extended strand (participates in β ladder)	trans	57.6	29.8	175.2	-48.4	-155.1	172.7	-160.4	0	114.8	R620 I621 N622 L675	R620-K647 WeakPolarHBondContact CD-O 3.46Å; I621-K647 PolarHBondContact O-N 2.7Å; I621-K647 VanDerWaalsContact O-N 3.16Å; N622-K647 PolarHBondContact OD1-N 3.04Å; K647-L675 HydrophobicContact CD-CD1 4.33Å; K647-L675 HydrophobicContact CG-CD1 4.02Å
648	K	93.4	Very high	91.5	Very high	4 Å²	4	27.9 Å²	27.9	2%	0.017	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.3	124.7	174.8	173.1	167.6	-179.4	173	0	109.8	R620 I621 V645 A646 V650 D652 D1302 Y1304	R620-K648 CarbonylContact C-O 3.57Å; R620-K648 WeakPolarHBondContact CA-O 3.34Å; I621-K648 HydrophobicContact CG1-CB 4.25Å; I621-K648 PolarHBondContact N-O 2.78Å; I621-K648 PolarHBondContact O-N 3.5Å; I621-K648 VanDerWaalsContact O-N 3.07Å; V645-K648 HydrophobicContact CG1-CB 3.4Å; V645-K648 VanDerWaalsContact CG1-CB 3.4Å; V645-K648 HydrophobicContact CG1-CD 4.13Å; V645-K648 HydrophobicContact CG1-CG 4.37Å; A646-K648 VanDerWaalsContact C-N 3.26Å; A646-K648 PolarHBondContact O-N 2.7Å; K648-V650 PolarHBondContact O-N 3.36Å; K648-D652 WeakPolarHBondContact CE-O 3.45Å; K648-D652 HydrophobicContact CG-CB 4.37Å; K648-D652 PolarHBondContact NZ-O 3.19Å; K648-D1302 IonicContact NZ-OD2 3.2Å; K648-D1302 PolarHBondContact NZ-OD2 2.79Å; K648-Y1304 HydrophobicContact CB-CD2 3.86Å; K648-Y1304 HydrophobicContact CB-CG 3.83Å; K648-Y1304 HydrophobicContact CD-CD2 4.18Å; K648-Y1304 HydrophobicContact CG-CD2 3.72Å; K648-Y1304 HydrophobicContact CG-CE2 4.28Å; K648-Y1304 HydrophobicContact CG-CG 4.23Å
649	P	93.9	Very high	91.9	Very high	22 Å²	22	23.8 Å²	23.8	14%	0.143	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-56.2	136.6	170.6	-23.6	34.8	0	0	0	110.8	S651 D652 Y1304	P649-S651 PolarHBondContact O-N 2.98Å; P649-D652 WeakPolarHBondContact CD-OD2 3.4Å; P649-D652 WeakPolarHBondContact CG-OD2 3.5Å; P649-D652 PolarHBondContact O-N 3.08Å; P649-Y1304 HydrophobicContact CG-CE1 4.37Å
650	V	93.3	Very high	92	Very high	1 Å²	1	25.5 Å²	25.5	1%	0.006	13%	0.134	C	C	.	.	G	3₁₀ helix	trans	-57.8	-32.7	175.7	165.5	0	0	0	0	111.4	V327 A619 I621 K648 D652 L653 F674 L735 L739	V327-V650 HydrophobicContact CG1-CG1 3.84Å; A619-V650 HydrophobicContact CB-CB 4.29Å; A619-V650 HydrophobicContact CB-CG2 3.75Å; A619-V650 WeakPolarHBondContact O-CG2 3.49Å; A619-V650 PolarHBondContact O-N 3.38Å; I621-V650 HydrophobicContact CG2-CG2 3.77Å; K648-V650 PolarHBondContact O-N 3.36Å; V650-D652 PolarHBondContact O-N 3.27Å; V650-L653 HydrophobicContact CG1-CD1 4.4Å; V650-L653 VanDerWaalsContact O-CB 3.29Å; V650-L653 WeakPolarHBondContact O-CB 3.12Å; V650-L653 WeakPolarHBondContact O-CG 3.37Å; V650-L653 PolarHBondContact O-N 3.41Å; V650-L653 VanDerWaalsContact O-N 3.08Å; V650-F674 HydrophobicContact CG2-CD1 4.42Å; V650-F674 HydrophobicContact CG2-CE1 4.07Å; V650-L735 HydrophobicContact CG1-CD1 4.31Å; V650-L735 HydrophobicContact CG2-CD2 4.38Å; V650-L739 HydrophobicContact CG1-CD1 3.54Å; V650-L739 HydrophobicContact CG1-CD2 3.39Å; V650-L739 HydrophobicContact CG1-CG 4Å; V650-L739 HydrophobicContact CG2-CD1 4.38Å
651	S	91.4	Very high	92.3	Very high	57 Å²	57	24 Å²	24	40%	0.399	13%	0.129	S	C	.	.	G	3₁₀ helix	trans	-67.4	-13.9	175.8	44	0	0	0	0	115.6	V327 P649	V327-S651 WeakPolarHBondContact O-CA 3.42Å; V327-S651 WeakPolarHBondContact O-CB 3.35Å; P649-S651 PolarHBondContact O-N 2.98Å
652	D	91.5	Very high	92.6	Very high	70 Å²	70	23.6 Å²	23.6	37%	0.374	12%	0.124	S	C	.	.	G	3₁₀ helix	trans	-93.7	6.3	171.6	-69.4	-42.8	0	0	0	113	K648 P649 V650 Y1304	K648-D652 WeakPolarHBondContact CE-O 3.45Å; K648-D652 HydrophobicContact CG-CB 4.37Å; K648-D652 PolarHBondContact NZ-O 3.19Å; P649-D652 WeakPolarHBondContact CD-OD2 3.4Å; P649-D652 WeakPolarHBondContact CG-OD2 3.5Å; P649-D652 PolarHBondContact O-N 3.08Å; V650-D652 PolarHBondContact O-N 3.27Å; D652-Y1304 HydrophobicContact CB-CE2 4.28Å; D652-Y1304 VanDerWaalsContact OD2-CE2 3.3Å; D652-Y1304 WeakPolarHBondContact OD2-CE2 3.43Å; D652-Y1304 PolarHBondContact OD2-OH 3.04Å
653	L	91.8	Very high	92.7	Very high	3 Å²	3	25.1 Å²	25.1	2%	0.016	13%	0.131	C	C	.	.			trans	-74.6	136.2	163.8	-65.2	171.3	0	0	0	109.2	S328 E329 I621 V650 F658 L661 L739	S328-L653 WeakPolarHBondContact CB-O 3.41Å; E329-L653 PolarHBondContact N-O 2.73Å; I621-L653 HydrophobicContact CD1-CD1 4.45Å; I621-L653 HydrophobicContact CD1-CD2 4.05Å; V650-L653 HydrophobicContact CG1-CD1 4.4Å; V650-L653 VanDerWaalsContact O-CB 3.29Å; V650-L653 WeakPolarHBondContact O-CB 3.12Å; V650-L653 WeakPolarHBondContact O-CG 3.37Å; V650-L653 PolarHBondContact O-N 3.41Å; V650-L653 VanDerWaalsContact O-N 3.08Å; L653-F658 HydrophobicContact CD1-CD2 3.88Å; L653-L661 HydrophobicContact CD2-CD1 4.17Å; L653-L739 HydrophobicContact CD1-CD1 4.32Å; L653-L739 HydrophobicContact CD1-CD2 4.46Å
654	F	90.8	Very high	92.8	Very high	32 Å²	32	24.4 Å²	24.4	14%	0.14	13%	0.129	C	C	.	.	B	Isolated β-bridge	trans	-125.8	129.6	-176.6	178.8	-86.6	0	0	0	112.2	E329 D656 Q657	E329-F654 HydrophobicContact CB-CD2 4.09Å; E329-F654 HydrophobicContact CG-CD2 3.88Å; E329-F654 HydrophobicContact CG-CE2 4.35Å; E329-F654 WeakPolarHBondContact O-CA 3.24Å; E329-F654 WeakPolarHBondContact O-CD2 3.5Å; F654-D656 PolarHBondContact O-N 3.1Å; F654-Q657 VanDerWaalsContact N-OE1 3.13Å; F654-Q657 WeakPolarHBondContact O-CB 3.16Å; F654-Q657 WeakPolarHBondContact O-CG 3.48Å; F654-Q657 PolarHBondContact O-N 3.03Å
655	G	88.4	Confident	92.9	Very high	1 Å²	1	26.3 Å²	26.3	1%	0.01	14%	0.138	C	C	.	.	T	Hydrogen-bonded Turn	trans	56.1	-126.5	171.8	0	0	0	0	0	113.6	E329 Q330 Q657 A743	E329-G655 PolarHBondContact O-N 2.72Å; Q330-G655 PolarHBondContact NE2-O 2.85Å; Q330-G655 VanDerWaalsContact OE1-CA 3.28Å; G655-Q657 VanDerWaalsContact C-N 3.28Å; G655-Q657 PolarHBondContact O-N 3.35Å; G655-A743 WeakPolarHBondContact O-CB 3.27Å
656	D	90.2	Very high	93	Very high	7 Å²	7	30.7 Å²	30.7	4%	0.037	16%	0.158	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.9	6.4	-177.6	75.7	-10.8	0	0	0	115.4	F654 F658 I659 K660 F746 V747 H947 L949	F654-D656 PolarHBondContact O-N 3.1Å; D656-F658 VanDerWaalsContact C-N 3.25Å; D656-F658 PolarHBondContact O-N 3.22Å; D656-I659 PolarHBondContact O-N 3.5Å; D656-K660 VanDerWaalsContact CG-CE 3.49Å; D656-K660 PolarHBondContact O-N 2.71Å; D656-K660 WeakPolarHBondContact OD1-CE 3.38Å; D656-K660 IonicContact OD1-NZ 3.11Å; D656-K660 PolarHBondContact OD1-NZ 2.87Å; D656-K660 WeakPolarHBondContact OD2-CE 3.39Å; D656-K660 IonicContact OD2-NZ 2.72Å; D656-K660 PolarHBondContact OD2-NZ 3.13Å; D656-F746 HydrophobicContact CB-CD1 4.14Å; D656-F746 HydrophobicContact CB-CE1 4.36Å; D656-V747 HydrophobicContact CB-CG2 4.22Å; D656-H947 IonicContact OD2-CE1 3.78Å; D656-H947 IonicContact OD2-NE2 3.52Å; D656-L949 HydrophobicContact CB-CD1 4Å
657	Q	92.3	Very high	93	Very high	47 Å²	47	34.3 Å²	34.3	22%	0.22	17%	0.17	C	C	.	.	H	α-helix	trans	-55.2	-38.7	179.7	-80.4	175.9	14	0	0	112.9	M642 F654 G655 K660 L661	M642-Q657 HydrophobicContact CE-CB 4.46Å; M642-Q657 HydrophobicContact CE-CG 4.32Å; M642-Q657 HydrophobicContact SD-CG 4.4Å; F654-Q657 VanDerWaalsContact N-OE1 3.13Å; F654-Q657 WeakPolarHBondContact O-CB 3.16Å; F654-Q657 WeakPolarHBondContact O-CG 3.48Å; F654-Q657 PolarHBondContact O-N 3.03Å; G655-Q657 VanDerWaalsContact C-N 3.28Å; G655-Q657 PolarHBondContact O-N 3.35Å; Q657-K660 PolarHBondContact O-N 2.98Å; Q657-L661 VanDerWaalsContact O-CG 3.3Å; Q657-L661 WeakPolarHBondContact O-CG 3.22Å; Q657-L661 PolarHBondContact O-N 3.21Å; Q657-L661 VanDerWaalsContact O-N 3.08Å
658	F	95	Very high	93.1	Very high	4 Å²	4	36 Å²	36	2%	0.018	18%	0.177	C	C	.	.	H	α-helix	trans	-71.2	-39.9	-175.6	-164.9	-113.8	0	0	0	112.4	L653 D656 K660 L661 M662 F674 R736 L739 H740 A743	L653-F658 HydrophobicContact CD1-CD2 3.88Å; D656-F658 VanDerWaalsContact C-N 3.25Å; D656-F658 PolarHBondContact O-N 3.22Å; F658-K660 PolarHBondContact O-N 3.2Å; F658-L661 PolarHBondContact O-N 3.49Å; F658-M662 HydrophobicContact CD1-CG 4.36Å; F658-M662 HydrophobicContact CD1-SD 3.72Å; F658-M662 HydrophobicContact CE1-CG 4.12Å; F658-M662 HydrophobicContact CE1-SD 3.41Å; F658-M662 WeakPolarHBondContact CE1-SD 3.22Å; F658-M662 HydrophobicContact CZ-CG 4.38Å; F658-M662 HydrophobicContact CZ-SD 4.17Å; F658-M662 WeakPolarHBondContact O-CG 3.42Å; F658-M662 PolarHBondContact O-N 2.86Å; F658-F674 AromaticContact CE2-CZ 3.91Å; F658-F674 HydrophobicContact CE2-CZ 3.91Å; F658-F674 HydrophobicContact CZ-CE2 4.36Å; F658-F674 AromaticContact CZ-CZ 3.88Å; F658-F674 HydrophobicContact CZ-CZ 3.88Å; F658-R736 HydrophobicContact CE1-CG 4.3Å; F658-R736 HydrophobicContact CZ-CG 4.12Å; F658-L739 HydrophobicContact CD1-CB 3.58Å; F658-L739 HydrophobicContact CD2-CB 4.39Å; F658-L739 HydrophobicContact CE1-CB 3.59Å; F658-L739 HydrophobicContact CE2-CB 4.42Å; F658-L739 HydrophobicContact CE2-CD1 4.2Å; F658-L739 HydrophobicContact CG-CB 4Å; F658-L739 HydrophobicContact CZ-CB 4.04Å; F658-L739 HydrophobicContact CZ-CD1 4.22Å; F658-H740 HydrophobicContact CD1-CB 4.4Å; F658-H740 HydrophobicContact CE1-CB 4.32Å; F658-A743 HydrophobicContact CB-CB 4.31Å
659	I	94.4	Very high	93.1	Very high	3 Å²	3	36.6 Å²	36.6	2%	0.015	18%	0.18	C	C	.	.	H	α-helix	trans	-61	-45	172.6	-66.3	167.4	0	0	0	110.2	D656 L661 M662 M663 A743 Q744 V747 L949 R952	D656-I659 PolarHBondContact O-N 3.5Å; I659-L661 PolarHBondContact O-N 2.9Å; I659-M662 PolarHBondContact O-N 2.92Å; I659-M663 HydrophobicContact CG2-CG 4.31Å; I659-M663 HydrophobicContact CG2-SD 4.05Å; I659-M663 VanDerWaalsContact O-CG 3.3Å; I659-M663 WeakPolarHBondContact O-CG 3.39Å; I659-M663 PolarHBondContact O-N 2.62Å; I659-A743 HydrophobicContact CD1-CB 3.8Å; I659-A743 HydrophobicContact CG1-CB 3.79Å; I659-Q744 HydrophobicContact CD1-CG 3.93Å; I659-V747 HydrophobicContact CD1-CG2 4.06Å; I659-L949 HydrophobicContact CB-CD1 4.35Å; I659-L949 HydrophobicContact CG2-CD1 3.95Å; I659-R952 HydrophobicContact CG2-CB 3.81Å; I659-R952 HydrophobicContact CG2-CG 4.08Å
660	K	93.6	Very high	93.2	Very high	39 Å²	39	35.7 Å²	35.7	17%	0.17	18%	0.175	C	C	.	.	H	α-helix	trans	-59.6	-33.8	176.8	-73.1	167.1	174.8	158.5	0	113.1	P638 V639 D656 Q657 F658 A664 L949	P638-K660 HydrophobicContact CB-CD 4.35Å; V639-K660 HydrophobicContact CG1-CB 4.2Å; V639-K660 WeakPolarHBondContact CG1-O 3.11Å; D656-K660 VanDerWaalsContact CG-CE 3.49Å; D656-K660 PolarHBondContact O-N 2.71Å; D656-K660 WeakPolarHBondContact OD1-CE 3.38Å; D656-K660 IonicContact OD1-NZ 3.11Å; D656-K660 PolarHBondContact OD1-NZ 2.87Å; D656-K660 WeakPolarHBondContact OD2-CE 3.39Å; D656-K660 IonicContact OD2-NZ 2.72Å; D656-K660 PolarHBondContact OD2-NZ 3.13Å; Q657-K660 PolarHBondContact O-N 2.98Å; F658-K660 PolarHBondContact O-N 3.2Å; K660-A664 PolarHBondContact O-N 2.83Å; K660-L949 HydrophobicContact CG-CD1 3.97Å
661	L	95.2	Very high	93.3	Very high	0 Å²	0	41 Å²	41	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-74.2	-43.8	175.1	-70.1	166.8	0	0	0	111.7	I621 I623 V639 M642 L653 Q657 F658 I659 A664 E665 L670 I672	I621-L661 HydrophobicContact CD1-CD1 4.4Å; I623-L661 HydrophobicContact CD1-CD1 3.71Å; I623-L661 HydrophobicContact CD1-CD2 3.56Å; I623-L661 HydrophobicContact CD1-CG 4.28Å; I623-L661 HydrophobicContact CG1-CD2 4.28Å; I623-L661 HydrophobicContact CG2-CD2 4.32Å; V639-L661 HydrophobicContact CG1-CD2 4.13Å; M642-L661 HydrophobicContact CB-CD2 4.19Å; M642-L661 HydrophobicContact CE-CD1 4.24Å; M642-L661 HydrophobicContact CE-CD2 3.86Å; M642-L661 HydrophobicContact CE-CG 3.91Å; M642-L661 HydrophobicContact SD-CD1 4.14Å; M642-L661 HydrophobicContact SD-CD2 4.31Å; M642-L661 HydrophobicContact SD-CG 4.42Å; L653-L661 HydrophobicContact CD2-CD1 4.17Å; Q657-L661 VanDerWaalsContact O-CG 3.3Å; Q657-L661 WeakPolarHBondContact O-CG 3.22Å; Q657-L661 PolarHBondContact O-N 3.21Å; Q657-L661 VanDerWaalsContact O-N 3.08Å; F658-L661 PolarHBondContact O-N 3.49Å; I659-L661 PolarHBondContact O-N 2.9Å; L661-A664 PolarHBondContact O-N 3.02Å; L661-E665 PolarHBondContact O-N 2.8Å; L661-L670 HydrophobicContact CD2-CD1 3.84Å; L661-I672 HydrophobicContact CB-CD1 3.78Å
662	M	94.1	Very high	93.5	Very high	21 Å²	21	39 Å²	39	10%	0.103	18%	0.184	C	C	.	.	H	α-helix	trans	-60.4	-45.1	175.5	-74.1	178.2	52.3	0	0	111.9	F658 I659 A664 E665 E666 H740	F658-M662 HydrophobicContact CD1-CG 4.36Å; F658-M662 HydrophobicContact CD1-SD 3.72Å; F658-M662 HydrophobicContact CE1-CG 4.12Å; F658-M662 HydrophobicContact CE1-SD 3.41Å; F658-M662 WeakPolarHBondContact CE1-SD 3.22Å; F658-M662 HydrophobicContact CZ-CG 4.38Å; F658-M662 HydrophobicContact CZ-SD 4.17Å; F658-M662 WeakPolarHBondContact O-CG 3.42Å; F658-M662 PolarHBondContact O-N 2.86Å; I659-M662 PolarHBondContact O-N 2.92Å; M662-A664 VanDerWaalsContact C-N 3.3Å; M662-A664 PolarHBondContact O-N 3.19Å; M662-E665 CarbonylContact O-C 3.45Å; M662-E665 WeakPolarHBondContact O-CA 3.41Å; M662-E665 WeakPolarHBondContact O-CB 3.23Å; M662-E665 PolarHBondContact O-N 3.48Å; M662-E666 WeakPolarHBondContact O-CG 3.36Å; M662-E666 PolarHBondContact O-N 3.25Å; M662-H740 VanDerWaalsContact CE-CD2 3.49Å; M662-H740 WeakPolarHBondContact CE-CD2 3.36Å; M662-H740 HydrophobicContact SD-CB 4.1Å; M662-H740 PolarHBondContact SD-CD2 3.37Å
663	M	94.1	Very high	93.7	Very high	38 Å²	38	38.4 Å²	38.4	19%	0.187	18%	0.183	C	C	.	.	H	α-helix	trans	-55.6	-44.4	173.5	-69.7	175.3	62.6	0	0	112.2	I659 E665 E666 E667 L949 R952	I659-M663 HydrophobicContact CG2-CG 4.31Å; I659-M663 HydrophobicContact CG2-SD 4.05Å; I659-M663 VanDerWaalsContact O-CG 3.3Å; I659-M663 WeakPolarHBondContact O-CG 3.39Å; I659-M663 PolarHBondContact O-N 2.62Å; M663-E665 PolarHBondContact O-N 3.4Å; M663-E666 PolarHBondContact O-N 2.82Å; M663-E667 WeakPolarHBondContact O-CB 3.41Å; M663-E667 VanDerWaalsContact O-CG 3.27Å; M663-E667 WeakPolarHBondContact O-CG 3.31Å; M663-E667 PolarHBondContact O-N 3.12Å; M663-L949 HydrophobicContact CE-CD2 4.23Å; M663-L949 HydrophobicContact SD-CD2 3.68Å; M663-R952 HydrophobicContact SD-CG 4.06Å
664	A	94.5	Very high	93.8	Very high	4 Å²	4	39 Å²	39	3%	0.033	19%	0.185	C	C	.	.	H	α-helix	trans	-70.8	-18.7	177.9	0	0	0	0	0	113.4	V639 K660 L661 M662 L669 L670	V639-A664 HydrophobicContact CG1-CB 4.2Å; V639-A664 HydrophobicContact CG2-CB 4.03Å; K660-A664 PolarHBondContact O-N 2.83Å; L661-A664 PolarHBondContact O-N 3.02Å; M662-A664 VanDerWaalsContact C-N 3.3Å; M662-A664 PolarHBondContact O-N 3.19Å; A664-L669 CarbonylContact O-C 3.59Å; A664-L669 WeakPolarHBondContact O-CA 3.3Å; A664-L669 WeakPolarHBondContact O-CB 3.42Å; A664-L669 PolarHBondContact O-N 2.86Å; A664-L670 HydrophobicContact CB-CB 4.25Å; A664-L670 HydrophobicContact CB-CD1 3.73Å; A664-L670 HydrophobicContact CB-CG 3.93Å; A664-L670 PolarHBondContact O-N 2.82Å
665	E	95.1	Very high	93.9	Very high	45 Å²	45	39 Å²	39	21%	0.21	19%	0.187	C	C	.	.	H	α-helix	trans	-82.9	-42	171.7	-175.5	170.1	-114.6	0	0	111.5	L661 M662 M663 E667 K668 I672 R736	L661-E665 PolarHBondContact O-N 2.8Å; M662-E665 CarbonylContact O-C 3.45Å; M662-E665 WeakPolarHBondContact O-CA 3.41Å; M662-E665 WeakPolarHBondContact O-CB 3.23Å; M662-E665 PolarHBondContact O-N 3.48Å; M663-E665 PolarHBondContact O-N 3.4Å; E665-E667 PolarHBondContact O-N 2.75Å; E665-K668 WeakPolarHBondContact O-CA 3.45Å; E665-K668 PolarHBondContact O-N 3.05Å; E665-I672 HydrophobicContact CB-CD1 4.29Å; E665-I672 HydrophobicContact CB-CG1 4.45Å; E665-I672 VanDerWaalsContact OE1-CB 3.32Å; E665-I672 WeakPolarHBondContact OE1-CB 3.46Å; E665-I672 WeakPolarHBondContact OE1-CG1 3.33Å; E665-I672 PolarHBondContact OE1-N 2.95Å; E665-R736 IonicContact OE2-CZ 2.75Å; E665-R736 IonicContact OE2-NH1 3.56Å; E665-R736 PolarHBondContact OE2-NH1 2.69Å; E665-R736 IonicContact OE2-NH2 2.75Å; E665-R736 PolarHBondContact OE2-NH2 2.92Å
666	E	94.4	Very high	93.9	Very high	95 Å²	95	43.3 Å²	43.3	44%	0.444	21%	0.207	S	C	.	.	H	α-helix	trans	-57.2	-46	170.2	-67	160.8	-155.7	0	0	111.8	M662 M663 K668 R952	M662-E666 WeakPolarHBondContact O-CG 3.36Å; M662-E666 PolarHBondContact O-N 3.25Å; M663-E666 PolarHBondContact O-N 2.82Å; E666-K668 PolarHBondContact O-N 3Å; E666-K668 VanDerWaalsContact O-N 3.12Å; E666-R952 VanDerWaalsContact CD-NH1 3.34Å; E666-R952 IonicContact OE1-NH1 3.89Å; E666-R952 PolarHBondContact OE1-NH1 2.93Å; E666-R952 IonicContact OE2-CZ 2.68Å; E666-R952 VanDerWaalsContact OE2-CZ 3.24Å; E666-R952 IonicContact OE2-NH1 2.77Å; E666-R952 PolarHBondContact OE2-NH1 3.34Å; E666-R952 IonicContact OE2-NH2 2.66Å; E666-R952 PolarHBondContact OE2-NH2 2.98Å
667	E	93.6	Very high	93.6	Very high	108 Å²	108	49.7 Å²	49.7	51%	0.505	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69	-0.3	173.2	-69.2	172.1	-161.5	0	0	113.1	M663 E665 L669	M663-E667 WeakPolarHBondContact O-CB 3.41Å; M663-E667 VanDerWaalsContact O-CG 3.27Å; M663-E667 WeakPolarHBondContact O-CG 3.31Å; M663-E667 PolarHBondContact O-N 3.12Å; E665-E667 PolarHBondContact O-N 2.75Å; E667-L669 HydrophobicContact CB-CD1 4.15Å; E667-L669 HydrophobicContact CB-CG 3.85Å; E667-L669 PolarHBondContact O-N 2.76Å; E667-L669 VanDerWaalsContact OE2-CD1 3.32Å; E667-L669 WeakPolarHBondContact OE2-CD1 3.47Å
668	K	94.4	Very high	93.2	Very high	154 Å²	154	48 Å²	48	67%	0.67	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	56.1	35.7	179.9	-59.6	169.5	-172.1	173	0	112.3	T626 E665 E666	T626-K668 WeakPolarHBondContact CB-O 3.17Å; T626-K668 VanDerWaalsContact CG2-O 3.29Å; T626-K668 WeakPolarHBondContact CG2-O 3.09Å; T626-K668 PolarHBondContact OG1-O 2.97Å; E665-K668 WeakPolarHBondContact O-CA 3.45Å; E665-K668 PolarHBondContact O-N 3.05Å; E666-K668 PolarHBondContact O-N 3Å; E666-K668 VanDerWaalsContact O-N 3.12Å
669	L	94	Very high	92.5	Very high	17 Å²	17	51.8 Å²	51.8	9%	0.089	25%	0.246	C	C	.	.	S	Bend	trans	-95.7	-36.3	175.1	-52.8	-177	0	0	0	112.1	P625 T626 N628 G629 L632 I633 A664 E667	P625-L669 WeakPolarHBondContact CA-O 3.38Å; T626-L669 PolarHBondContact N-O 2.82Å; T626-L669 PolarHBondContact OG1-O 2.84Å; N628-L669 HydrophobicContact CB-CD2 4.1Å; G629-L669 VanDerWaalsContact CA-O 3.28Å; G629-L669 WeakPolarHBondContact CA-O 3.42Å; L632-L669 HydrophobicContact CB-CD2 4.15Å; L632-L669 HydrophobicContact CD1-CD2 3.75Å; I633-L669 HydrophobicContact CD1-CB 4.02Å; I633-L669 HydrophobicContact CG1-CB 4.21Å; I633-L669 HydrophobicContact CG1-CD1 4.37Å; A664-L669 CarbonylContact O-C 3.59Å; A664-L669 WeakPolarHBondContact O-CA 3.3Å; A664-L669 WeakPolarHBondContact O-CB 3.42Å; A664-L669 PolarHBondContact O-N 2.86Å; E667-L669 HydrophobicContact CB-CD1 4.15Å; E667-L669 HydrophobicContact CB-CG 3.85Å; E667-L669 PolarHBondContact O-N 2.76Å; E667-L669 VanDerWaalsContact OE2-CD1 3.32Å; E667-L669 WeakPolarHBondContact OE2-CD1 3.47Å
670	L	94.8	Very high	91.5	Very high	4 Å²	4	51.9 Å²	51.9	2%	0.021	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	165.7	177.7	-65.3	-179.4	0	0	0	111.6	I623 R624 P625 I633 V639 L661 A664	I623-L670 HydrophobicContact CG2-CB 4.25Å; I623-L670 HydrophobicContact CG2-CD1 3.75Å; I623-L670 HydrophobicContact CG2-CD2 3.92Å; I623-L670 HydrophobicContact CG2-CG 4.19Å; R624-L670 CarbonylContact O-C 3.24Å; R624-L670 WeakPolarHBondContact O-CA 3.49Å; P625-L670 HydrophobicContact CB-CD2 4.16Å; I633-L670 HydrophobicContact CD1-CD1 4.45Å; I633-L670 HydrophobicContact CD1-CD2 3.38Å; I633-L670 HydrophobicContact CD1-CG 3.76Å; V639-L670 HydrophobicContact CB-CD1 3.91Å; V639-L670 HydrophobicContact CG1-CD1 4.28Å; V639-L670 HydrophobicContact CG2-CD1 3.86Å; L661-L670 HydrophobicContact CD2-CD1 3.84Å; A664-L670 HydrophobicContact CB-CB 4.25Å; A664-L670 HydrophobicContact CB-CD1 3.73Å; A664-L670 HydrophobicContact CB-CG 3.93Å; A664-L670 PolarHBondContact O-N 2.82Å
671	E	95.2	Very high	90.5	Very high	112 Å²	112	51.5 Å²	51.5	52%	0.523	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	124.5	171.3	-179.6	-175.3	176	0	0	107.3	I623 R624	I623-E671 WeakPolarHBondContact CA-O 3.3Å; R624-E671 PolarHBondContact N-O 2.92Å; R624-E671 PolarHBondContact O-N 2.78Å
672	I	95.4	Very high	88.9	Confident	14 Å²	14	54.8 Å²	54.8	7%	0.072	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	110.4	-177.7	-51	173	0	0	0	109.3	L661 E665 F674	L661-I672 HydrophobicContact CB-CD1 3.78Å; E665-I672 HydrophobicContact CB-CD1 4.29Å; E665-I672 HydrophobicContact CB-CG1 4.45Å; E665-I672 VanDerWaalsContact OE1-CB 3.32Å; E665-I672 WeakPolarHBondContact OE1-CB 3.46Å; E665-I672 WeakPolarHBondContact OE1-CG1 3.33Å; E665-I672 PolarHBondContact OE1-N 2.95Å; I672-F674 HydrophobicContact CG2-CE2 4.19Å
673	T	95.6	Very high	87	Confident	59 Å²	59	58 Å²	58	36%	0.362	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	114.8	177.2	-31.5	0	0	0	0	110.5	I621 N622	I621-T673 CarbonylContact C-O 3.6Å; I621-T673 WeakPolarHBondContact CA-O 3.05Å; N622-T673 PolarHBondContact N-O 3.18Å; N622-T673 PolarHBondContact O-N 3.24Å
674	F	95	Very high	85.1	Confident	14 Å²	14	60.9 Å²	60.9	6%	0.061	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	136.6	163.8	-70.5	-95.1	0	0	0	109.2	I621 V650 F658 I672 I732 L735 R736 L739	I621-F674 HydrophobicContact CG2-CD1 3.75Å; I621-F674 HydrophobicContact CG2-CE1 3.64Å; I621-F674 HydrophobicContact CG2-CG 4.35Å; I621-F674 HydrophobicContact CG2-CZ 4.16Å; V650-F674 HydrophobicContact CG2-CD1 4.42Å; V650-F674 HydrophobicContact CG2-CE1 4.07Å; F658-F674 AromaticContact CE2-CZ 3.91Å; F658-F674 HydrophobicContact CE2-CZ 3.91Å; F658-F674 HydrophobicContact CZ-CE2 4.36Å; F658-F674 AromaticContact CZ-CZ 3.88Å; F658-F674 HydrophobicContact CZ-CZ 3.88Å; I672-F674 HydrophobicContact CG2-CE2 4.19Å; F674-I732 HydrophobicContact CB-CD1 4.17Å; F674-I732 HydrophobicContact CB-CG1 4.06Å; F674-I732 HydrophobicContact CB-CG2 3.9Å; F674-I732 HydrophobicContact CD2-CG2 4.08Å; F674-I732 HydrophobicContact CG-CG2 4.09Å; F674-L735 HydrophobicContact CD1-CD2 3.81Å; F674-L735 HydrophobicContact CE1-CD2 3.81Å; F674-L735 HydrophobicContact CE1-CG 4.07Å; F674-R736 HydrophobicContact CE2-CB 4.42Å; F674-L739 HydrophobicContact CE1-CD1 3.81Å; F674-L739 HydrophobicContact CZ-CD1 3.92Å
675	L	92.4	Very high	83.1	Confident	32 Å²	32	69 Å²	69	17%	0.168	37%	0.371	C	S	.	.			trans	-81.6	124.7	-178.5	-67.5	-179.9	0	0	0	111.7	Y615 R620 K647	Y615-L675 VanDerWaalsContact CE2-O 3.32Å; Y615-L675 WeakPolarHBondContact CE2-O 3.45Å; Y615-L675 PolarHBondContact OH-O 2.82Å; R620-L675 HydrophobicContact CB-CD1 4Å; R620-L675 PolarHBondContact O-N 2.78Å; K647-L675 HydrophobicContact CD-CD1 4.33Å; K647-L675 HydrophobicContact CG-CD1 4.02Å
676	E	88.9	Confident	81.2	Confident	92 Å²	92	68.9 Å²	68.9	43%	0.43	38%	0.382	S	S	.	.	S	Bend	trans	-74.1	-33	171.3	-64.5	-178.3	-157.2	0	0	112.5	F678 I728 I732	E676-F678 WeakPolarHBondContact O-CD1 3.24Å; E676-I728 HydrophobicContact CB-CG2 4.07Å; E676-I728 HydrophobicContact CG-CG2 3.99Å; E676-I732 HydrophobicContact CG-CD1 4.03Å
677	E	82.7	Confident	79.5	Confident	141 Å²	141	70.6 Å²	70.6	66%	0.659	40%	0.399	S	S	*	.	S	Bend	trans	-83.3	123.1	171.3	-65.2	-179.7	174.1	0	0	110.1
678	F	85.2	Confident	77.9	Confident	12 Å²	12	67.8 Å²	67.8	5%	0.053	39%	0.39	C	S	.	.			trans	-138.2	157.5	-179.2	62.1	-85	0	0	0	112.6	M611 V614 Y615 R618 E676 G680 Y691 I728	M611-F678 HydrophobicContact CE-CE1 4.23Å; M611-F678 HydrophobicContact CE-CZ 3.8Å; V614-F678 HydrophobicContact CG1-CE2 3.92Å; Y615-F678 AromaticContact CD2-CD1 3.53Å; Y615-F678 HydrophobicContact CD2-CD1 3.53Å; Y615-F678 AromaticContact CD2-CE1 3.6Å; Y615-F678 HydrophobicContact CD2-CE1 3.6Å; Y615-F678 HydrophobicContact CD2-CG 4.03Å; Y615-F678 HydrophobicContact CD2-CZ 4.13Å; Y615-F678 AromaticContact CE2-CD1 3.76Å; Y615-F678 HydrophobicContact CE2-CD1 3.76Å; Y615-F678 HydrophobicContact CE2-CE1 4.16Å; Y615-F678 HydrophobicContact CE2-CG 4.34Å; R618-F678 HydrophobicContact CB-CD2 4.23Å; E676-F678 WeakPolarHBondContact O-CD1 3.24Å; F678-G680 PolarHBondContact O-N 2.96Å; F678-Y691 HydrophobicContact CD2-CG 4.31Å; F678-Y691 AromaticContact CE2-CD1 3.48Å; F678-Y691 HydrophobicContact CE2-CD1 3.48Å; F678-Y691 VanDerWaalsContact CE2-CD1 3.48Å; F678-Y691 HydrophobicContact CE2-CD2 4.4Å; F678-Y691 HydrophobicContact CE2-CE1 4.36Å; F678-Y691 AromaticContact CE2-CG 3.49Å; F678-Y691 HydrophobicContact CE2-CG 3.49Å; F678-Y691 VanDerWaalsContact CE2-CG 3.49Å; F678-Y691 AromaticContact CZ-CD1 3.44Å; F678-Y691 HydrophobicContact CZ-CD1 3.44Å; F678-Y691 VanDerWaalsContact CZ-CD1 3.44Å; F678-Y691 HydrophobicContact CZ-CE1 4.33Å; F678-Y691 AromaticContact CZ-CG 3.88Å; F678-Y691 HydrophobicContact CZ-CG 3.88Å; F678-Y691 PolarHBondContact O-N 2.89Å; F678-Y691 VanDerWaalsContact O-N 3.09Å; F678-I728 HydrophobicContact CE1-CD1 4.21Å
679	E	79.6	Confident	76.8	Confident	83 Å²	83	62.2 Å²	62.2	39%	0.388	38%	0.376	S	S	.	.	B	Isolated β-bridge	trans	-65.4	124.1	-168.8	-75.7	178	-179.7	0	0	112.4	R618 R620 P688	R618-E679 VanDerWaalsContact CD-O 3.25Å; R618-E679 WeakPolarHBondContact CD-O 3.25Å; R618-E679 PolarHBondContact NH1-O 2.75Å; R620-E679 IonicContact CZ-OE1 3.24Å; R620-E679 IonicContact CZ-OE2 2.7Å; R620-E679 IonicContact NH1-OE1 2.72Å; R620-E679 PolarHBondContact NH1-OE1 2.94Å; R620-E679 IonicContact NH1-OE2 3.68Å; R620-E679 IonicContact NH2-OE1 2.88Å; R620-E679 PolarHBondContact NH2-OE1 3.24Å; R620-E679 IonicContact NH2-OE2 2.81Å; R620-E679 PolarHBondContact NH2-OE2 3.26Å; E679-P688 HydrophobicContact CB-CB 3.91Å; E679-P688 HydrophobicContact CB-CG 4.41Å; E679-P688 HydrophobicContact CG-CB 4.09Å; E679-P688 HydrophobicContact CG-CG 4.4Å
680	G	74.4	Confident	76.4	Confident	5 Å²	5	63.2 Å²	63.2	5%	0.052	38%	0.381	C	S	.	.			trans	-67.8	178.3	174.9	0	0	0	0	0	114.1	R618 F678 A682 G689 E694	R618-G680 PolarHBondContact NH1-O 3.13Å; F678-G680 PolarHBondContact O-N 2.96Å; G680-A682 PolarHBondContact O-N 3.43Å; G680-G689 PolarHBondContact N-O 3.04Å; G680-E694 WeakPolarHBondContact CA-OE1 3.46Å
681	N	72.1	Confident	76.1	Confident	32 Å²	32	63.2 Å²	63.2	17%	0.171	38%	0.381	C	S	.	.			trans	-74.7	94.2	177.1	-78.9	-44.3	0	0	0	110.7	N558 R618 C683 E694	N558-N681 PolarHBondContact OD1-ND2 3.29Å; R618-N681 PolarHBondContact NH1-OD1 3.42Å; R618-N681 PolarHBondContact NH2-OD1 3.39Å; N681-C683 PolarHBondContact O-N 2.84Å; N681-E694 WeakPolarHBondContact CB-OE2 3.34Å; N681-E694 PolarHBondContact N-OE1 3.36Å; N681-E694 PolarHBondContact N-OE2 2.77Å
682	A	61.9	Low	75.8	Confident	69 Å²	69	57.9 Å²	57.9	57%	0.57	36%	0.357	S	S	*	.			trans	-31.8	104.9	180	0	0	0	0	0	114.2	G680 P688	G680-A682 PolarHBondContact O-N 3.43Å; A682-P688 HydrophobicContact CB-CG 4.39Å
683	C	53	Low	75.5	Confident	87 Å²	87	62.4 Å²	62.4	59%	0.588	38%	0.377	S	S	*	.			trans	-58.6	139.9	171.3	-77.6	0	0	0	0	109.3	N681 N685 G686	N681-C683 PolarHBondContact O-N 2.84Å; C683-N685 PolarHBondContact O-N 3.01Å; C683-G686 PolarHBondContact O-N 3.29Å
684	A	54.3	Low	75.1	Confident	100 Å²	100	61.4 Å²	61.4	83%	0.826	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-9.8	-162	0	0	0	0	0	117.4
685	N	52.4	Low	74.9	Confident	174 Å²	174	60.8 Å²	60.8	93%	0.93	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-142.9	26.9	171.2	-66.3	-78.6	0	0	0	112.6	C683	C683-N685 PolarHBondContact O-N 3.01Å
686	G	56.2	Low	74.9	Confident	42 Å²	42	59.8 Å²	59.8	43%	0.433	36%	0.36	S	S	.	.	S	Bend	trans	-129.2	162.5	-175.2	0	0	0	0	0	113.7	C683	C683-G686 PolarHBondContact O-N 3.29Å
687	T	57.6	Low	75	Confident	132 Å²	132	57.7 Å²	57.7	81%	0.81	36%	0.359	S	S	*	.			trans	-57.2	146.3	159.9	11.3	0	0	0	0	109.7
688	P	61.7	Low	75.4	Confident	49 Å²	49	51.8 Å²	51.8	32%	0.318	33%	0.332	S	S	.	.			trans	-53.1	140.9	167	-23.6	34.3	0	0	0	110.7	E679 A682	E679-P688 HydrophobicContact CB-CB 3.91Å; E679-P688 HydrophobicContact CB-CG 4.41Å; E679-P688 HydrophobicContact CG-CB 4.09Å; E679-P688 HydrophobicContact CG-CG 4.4Å; A682-P688 HydrophobicContact CB-CG 4.39Å
689	G	71.2	Confident	75.8	Confident	36 Å²	36	51.4 Å²	51.4	37%	0.371	33%	0.33	S	S	.	.			trans	-74.7	-171.8	167.3	0	0	0	0	0	111.3	G680 E694	G680-G689 PolarHBondContact N-O 3.04Å; G689-E694 PolarHBondContact N-OE1 2.66Å
690	D	84.8	Confident	76.3	Confident	38 Å²	38	50.9 Å²	50.9	20%	0.203	33%	0.327	C	S	.	.	B	Isolated β-bridge	trans	-80.8	137.7	153.1	159.4	56.8	0	0	0	108.9	V692 E693 E694	D690-V692 VanDerWaalsContact C-N 3.29Å; D690-V692 VanDerWaalsContact CG-N 3.34Å; D690-V692 PolarHBondContact O-N 2.76Å; D690-V692 PolarHBondContact OD1-N 3.47Å; D690-V692 WeakPolarHBondContact OD2-CA 3.02Å; D690-V692 WeakPolarHBondContact OD2-CB 3.39Å; D690-V692 PolarHBondContact OD2-N 3.49Å; D690-E693 HydrophobicContact CB-CG 4.38Å; D690-E693 PolarHBondContact O-N 3.04Å; D690-E693 PolarHBondContact OD2-N 2.93Å; D690-E694 PolarHBondContact O-N 2.91Å; D690-E694 VanDerWaalsContact O-N 3.12Å
691	Y	88.6	Confident	77.1	Confident	4 Å²	4	51.9 Å²	51.9	2%	0.016	33%	0.331	C	S	.	.	H	α-helix	trans	-68.3	-25.5	-179.9	-169.8	-98.9	0	0	0	113.1	L555 M611 V614 F678 E694 S695	L555-Y691 HydrophobicContact CD1-CE1 4.18Å; M611-Y691 HydrophobicContact CE-CD1 4.45Å; M611-Y691 HydrophobicContact CE-CE1 4.48Å; M611-Y691 HydrophobicContact SD-CD1 4.27Å; M611-Y691 HydrophobicContact SD-CE1 3.77Å; V614-Y691 HydrophobicContact CG1-CD2 4.29Å; V614-Y691 HydrophobicContact CG1-CE1 4.28Å; V614-Y691 HydrophobicContact CG1-CE2 4.03Å; F678-Y691 HydrophobicContact CD2-CG 4.31Å; F678-Y691 AromaticContact CE2-CD1 3.48Å; F678-Y691 HydrophobicContact CE2-CD1 3.48Å; F678-Y691 VanDerWaalsContact CE2-CD1 3.48Å; F678-Y691 HydrophobicContact CE2-CD2 4.4Å; F678-Y691 HydrophobicContact CE2-CE1 4.36Å; F678-Y691 AromaticContact CE2-CG 3.49Å; F678-Y691 HydrophobicContact CE2-CG 3.49Å; F678-Y691 VanDerWaalsContact CE2-CG 3.49Å; F678-Y691 AromaticContact CZ-CD1 3.44Å; F678-Y691 HydrophobicContact CZ-CD1 3.44Å; F678-Y691 VanDerWaalsContact CZ-CD1 3.44Å; F678-Y691 HydrophobicContact CZ-CE1 4.33Å; F678-Y691 AromaticContact CZ-CG 3.88Å; F678-Y691 HydrophobicContact CZ-CG 3.88Å; F678-Y691 PolarHBondContact O-N 2.89Å; F678-Y691 VanDerWaalsContact O-N 3.09Å; Y691-E694 PolarHBondContact O-N 2.82Å; Y691-S695 VanDerWaalsContact O-CB 3.31Å; Y691-S695 WeakPolarHBondContact O-CB 3.5Å; Y691-S695 PolarHBondContact O-N 3.16Å; Y691-S695 PolarHBondContact O-OG 2.88Å
692	V	89.5	Confident	77.9	Confident	1 Å²	1	57 Å²	57	1%	0.006	36%	0.359	C	S	.	.	H	α-helix	trans	-70.6	-39.6	175.4	-171.5	0	0	0	0	110.6	D690 S695 K696 L723 I728	D690-V692 VanDerWaalsContact C-N 3.29Å; D690-V692 VanDerWaalsContact CG-N 3.34Å; D690-V692 PolarHBondContact O-N 2.76Å; D690-V692 PolarHBondContact OD1-N 3.47Å; D690-V692 WeakPolarHBondContact OD2-CA 3.02Å; D690-V692 WeakPolarHBondContact OD2-CB 3.39Å; D690-V692 PolarHBondContact OD2-N 3.49Å; V692-S695 WeakPolarHBondContact O-CB 3.28Å; V692-S695 PolarHBondContact O-N 2.84Å; V692-K696 WeakPolarHBondContact O-CG 3.37Å; V692-K696 PolarHBondContact O-N 2.91Å; V692-L723 HydrophobicContact CG1-CB 4.28Å; V692-L723 HydrophobicContact CG1-CD1 4.07Å; V692-I728 HydrophobicContact CG2-CD1 3.77Å
693	E	88.1	Confident	79.2	Confident	109 Å²	109	58.5 Å²	58.5	51%	0.509	35%	0.354	S	S	.	.	H	α-helix	trans	-64.2	-42.8	170.1	-63.9	-56	160.7	0	0	113	D690 S695 K696 A697	D690-E693 HydrophobicContact CB-CG 4.38Å; D690-E693 PolarHBondContact O-N 3.04Å; D690-E693 PolarHBondContact OD2-N 2.93Å; E693-S695 VanDerWaalsContact C-N 3.29Å; E693-S695 PolarHBondContact O-N 2.9Å; E693-K696 PolarHBondContact O-N 3.49Å; E693-K696 IonicContact OE1-NZ 2.67Å; E693-K696 PolarHBondContact OE1-NZ 3.13Å; E693-K696 WeakPolarHBondContact OE2-CD 3.29Å; E693-K696 WeakPolarHBondContact OE2-CE 3.42Å; E693-K696 IonicContact OE2-NZ 2.67Å; E693-K696 PolarHBondContact OE2-NZ 3.46Å; E693-A697 PolarHBondContact O-N 3.26Å
694	E	87.5	Confident	80.9	Confident	38 Å²	38	62.5 Å²	62.5	18%	0.178	36%	0.362	C	S	.	.	H	α-helix	trans	-61.6	-39	174.6	-71.5	-179.2	-164.4	0	0	111.7	G680 N681 G689 D690 Y691 K696 A697	G680-E694 WeakPolarHBondContact CA-OE1 3.46Å; N681-E694 WeakPolarHBondContact CB-OE2 3.34Å; N681-E694 PolarHBondContact N-OE1 3.36Å; N681-E694 PolarHBondContact N-OE2 2.77Å; G689-E694 PolarHBondContact N-OE1 2.66Å; D690-E694 PolarHBondContact O-N 2.91Å; D690-E694 VanDerWaalsContact O-N 3.12Å; Y691-E694 PolarHBondContact O-N 2.82Å; E694-K696 PolarHBondContact O-N 2.83Å; E694-A697 WeakPolarHBondContact O-CB 3.49Å; E694-A697 PolarHBondContact O-N 3.28Å
695	S	91.1	Very high	82.6	Confident	1 Å²	1	59.6 Å²	59.6	1%	0.007	34%	0.337	C	S	.	.	H	α-helix	trans	-61.5	-42.4	174.8	-62.3	0	0	0	0	112.1	Y551 L555 Y691 V692 E693 A697 L698	Y551-S695 PolarHBondContact OH-O 2.81Å; L555-S695 WeakPolarHBondContact CD1-OG 3.1Å; Y691-S695 VanDerWaalsContact O-CB 3.31Å; Y691-S695 WeakPolarHBondContact O-CB 3.5Å; Y691-S695 PolarHBondContact O-N 3.16Å; Y691-S695 PolarHBondContact O-OG 2.88Å; V692-S695 WeakPolarHBondContact O-CB 3.28Å; V692-S695 PolarHBondContact O-N 2.84Å; E693-S695 VanDerWaalsContact C-N 3.29Å; E693-S695 PolarHBondContact O-N 2.9Å; S695-A697 PolarHBondContact O-N 3.35Å; S695-L698 WeakPolarHBondContact O-CB 3.5Å; S695-L698 PolarHBondContact O-N 2.72Å
696	K	92.5	Very high	84.4	Confident	11 Å²	11	58.1 Å²	58.1	5%	0.048	32%	0.323	C	S	.	.	H	α-helix	trans	-58.2	-33	177.1	-72.6	175.3	-127.5	177.5	0	112.6	V692 E693 E694 L698 Y699 Q700 A716 V719 Q720	V692-K696 WeakPolarHBondContact O-CG 3.37Å; V692-K696 PolarHBondContact O-N 2.91Å; E693-K696 PolarHBondContact O-N 3.49Å; E693-K696 IonicContact OE1-NZ 2.67Å; E693-K696 PolarHBondContact OE1-NZ 3.13Å; E693-K696 WeakPolarHBondContact OE2-CD 3.29Å; E693-K696 WeakPolarHBondContact OE2-CE 3.42Å; E693-K696 IonicContact OE2-NZ 2.67Å; E693-K696 PolarHBondContact OE2-NZ 3.46Å; E694-K696 PolarHBondContact O-N 2.83Å; K696-L698 PolarHBondContact O-N 3.13Å; K696-Y699 PolarHBondContact O-N 2.7Å; K696-Q700 WeakPolarHBondContact O-CG 3.08Å; K696-Q700 PolarHBondContact O-NE2 3.48Å; K696-A716 HydrophobicContact CB-CB 4.17Å; K696-A716 HydrophobicContact CD-CB 4.13Å; K696-A716 HydrophobicContact CG-CB 4.19Å; K696-V719 HydrophobicContact CG-CB 4.09Å; K696-V719 HydrophobicContact CG-CG1 3.91Å; K696-Q720 HydrophobicContact CD-CB 4.3Å
697	A	89.8	Confident	85.9	Confident	48 Å²	48	59.3 Å²	59.3	40%	0.397	32%	0.317	S	S	.	.	H	α-helix	trans	-67.6	-23.8	177.7	0	0	0	0	0	113	Q560 E693 E694 S695 Y699 Q700	Q560-A697 PolarHBondContact NE2-O 3.06Å; E693-A697 PolarHBondContact O-N 3.26Å; E694-A697 WeakPolarHBondContact O-CB 3.49Å; E694-A697 PolarHBondContact O-N 3.28Å; S695-A697 PolarHBondContact O-N 3.35Å; A697-Y699 PolarHBondContact O-N 3.36Å; A697-Q700 PolarHBondContact O-N 2.9Å
698	L	91.9	Very high	87.5	Confident	17 Å²	17	53 Å²	53	9%	0.089	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77	-5.4	178.3	-59.9	171.9	0	0	0	113.5	Y551 N554 L555 Q560 S695 K696	Y551-L698 HydrophobicContact CE2-CB 4.03Å; N554-L698 HydrophobicContact CB-CB 4.28Å; N554-L698 PolarHBondContact ND2-O 2.74Å; L555-L698 HydrophobicContact CD1-CD1 4.02Å; Q560-L698 HydrophobicContact CG-CD2 4.3Å; S695-L698 WeakPolarHBondContact O-CB 3.5Å; S695-L698 PolarHBondContact O-N 2.72Å; K696-L698 PolarHBondContact O-N 3.13Å
699	Y	94	Very high	89	Confident	4 Å²	4	55.5 Å²	55.5	2%	0.016	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	-119.1	30.1	170.9	-148.6	160.2	0	0	0	112.6	F544 L546 Y551 I564 L601 K696 A697 R715 V719	F544-Y699 WeakPolarHBondContact CB-OH 3.22Å; L546-Y699 HydrophobicContact CB-CE2 3.79Å; L546-Y699 HydrophobicContact CD1-CD2 3.85Å; L546-Y699 HydrophobicContact CD1-CE2 3.96Å; L546-Y699 HydrophobicContact CD1-CG 4.49Å; L546-Y699 HydrophobicContact CG-CD2 4.33Å; L546-Y699 HydrophobicContact CG-CE2 3.96Å; L546-Y699 PolarHBondContact O-OH 3.33Å; L546-Y699 VanDerWaalsContact O-OH 3.13Å; Y551-Y699 AromaticContact CD2-CD1 3.75Å; Y551-Y699 HydrophobicContact CD2-CD1 3.75Å; Y551-Y699 AromaticContact CD2-CG 3.87Å; Y551-Y699 HydrophobicContact CD2-CG 3.87Å; Y551-Y699 HydrophobicContact CE2-CD1 4.22Å; Y551-Y699 HydrophobicContact CE2-CG 4.31Å; Y551-Y699 HydrophobicContact CG-CD1 4.1Å; I564-Y699 HydrophobicContact CD1-CD2 4.24Å; I564-Y699 HydrophobicContact CG1-CD2 4.3Å; L601-Y699 HydrophobicContact CD1-CE1 4.32Å; K696-Y699 PolarHBondContact O-N 2.7Å; A697-Y699 PolarHBondContact O-N 3.36Å; Y699-R715 HydrophobicContact CD1-CB 4.35Å; Y699-R715 HydrophobicContact CD2-CB 3.96Å; Y699-R715 HydrophobicContact CD2-CG 3.75Å; Y699-R715 HydrophobicContact CE2-CB 4.38Å; Y699-R715 HydrophobicContact CE2-CG 3.75Å; Y699-R715 HydrophobicContact CG-CB 3.93Å; Y699-R715 HydrophobicContact CG-CG 4.22Å; Y699-R715 VanDerWaalsContact O-CB 3.3Å; Y699-R715 WeakPolarHBondContact O-CB 3.31Å; Y699-R715 WeakPolarHBondContact O-CD 3.19Å; Y699-V719 HydrophobicContact CD1-CG2 3.82Å; Y699-V719 HydrophobicContact CG-CG2 4.41Å
700	Q	90.3	Very high	90	Very high	72 Å²	72	56.6 Å²	56.6	34%	0.336	28%	0.281	S	S	.	.			trans	-122	133.5	176.8	-70.6	176.2	37.3	0	0	112.4	Q560 K696 A697 N712	Q560-Q700 PolarHBondContact NE2-O 3.01Å; K696-Q700 WeakPolarHBondContact O-CG 3.08Å; K696-Q700 PolarHBondContact O-NE2 3.48Å; A697-Q700 PolarHBondContact O-N 2.9Å; Q700-N712 HydrophobicContact CG-CB 4.18Å
701	L	91.1	Very high	90.5	Very high	25 Å²	25	54.8 Å²	54.8	13%	0.131	27%	0.271	C	S	.	.			trans	-91.1	121.3	174.3	179.7	60.3	0	0	0	109.7	I564 Q566 Q703 V708 N712	I564-L701 HydrophobicContact CB-CB 4.34Å; I564-L701 HydrophobicContact CD1-CB 4Å; Q566-L701 HydrophobicContact CB-CD2 3.68Å; Q566-L701 HydrophobicContact CG-CD2 3.99Å; L701-Q703 VanDerWaalsContact C-N 3.27Å; L701-Q703 HydrophobicContact CD2-CG 4.45Å; L701-Q703 HydrophobicContact CG-CG 4.09Å; L701-Q703 PolarHBondContact O-N 2.72Å; L701-V708 HydrophobicContact CB-CG1 3.96Å; L701-V708 HydrophobicContact CD2-CG1 4.01Å; L701-V708 HydrophobicContact CG-CG1 4.17Å; L701-N712 PolarHBondContact N-ND2 3.44Å; L701-N712 PolarHBondContact N-OD1 2.97Å; L701-N712 PolarHBondContact O-ND2 2.89Å
702	D	88.7	Confident	90.7	Very high	140 Å²	140	55.5 Å²	55.5	75%	0.749	28%	0.275	S	S	*	.			trans	-73.7	74.7	-178	-172.5	21.2	0	0	0	112.4
703	Q	88.9	Confident	90.9	Very high	100 Å²	100	61.8 Å²	61.8	47%	0.467	30%	0.303	S	S	.	.			trans	-142.1	136.5	174.6	-62.7	-177.2	20	0	0	111.6	L701 A705 V708	L701-Q703 VanDerWaalsContact C-N 3.27Å; L701-Q703 HydrophobicContact CD2-CG 4.45Å; L701-Q703 HydrophobicContact CG-CG 4.09Å; L701-Q703 PolarHBondContact O-N 2.72Å; Q703-A705 VanDerWaalsContact C-N 3.28Å; Q703-A705 PolarHBondContact O-N 3.43Å; Q703-V708 HydrophobicContact CB-CB 4.48Å; Q703-V708 HydrophobicContact CB-CG1 4.21Å; Q703-V708 HydrophobicContact CB-CG2 4.44Å
704	F	88	Confident	91.2	Very high	172 Å²	172	57.4 Å²	57.4	75%	0.754	28%	0.282	S	S	*	.			trans	-85.2	14	-175.1	-58.2	-85.1	0	0	0	114.7
705	A	90.2	Very high	91.6	Very high	38 Å²	38	55.6 Å²	55.6	31%	0.314	27%	0.274	S	S	.	.			trans	-78.4	136.4	179	0	0	0	0	0	110.9	Q703 H707 V708 Q709	Q703-A705 VanDerWaalsContact C-N 3.28Å; Q703-A705 PolarHBondContact O-N 3.43Å; A705-H707 PolarHBondContact O-N 3.36Å; A705-V708 HydrophobicContact CB-CB 4.48Å; A705-V708 HydrophobicContact CB-CG2 3.96Å; A705-V708 WeakPolarHBondContact O-CA 3.42Å; A705-V708 WeakPolarHBondContact O-CB 3.18Å; A705-V708 PolarHBondContact O-N 2.89Å; A705-Q709 PolarHBondContact O-N 2.98Å
706	K	90	Very high	91.8	Very high	144 Å²	144	56.3 Å²	56.3	63%	0.626	28%	0.28	S	S	*	.	H	α-helix	trans	-53	-45.9	-171.3	-177.7	173.9	179.2	-73.1	0	113.8	V708 Q709 E710	K706-V708 VanDerWaalsContact C-N 3.33Å; K706-V708 PolarHBondContact O-N 2.94Å; K706-Q709 PolarHBondContact O-N 2.85Å; K706-E710 WeakPolarHBondContact CE-OE1 3.32Å; K706-E710 IonicContact NZ-OE1 3.38Å; K706-E710 PolarHBondContact NZ-OE1 3.26Å; K706-E710 WeakPolarHBondContact O-CG 3.48Å; K706-E710 PolarHBondContact O-N 3.45Å
707	H	88.9	Confident	91.9	Very high	67 Å²	67	58.3 Å²	58.3	31%	0.31	29%	0.29	S	S	.	.	H	α-helix	trans	-65.6	-35.2	177.8	58.5	-96.1	0	0	0	112.1	A705 E710 W711	A705-H707 PolarHBondContact O-N 3.36Å; H707-E710 PolarHBondContact O-N 3.47Å; H707-W711 WeakPolarHBondContact O-CB 3.3Å; H707-W711 PolarHBondContact O-N 3.42Å
708	V	91.6	Very high	92.2	Very high	0 Å²	0	56 Å²	56	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-68	-39.2	175.3	-171.6	0	0	0	0	110.8	Q566 L701 Q703 A705 K706 W711 N712	Q566-V708 HydrophobicContact CG-CG2 3.79Å; L701-V708 HydrophobicContact CB-CG1 3.96Å; L701-V708 HydrophobicContact CD2-CG1 4.01Å; L701-V708 HydrophobicContact CG-CG1 4.17Å; Q703-V708 HydrophobicContact CB-CB 4.48Å; Q703-V708 HydrophobicContact CB-CG1 4.21Å; Q703-V708 HydrophobicContact CB-CG2 4.44Å; A705-V708 HydrophobicContact CB-CB 4.48Å; A705-V708 HydrophobicContact CB-CG2 3.96Å; A705-V708 WeakPolarHBondContact O-CA 3.42Å; A705-V708 WeakPolarHBondContact O-CB 3.18Å; A705-V708 PolarHBondContact O-N 2.89Å; K706-V708 VanDerWaalsContact C-N 3.33Å; K706-V708 PolarHBondContact O-N 2.94Å; V708-W711 PolarHBondContact O-N 3.44Å; V708-N712 VanDerWaalsContact O-CB 3.24Å; V708-N712 WeakPolarHBondContact O-CB 3.45Å; V708-N712 PolarHBondContact O-N 3.32Å
709	Q	91.9	Very high	92.3	Very high	101 Å²	101	55.3 Å²	55.3	47%	0.472	27%	0.267	S	S	.	.	H	α-helix	trans	-65.1	-39.4	174.8	-67.6	177.7	-28.1	0	0	112	A705 K706 K713	A705-Q709 PolarHBondContact O-N 2.98Å; K706-Q709 PolarHBondContact O-N 2.85Å; Q709-K713 WeakPolarHBondContact O-CB 3.2Å; Q709-K713 PolarHBondContact O-N 2.95Å
710	E	92.7	Very high	92.3	Very high	59 Å²	59	58.3 Å²	58.3	28%	0.276	28%	0.281	S	S	.	.	H	α-helix	trans	-63.4	-45.9	173.2	-71.8	165.1	170.2	0	0	111.8	P571 K706 H707 K713 L714	P571-E710 HydrophobicContact CG-CB 3.82Å; K706-E710 WeakPolarHBondContact CE-OE1 3.32Å; K706-E710 IonicContact NZ-OE1 3.38Å; K706-E710 PolarHBondContact NZ-OE1 3.26Å; K706-E710 WeakPolarHBondContact O-CG 3.48Å; K706-E710 PolarHBondContact O-N 3.45Å; H707-E710 PolarHBondContact O-N 3.47Å; E710-K713 PolarHBondContact O-N 3.23Å; E710-L714 WeakPolarHBondContact O-CG 3.44Å; E710-L714 PolarHBondContact O-N 3.24Å
711	W	94.7	Very high	92.6	Very high	0 Å²	0	57.3 Å²	57.3	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-65.5	-42.6	174.9	-82.3	113	0	0	0	112.8	F540 H543 F544 E567 I569 P571 L574 H707 V708 K713 L714 R715	F540-W711 AromaticContact CE1-CH2 3.83Å; F540-W711 HydrophobicContact CE1-CH2 3.83Å; F540-W711 HydrophobicContact CE1-CZ3 4.13Å; F540-W711 AromaticContact CZ-CH2 3.83Å; F540-W711 HydrophobicContact CZ-CH2 3.83Å; F540-W711 HydrophobicContact CZ-CZ3 4.43Å; H543-W711 HydrophobicContact CB-CH2 3.88Å; H543-W711 HydrophobicContact CB-CZ2 4.16Å; F544-W711 HydrophobicContact CD1-CE3 4.49Å; F544-W711 HydrophobicContact CD1-CZ3 4.31Å; F544-W711 HydrophobicContact CD2-CH2 4.5Å; F544-W711 AromaticContact CD2-CZ3 3.73Å; F544-W711 HydrophobicContact CD2-CZ3 3.73Å; F544-W711 HydrophobicContact CE1-CZ3 4.42Å; F544-W711 AromaticContact CE2-CZ3 3.87Å; F544-W711 HydrophobicContact CE2-CZ3 3.87Å; F544-W711 HydrophobicContact CG-CE3 4.46Å; F544-W711 AromaticContact CG-CZ3 3.98Å; F544-W711 HydrophobicContact CG-CZ3 3.98Å; F544-W711 HydrophobicContact CZ-CZ3 4.22Å; E567-W711 HydrophobicContact CB-CZ2 4.18Å; E567-W711 HydrophobicContact CG-CZ2 4.19Å; I569-W711 PolarHBondContact O-NE1 3.38Å; P571-W711 HydrophobicContact CB-CD2 4.15Å; P571-W711 HydrophobicContact CB-CE3 4.34Å; P571-W711 HydrophobicContact CB-CH2 4.16Å; P571-W711 HydrophobicContact CB-CZ2 3.94Å; P571-W711 HydrophobicContact CB-CZ3 4.35Å; P571-W711 HydrophobicContact CG-CD2 4.39Å; L574-W711 HydrophobicContact CD2-CH2 3.92Å; L574-W711 HydrophobicContact CD2-CZ2 3.8Å; H707-W711 WeakPolarHBondContact O-CB 3.3Å; H707-W711 PolarHBondContact O-N 3.42Å; V708-W711 PolarHBondContact O-N 3.44Å; W711-K713 VanDerWaalsContact C-N 3.32Å; W711-K713 PolarHBondContact O-N 3.32Å; W711-L714 HydrophobicContact CE3-CD1 4.41Å; W711-L714 PolarHBondContact O-N 2.88Å; W711-R715 VanDerWaalsContact O-CG 3.27Å; W711-R715 WeakPolarHBondContact O-CG 3.34Å; W711-R715 PolarHBondContact O-N 3.31Å
712	N	93.7	Very high	92.8	Very high	18 Å²	18	56.1 Å²	56.1	10%	0.096	27%	0.272	C	S	.	.	H	α-helix	trans	-61.5	-38.6	176.4	-77.5	-6.8	0	0	0	112.1	Q700 L701 V708 R715 A716	Q700-N712 HydrophobicContact CG-CB 4.18Å; L701-N712 PolarHBondContact N-ND2 3.44Å; L701-N712 PolarHBondContact N-OD1 2.97Å; L701-N712 PolarHBondContact O-ND2 2.89Å; V708-N712 VanDerWaalsContact O-CB 3.24Å; V708-N712 WeakPolarHBondContact O-CB 3.45Å; V708-N712 PolarHBondContact O-N 3.32Å; N712-R715 PolarHBondContact O-N 2.95Å; N712-R715 PolarHBondContact OD1-NH1 2.76Å; N712-A716 WeakPolarHBondContact O-CB 3.32Å; N712-A716 PolarHBondContact O-N 3.4Å
713	K	93.7	Very high	93.1	Very high	134 Å²	134	49.5 Å²	49.5	58%	0.583	24%	0.236	S	C	*	.	H	α-helix	trans	-59	-49.6	172.2	177.8	176	171.4	178.2	0	110.8	Q709 E710 W711 R715 A716 E717	Q709-K713 WeakPolarHBondContact O-CB 3.2Å; Q709-K713 PolarHBondContact O-N 2.95Å; E710-K713 PolarHBondContact O-N 3.23Å; W711-K713 VanDerWaalsContact C-N 3.32Å; W711-K713 PolarHBondContact O-N 3.32Å; K713-R715 PolarHBondContact O-N 3.32Å; K713-A716 PolarHBondContact O-N 2.81Å; K713-E717 WeakPolarHBondContact CE-OE1 3.39Å; K713-E717 WeakPolarHBondContact CG-OE1 3.25Å; K713-E717 IonicContact NZ-OE1 2.92Å; K713-E717 WeakPolarHBondContact O-CG 3.31Å; K713-E717 PolarHBondContact O-N 2.84Å
714	L	94.2	Very high	93.3	Very high	16 Å²	16	47.9 Å²	47.9	8%	0.084	23%	0.229	C	C	.	.	H	α-helix	trans	-63.4	-38.8	178.3	-65.1	176.6	0	0	0	112.8	F544 P571 I590 K594 E710 W711 E717 C718	F544-L714 HydrophobicContact CE1-CB 3.97Å; F544-L714 HydrophobicContact CZ-CB 4.45Å; P571-L714 HydrophobicContact CB-CD1 3.41Å; P571-L714 VanDerWaalsContact CB-CD1 3.41Å; P571-L714 HydrophobicContact CG-CD1 3.63Å; I590-L714 HydrophobicContact CG2-CD1 4.2Å; I590-L714 HydrophobicContact CG2-CD2 3.61Å; K594-L714 HydrophobicContact CD-CD2 3.89Å; K594-L714 HydrophobicContact CG-CD2 4.24Å; E710-L714 WeakPolarHBondContact O-CG 3.44Å; E710-L714 PolarHBondContact O-N 3.24Å; W711-L714 HydrophobicContact CE3-CD1 4.41Å; W711-L714 PolarHBondContact O-N 2.88Å; L714-E717 PolarHBondContact O-N 2.61Å; L714-C718 PolarHBondContact O-N 3.43Å; L714-C718 PolarHBondContact O-SG 2.59Å
715	R	95.7	Very high	93.6	Very high	0 Å²	0	46 Å²	46	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-61.9	-48.2	175.1	-69.4	164.2	-174.7	141.9	-0.2	111.7	F544 I564 Q566 Y699 W711 N712 K713 E717 C718 V719	F544-R715 HydrophobicContact CD1-CG 4.06Å; F544-R715 VanDerWaalsContact O-CZ 3.27Å; F544-R715 PolarHBondContact O-NE 2.69Å; F544-R715 PolarHBondContact O-NH2 3.21Å; I564-R715 VanDerWaalsContact CG2-CZ 3.43Å; I564-R715 VanDerWaalsContact CG2-NH2 3.33Å; Q566-R715 VanDerWaalsContact OE1-CZ 3.31Å; Y699-R715 HydrophobicContact CD1-CB 4.35Å; Y699-R715 HydrophobicContact CD2-CB 3.96Å; Y699-R715 HydrophobicContact CD2-CG 3.75Å; Y699-R715 HydrophobicContact CE2-CB 4.38Å; Y699-R715 HydrophobicContact CE2-CG 3.75Å; Y699-R715 HydrophobicContact CG-CB 3.93Å; Y699-R715 HydrophobicContact CG-CG 4.22Å; Y699-R715 VanDerWaalsContact O-CB 3.3Å; Y699-R715 WeakPolarHBondContact O-CB 3.31Å; Y699-R715 WeakPolarHBondContact O-CD 3.19Å; W711-R715 VanDerWaalsContact O-CG 3.27Å; W711-R715 WeakPolarHBondContact O-CG 3.34Å; W711-R715 PolarHBondContact O-N 3.31Å; N712-R715 PolarHBondContact O-N 2.95Å; N712-R715 PolarHBondContact OD1-NH1 2.76Å; K713-R715 PolarHBondContact O-N 3.32Å; R715-E717 VanDerWaalsContact C-N 3.35Å; R715-E717 PolarHBondContact O-N 3.48Å; R715-C718 WeakPolarHBondContact O-CB 3.45Å; R715-C718 PolarHBondContact O-N 3.45Å; R715-C718 VanDerWaalsContact O-N 3.12Å; R715-V719 PolarHBondContact O-N 2.96Å
716	A	94.4	Very high	93.8	Very high	16 Å²	16	45.8 Å²	45.8	13%	0.132	21%	0.211	C	C	.	.	H	α-helix	trans	-61.3	-41.8	176.9	0	0	0	0	0	112	K696 N712 K713 C718 V719 Q720	K696-A716 HydrophobicContact CB-CB 4.17Å; K696-A716 HydrophobicContact CD-CB 4.13Å; K696-A716 HydrophobicContact CG-CB 4.19Å; N712-A716 WeakPolarHBondContact O-CB 3.32Å; N712-A716 PolarHBondContact O-N 3.4Å; K713-A716 PolarHBondContact O-N 2.81Å; A716-C718 VanDerWaalsContact C-N 3.32Å; A716-C718 PolarHBondContact O-N 2.76Å; A716-V719 PolarHBondContact O-N 3.43Å; A716-Q720 WeakPolarHBondContact O-CB 3.34Å; A716-Q720 PolarHBondContact O-N 2.85Å
717	E	94.8	Very high	94.1	Very high	54 Å²	54	38.9 Å²	38.9	25%	0.252	18%	0.182	S	C	.	.	H	α-helix	trans	-64.1	-33.7	173.7	-71.7	173.4	-173.7	0	0	112.7	K594 K713 L714 R715 L721	K594-E717 WeakPolarHBondContact CE-OE2 3.45Å; K594-E717 IonicContact NZ-OE2 3.98Å; K594-E717 PolarHBondContact NZ-OE2 2.79Å; K713-E717 WeakPolarHBondContact CE-OE1 3.39Å; K713-E717 WeakPolarHBondContact CG-OE1 3.25Å; K713-E717 IonicContact NZ-OE1 2.92Å; K713-E717 WeakPolarHBondContact O-CG 3.31Å; K713-E717 PolarHBondContact O-N 2.84Å; L714-E717 PolarHBondContact O-N 2.61Å; R715-E717 VanDerWaalsContact C-N 3.35Å; R715-E717 PolarHBondContact O-N 3.48Å; E717-L721 WeakPolarHBondContact O-CB 3.43Å; E717-L721 PolarHBondContact O-N 3.43Å
718	C	96	Very high	94.4	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-70.1	-42.2	174.6	-67.8	0	0	0	0	112.5	F544 V597 A598 L601 L714 R715 A716 A722	F544-C718 VanDerWaalsContact CE1-SG 3.52Å; V597-C718 HydrophobicContact CB-CB 4.49Å; V597-C718 HydrophobicContact CG1-CB 4.02Å; A598-C718 HydrophobicContact CB-CB 4.41Å; A598-C718 WeakPolarHBondContact CB-O 3.31Å; L601-C718 HydrophobicContact CD1-CB 4.31Å; L714-C718 PolarHBondContact O-N 3.43Å; L714-C718 PolarHBondContact O-SG 2.59Å; R715-C718 WeakPolarHBondContact O-CB 3.45Å; R715-C718 PolarHBondContact O-N 3.45Å; R715-C718 VanDerWaalsContact O-N 3.12Å; A716-C718 VanDerWaalsContact C-N 3.32Å; A716-C718 PolarHBondContact O-N 2.76Å; C718-A722 VanDerWaalsContact O-CB 3.24Å; C718-A722 WeakPolarHBondContact O-CB 3.32Å; C718-A722 PolarHBondContact O-N 3.33Å
719	V	95.1	Very high	94.6	Very high	1 Å²	1	38 Å²	38	1%	0.006	18%	0.182	C	C	.	.	H	α-helix	trans	-62.1	-47	174.7	170.6	0	0	0	0	110.5	Y551 L601 K696 Y699 R715 A716 A722 L723	Y551-V719 HydrophobicContact CE1-CG2 4.31Å; Y551-V719 HydrophobicContact CE2-CG2 3.92Å; Y551-V719 VanDerWaalsContact OH-CG1 3.28Å; Y551-V719 WeakPolarHBondContact OH-CG1 3.49Å; L601-V719 HydrophobicContact CD1-CG2 4.35Å; K696-V719 HydrophobicContact CG-CB 4.09Å; K696-V719 HydrophobicContact CG-CG1 3.91Å; Y699-V719 HydrophobicContact CD1-CG2 3.82Å; Y699-V719 HydrophobicContact CG-CG2 4.41Å; R715-V719 PolarHBondContact O-N 2.96Å; A716-V719 PolarHBondContact O-N 3.43Å; V719-A722 PolarHBondContact O-N 3.24Å; V719-L723 HydrophobicContact CG1-CD1 3.94Å; V719-L723 HydrophobicContact CG1-CG 4.46Å; V719-L723 WeakPolarHBondContact O-CG 3.33Å; V719-L723 PolarHBondContact O-N 2.93Å
720	Q	94.5	Very high	94.7	Very high	68 Å²	68	35.9 Å²	35.9	32%	0.318	17%	0.173	S	C	.	.	H	α-helix	trans	-60.9	-47.5	178.2	-174.4	169.6	-13.6	0	0	111.8	K696 A716 A722 L723 Q724	K696-Q720 HydrophobicContact CD-CB 4.3Å; A716-Q720 WeakPolarHBondContact O-CB 3.34Å; A716-Q720 PolarHBondContact O-N 2.85Å; Q720-A722 VanDerWaalsContact C-N 3.33Å; Q720-A722 PolarHBondContact O-N 2.96Å; Q720-L723 PolarHBondContact O-N 3.3Å; Q720-Q724 HydrophobicContact CG-CG 4.38Å; Q720-Q724 WeakPolarHBondContact O-CB 3.35Å; Q720-Q724 PolarHBondContact O-N 3Å
721	L	94.9	Very high	94.9	Very high	50 Å²	50	33 Å²	33	26%	0.262	16%	0.16	S	C	.	.	H	α-helix	trans	-62.5	-38.4	177	-177.3	62.9	0	0	0	112.2	A598 E717 K725 W726	A598-L721 HydrophobicContact CB-CB 3.92Å; A598-L721 HydrophobicContact CB-CD2 3.76Å; A598-L721 HydrophobicContact CB-CG 3.85Å; E717-L721 WeakPolarHBondContact O-CB 3.43Å; E717-L721 PolarHBondContact O-N 3.43Å; L721-K725 HydrophobicContact CD1-CB 4.02Å; L721-K725 HydrophobicContact CD1-CD 3.7Å; L721-K725 HydrophobicContact CD1-CG 4.48Å; L721-K725 WeakPolarHBondContact O-CB 3.43Å; L721-K725 PolarHBondContact O-N 2.89Å; L721-W726 HydrophobicContact CG-CH2 4.49Å; L721-W726 HydrophobicContact CG-CZ3 4.3Å
722	A	95.8	Very high	94.9	Very high	1 Å²	1	34.6 Å²	34.6	1%	0.008	17%	0.168	C	C	.	.	H	α-helix	trans	-64.2	-47.6	177.8	0	0	0	0	0	112.1	A598 L601 A602 C718 V719 Q720 V727	A598-A722 HydrophobicContact CB-CB 4.25Å; A598-A722 VanDerWaalsContact O-CB 3.28Å; A598-A722 WeakPolarHBondContact O-CB 3.44Å; L601-A722 HydrophobicContact CB-CB 3.72Å; L601-A722 HydrophobicContact CD1-CB 4.31Å; A602-A722 HydrophobicContact CB-CB 4.2Å; C718-A722 VanDerWaalsContact O-CB 3.24Å; C718-A722 WeakPolarHBondContact O-CB 3.32Å; C718-A722 PolarHBondContact O-N 3.33Å; V719-A722 PolarHBondContact O-N 3.24Å; Q720-A722 VanDerWaalsContact C-N 3.33Å; Q720-A722 PolarHBondContact O-N 2.96Å; A722-V727 PolarHBondContact O-N 3.44Å
723	L	94.9	Very high	95	Very high	1 Å²	1	39.8 Å²	39.8	1%	0.005	19%	0.19	C	C	.	.	I	π-helix	trans	-75.9	-52.6	-175	-64.6	-178.5	0	0	0	112	L607 M611 V692 V719 Q720 V727 I728	L607-L723 HydrophobicContact CD2-CD2 3.99Å; M611-L723 HydrophobicContact CE-CD1 4.4Å; M611-L723 HydrophobicContact CE-CD2 3.93Å; M611-L723 HydrophobicContact CG-CD2 3.83Å; M611-L723 HydrophobicContact SD-CD1 4.23Å; M611-L723 HydrophobicContact SD-CD2 3.74Å; V692-L723 HydrophobicContact CG1-CB 4.28Å; V692-L723 HydrophobicContact CG1-CD1 4.07Å; V719-L723 HydrophobicContact CG1-CD1 3.94Å; V719-L723 HydrophobicContact CG1-CG 4.46Å; V719-L723 WeakPolarHBondContact O-CG 3.33Å; V719-L723 PolarHBondContact O-N 2.93Å; Q720-L723 PolarHBondContact O-N 3.3Å; L723-V727 HydrophobicContact CD2-CB 4.13Å; L723-V727 HydrophobicContact CD2-CG1 4.38Å; L723-V727 HydrophobicContact CD2-CG2 4.33Å; L723-V727 PolarHBondContact O-N 3.09Å; L723-I728 HydrophobicContact CB-CD1 4.16Å; L723-I728 WeakPolarHBondContact O-CB 3.49Å; L723-I728 WeakPolarHBondContact O-CG1 3.28Å; L723-I728 PolarHBondContact O-N 2.77Å
724	Q	93.7	Very high	95.1	Very high	66 Å²	66	35.3 Å²	35.3	31%	0.308	17%	0.171	S	C	.	.	I	π-helix	trans	-73.3	-34.2	-174.8	-67.2	-177	-41.6	0	0	113.4	Q720 P729	Q720-Q724 HydrophobicContact CG-CG 4.38Å; Q720-Q724 WeakPolarHBondContact O-CB 3.35Å; Q720-Q724 PolarHBondContact O-N 3Å; Q724-P729 VanDerWaalsContact O-CD 3.24Å; Q724-P729 WeakPolarHBondContact O-CD 3.38Å; Q724-P729 VanDerWaalsContact O-CG 3.23Å; Q724-P729 WeakPolarHBondContact O-CG 3.45Å
725	K	94.2	Very high	95.2	Very high	133 Å²	133	34.5 Å²	34.5	58%	0.578	17%	0.167	S	C	*	.	I	π-helix	trans	-87.6	-18.4	-174.8	-165.6	161.4	-174.5	157	0	114.8	L721	L721-K725 HydrophobicContact CD1-CB 4.02Å; L721-K725 HydrophobicContact CD1-CD 3.7Å; L721-K725 HydrophobicContact CD1-CG 4.48Å; L721-K725 WeakPolarHBondContact O-CB 3.43Å; L721-K725 PolarHBondContact O-N 2.89Å
726	W	94.4	Very high	95.2	Very high	32 Å²	32	38.1 Å²	38.1	12%	0.121	18%	0.181	C	C	.	.	I	π-helix	trans	-137.9	-60.5	-174.4	-61.9	-54.9	0	0	0	112.9	Y595 A598 R599 A602 L721 D730	Y595-W726 HydrophobicContact CD2-CH2 4.09Å; Y595-W726 HydrophobicContact CD2-CZ2 4.39Å; Y595-W726 AromaticContact CE2-CH2 3.84Å; Y595-W726 HydrophobicContact CE2-CH2 3.84Å; Y595-W726 AromaticContact CE2-CZ2 3.71Å; Y595-W726 HydrophobicContact CE2-CZ2 3.71Å; Y595-W726 AromaticContact CZ-CZ2 3.89Å; A598-W726 HydrophobicContact CB-CZ3 3.85Å; R599-W726 HydrophobicContact CB-CH2 4.23Å; R599-W726 HydrophobicContact CB-CZ3 4.24Å; R599-W726 VanDerWaalsContact NH1-CD1 3.32Å; A602-W726 HydrophobicContact CB-CB 3.88Å; A602-W726 HydrophobicContact CB-CD2 4.23Å; A602-W726 HydrophobicContact CB-CE3 3.63Å; A602-W726 HydrophobicContact CB-CG 4.37Å; L721-W726 HydrophobicContact CG-CH2 4.49Å; L721-W726 HydrophobicContact CG-CZ3 4.3Å; W726-D730 VanDerWaalsContact O-CB 3.31Å; W726-D730 WeakPolarHBondContact O-CB 3.43Å; W726-D730 PolarHBondContact O-N 3.06Å
727	V	95.7	Very high	95.2	Very high	0 Å²	0	40 Å²	40	0%	0	19%	0.193	C	C	.	.	I	π-helix	trans	-67.2	-45.6	-168.6	-177.2	0	0	0	0	112.5	A602 L607 M611 A722 L723 L731	A602-V727 HydrophobicContact CB-CG2 3.82Å; L607-V727 HydrophobicContact CD2-CG1 4.26Å; L607-V727 HydrophobicContact CD2-CG2 3.87Å; M611-V727 HydrophobicContact CB-CG1 3.78Å; M611-V727 HydrophobicContact CG-CG1 3.98Å; A722-V727 PolarHBondContact O-N 3.44Å; L723-V727 HydrophobicContact CD2-CB 4.13Å; L723-V727 HydrophobicContact CD2-CG1 4.38Å; L723-V727 HydrophobicContact CD2-CG2 4.33Å; L723-V727 PolarHBondContact O-N 3.09Å; V727-L731 HydrophobicContact CG1-CD1 3.82Å; V727-L731 HydrophobicContact CG1-CG 4.41Å; V727-L731 WeakPolarHBondContact O-CB 3.39Å; V727-L731 WeakPolarHBondContact O-CG 3.39Å; V727-L731 PolarHBondContact O-N 3.25Å
728	I	95.2	Very high	95.2	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-69.1	-46.3	-179.9	-64.1	169.2	0	0	0	111.3	M611 Y615 E676 F678 V692 L723 D730 L731 I732	M611-I728 HydrophobicContact CE-CD1 4.4Å; M611-I728 HydrophobicContact CE-CG1 4.11Å; Y615-I728 HydrophobicContact CE2-CG2 4.46Å; E676-I728 HydrophobicContact CB-CG2 4.07Å; E676-I728 HydrophobicContact CG-CG2 3.99Å; F678-I728 HydrophobicContact CE1-CD1 4.21Å; V692-I728 HydrophobicContact CG2-CD1 3.77Å; L723-I728 HydrophobicContact CB-CD1 4.16Å; L723-I728 WeakPolarHBondContact O-CB 3.49Å; L723-I728 WeakPolarHBondContact O-CG1 3.28Å; L723-I728 PolarHBondContact O-N 2.77Å; I728-D730 PolarHBondContact O-N 2.84Å; I728-L731 PolarHBondContact O-N 2.76Å; I728-I732 HydrophobicContact CG2-CD1 3.88Å; I728-I732 HydrophobicContact CG2-CG1 4.41Å; I728-I732 WeakPolarHBondContact O-CG1 3.38Å; I728-I732 PolarHBondContact O-N 3.41Å
729	P	95.5	Very high	95.1	Very high	49 Å²	49	38.9 Å²	38.9	32%	0.318	19%	0.189	S	C	.	.	H	α-helix	trans	-57.8	-42.3	172.6	-28.7	36.2	0	0	0	114.5	Q724 L731 I732 K733	Q724-P729 VanDerWaalsContact O-CD 3.24Å; Q724-P729 WeakPolarHBondContact O-CD 3.38Å; Q724-P729 VanDerWaalsContact O-CG 3.23Å; Q724-P729 WeakPolarHBondContact O-CG 3.45Å; P729-L731 VanDerWaalsContact C-N 3.33Å; P729-L731 PolarHBondContact O-N 2.79Å; P729-I732 PolarHBondContact O-N 3.3Å; P729-K733 PolarHBondContact O-N 3.14Å; P729-K733 VanDerWaalsContact O-N 3.1Å
730	D	94.9	Very high	95.1	Very high	55 Å²	55	41.1 Å²	41.1	29%	0.294	20%	0.2	S	C	.	.	H	α-helix	trans	-59.6	-45	174.6	-71.7	-16.5	0	0	0	111	R608 W726 I728 I732 K733 E734	R608-D730 IonicContact CZ-OD2 3.84Å; R608-D730 VanDerWaalsContact CZ-OD2 3.23Å; R608-D730 IonicContact NH1-OD2 2.46Å; R608-D730 PolarHBondContact NH1-OD2 3.29Å; R608-D730 IonicContact NH2-OD2 3.58Å; R608-D730 PolarHBondContact NH2-OD2 3.07Å; W726-D730 VanDerWaalsContact O-CB 3.31Å; W726-D730 WeakPolarHBondContact O-CB 3.43Å; W726-D730 PolarHBondContact O-N 3.06Å; I728-D730 PolarHBondContact O-N 2.84Å; D730-I732 VanDerWaalsContact C-N 3.35Å; D730-K733 WeakPolarHBondContact O-CB 3.49Å; D730-K733 PolarHBondContact O-N 3.2Å; D730-E734 WeakPolarHBondContact O-CB 3.45Å; D730-E734 PolarHBondContact O-N 3.16Å
731	L	96.1	Very high	95	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-70.9	-27.2	179.7	-70.1	174.3	0	0	0	113	M611 R612 Y615 F616 V727 I728 P729 L735	M611-L731 HydrophobicContact CB-CD1 3.72Å; R612-L731 HydrophobicContact CB-CD1 4.47Å; R612-L731 HydrophobicContact CB-CD2 3.64Å; R612-L731 HydrophobicContact CG-CD2 3.93Å; Y615-L731 HydrophobicContact CD1-CB 4.17Å; F616-L731 HydrophobicContact CE1-CB 4.34Å; F616-L731 HydrophobicContact CE1-CD2 4.15Å; V727-L731 HydrophobicContact CG1-CD1 3.82Å; V727-L731 HydrophobicContact CG1-CG 4.41Å; V727-L731 WeakPolarHBondContact O-CB 3.39Å; V727-L731 WeakPolarHBondContact O-CG 3.39Å; V727-L731 PolarHBondContact O-N 3.25Å; I728-L731 PolarHBondContact O-N 2.76Å; P729-L731 VanDerWaalsContact C-N 3.33Å; P729-L731 PolarHBondContact O-N 2.79Å; L731-L735 WeakPolarHBondContact O-CB 3.25Å; L731-L735 PolarHBondContact O-N 3.24Å
732	I	96.3	Very high	95	Very high	32 Å²	32	40.9 Å²	40.9	16%	0.164	20%	0.197	C	C	.	.	H	α-helix	trans	-68.9	-42.3	171.1	-72	168.1	0	0	0	110.6	Y615 F674 E676 I728 P729 D730 R736	Y615-I732 HydrophobicContact CE1-CG1 3.8Å; Y615-I732 WeakPolarHBondContact OH-CG1 3.43Å; F674-I732 HydrophobicContact CB-CD1 4.17Å; F674-I732 HydrophobicContact CB-CG1 4.06Å; F674-I732 HydrophobicContact CB-CG2 3.9Å; F674-I732 HydrophobicContact CD2-CG2 4.08Å; F674-I732 HydrophobicContact CG-CG2 4.09Å; E676-I732 HydrophobicContact CG-CD1 4.03Å; I728-I732 HydrophobicContact CG2-CD1 3.88Å; I728-I732 HydrophobicContact CG2-CG1 4.41Å; I728-I732 WeakPolarHBondContact O-CG1 3.38Å; I728-I732 PolarHBondContact O-N 3.41Å; P729-I732 PolarHBondContact O-N 3.3Å; D730-I732 VanDerWaalsContact C-N 3.35Å; I732-R736 WeakPolarHBondContact O-CB 3.11Å; I732-R736 PolarHBondContact O-N 2.62Å
733	K	95.5	Very high	94.9	Very high	128 Å²	128	40.8 Å²	40.8	56%	0.557	20%	0.197	S	C	*	.	H	α-helix	trans	-58.6	-49.3	170.8	-83.9	-165.5	166.8	-167.3	0	111	E8 P729 D730 L735 R736 S737	E8-K733 IonicContact OE1-NZ 2.75Å; E8-K733 PolarHBondContact OE1-NZ 3.34Å; P729-K733 PolarHBondContact O-N 3.14Å; P729-K733 VanDerWaalsContact O-N 3.1Å; D730-K733 WeakPolarHBondContact O-CB 3.49Å; D730-K733 PolarHBondContact O-N 3.2Å; K733-L735 PolarHBondContact O-N 3.11Å; K733-R736 PolarHBondContact O-N 2.73Å; K733-S737 PolarHBondContact O-N 3.18Å; K733-S737 VanDerWaalsContact O-N 3.09Å
734	E	95.3	Very high	94.9	Very high	39 Å²	39	41.8 Å²	41.8	18%	0.182	20%	0.201	C	C	.	.	H	α-helix	trans	-62.3	-42.2	-178.8	-161.1	-169.2	103.4	0	0	112.6	E448 R612 F616 D730 S737 T738	E448-E734 HydrophobicContact CG-CG 4.3Å; R612-E734 VanDerWaalsContact CD-OE1 3.23Å; R612-E734 WeakPolarHBondContact CD-OE1 3.42Å; R612-E734 IonicContact CZ-OE1 2.66Å; R612-E734 IonicContact CZ-OE2 2.69Å; R612-E734 VanDerWaalsContact NE-CD 3.31Å; R612-E734 IonicContact NE-OE1 2.66Å; R612-E734 PolarHBondContact NE-OE1 3.08Å; R612-E734 IonicContact NE-OE2 3.8Å; R612-E734 PolarHBondContact NE-OE2 3.23Å; R612-E734 VanDerWaalsContact NE-OE2 3.13Å; R612-E734 IonicContact NH2-OE1 3.91Å; R612-E734 IonicContact NH2-OE2 3.18Å; R612-E734 PolarHBondContact NH2-OE2 3.35Å; F616-E734 HydrophobicContact CZ-CB 4.15Å; F616-E734 HydrophobicContact CZ-CG 4.15Å; F616-E734 WeakPolarHBondContact CZ-OE1 3.25Å; D730-E734 WeakPolarHBondContact O-CB 3.45Å; D730-E734 PolarHBondContact O-N 3.16Å; E734-S737 PolarHBondContact O-N 3.48Å; E734-T738 PolarHBondContact O-N 3.34Å; E734-T738 PolarHBondContact O-OG1 3.35Å
735	L	95.6	Very high	94.8	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-65.3	-41.7	175.9	-179.2	60.5	0	0	0	111.9	V327 Y615 F616 A619 V650 F674 L731 K733 T738 L739	V327-L735 HydrophobicContact CG1-CD1 3.95Å; Y615-L735 HydrophobicContact CD1-CD2 4.24Å; Y615-L735 HydrophobicContact CE1-CD2 3.77Å; F616-L735 HydrophobicContact CD1-CB 4.37Å; F616-L735 HydrophobicContact CD1-CD1 4.17Å; F616-L735 HydrophobicContact CD2-CD1 3.85Å; F616-L735 HydrophobicContact CE1-CB 3.82Å; F616-L735 HydrophobicContact CE1-CD1 4.31Å; F616-L735 HydrophobicContact CE2-CB 4.41Å; F616-L735 HydrophobicContact CE2-CD1 4.01Å; F616-L735 HydrophobicContact CG-CD1 3.93Å; F616-L735 HydrophobicContact CZ-CB 3.85Å; F616-L735 HydrophobicContact CZ-CD1 4.24Å; A619-L735 HydrophobicContact CB-CD2 3.49Å; A619-L735 VanDerWaalsContact CB-CD2 3.49Å; V650-L735 HydrophobicContact CG1-CD1 4.31Å; V650-L735 HydrophobicContact CG2-CD2 4.38Å; F674-L735 HydrophobicContact CD1-CD2 3.81Å; F674-L735 HydrophobicContact CE1-CD2 3.81Å; F674-L735 HydrophobicContact CE1-CG 4.07Å; L731-L735 WeakPolarHBondContact O-CB 3.25Å; L731-L735 PolarHBondContact O-N 3.24Å; K733-L735 PolarHBondContact O-N 3.11Å; L735-T738 PolarHBondContact O-N 2.91Å; L735-L739 HydrophobicContact CD1-CD1 4.08Å; L735-L739 HydrophobicContact CD1-CG 4.18Å; L735-L739 HydrophobicContact CG-CD1 3.97Å; L735-L739 HydrophobicContact CG-CG 4.49Å; L735-L739 VanDerWaalsContact O-CG 3.28Å; L735-L739 WeakPolarHBondContact O-CG 3.41Å; L735-L739 PolarHBondContact O-N 3.19Å
736	R	95.9	Very high	94.7	Very high	76 Å²	76	37.4 Å²	37.4	29%	0.287	18%	0.183	S	C	.	.	H	α-helix	trans	-62.5	-41.3	176.9	-179.2	166.7	179.9	126.4	0.6	111.8	F658 E665 F674 I732 K733 H740	F658-R736 HydrophobicContact CE1-CG 4.3Å; F658-R736 HydrophobicContact CZ-CG 4.12Å; E665-R736 IonicContact OE2-CZ 2.75Å; E665-R736 IonicContact OE2-NH1 3.56Å; E665-R736 PolarHBondContact OE2-NH1 2.69Å; E665-R736 IonicContact OE2-NH2 2.75Å; E665-R736 PolarHBondContact OE2-NH2 2.92Å; F674-R736 HydrophobicContact CE2-CB 4.42Å; I732-R736 WeakPolarHBondContact O-CB 3.11Å; I732-R736 PolarHBondContact O-N 2.62Å; K733-R736 PolarHBondContact O-N 2.73Å; R736-H740 WeakPolarHBondContact O-CB 3.5Å; R736-H740 PolarHBondContact O-N 2.91Å; R736-H740 VanDerWaalsContact O-N 3.11Å
737	S	94.6	Very high	94.6	Very high	55 Å²	55	35.9 Å²	35.9	39%	0.385	18%	0.177	S	C	.	.	H	α-helix	trans	-61.7	-50.7	172.6	-157.9	0	0	0	0	110.9	K733 E734 L739 H740 E741	K733-S737 PolarHBondContact O-N 3.18Å; K733-S737 VanDerWaalsContact O-N 3.09Å; E734-S737 PolarHBondContact O-N 3.48Å; S737-L739 VanDerWaalsContact C-N 3.31Å; S737-L739 PolarHBondContact O-N 3.33Å; S737-H740 WeakPolarHBondContact O-CB 3.28Å; S737-H740 PolarHBondContact O-N 2.88Å; S737-E741 WeakPolarHBondContact CB-OE1 3.42Å; S737-E741 WeakPolarHBondContact O-CG 3.16Å; S737-E741 PolarHBondContact O-N 3.18Å; S737-E741 PolarHBondContact OG-OE1 2.8Å
738	T	94.3	Very high	94.5	Very high	29 Å²	29	36 Å²	36	18%	0.178	18%	0.177	C	C	.	.	H	α-helix	trans	-54.6	-44.2	-179.7	-55.2	0	0	0	0	112.3	V327 E734 L735 E742	V327-T738 HydrophobicContact CG2-CG2 3.74Å; E734-T738 PolarHBondContact O-N 3.34Å; E734-T738 PolarHBondContact O-OG1 3.35Å; L735-T738 PolarHBondContact O-N 2.91Å; T738-E742 WeakPolarHBondContact O-CB 3.41Å; T738-E742 VanDerWaalsContact O-CG 3.28Å; T738-E742 WeakPolarHBondContact O-CG 3.35Å; T738-E742 PolarHBondContact O-N 3.13Å
739	L	95.3	Very high	94.3	Very high	1 Å²	1	40.9 Å²	40.9	1%	0.005	20%	0.196	C	C	.	.	H	α-helix	trans	-72.6	-31.6	179.7	-66.5	168.5	0	0	0	113.5	V327 V650 L653 F658 F674 L735 S737 A743	V327-L739 HydrophobicContact CB-CD2 4.29Å; V650-L739 HydrophobicContact CG1-CD1 3.54Å; V650-L739 HydrophobicContact CG1-CD2 3.39Å; V650-L739 HydrophobicContact CG1-CG 4Å; V650-L739 HydrophobicContact CG2-CD1 4.38Å; L653-L739 HydrophobicContact CD1-CD1 4.32Å; L653-L739 HydrophobicContact CD1-CD2 4.46Å; F658-L739 HydrophobicContact CD1-CB 3.58Å; F658-L739 HydrophobicContact CD2-CB 4.39Å; F658-L739 HydrophobicContact CE1-CB 3.59Å; F658-L739 HydrophobicContact CE2-CB 4.42Å; F658-L739 HydrophobicContact CE2-CD1 4.2Å; F658-L739 HydrophobicContact CG-CB 4Å; F658-L739 HydrophobicContact CZ-CB 4.04Å; F658-L739 HydrophobicContact CZ-CD1 4.22Å; F674-L739 HydrophobicContact CE1-CD1 3.81Å; F674-L739 HydrophobicContact CZ-CD1 3.92Å; L735-L739 HydrophobicContact CD1-CD1 4.08Å; L735-L739 HydrophobicContact CD1-CG 4.18Å; L735-L739 HydrophobicContact CG-CD1 3.97Å; L735-L739 HydrophobicContact CG-CG 4.49Å; L735-L739 VanDerWaalsContact O-CG 3.28Å; L735-L739 WeakPolarHBondContact O-CG 3.41Å; L735-L739 PolarHBondContact O-N 3.19Å; S737-L739 VanDerWaalsContact C-N 3.31Å; S737-L739 PolarHBondContact O-N 3.33Å; L739-A743 WeakPolarHBondContact O-CB 3.15Å; L739-A743 PolarHBondContact O-N 2.88Å; L739-A743 VanDerWaalsContact O-N 3.16Å
740	H	94.8	Very high	94.1	Very high	48 Å²	48	39.9 Å²	39.9	22%	0.222	19%	0.19	C	C	.	.	H	α-helix	trans	-68.2	-49.3	173.8	-173.8	-124	0	0	0	110.5	F658 M662 R736 S737 E742 A743 Q744	F658-H740 HydrophobicContact CD1-CB 4.4Å; F658-H740 HydrophobicContact CE1-CB 4.32Å; M662-H740 VanDerWaalsContact CE-CD2 3.49Å; M662-H740 WeakPolarHBondContact CE-CD2 3.36Å; M662-H740 HydrophobicContact SD-CB 4.1Å; M662-H740 PolarHBondContact SD-CD2 3.37Å; R736-H740 WeakPolarHBondContact O-CB 3.5Å; R736-H740 PolarHBondContact O-N 2.91Å; R736-H740 VanDerWaalsContact O-N 3.11Å; S737-H740 WeakPolarHBondContact O-CB 3.28Å; S737-H740 PolarHBondContact O-N 2.88Å; H740-E742 PolarHBondContact O-N 2.84Å; H740-A743 PolarHBondContact O-N 2.84Å; H740-Q744 VanDerWaalsContact CE1-CD 3.48Å; H740-Q744 PolarHBondContact CE1-NE2 2.85Å; H740-Q744 WeakPolarHBondContact O-CG 3.34Å; H740-Q744 PolarHBondContact O-N 3.4Å
741	E	93.1	Very high	94.1	Very high	90 Å²	90	37.3 Å²	37.3	42%	0.421	18%	0.176	S	C	.	.	H	α-helix	trans	-58.7	-46.3	175.6	-68.9	164.2	-128.5	0	0	111.6	S737 A743 Q744 Q745	S737-E741 WeakPolarHBondContact CB-OE1 3.42Å; S737-E741 WeakPolarHBondContact O-CG 3.16Å; S737-E741 PolarHBondContact O-N 3.18Å; S737-E741 PolarHBondContact OG-OE1 2.8Å; E741-A743 VanDerWaalsContact C-N 3.33Å; E741-A743 PolarHBondContact O-N 3.17Å; E741-Q744 PolarHBondContact O-N 3.16Å; E741-Q745 VanDerWaalsContact O-CG 3.3Å; E741-Q745 WeakPolarHBondContact O-CG 3.48Å; E741-Q745 PolarHBondContact O-N 2.83Å
742	E	93.7	Very high	93.9	Very high	23 Å²	23	38 Å²	38	11%	0.107	18%	0.18	C	C	.	.	H	α-helix	trans	-58.2	-41.9	176.1	-81.7	-178.9	-177.7	0	0	112.8	T326 V327 S328 Q330 T738 H740 F746	T326-E742 WeakPolarHBondContact CA-OE1 3.34Å; T326-E742 VanDerWaalsContact CB-CD 3.47Å; T326-E742 VanDerWaalsContact CB-OE1 3.28Å; T326-E742 WeakPolarHBondContact CB-OE1 3.17Å; T326-E742 HydrophobicContact CG2-CG 3.98Å; V327-E742 PolarHBondContact N-OE1 2.85Å; V327-E742 PolarHBondContact N-OE2 3.42Å; S328-E742 WeakPolarHBondContact CB-OE2 3.22Å; S328-E742 PolarHBondContact N-OE2 2.82Å; S328-E742 PolarHBondContact OG-OE2 2.7Å; Q330-E742 HydrophobicContact CG-CB 3.97Å; Q330-E742 HydrophobicContact CG-CG 4.49Å; Q330-E742 PolarHBondContact OE1-O 3.11Å; T738-E742 WeakPolarHBondContact O-CB 3.41Å; T738-E742 VanDerWaalsContact O-CG 3.28Å; T738-E742 WeakPolarHBondContact O-CG 3.35Å; T738-E742 PolarHBondContact O-N 3.13Å; H740-E742 PolarHBondContact O-N 2.84Å; E742-F746 PolarHBondContact O-N 2.81Å
743	A	93.9	Very high	93.8	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-71.7	-37.2	176.8	0	0	0	0	0	112.6	G655 F658 I659 L739 H740 E741 Q745 F746 V747	G655-A743 WeakPolarHBondContact O-CB 3.27Å; F658-A743 HydrophobicContact CB-CB 4.31Å; I659-A743 HydrophobicContact CD1-CB 3.8Å; I659-A743 HydrophobicContact CG1-CB 3.79Å; L739-A743 WeakPolarHBondContact O-CB 3.15Å; L739-A743 PolarHBondContact O-N 2.88Å; L739-A743 VanDerWaalsContact O-N 3.16Å; H740-A743 PolarHBondContact O-N 2.84Å; E741-A743 VanDerWaalsContact C-N 3.33Å; E741-A743 PolarHBondContact O-N 3.17Å; A743-Q745 VanDerWaalsContact C-N 3.35Å; A743-F746 WeakPolarHBondContact O-CB 3.38Å; A743-F746 PolarHBondContact O-N 3.06Å; A743-F746 VanDerWaalsContact O-N 3.16Å; A743-V747 PolarHBondContact O-N 2.87Å; A743-V747 VanDerWaalsContact O-N 3.1Å
744	Q	94	Very high	93.6	Very high	22 Å²	22	34.2 Å²	34.2	10%	0.103	17%	0.169	C	C	.	.	H	α-helix	trans	-63.6	-40.2	173.6	-73.5	-178.8	-38.6	0	0	111.3	I659 H740 E741 F746 V747 L748 R952 V953	I659-Q744 HydrophobicContact CD1-CG 3.93Å; H740-Q744 VanDerWaalsContact CE1-CD 3.48Å; H740-Q744 PolarHBondContact CE1-NE2 2.85Å; H740-Q744 WeakPolarHBondContact O-CG 3.34Å; H740-Q744 PolarHBondContact O-N 3.4Å; E741-Q744 PolarHBondContact O-N 3.16Å; Q744-F746 VanDerWaalsContact C-N 3.25Å; Q744-F746 PolarHBondContact O-N 3.45Å; Q744-V747 PolarHBondContact O-N 2.91Å; Q744-V747 VanDerWaalsContact O-N 3.12Å; Q744-L748 WeakPolarHBondContact O-CG 3.43Å; Q744-L748 PolarHBondContact O-N 3.38Å; Q744-R952 PolarHBondContact NE2-O 2.72Å; Q744-V953 HydrophobicContact CB-CG2 4.28Å; Q744-V953 HydrophobicContact CG-CG2 4.28Å
745	Q	91.9	Very high	93.6	Very high	67 Å²	67	32.4 Å²	32.4	31%	0.313	16%	0.161	S	C	.	.	H	α-helix	trans	-64.7	-25.2	173.6	-68.6	-60.5	-30.4	0	0	113.4	E741 A743 R749	E741-Q745 VanDerWaalsContact O-CG 3.3Å; E741-Q745 WeakPolarHBondContact O-CG 3.48Å; E741-Q745 PolarHBondContact O-N 2.83Å; A743-Q745 VanDerWaalsContact C-N 3.35Å; Q745-R749 WeakPolarHBondContact O-CB 3.28Å; Q745-R749 VanDerWaalsContact O-CG 3.22Å; Q745-R749 WeakPolarHBondContact O-CG 3.03Å; Q745-R749 PolarHBondContact O-N 2.61Å; Q745-R749 PolarHBondContact O-NE 2.89Å; Q745-R749 VanDerWaalsContact O-NE 3.1Å
746	F	92.7	Very high	93.6	Very high	40 Å²	40	36 Å²	36	18%	0.175	18%	0.175	C	C	.	.	H	α-helix	trans	-74.6	-40.4	169.6	175.8	-86	0	0	0	112.5	D656 E742 A743 Q744 S750	D656-F746 HydrophobicContact CB-CD1 4.14Å; D656-F746 HydrophobicContact CB-CE1 4.36Å; E742-F746 PolarHBondContact O-N 2.81Å; A743-F746 WeakPolarHBondContact O-CB 3.38Å; A743-F746 PolarHBondContact O-N 3.06Å; A743-F746 VanDerWaalsContact O-N 3.16Å; Q744-F746 VanDerWaalsContact C-N 3.25Å; Q744-F746 PolarHBondContact O-N 3.45Å; F746-S750 WeakPolarHBondContact O-CB 3.11Å; F746-S750 PolarHBondContact O-N 2.91Å; F746-S750 PolarHBondContact O-OG 3.33Å
747	V	93.1	Very high	93.4	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-63.2	-46.9	174.3	175.2	0	0	0	0	110.7	D656 I659 A743 Q744 R749 S750 C751 H947 L949 V953	D656-V747 HydrophobicContact CB-CG2 4.22Å; I659-V747 HydrophobicContact CD1-CG2 4.06Å; A743-V747 PolarHBondContact O-N 2.87Å; A743-V747 VanDerWaalsContact O-N 3.1Å; Q744-V747 PolarHBondContact O-N 2.91Å; Q744-V747 VanDerWaalsContact O-N 3.12Å; V747-R749 PolarHBondContact O-N 3.15Å; V747-S750 WeakPolarHBondContact O-CA 3.37Å; V747-S750 WeakPolarHBondContact O-CB 3.47Å; V747-S750 PolarHBondContact O-N 2.82Å; V747-S750 VanDerWaalsContact O-N 3.08Å; V747-C751 PolarHBondContact O-N 3.01Å; V747-C751 PolarHBondContact O-SG 3.01Å; V747-H947 HydrophobicContact CG1-CB 4.28Å; V747-L949 HydrophobicContact CG2-CB 4.38Å; V747-V953 HydrophobicContact CB-CG2 3.83Å; V747-V953 HydrophobicContact CG1-CG2 3.61Å
748	L	93.5	Very high	93.4	Very high	2 Å²	2	35.4 Å²	35.4	1%	0.01	17%	0.166	C	C	.	.	H	α-helix	trans	-55.6	-49	176	-77.8	165.8	0	0	0	112.7	Q744 S750 C751 T752 V953 Q957 L958 Q961	Q744-L748 WeakPolarHBondContact O-CG 3.43Å; Q744-L748 PolarHBondContact O-N 3.38Å; L748-S750 VanDerWaalsContact C-N 3.26Å; L748-S750 PolarHBondContact O-N 3.23Å; L748-C751 PolarHBondContact O-N 2.84Å; L748-T752 PolarHBondContact O-N 2.88Å; L748-T752 PolarHBondContact O-OG1 3.26Å; L748-V953 HydrophobicContact CD1-CG1 4.05Å; L748-V953 HydrophobicContact CD2-CG1 3.6Å; L748-V953 HydrophobicContact CG-CG1 3.68Å; L748-Q957 HydrophobicContact CD1-CG 3.76Å; L748-Q957 HydrophobicContact CD2-CG 4.4Å; L748-L958 HydrophobicContact CD2-CB 4.3Å; L748-L958 HydrophobicContact CD2-CD1 4.1Å; L748-Q961 HydrophobicContact CD2-CB 4.17Å; L748-Q961 HydrophobicContact CD2-CG 4.13Å
749	R	91.2	Very high	93.5	Very high	102 Å²	102	34 Å²	34	39%	0.385	16%	0.158	S	C	.	.	H	α-helix	trans	-64.8	-29.6	177.1	-70.7	-177	-62.3	160.7	4	112.7	Q330 E331 Q745 V747 T752 G753	Q330-R749 PolarHBondContact O-NH2 3.27Å; E331-R749 IonicContact OE1-CZ 2.8Å; E331-R749 IonicContact OE1-NH1 3.31Å; E331-R749 PolarHBondContact OE1-NH1 2.81Å; Q745-R749 WeakPolarHBondContact O-CB 3.28Å; Q745-R749 VanDerWaalsContact O-CG 3.22Å; Q745-R749 WeakPolarHBondContact O-CG 3.03Å; Q745-R749 PolarHBondContact O-N 2.61Å; Q745-R749 PolarHBondContact O-NE 2.89Å; Q745-R749 VanDerWaalsContact O-NE 3.1Å; V747-R749 PolarHBondContact O-N 3.15Å; R749-T752 WeakPolarHBondContact CA-OG1 3.21Å; R749-T752 PolarHBondContact O-OG1 3.21Å; R749-G753 PolarHBondContact O-N 3.35Å
750	S	91.1	Very high	93.4	Very high	29 Å²	29	35.7 Å²	35.7	20%	0.203	17%	0.165	C	C	.	.	H	α-helix	trans	-71.5	-41	172.7	-58.4	0	0	0	0	111.8	F746 V747 L748 K754	F746-S750 WeakPolarHBondContact O-CB 3.11Å; F746-S750 PolarHBondContact O-N 2.91Å; F746-S750 PolarHBondContact O-OG 3.33Å; V747-S750 WeakPolarHBondContact O-CA 3.37Å; V747-S750 WeakPolarHBondContact O-CB 3.47Å; V747-S750 PolarHBondContact O-N 2.82Å; V747-S750 VanDerWaalsContact O-N 3.08Å; L748-S750 VanDerWaalsContact C-N 3.26Å; L748-S750 PolarHBondContact O-N 3.23Å; S750-K754 PolarHBondContact O-N 3.49Å; S750-K754 VanDerWaalsContact O-N 3.13Å
751	C	94.2	Very high	93.4	Very high	0 Å²	0	35 Å²	35	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-65.2	-52.8	176.6	-66.8	0	0	0	0	112.2	V747 L748 G753 K754 L755 Y946 H947 L958	V747-C751 PolarHBondContact O-N 3.01Å; V747-C751 PolarHBondContact O-SG 3.01Å; L748-C751 PolarHBondContact O-N 2.84Å; C751-G753 VanDerWaalsContact C-N 3.32Å; C751-G753 PolarHBondContact O-N 2.85Å; C751-K754 PolarHBondContact O-N 3.44Å; C751-K754 VanDerWaalsContact O-N 3.08Å; C751-L755 PolarHBondContact O-N 3.36Å; C751-Y946 HydrophobicContact CB-CG 4.32Å; C751-H947 VanDerWaalsContact SG-CB 3.54Å; C751-L958 HydrophobicContact CB-CD1 3.88Å
752	T	92.8	Very high	93.5	Very high	14 Å²	14	31.1 Å²	31.1	9%	0.086	15%	0.147	C	C	.	.	H	α-helix	trans	-63.6	-37.7	178.2	53.3	0	0	0	0	112	L748 R749 K754 L755 Y756 Q961 Q965	L748-T752 PolarHBondContact O-N 2.88Å; L748-T752 PolarHBondContact O-OG1 3.26Å; R749-T752 WeakPolarHBondContact CA-OG1 3.21Å; R749-T752 PolarHBondContact O-OG1 3.21Å; T752-K754 VanDerWaalsContact C-N 3.26Å; T752-K754 PolarHBondContact O-N 3.3Å; T752-L755 PolarHBondContact O-N 2.71Å; T752-Y756 VanDerWaalsContact O-CB 3.27Å; T752-Y756 WeakPolarHBondContact O-CB 3.31Å; T752-Y756 PolarHBondContact O-N 2.77Å; T752-Q961 HydrophobicContact CG2-CB 3.74Å; T752-Q961 WeakPolarHBondContact CG2-O 3.47Å; T752-Q965 HydrophobicContact CG2-CG 4.22Å
753	G	92.5	Very high	93.4	Very high	23 Å²	23	31.6 Å²	31.6	24%	0.237	15%	0.152	C	C	.	.	H	α-helix	trans	-61.4	-31	172.7	0	0	0	0	0	113.8	R749 C751 K757	R749-G753 PolarHBondContact O-N 3.35Å; C751-G753 VanDerWaalsContact C-N 3.32Å; C751-G753 PolarHBondContact O-N 2.85Å; G753-K757 PolarHBondContact O-N 3.2Å
754	K	93	Very high	93.5	Very high	59 Å²	59	33.1 Å²	33.1	26%	0.257	16%	0.158	S	C	.	.	H	α-helix	trans	-79.5	-41.7	174	-169.6	175.1	169.3	-172.5	0	112.3	S750 C751 T752 Y756 K757 W758 R945 Y946	S750-K754 PolarHBondContact O-N 3.49Å; S750-K754 VanDerWaalsContact O-N 3.13Å; C751-K754 PolarHBondContact O-N 3.44Å; C751-K754 VanDerWaalsContact O-N 3.08Å; T752-K754 VanDerWaalsContact C-N 3.26Å; T752-K754 PolarHBondContact O-N 3.3Å; K754-Y756 PolarHBondContact O-N 3.44Å; K754-K757 WeakPolarHBondContact O-CB 3.43Å; K754-K757 PolarHBondContact O-N 3.44Å; K754-W758 HydrophobicContact CD-CZ2 4.32Å; K754-W758 HydrophobicContact CG-CZ2 4.25Å; K754-W758 PolarHBondContact O-N 3.08Å; K754-R945 PolarHBondContact NZ-O 3.43Å; K754-Y946 WeakPolarHBondContact CD-O 3.42Å
755	L	94.9	Very high	93.3	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-61.1	-44.2	172.4	179.8	60.6	0	0	0	111.3	C751 T752 K757 W758 L759 Y946 L962 Q965 F966	C751-L755 PolarHBondContact O-N 3.36Å; T752-L755 PolarHBondContact O-N 2.71Å; L755-K757 VanDerWaalsContact C-N 3.31Å; L755-K757 PolarHBondContact O-N 2.87Å; L755-W758 HydrophobicContact CD1-CE3 4.25Å; L755-W758 WeakPolarHBondContact O-CA 3.44Å; L755-W758 WeakPolarHBondContact O-CB 3.36Å; L755-W758 PolarHBondContact O-N 3.33Å; L755-L759 HydrophobicContact CD1-CD1 3.89Å; L755-L759 HydrophobicContact CD1-CD2 4.03Å; L755-L759 HydrophobicContact CD1-CG 3.73Å; L755-L759 HydrophobicContact CD2-CD1 4.17Å; L755-L759 HydrophobicContact CG-CD1 3.79Å; L755-L759 HydrophobicContact CG-CG 4Å; L755-L759 WeakPolarHBondContact O-CG 3.46Å; L755-L759 PolarHBondContact O-N 3.4Å; L755-Y946 HydrophobicContact CB-CD1 4.35Å; L755-Y946 HydrophobicContact CB-CE1 3.94Å; L755-Y946 HydrophobicContact CD1-CE1 4.23Å; L755-L962 HydrophobicContact CB-CD2 3.96Å; L755-L962 HydrophobicContact CD2-CB 3.88Å; L755-L962 HydrophobicContact CD2-CD2 3.6Å; L755-L962 HydrophobicContact CD2-CG 4.31Å; L755-L962 HydrophobicContact CG-CD2 4.39Å; L755-Q965 HydrophobicContact CD2-CB 4.04Å; L755-Q965 HydrophobicContact CG-CB 4.41Å; L755-F966 HydrophobicContact CD1-CE2 4.29Å; L755-F966 HydrophobicContact CD1-CZ 4.38Å; L755-F966 HydrophobicContact CD2-CD2 4.04Å; L755-F966 HydrophobicContact CD2-CE2 3.79Å
756	Y	94.6	Very high	93.1	Very high	77 Å²	77	37.3 Å²	37.3	30%	0.302	18%	0.177	S	C	.	.	H	α-helix	trans	-56.1	-42	175.7	168.7	-109.1	0	0	0	112.4	T752 K754 W758 L759 K760	T752-Y756 VanDerWaalsContact O-CB 3.27Å; T752-Y756 WeakPolarHBondContact O-CB 3.31Å; T752-Y756 PolarHBondContact O-N 2.77Å; K754-Y756 PolarHBondContact O-N 3.44Å; Y756-W758 PolarHBondContact O-N 2.95Å; Y756-L759 PolarHBondContact O-N 3.36Å; Y756-K760 HydrophobicContact CD1-CD 4.34Å; Y756-K760 HydrophobicContact CD2-CB 4.38Å; Y756-K760 HydrophobicContact CE1-CD 3.72Å; Y756-K760 HydrophobicContact CE2-CB 3.94Å; Y756-K760 HydrophobicContact CE2-CD 4.33Å; Y756-K760 WeakPolarHBondContact O-CB 3.28Å; Y756-K760 VanDerWaalsContact O-CG 3.3Å; Y756-K760 WeakPolarHBondContact O-CG 3.01Å; Y756-K760 PolarHBondContact O-N 3.39Å
757	K	93	Very high	92.7	Very high	70 Å²	70	44.2 Å²	44.2	30%	0.304	21%	0.21	S	C	.	.	H	α-helix	trans	-57.7	-35.8	173.6	-81.9	175.9	166.9	-176.1	0	113.2	G753 K754 L755 W1722	G753-K757 PolarHBondContact O-N 3.2Å; K754-K757 WeakPolarHBondContact O-CB 3.43Å; K754-K757 PolarHBondContact O-N 3.44Å; L755-K757 VanDerWaalsContact C-N 3.31Å; L755-K757 PolarHBondContact O-N 2.87Å; K757-W1722 VanDerWaalsContact CE-CD1 3.44Å; K757-W1722 VanDerWaalsContact CE-CD2 3.5Å; K757-W1722 VanDerWaalsContact CE-CE2 3.42Å; K757-W1722 VanDerWaalsContact CE-CG 3.47Å; K757-W1722 VanDerWaalsContact NZ-CE2 3.29Å; K757-W1722 VanDerWaalsContact NZ-CG 3.31Å
758	W	94.3	Very high	92	Very high	48 Å²	48	46 Å²	46	18%	0.182	22%	0.22	C	C	.	.	H	α-helix	trans	-77.6	-48.6	-179.9	-64.9	-25.9	0	0	0	111.6	K754 L755 Y756 K760 V761 Y931 L944 Y946	K754-W758 HydrophobicContact CD-CZ2 4.32Å; K754-W758 HydrophobicContact CG-CZ2 4.25Å; K754-W758 PolarHBondContact O-N 3.08Å; L755-W758 HydrophobicContact CD1-CE3 4.25Å; L755-W758 WeakPolarHBondContact O-CA 3.44Å; L755-W758 WeakPolarHBondContact O-CB 3.36Å; L755-W758 PolarHBondContact O-N 3.33Å; Y756-W758 PolarHBondContact O-N 2.95Å; W758-K760 VanDerWaalsContact C-N 3.34Å; W758-K760 PolarHBondContact O-N 2.86Å; W758-V761 PolarHBondContact O-N 2.73Å; W758-Y931 HydrophobicContact CB-CD2 4.29Å; W758-Y931 HydrophobicContact CB-CE2 3.69Å; W758-Y931 HydrophobicContact CD2-CE1 4.1Å; W758-Y931 HydrophobicContact CD2-CE2 4.47Å; W758-Y931 AromaticContact CD2-CZ 3.75Å; W758-Y931 HydrophobicContact CE3-CD1 4.35Å; W758-Y931 AromaticContact CE3-CE1 3.53Å; W758-Y931 HydrophobicContact CE3-CE1 3.53Å; W758-Y931 AromaticContact CE3-CZ 3.69Å; W758-Y931 HydrophobicContact CG-CE2 4.17Å; W758-Y931 AromaticContact CG-CZ 3.89Å; W758-Y931 AromaticContact CZ3-CE1 3.88Å; W758-Y931 HydrophobicContact CZ3-CE1 3.88Å; W758-L944 HydrophobicContact CH2-CD2 4.31Å; W758-L944 HydrophobicContact CZ3-CB 4.32Å; W758-L944 HydrophobicContact CZ3-CD1 4.16Å; W758-L944 HydrophobicContact CZ3-CD2 4.3Å; W758-Y946 HydrophobicContact CE3-CE1 4.11Å; W758-Y946 HydrophobicContact CH2-CE1 4.48Å; W758-Y946 AromaticContact CZ3-CD1 3.92Å; W758-Y946 HydrophobicContact CZ3-CD1 3.92Å; W758-Y946 AromaticContact CZ3-CE1 3.54Å; W758-Y946 HydrophobicContact CZ3-CE1 3.54Å
759	L	95.1	Very high	91.3	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-72	-23.5	-178	-56.9	-175.1	0	0	0	113.5	L755 Y756 V761 L928 Y931 F966 R969 R1140	L755-L759 HydrophobicContact CD1-CD1 3.89Å; L755-L759 HydrophobicContact CD1-CD2 4.03Å; L755-L759 HydrophobicContact CD1-CG 3.73Å; L755-L759 HydrophobicContact CD2-CD1 4.17Å; L755-L759 HydrophobicContact CG-CD1 3.79Å; L755-L759 HydrophobicContact CG-CG 4Å; L755-L759 WeakPolarHBondContact O-CG 3.46Å; L755-L759 PolarHBondContact O-N 3.4Å; Y756-L759 PolarHBondContact O-N 3.36Å; L759-V761 PolarHBondContact O-N 3.03Å; L759-L928 HydrophobicContact CB-CD1 4.41Å; L759-L928 HydrophobicContact CD1-CD1 4.19Å; L759-L928 HydrophobicContact CD2-CD1 3.94Å; L759-L928 HydrophobicContact CG-CD1 4.4Å; L759-Y931 HydrophobicContact CD2-CD2 4.13Å; L759-Y931 HydrophobicContact CD2-CG 4.13Å; L759-F966 HydrophobicContact CD1-CD1 3.84Å; L759-F966 HydrophobicContact CD1-CD2 4.32Å; L759-F966 HydrophobicContact CD1-CE1 3.94Å; L759-F966 HydrophobicContact CD1-CE2 4.4Å; L759-F966 HydrophobicContact CD1-CG 4.04Å; L759-F966 HydrophobicContact CD1-CZ 4.23Å; L759-F966 HydrophobicContact CD2-CD1 4.46Å; L759-F966 HydrophobicContact CD2-CE1 3.85Å; L759-F966 HydrophobicContact CD2-CZ 4.19Å; L759-R969 HydrophobicContact CB-CB 4.32Å; L759-R969 HydrophobicContact CB-CG 3.75Å; L759-R969 HydrophobicContact CD1-CG 4.37Å; L759-R1140 WeakPolarHBondContact O-CD 3.29Å
760	K	94.3	Very high	90.4	Very high	35 Å²	35	48.2 Å²	48.2	15%	0.152	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.3	0.4	177.3	80.4	174.5	-167	166.4	0	114.7	Y756 W758 R1140 T1141	Y756-K760 HydrophobicContact CD1-CD 4.34Å; Y756-K760 HydrophobicContact CD2-CB 4.38Å; Y756-K760 HydrophobicContact CE1-CD 3.72Å; Y756-K760 HydrophobicContact CE2-CB 3.94Å; Y756-K760 HydrophobicContact CE2-CD 4.33Å; Y756-K760 WeakPolarHBondContact O-CB 3.28Å; Y756-K760 VanDerWaalsContact O-CG 3.3Å; Y756-K760 WeakPolarHBondContact O-CG 3.01Å; Y756-K760 PolarHBondContact O-N 3.39Å; W758-K760 VanDerWaalsContact C-N 3.34Å; W758-K760 PolarHBondContact O-N 2.86Å; K760-R1140 WeakPolarHBondContact O-CB 3.14Å; K760-T1141 WeakPolarHBondContact O-CB 3.27Å; K760-T1141 PolarHBondContact O-N 2.92Å
761	V	94.5	Very high	89.5	Confident	35 Å²	35	54 Å²	54	21%	0.212	28%	0.276	C	S	.	.	B	Isolated β-bridge	trans	-88.3	129.5	179.4	178.4	0	0	0	0	109.7	W758 L759 P927 T1141 Y1143	W758-V761 PolarHBondContact O-N 2.73Å; L759-V761 PolarHBondContact O-N 3.03Å; V761-P927 HydrophobicContact CB-CG 4.1Å; V761-P927 HydrophobicContact CG1-CG 4.12Å; V761-T1141 WeakPolarHBondContact CA-O 3.43Å; V761-Y1143 HydrophobicContact CG1-CD2 4.29Å
762	A	94.4	Very high	88.4	Confident	7 Å²	7	56.9 Å²	56.9	6%	0.058	29%	0.288	C	S	.	.			trans	-80.6	155.8	177.9	0	0	0	0	0	111.7	R1140 T1141	A762-R1140 HydrophobicContact CB-CB 3.76Å; A762-T1141 PolarHBondContact N-O 3.46Å
763	P	93.6	Very high	86.8	Confident	33 Å²	33	57.8 Å²	57.8	21%	0.214	30%	0.301	C	S	.	.			trans	-38.3	137.8	163.3	-35.8	37.1	0	0	0	114.1	K765 Q925 D926	P763-K765 PolarHBondContact O-N 2.83Å; P763-Q925 VanDerWaalsContact CA-O 3.28Å; P763-Q925 WeakPolarHBondContact CA-O 3.43Å; P763-Q925 WeakPolarHBondContact CB-O 3.35Å; P763-Q925 VanDerWaalsContact CG-O 3.29Å; P763-Q925 WeakPolarHBondContact CG-O 3.5Å; P763-D926 HydrophobicContact CG-CB 4.2Å; P763-D926 WeakPolarHBondContact CG-OD2 3.38Å
764	Y	94.2	Very high	85.2	Confident	33 Å²	33	66.6 Å²	66.6	13%	0.129	33%	0.328	C	S	.	.			trans	-63.8	136.1	176.6	-179.7	-108.1	0	0	0	111.4	P766 I783 I851 M924 Y1143	Y764-P766 HydrophobicContact CD1-CB 4.49Å; Y764-P766 HydrophobicContact CE1-CB 3.73Å; Y764-P766 HydrophobicContact CE1-CG 4.44Å; Y764-I783 HydrophobicContact CD1-CD1 3.93Å; Y764-I783 HydrophobicContact CG-CD1 4.43Å; Y764-I851 HydrophobicContact CD1-CB 4.09Å; Y764-I851 HydrophobicContact CD1-CD1 3.82Å; Y764-I851 HydrophobicContact CD1-CG2 3.79Å; Y764-I851 HydrophobicContact CD2-CD1 4.27Å; Y764-I851 HydrophobicContact CE1-CB 3.76Å; Y764-I851 HydrophobicContact CE1-CD1 3.59Å; Y764-I851 HydrophobicContact CE1-CG1 4.21Å; Y764-I851 HydrophobicContact CE1-CG2 4Å; Y764-I851 HydrophobicContact CE2-CD1 4.09Å; Y764-I851 HydrophobicContact CG-CD1 4.15Å; Y764-M924 HydrophobicContact CG-CG 4.47Å; Y764-M924 HydrophobicContact CG-SD 4.29Å; Y764-M924 PolarHBondContact N-O 2.64Å; Y764-Y1143 AromaticContact CD2-CD1 3.78Å; Y764-Y1143 HydrophobicContact CD2-CD1 3.78Å; Y764-Y1143 HydrophobicContact CD2-CG 4.33Å; Y764-Y1143 HydrophobicContact CE2-CD1 4.15Å
765	K	90.6	Very high	84.2	Confident	154 Å²	154	72.1 Å²	72.1	67%	0.67	36%	0.355	S	S	*	.			trans	-122.3	102.7	177.4	-65.1	-173.4	-179.1	-176.8	0	108.6	P763	P763-K765 PolarHBondContact O-N 2.83Å
766	P	87.7	Confident	83.3	Confident	22 Å²	22	77 Å²	77	14%	0.143	38%	0.378	C	S	.	.			trans	-67	142.4	-177.9	28.5	-36	0	0	0	111	Y764 L768 T779 I783 H850	Y764-P766 HydrophobicContact CD1-CB 4.49Å; Y764-P766 HydrophobicContact CE1-CB 3.73Å; Y764-P766 HydrophobicContact CE1-CG 4.44Å; P766-L768 VanDerWaalsContact C-N 3.32Å; P766-L768 HydrophobicContact CB-CG 4.35Å; P766-L768 HydrophobicContact CG-CG 4.36Å; P766-L768 PolarHBondContact O-N 3.23Å; P766-L768 VanDerWaalsContact O-N 3.13Å; P766-T779 HydrophobicContact CG-CG2 3.71Å; P766-I783 HydrophobicContact CG-CG2 4.13Å; P766-H850 HydrophobicContact CG-CB 4.24Å
767	Q	83.6	Confident	82.8	Confident	186 Å²	186	74 Å²	74	87%	0.869	37%	0.366	S	S	*	.			trans	-88.7	70.5	178.6	-62.7	-177.8	32.5	0	0	110.2
768	L	79.2	Confident	82.3	Confident	38 Å²	38	72.4 Å²	72.4	20%	0.199	36%	0.363	C	S	.	.			trans	-70.6	137.8	177.4	-63.5	175.2	0	0	0	111	P766 W777 T779 P882	P766-L768 VanDerWaalsContact C-N 3.32Å; P766-L768 HydrophobicContact CB-CG 4.35Å; P766-L768 HydrophobicContact CG-CG 4.36Å; P766-L768 PolarHBondContact O-N 3.23Å; P766-L768 VanDerWaalsContact O-N 3.13Å; L768-W777 HydrophobicContact CD1-CB 4.1Å; L768-W777 WeakPolarHBondContact CD1-O 3.44Å; L768-T779 HydrophobicContact CD1-CG2 3.77Å; L768-P882 HydrophobicContact CD2-CB 3.87Å; L768-P882 HydrophobicContact CD2-CG 4.06Å
769	P	79.2	Confident	81.8	Confident	41 Å²	41	72.7 Å²	72.7	27%	0.266	37%	0.37	S	S	.	.			trans	-61.7	147.5	170.2	-18.8	30.4	0	0	0	111.1	D771 F772 P883	P769-D771 PolarHBondContact O-N 3.29Å; P769-F772 HydrophobicContact CB-CD2 3.94Å; P769-F772 HydrophobicContact CB-CE2 4.23Å; P769-F772 HydrophobicContact CG-CD2 3.97Å; P769-F772 HydrophobicContact CG-CE2 4.06Å; P769-F772 PolarHBondContact O-N 2.9Å; P769-F772 VanDerWaalsContact O-N 3.1Å; P769-P883 HydrophobicContact CG-CG 4.32Å
770	P	71.5	Confident	80.9	Confident	108 Å²	108	80.3 Å²	80.3	70%	0.701	41%	0.41	S	S	*	.	G	3₁₀ helix	trans	-54.1	-34.5	-172.7	-28.4	35.7	0	0	0	114.7	F772 G773	P770-F772 PolarHBondContact O-N 3.28Å; P770-F772 VanDerWaalsContact O-N 3.12Å; P770-G773 PolarHBondContact O-N 3.28Å
771	D	73.1	Confident	80.1	Confident	151 Å²	151	88.9 Å²	88.9	81%	0.807	44%	0.442	S	S	*	.	G	3₁₀ helix	trans	-62.9	-18.4	-176.5	-53.7	-34.6	0	0	0	113.7	P769	P769-D771 PolarHBondContact O-N 3.29Å
772	F	71	Confident	79.7	Confident	60 Å²	60	88.6 Å²	88.6	26%	0.263	45%	0.446	S	S	.	.	G	3₁₀ helix	trans	-95.5	-8.5	-179.9	-65.8	-84.4	0	0	0	114.4	P769 P770 Y774 W777 Q880 P882	P769-F772 HydrophobicContact CB-CD2 3.94Å; P769-F772 HydrophobicContact CB-CE2 4.23Å; P769-F772 HydrophobicContact CG-CD2 3.97Å; P769-F772 HydrophobicContact CG-CE2 4.06Å; P769-F772 PolarHBondContact O-N 2.9Å; P769-F772 VanDerWaalsContact O-N 3.1Å; P770-F772 PolarHBondContact O-N 3.28Å; P770-F772 VanDerWaalsContact O-N 3.12Å; F772-Y774 VanDerWaalsContact C-N 3.34Å; F772-Y774 PolarHBondContact O-N 3.49Å; F772-W777 HydrophobicContact CB-CB 4.49Å; F772-Q880 WeakPolarHBondContact CE1-O 3.29Å; F772-P882 HydrophobicContact CD1-CB 4.12Å; F772-P882 HydrophobicContact CD1-CG 4.43Å; F772-P882 HydrophobicContact CD2-CB 4.15Å; F772-P882 HydrophobicContact CE1-CB 4.22Å; F772-P882 HydrophobicContact CE2-CB 4.25Å; F772-P882 HydrophobicContact CG-CB 4.08Å; F772-P882 HydrophobicContact CZ-CB 4.28Å
773	G	59.5	Low	79.6	Confident	34 Å²	34	88.8 Å²	88.8	35%	0.351	45%	0.446	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73	-11.4	-160.9	0	0	0	0	0	117.6	P770	P770-G773 PolarHBondContact O-N 3.28Å
774	Y	58.6	Low	79.7	Confident	208 Å²	208	90 Å²	90	82%	0.816	45%	0.446	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.1	-28.4	-158	-78.8	-77.4	0	0	0	117.3	F772	F772-Y774 VanDerWaalsContact C-N 3.34Å; F772-Y774 PolarHBondContact O-N 3.49Å
775	E	70.6	Confident	79.8	Confident	174 Å²	174	88.4 Å²	88.4	81%	0.813	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-137.9	-85.4	-179.3	-65.4	-174.1	168	0	0	112.8	W777 S778	E775-W777 VanDerWaalsContact C-N 3.35Å; E775-W777 PolarHBondContact O-N 2.76Å; E775-S778 VanDerWaalsContact O-CB 3.32Å; E775-S778 WeakPolarHBondContact O-CB 3.23Å; E775-S778 PolarHBondContact O-N 3.09Å
776	E	77.1	Confident	80.2	Confident	103 Å²	103	81 Å²	81	48%	0.481	41%	0.408	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.6	-29.5	-165.7	-170.4	176.9	-127.2	0	0	115.5	R784 K848	E776-R784 PolarHBondContact O-NH1 3.38Å; E776-R784 PolarHBondContact O-NH2 2.91Å; E776-R784 VanDerWaalsContact O-NH2 3.09Å; E776-K848 HydrophobicContact CG-CD 4.17Å; E776-K848 IonicContact OE1-NZ 2.64Å; E776-K848 PolarHBondContact OE1-NZ 3.49Å; E776-K848 IonicContact OE2-NZ 2.79Å; E776-K848 PolarHBondContact OE2-NZ 2.95Å
777	W	84.5	Confident	80.6	Confident	15 Å²	15	80 Å²	80	6%	0.057	40%	0.401	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107.3	18.8	179.8	-58.7	93.8	0	0	0	112.4	L768 F772 E775 T779 K848 H850 F881 P882 I884	L768-W777 HydrophobicContact CD1-CB 4.1Å; L768-W777 WeakPolarHBondContact CD1-O 3.44Å; F772-W777 HydrophobicContact CB-CB 4.49Å; E775-W777 VanDerWaalsContact C-N 3.35Å; E775-W777 PolarHBondContact O-N 2.76Å; W777-T779 PolarHBondContact O-N 3.33Å; W777-K848 HydrophobicContact CH2-CB 3.55Å; W777-K848 HydrophobicContact CH2-CD 4.35Å; W777-K848 HydrophobicContact CH2-CG 3.94Å; W777-K848 HydrophobicContact CZ2-CB 3.94Å; W777-K848 HydrophobicContact CZ2-CD 3.86Å; W777-K848 HydrophobicContact CZ2-CG 3.95Å; W777-K848 HydrophobicContact CZ3-CB 3.98Å; W777-H850 AromaticContact CE3-CD2 3.96Å; W777-F881 AromaticContact CH2-CD1 3.7Å; W777-F881 HydrophobicContact CH2-CD1 3.7Å; W777-F881 AromaticContact CH2-CE1 3.75Å; W777-F881 HydrophobicContact CH2-CE1 3.75Å; W777-F881 HydrophobicContact CH2-CG 4.47Å; W777-F881 AromaticContact CZ2-CD1 3.84Å; W777-F881 HydrophobicContact CZ2-CD1 3.84Å; W777-F881 AromaticContact CZ2-CE1 3.9Å; W777-F881 HydrophobicContact CZ2-CE1 3.9Å; W777-F881 HydrophobicContact CZ2-CG 4.22Å; W777-F881 HydrophobicContact CZ2-CZ 4.33Å; W777-P882 HydrophobicContact CD2-CG 3.71Å; W777-P882 HydrophobicContact CE3-CG 3.84Å; W777-P882 HydrophobicContact CG-CG 4.21Å; W777-P882 HydrophobicContact CH2-CG 4.2Å; W777-P882 HydrophobicContact CZ2-CG 4.1Å; W777-P882 HydrophobicContact CZ3-CG 4.08Å; W777-I884 HydrophobicContact CH2-CD1 3.85Å; W777-I884 HydrophobicContact CZ3-CD1 3.98Å; W777-I884 HydrophobicContact CZ3-CG1 4.48Å
778	S	81.7	Confident	81.3	Confident	35 Å²	35	71.1 Å²	71.1	25%	0.245	36%	0.36	C	S	.	.			trans	-65.4	124.7	178.8	-174.9	0	0	0	0	111.6	E775	E775-S778 VanDerWaalsContact O-CB 3.32Å; E775-S778 WeakPolarHBondContact O-CB 3.23Å; E775-S778 PolarHBondContact O-N 3.09Å
779	T	83	Confident	82.2	Confident	54 Å²	54	69.4 Å²	69.4	33%	0.331	35%	0.351	S	S	.	.			trans	-99.1	6.3	-178.8	60.5	0	0	0	0	113.3	P766 L768 W777 R781 G782 I783	P766-T779 HydrophobicContact CG-CG2 3.71Å; L768-T779 HydrophobicContact CD1-CG2 3.77Å; W777-T779 PolarHBondContact O-N 3.33Å; T779-R781 PolarHBondContact O-N 3.02Å; T779-G782 WeakPolarHBondContact CA-O 2.99Å; T779-G782 PolarHBondContact O-N 3.19Å; T779-G782 VanDerWaalsContact O-N 3.08Å; T779-I783 HydrophobicContact CG2-CG2 4.1Å
780	L	76.6	Confident	83	Confident	160 Å²	160	67.6 Å²	67.6	84%	0.838	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.3	-27.4	-174.2	-66.6	173.3	0	0	0	113.1
781	R	78.1	Confident	84.1	Confident	215 Å²	215	65.3 Å²	65.3	81%	0.811	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.1	7.9	177.8	-64.8	-173	175.7	-162.3	-2.6	114.2	T779 V805	T779-R781 PolarHBondContact O-N 3.02Å; R781-V805 HydrophobicContact CB-CG2 4.2Å
782	G	85.9	Confident	85	Confident	30 Å²	30	60.8 Å²	60.8	31%	0.309	30%	0.3	S	S	.	.			trans	108.2	-163.6	-171.3	0	0	0	0	0	112.9	T779	T779-G782 WeakPolarHBondContact CA-O 2.99Å; T779-G782 PolarHBondContact O-N 3.19Å; T779-G782 VanDerWaalsContact O-N 3.08Å
783	I	92.6	Very high	86	Confident	11 Å²	11	61.7 Å²	61.7	6%	0.056	31%	0.307	C	S	.	.			trans	-133.7	132.5	-170.6	51.8	164.5	0	0	0	113.7	Y764 P766 T779 V785 H850 I851 Q925	Y764-I783 HydrophobicContact CD1-CD1 3.93Å; Y764-I783 HydrophobicContact CG-CD1 4.43Å; P766-I783 HydrophobicContact CG-CG2 4.13Å; T779-I783 HydrophobicContact CG2-CG2 4.1Å; I783-V785 HydrophobicContact CD1-CG2 3.75Å; I783-V785 HydrophobicContact CG1-CG2 4.04Å; I783-H850 HydrophobicContact CB-CB 4.41Å; I783-H850 HydrophobicContact CG2-CB 4.26Å; I783-I851 HydrophobicContact CD1-CG2 4.28Å; I783-Q925 HydrophobicContact CG1-CG 4.45Å; I783-Q925 PolarHBondContact O-NE2 3.33Å
784	R	94.9	Very high	87.4	Confident	57 Å²	57	65.2 Å²	65.2	22%	0.215	31%	0.314	C	S	.	.			trans	-69.4	127.5	160.4	-54.8	177.4	-61.8	-99.6	5.5	109.7	E776 T803 V805 K848 H850	E776-R784 PolarHBondContact O-NH1 3.38Å; E776-R784 PolarHBondContact O-NH2 2.91Å; E776-R784 VanDerWaalsContact O-NH2 3.09Å; R784-T803 WeakPolarHBondContact CA-O 3.2Å; R784-T803 WeakPolarHBondContact CB-O 3.34Å; R784-V805 HydrophobicContact CG-CG1 4.05Å; R784-K848 VanDerWaalsContact CZ-O 3.29Å; R784-K848 PolarHBondContact NE-O 3.27Å; R784-K848 PolarHBondContact NH2-O 2.81Å; R784-H850 PolarHBondContact N-CE1 2.66Å; R784-H850 PolarHBondContact N-ND1 2.73Å; R784-H850 PolarHBondContact NH2-NE2 2.73Å; R784-H850 PolarHBondContact O-N 3.49Å; R784-H850 PolarHBondContact O-ND1 3.04Å; R784-H850 VanDerWaalsContact O-ND1 3.14Å
785	V	96.9	Very high	88.9	Confident	0 Å²	0	60 Å²	60	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	136.7	-179.1	179	0	0	0	0	110.3	I783 V802 T803 I851 V853 A921 M924 Q925	I783-V785 HydrophobicContact CD1-CG2 3.75Å; I783-V785 HydrophobicContact CG1-CG2 4.04Å; V785-V802 CarbonylContact O-C 3.3Å; V785-V802 VanDerWaalsContact O-CA 3.31Å; V785-V802 WeakPolarHBondContact O-CA 3.27Å; V785-T803 PolarHBondContact N-OG1 3.45Å; V785-T803 PolarHBondContact O-N 2.96Å; V785-T803 PolarHBondContact O-OG1 2.85Å; V785-I851 HydrophobicContact CB-CG2 4.39Å; V785-I851 HydrophobicContact CG1-CG2 4.11Å; V785-I851 HydrophobicContact CG2-CG2 3.84Å; V785-V853 HydrophobicContact CG1-CB 4.39Å; V785-V853 HydrophobicContact CG1-CG2 3.69Å; V785-A921 HydrophobicContact CB-CB 4.06Å; V785-A921 HydrophobicContact CG1-CB 3.84Å; V785-M924 HydrophobicContact CG1-CB 4.28Å; V785-Q925 HydrophobicContact CG2-CG 3.84Å
786	L	98	Very high	90	Very high	0 Å²	0	54.2 Å²	54.2	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	105.5	170	172.2	63.2	0	0	0	109.7	C800 A801 V802 L840 F843 I844 P849 I851 V852 V853	L786-C800 HydrophobicContact CD1-CB 3.78Å; L786-A801 WeakPolarHBondContact CA-O 3.46Å; L786-V802 HydrophobicContact CB-CG2 4.15Å; L786-V802 HydrophobicContact CD1-CG2 3.58Å; L786-V802 HydrophobicContact CG-CG2 4.41Å; L786-L840 HydrophobicContact CD2-CD1 4.25Å; L786-F843 HydrophobicContact CD1-CD1 4.25Å; L786-F843 HydrophobicContact CD1-CE1 3.81Å; L786-I844 HydrophobicContact CD2-CD1 4.09Å; L786-I844 HydrophobicContact CD2-CG1 3.62Å; L786-P849 HydrophobicContact CB-CB 3.7Å; L786-P849 HydrophobicContact CB-CG 3.83Å; L786-P849 HydrophobicContact CD2-CG 4.32Å; L786-I851 PolarHBondContact N-O 3.04Å; L786-I851 VanDerWaalsContact N-O 3.08Å; L786-V852 HydrophobicContact CB-CG1 4.34Å; L786-V852 HydrophobicContact CB-CG2 4.29Å; L786-V852 HydrophobicContact CD2-CG1 3.88Å; L786-V852 HydrophobicContact CD2-CG2 3.99Å; L786-V852 HydrophobicContact CG-CG1 4.04Å; L786-V852 CarbonylContact O-C 3.5Å; L786-V852 WeakPolarHBondContact O-CA 3.39Å; L786-V853 PolarHBondContact O-N 3.16Å
787	G	97.8	Very high	90.8	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	140.9	171.7	0	0	0	0	0	111.6	C800 A801 V853	G787-C800 CarbonylContact O-C 3.54Å; G787-C800 WeakPolarHBondContact O-CA 3.28Å; G787-C800 WeakPolarHBondContact O-CB 3.37Å; G787-A801 PolarHBondContact N-O 2.8Å; G787-A801 PolarHBondContact O-N 2.83Å; G787-V853 CarbonylContact C-O 3.4Å; G787-V853 WeakPolarHBondContact CA-O 3.46Å
788	L	98	Very high	91.4	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	123.7	176.6	-172.4	159	0	0	0	110.3	Y790 F799 C800 L815 V853 I854 G855 I864 I868	L788-Y790 HydrophobicContact CD2-CD1 4.05Å; L788-F799 WeakPolarHBondContact CA-O 3.46Å; L788-C800 HydrophobicContact CB-CB 3.92Å; L788-C800 HydrophobicContact CD1-CB 4.32Å; L788-C800 HydrophobicContact CG-CB 4.03Å; L788-L815 HydrophobicContact CD1-CD1 4.33Å; L788-V853 PolarHBondContact N-O 3.33Å; L788-I854 HydrophobicContact CD2-CG2 4.5Å; L788-G855 PolarHBondContact O-N 3.27Å; L788-I864 HydrophobicContact CD1-CG2 4.05Å; L788-I864 HydrophobicContact CD2-CD1 4.34Å; L788-I864 HydrophobicContact CD2-CG2 4.31Å; L788-I868 HydrophobicContact CD1-CD1 4.01Å
789	A	97.7	Very high	92.2	Very high	1 Å²	1	48.6 Å²	48.6	1%	0.008	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	146.1	173.2	0	0	0	0	0	110.9	A798 F799 L913 Q916 A917 L920	A789-A798 WeakPolarHBondContact O-CA 3.22Å; A789-A798 WeakPolarHBondContact O-CB 3.47Å; A789-F799 PolarHBondContact N-O 2.77Å; A789-F799 PolarHBondContact O-N 2.7Å; A789-F799 VanDerWaalsContact O-O 3.09Å; A789-L913 HydrophobicContact CB-CD2 4.27Å; A789-L913 WeakPolarHBondContact CB-O 3.44Å; A789-Q916 HydrophobicContact CB-CB 3.72Å; A789-A917 HydrophobicContact CB-CB 4.1Å; A789-L920 HydrophobicContact CB-CD1 4.06Å
790	Y	96.6	Very high	92.8	Very high	4 Å²	4	46 Å²	46	2%	0.016	24%	0.241	C	C	.	.			trans	-149.7	161.8	178.6	71.1	-82.9	0	0	0	109.4	L788 L819 I854 G855 E857 S858 D860 A861 I864	L788-Y790 HydrophobicContact CD2-CD1 4.05Å; Y790-L819 HydrophobicContact CD2-CD1 4.38Å; Y790-L819 HydrophobicContact CD2-CD2 3.7Å; Y790-L819 HydrophobicContact CE2-CD2 4.11Å; Y790-L819 HydrophobicContact CG-CD2 4.35Å; Y790-I854 HydrophobicContact CE1-CG2 4.09Å; Y790-G855 VanDerWaalsContact CE1-O 3.3Å; Y790-G855 WeakPolarHBondContact CE1-O 3.48Å; Y790-E857 HydrophobicContact CE1-CB 4.37Å; Y790-E857 HydrophobicContact CE2-CB 4.13Å; Y790-S858 PolarHBondContact OH-N 3.41Å; Y790-S858 PolarHBondContact OH-O 3.46Å; Y790-D860 HydrophobicContact CE2-CB 4.35Å; Y790-A861 HydrophobicContact CE1-CB 4.17Å; Y790-A861 WeakPolarHBondContact OH-CB 3.41Å; Y790-A861 PolarHBondContact OH-N 3.22Å; Y790-I864 HydrophobicContact CD1-CD1 3.63Å; Y790-I864 HydrophobicContact CD2-CD1 4.37Å; Y790-I864 HydrophobicContact CE1-CD1 3.82Å; Y790-I864 HydrophobicContact CG-CD1 3.95Å
791	D	94.5	Very high	93.8	Very high	60 Å²	60	38.4 Å²	38.4	32%	0.321	20%	0.201	S	C	.	.			trans	-109	149.2	171.7	-174.4	-78.2	0	0	0	108.9	D793 V796 L819 L913	D791-D793 PolarHBondContact O-N 3.49Å; D791-D793 WeakPolarHBondContact OD1-CB 3.4Å; D791-D793 PolarHBondContact OD1-N 3.5Å; D791-V796 HydrophobicContact CB-CB 4.02Å; D791-V796 HydrophobicContact CB-CG1 3.92Å; D791-V796 HydrophobicContact CB-CG2 4.41Å; D791-L819 WeakPolarHBondContact O-CD1 3.39Å; D791-L913 HydrophobicContact CB-CD1 4.3Å
792	P	91.2	Very high	94.7	Very high	56 Å²	56	28.2 Å²	28.2	36%	0.364	16%	0.163	S	C	.	.	S	Bend	trans	-65.1	-18.6	179.4	-21.4	35.7	0	0	0	114.4	H794 E857	P792-H794 PolarHBondContact O-N 2.56Å; P792-E857 HydrophobicContact CG-CG 3.81Å
793	D	92.6	Very high	95.1	Very high	78 Å²	78	26.8 Å²	26.8	42%	0.417	15%	0.148	S	C	.	.			trans	-72.3	120.8	173.5	-179.2	16.7	0	0	0	112	D791 S795 V796	D791-D793 PolarHBondContact O-N 3.49Å; D791-D793 WeakPolarHBondContact OD1-CB 3.4Å; D791-D793 PolarHBondContact OD1-N 3.5Å; D793-S795 PolarHBondContact O-N 2.97Å; D793-S795 VanDerWaalsContact O-N 3.11Å; D793-S795 PolarHBondContact OD1-N 3.37Å; D793-S795 VanDerWaalsContact OD2-CB 3.25Å; D793-S795 WeakPolarHBondContact OD2-CB 3.43Å; D793-S795 PolarHBondContact OD2-OG 2.88Å; D793-V796 HydrophobicContact CB-CG2 4.11Å; D793-V796 PolarHBondContact O-N 2.84Å
794	H	88.3	Confident	95.1	Very high	108 Å²	108	27.9 Å²	27.9	50%	0.5	16%	0.155	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-10.8	174.8	-70.1	-160.5	0	0	0	114.3	P792	P792-H794 PolarHBondContact O-N 2.56Å
795	S	90.5	Very high	94.9	Very high	100 Å²	100	27 Å²	27	70%	0.699	16%	0.156	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.9	-26.8	171.2	95.9	0	0	0	0	112.9	D793	D793-S795 PolarHBondContact O-N 2.97Å; D793-S795 VanDerWaalsContact O-N 3.11Å; D793-S795 PolarHBondContact OD1-N 3.37Å; D793-S795 VanDerWaalsContact OD2-CB 3.25Å; D793-S795 WeakPolarHBondContact OD2-CB 3.43Å; D793-S795 PolarHBondContact OD2-OG 2.88Å
796	V	93.7	Very high	94.4	Very high	52 Å²	52	31.5 Å²	31.5	32%	0.315	18%	0.177	S	C	.	.	S	Bend	trans	-86.4	137.1	-176	-177.1	0	0	0	0	110.1	D791 D793 L913	D791-V796 HydrophobicContact CB-CB 4.02Å; D791-V796 HydrophobicContact CB-CG1 3.92Å; D791-V796 HydrophobicContact CB-CG2 4.41Å; D793-V796 HydrophobicContact CB-CG2 4.11Å; D793-V796 PolarHBondContact O-N 2.84Å; V796-L913 HydrophobicContact CG1-CD1 3.49Å; V796-L913 VanDerWaalsContact CG1-CD1 3.49Å
797	A	94.5	Very high	93.9	Very high	8 Å²	8	31.5 Å²	31.5	7%	0.066	18%	0.177	C	C	.	.	P	Polyproline II helix	trans	-83.6	128.2	178.2	0	0	0	0	0	111	F799 R814 P816 L913	A797-F799 HydrophobicContact CB-CE2 4.31Å; A797-F799 WeakPolarHBondContact O-CD2 3.46Å; A797-F799 VanDerWaalsContact O-CE2 3.27Å; A797-F799 WeakPolarHBondContact O-CE2 3.07Å; A797-R814 HydrophobicContact CB-CG 3.85Å; A797-P816 HydrophobicContact CB-CB 3.94Å; A797-L913 WeakPolarHBondContact O-CD1 3.37Å
798	A	96.6	Very high	93.6	Very high	2 Å²	2	35.3 Å²	35.3	2%	0.017	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	154.5	167.7	0	0	0	0	0	111.2	A789 L815 I818	A789-A798 WeakPolarHBondContact O-CA 3.22Å; A789-A798 WeakPolarHBondContact O-CB 3.47Å; A798-L815 HydrophobicContact CB-CB 4.35Å; A798-L815 PolarHBondContact N-O 3.32Å; A798-L815 PolarHBondContact O-N 3.25Å; A798-I818 HydrophobicContact CB-CG2 3.43Å; A798-I818 VanDerWaalsContact CB-CG2 3.43Å
799	F	97.4	Very high	93.4	Very high	25 Å²	25	36.8 Å²	36.8	11%	0.11	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	146.4	176.6	-72.6	-97.1	0	0	0	110.1	L788 A789 A797 L813 R814 P911 L913 L914	L788-F799 WeakPolarHBondContact CA-O 3.46Å; A789-F799 PolarHBondContact N-O 2.77Å; A789-F799 PolarHBondContact O-N 2.7Å; A789-F799 VanDerWaalsContact O-O 3.09Å; A797-F799 HydrophobicContact CB-CE2 4.31Å; A797-F799 WeakPolarHBondContact O-CD2 3.46Å; A797-F799 VanDerWaalsContact O-CE2 3.27Å; A797-F799 WeakPolarHBondContact O-CE2 3.07Å; F799-L813 WeakPolarHBondContact CA-O 3.41Å; F799-R814 HydrophobicContact CD1-CB 4.1Å; F799-R814 HydrophobicContact CD1-CG 4.29Å; F799-R814 HydrophobicContact CE1-CB 3.79Å; F799-R814 HydrophobicContact CE1-CG 3.73Å; F799-R814 HydrophobicContact CE2-CG 4.34Å; F799-R814 HydrophobicContact CZ-CB 4.35Å; F799-R814 HydrophobicContact CZ-CG 3.76Å; F799-P911 HydrophobicContact CD1-CG 4.47Å; F799-P911 HydrophobicContact CE1-CG 3.85Å; F799-P911 HydrophobicContact CE2-CG 4.02Å; F799-P911 HydrophobicContact CZ-CG 3.6Å; F799-L913 HydrophobicContact CD2-CB 3.79Å; F799-L913 HydrophobicContact CD2-CD1 4.46Å; F799-L913 HydrophobicContact CE2-CB 4.5Å; F799-L914 HydrophobicContact CB-CB 4.19Å; F799-L914 HydrophobicContact CB-CD1 4.26Å; F799-L914 HydrophobicContact CD1-CB 4.02Å; F799-L914 HydrophobicContact CD1-CD1 4.4Å; F799-L914 HydrophobicContact CD1-CD2 4.47Å; F799-L914 HydrophobicContact CG-CB 4.13Å
800	C	96.7	Very high	93.2	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	150.8	166.2	62.9	0	0	0	0	111.6	L786 G787 L788 Y812 L813	L786-C800 HydrophobicContact CD1-CB 3.78Å; G787-C800 CarbonylContact O-C 3.54Å; G787-C800 WeakPolarHBondContact O-CA 3.28Å; G787-C800 WeakPolarHBondContact O-CB 3.37Å; L788-C800 HydrophobicContact CB-CB 3.92Å; L788-C800 HydrophobicContact CD1-CB 4.32Å; L788-C800 HydrophobicContact CG-CB 4.03Å; C800-Y812 CarbonylContact O-C 3.5Å; C800-Y812 WeakPolarHBondContact O-CA 3.3Å; C800-Y812 WeakPolarHBondContact O-CB 3.49Å; C800-L813 PolarHBondContact N-O 3.42Å; C800-L813 PolarHBondContact O-N 3.1Å
801	A	96.9	Very high	93.1	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	142	-175	0	0	0	0	0	110.1	L786 G787 I809 D811 L914 A917	L786-A801 WeakPolarHBondContact CA-O 3.46Å; G787-A801 PolarHBondContact N-O 2.8Å; G787-A801 PolarHBondContact O-N 2.83Å; A801-I809 HydrophobicContact CB-CD1 4.42Å; A801-I809 HydrophobicContact CB-CG2 4.15Å; A801-D811 WeakPolarHBondContact CA-O 3.4Å; A801-L914 HydrophobicContact CB-CD1 3.96Å; A801-A917 HydrophobicContact CB-CB 4.23Å
802	V	97.2	Very high	93.2	Very high	1 Å²	1	43.7 Å²	43.7	1%	0.006	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	123.1	176.4	-177.6	0	0	0	0	110.8	V785 L786 S810 D811 F843 K847	V785-V802 CarbonylContact O-C 3.3Å; V785-V802 VanDerWaalsContact O-CA 3.31Å; V785-V802 WeakPolarHBondContact O-CA 3.27Å; L786-V802 HydrophobicContact CB-CG2 4.15Å; L786-V802 HydrophobicContact CD1-CG2 3.58Å; L786-V802 HydrophobicContact CG-CG2 4.41Å; V802-S810 WeakPolarHBondContact O-CB 3.39Å; V802-S810 PolarHBondContact O-N 2.94Å; V802-S810 PolarHBondContact O-OG 3.45Å; V802-D811 PolarHBondContact N-O 3.19Å; V802-F843 HydrophobicContact CG2-CD1 4.43Å; V802-F843 HydrophobicContact CG2-CE1 3.68Å; V802-F843 HydrophobicContact CG2-CZ 4.04Å; V802-K847 HydrophobicContact CB-CB 4.29Å; V802-K847 HydrophobicContact CG1-CB 4.09Å; V802-K847 HydrophobicContact CG2-CB 3.95Å; V802-K847 HydrophobicContact CG2-CG 4.35Å
803	T	95.3	Very high	93.4	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	147.3	172.6	56.6	0	0	0	0	112.8	R784 V785 D808 I809 A921 R922 Q925	R784-T803 WeakPolarHBondContact CA-O 3.2Å; R784-T803 WeakPolarHBondContact CB-O 3.34Å; V785-T803 PolarHBondContact N-OG1 3.45Å; V785-T803 PolarHBondContact O-N 2.96Å; V785-T803 PolarHBondContact O-OG1 2.85Å; T803-D808 CarbonylContact C-O 3.46Å; T803-D808 VanDerWaalsContact CA-O 3.22Å; T803-D808 WeakPolarHBondContact CA-O 3.35Å; T803-I809 HydrophobicContact CG2-CD1 4Å; T803-A921 HydrophobicContact CG2-CB 3.61Å; T803-R922 HydrophobicContact CG2-CG 4.2Å; T803-Q925 PolarHBondContact OG1-NE2 3.05Å
804	T	92.9	Very high	93.6	Very high	34 Å²	34	46 Å²	46	21%	0.209	24%	0.236	C	C	.	.			trans	-67.4	174.6	157.6	66.8	0	0	0	0	110.3	E806 G807 D808 Q925	T804-E806 WeakPolarHBondContact CB-OE2 3.35Å; T804-E806 PolarHBondContact O-N 3.34Å; T804-E806 PolarHBondContact OG1-N 3.32Å; T804-E806 PolarHBondContact OG1-OE2 2.89Å; T804-E806 VanDerWaalsContact OG1-OE2 3.14Å; T804-G807 PolarHBondContact O-N 2.74Å; T804-G807 VanDerWaalsContact O-N 3.16Å; T804-G807 PolarHBondContact OG1-N 3.07Å; T804-G807 VanDerWaalsContact OG1-N 3.12Å; T804-D808 HydrophobicContact CG2-CB 4.31Å; T804-D808 PolarHBondContact N-O 2.91Å; T804-D808 PolarHBondContact OG1-N 3.47Å; T804-D808 VanDerWaalsContact OG1-N 3.07Å; T804-Q925 PolarHBondContact O-NE2 3.09Å
805	V	90	Very high	94	Very high	37 Å²	37	40.9 Å²	40.9	22%	0.224	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-25.5	174.9	-58.9	0	0	0	0	111.5	R781 R784 G807	R781-V805 HydrophobicContact CB-CG2 4.2Å; R784-V805 HydrophobicContact CG-CG1 4.05Å; V805-G807 VanDerWaalsContact C-N 3.3Å
806	E	86.1	Confident	94.2	Very high	96 Å²	96	38.6 Å²	38.6	45%	0.449	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.9	-12.6	173.3	-54.8	76.8	-170.2	0	0	113.2	T804 N983 R985	T804-E806 WeakPolarHBondContact CB-OE2 3.35Å; T804-E806 PolarHBondContact O-N 3.34Å; T804-E806 PolarHBondContact OG1-N 3.32Å; T804-E806 PolarHBondContact OG1-OE2 2.89Å; T804-E806 VanDerWaalsContact OG1-OE2 3.14Å; E806-N983 PolarHBondContact O-ND2 2.85Å; E806-R985 PolarHBondContact O-NH2 3.11Å
807	G	88.3	Confident	94.2	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	19%	0.186	C	C	.	.	S	Bend	trans	88.9	14.9	173.8	0	0	0	0	0	116.6	T804 V805 R922	T804-G807 PolarHBondContact O-N 2.74Å; T804-G807 VanDerWaalsContact O-N 3.16Å; T804-G807 PolarHBondContact OG1-N 3.07Å; T804-G807 VanDerWaalsContact OG1-N 3.12Å; V805-G807 VanDerWaalsContact C-N 3.3Å; G807-R922 PolarHBondContact O-NE 2.82Å
808	D	91.3	Very high	94.1	Very high	80 Å²	80	37.1 Å²	37.1	43%	0.428	18%	0.184	S	C	.	.			trans	-82.2	155.9	171.6	-56.2	-53.4	0	0	0	110.7	T803 T804 S810	T803-D808 CarbonylContact C-O 3.46Å; T803-D808 VanDerWaalsContact CA-O 3.22Å; T803-D808 WeakPolarHBondContact CA-O 3.35Å; T804-D808 HydrophobicContact CG2-CB 4.31Å; T804-D808 PolarHBondContact N-O 2.91Å; T804-D808 PolarHBondContact OG1-N 3.47Å; T804-D808 VanDerWaalsContact OG1-N 3.07Å; D808-S810 PolarHBondContact O-N 3.35Å
809	I	93.5	Very high	93.9	Very high	31 Å²	31	37.9 Å²	37.9	16%	0.159	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	105.8	-176.6	-55.2	-54.4	0	0	0	110	A801 T803 F907 Y910 A918	A801-I809 HydrophobicContact CB-CD1 4.42Å; A801-I809 HydrophobicContact CB-CG2 4.15Å; T803-I809 HydrophobicContact CG2-CD1 4Å; I809-F907 HydrophobicContact CG1-CE1 3.82Å; I809-F907 HydrophobicContact CG1-CZ 3.62Å; I809-Y910 HydrophobicContact CG2-CE2 4.49Å; I809-A918 HydrophobicContact CD1-CB 3.6Å; I809-A918 HydrophobicContact CG1-CB 4.09Å
810	S	92.4	Very high	93.6	Very high	43 Å²	43	39.1 Å²	39.1	30%	0.301	19%	0.193	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	-19.1	-176.9	71.5	0	0	0	0	114.3	V802 D808 K847	V802-S810 WeakPolarHBondContact O-CB 3.39Å; V802-S810 PolarHBondContact O-N 2.94Å; V802-S810 PolarHBondContact O-OG 3.45Å; D808-S810 PolarHBondContact O-N 3.35Å; S810-K847 PolarHBondContact O-NZ 2.94Å
811	D	95.3	Very high	93.2	Very high	56 Å²	56	48.1 Å²	48.1	30%	0.299	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-178.2	167.1	175.6	-136	-49.6	0	0	0	111.3	A801 V802 F843 K847	A801-D811 WeakPolarHBondContact CA-O 3.4Å; V802-D811 PolarHBondContact N-O 3.19Å; D811-F843 HydrophobicContact CB-CE2 3.65Å; D811-F843 HydrophobicContact CB-CZ 3.84Å; D811-K847 HydrophobicContact CB-CD 4.05Å; D811-K847 VanDerWaalsContact CB-CE 3.47Å; D811-K847 HydrophobicContact CB-CG 4.41Å; D811-K847 WeakPolarHBondContact OD2-CE 3.44Å; D811-K847 IonicContact OD2-NZ 3.17Å; D811-K847 PolarHBondContact OD2-NZ 2.95Å
812	Y	96	Very high	92.7	Very high	111 Å²	111	50.4 Å²	50.4	44%	0.435	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	156.9	170.7	64.2	-93.1	0	0	0	113.3	C800 Y910 L914	C800-Y812 CarbonylContact O-C 3.5Å; C800-Y812 WeakPolarHBondContact O-CA 3.3Å; C800-Y812 WeakPolarHBondContact O-CB 3.49Å; Y812-Y910 HydrophobicContact CE1-CE1 4.11Å; Y812-L914 HydrophobicContact CD1-CD2 4.02Å; Y812-L914 HydrophobicContact CD2-CD1 4.37Å; Y812-L914 HydrophobicContact CD2-CD2 3.73Å; Y812-L914 HydrophobicContact CE1-CD2 4.33Å; Y812-L914 HydrophobicContact CE2-CD2 4.06Å; Y812-L914 HydrophobicContact CG-CD1 3.98Å; Y812-L914 HydrophobicContact CG-CD2 3.71Å
813	L	96.1	Very high	92.2	Very high	32 Å²	32	56.4 Å²	56.4	17%	0.168	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	130.4	-179	177.1	64.7	0	0	0	111.4	F799 C800 L815 K839 F843	F799-L813 WeakPolarHBondContact CA-O 3.41Å; C800-L813 PolarHBondContact N-O 3.42Å; C800-L813 PolarHBondContact O-N 3.1Å; L813-L815 HydrophobicContact CD2-CD2 3.74Å; L813-L815 HydrophobicContact CD2-CG 4.38Å; L813-L815 HydrophobicContact CG-CD2 3.86Å; L813-L815 HydrophobicContact CG-CG 4.18Å; L813-K839 HydrophobicContact CD1-CB 4.32Å; L813-K839 HydrophobicContact CD1-CD 4.45Å; L813-K839 HydrophobicContact CD2-CB 3.95Å; L813-F843 HydrophobicContact CB-CD1 4.17Å; L813-F843 HydrophobicContact CB-CD2 4.15Å; L813-F843 HydrophobicContact CB-CE1 4.05Å; L813-F843 HydrophobicContact CB-CE2 4.04Å; L813-F843 HydrophobicContact CB-CG 4.22Å; L813-F843 HydrophobicContact CB-CZ 3.99Å; L813-F843 HydrophobicContact CD2-CB 3.82Å; L813-F843 HydrophobicContact CD2-CD1 4.19Å; L813-F843 HydrophobicContact CD2-CD2 4.42Å; L813-F843 HydrophobicContact CD2-CG 3.94Å
814	R	96.6	Very high	91.7	Very high	151 Å²	151	57.4 Å²	57.4	57%	0.57	28%	0.276	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.1	126.9	175.3	-174.5	-177.3	174.2	-157.7	-1	110.7	A797 F799 P816	A797-R814 HydrophobicContact CB-CG 3.85Å; F799-R814 HydrophobicContact CD1-CB 4.1Å; F799-R814 HydrophobicContact CD1-CG 4.29Å; F799-R814 HydrophobicContact CE1-CB 3.79Å; F799-R814 HydrophobicContact CE1-CG 3.73Å; F799-R814 HydrophobicContact CE2-CG 4.34Å; F799-R814 HydrophobicContact CZ-CB 4.35Å; F799-R814 HydrophobicContact CZ-CG 3.76Å; R814-P816 WeakPolarHBondContact O-CD 3.16Å
815	L	96.1	Very high	91.4	Very high	0 Å²	0	66.7 Å²	66.7	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	74.1	-172.3	-61.8	172.6	0	0	0	111.4	L788 A798 L813 N817 I818 D836 L840	L788-L815 HydrophobicContact CD1-CD1 4.33Å; A798-L815 HydrophobicContact CB-CB 4.35Å; A798-L815 PolarHBondContact N-O 3.32Å; A798-L815 PolarHBondContact O-N 3.25Å; L813-L815 HydrophobicContact CD2-CD2 3.74Å; L813-L815 HydrophobicContact CD2-CG 4.38Å; L813-L815 HydrophobicContact CG-CD2 3.86Å; L813-L815 HydrophobicContact CG-CG 4.18Å; L815-N817 PolarHBondContact O-N 3.16Å; L815-N817 VanDerWaalsContact O-N 3.08Å; L815-I818 HydrophobicContact CB-CB 4.12Å; L815-I818 HydrophobicContact CD1-CD1 4.38Å; L815-I818 PolarHBondContact O-N 3.23Å; L815-D836 HydrophobicContact CD2-CB 4.01Å; L815-L840 HydrophobicContact CD1-CD1 4.32Å; L815-L840 HydrophobicContact CD1-CD2 4.2Å; L815-L840 HydrophobicContact CD2-CB 4.47Å
816	P	94.7	Very high	91.3	Very high	51 Å²	51	68.1 Å²	68.1	33%	0.331	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-5.6	-173.5	26.5	-32.9	0	0	0	115.8	A797 R814 D836	A797-P816 HydrophobicContact CB-CB 3.94Å; R814-P816 WeakPolarHBondContact O-CD 3.16Å; P816-D836 VanDerWaalsContact CD-OD2 3.28Å; P816-D836 WeakPolarHBondContact CD-OD2 3.43Å
817	N	94	Very high	91.5	Very high	25 Å²	25	70.4 Å²	70.4	13%	0.134	33%	0.33	C	S	.	.	T	Hydrogen-bonded Turn	trans	-125.4	11.5	-177.1	-54.3	-82.4	0	0	0	113.6	L815 L819 K820 Q832 D836	L815-N817 PolarHBondContact O-N 3.16Å; L815-N817 VanDerWaalsContact O-N 3.08Å; N817-L819 PolarHBondContact O-N 3.16Å; N817-K820 HydrophobicContact CB-CD 4.04Å; N817-K820 WeakPolarHBondContact O-CB 3.42Å; N817-K820 PolarHBondContact O-N 3.38Å; N817-K820 VanDerWaalsContact O-N 3.08Å; N817-K820 PolarHBondContact OD1-NZ 2.9Å; N817-Q832 HydrophobicContact CB-CB 4.02Å; N817-D836 WeakPolarHBondContact CA-OD2 3.43Å; N817-D836 WeakPolarHBondContact CB-OD2 3.28Å; N817-D836 PolarHBondContact N-OD2 2.86Å; N817-D836 PolarHBondContact ND2-OD2 2.86Å
818	I	93.7	Very high	91.6	Very high	4 Å²	4	76.2 Å²	76.2	2%	0.021	36%	0.357	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-24.1	-172.5	-155.1	65.5	0	0	0	113.5	A798 L815 K833 L837 L840 I864	A798-I818 HydrophobicContact CB-CG2 3.43Å; A798-I818 VanDerWaalsContact CB-CG2 3.43Å; L815-I818 HydrophobicContact CB-CB 4.12Å; L815-I818 HydrophobicContact CD1-CD1 4.38Å; L815-I818 PolarHBondContact O-N 3.23Å; I818-K833 WeakPolarHBondContact O-CE 3.47Å; I818-K833 PolarHBondContact O-NZ 3.01Å; I818-L837 HydrophobicContact CD1-CD2 3.77Å; I818-L840 HydrophobicContact CD1-CD2 4.41Å; I818-I864 HydrophobicContact CG1-CG1 4.34Å; I818-I864 HydrophobicContact CG2-CD1 4.3Å
819	L	92.5	Very high	91.5	Very high	19 Å²	19	75.5 Å²	75.5	10%	0.099	35%	0.351	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.9	-13.6	178.3	-58.8	170.6	0	0	0	113.4	Y790 D791 N817 D860 I864	Y790-L819 HydrophobicContact CD2-CD1 4.38Å; Y790-L819 HydrophobicContact CD2-CD2 3.7Å; Y790-L819 HydrophobicContact CE2-CD2 4.11Å; Y790-L819 HydrophobicContact CG-CD2 4.35Å; D791-L819 WeakPolarHBondContact O-CD1 3.39Å; N817-L819 PolarHBondContact O-N 3.16Å; L819-D860 HydrophobicContact CD2-CB 4.02Å; L819-I864 HydrophobicContact CD2-CD1 4.04Å
820	K	91	Very high	91.4	Very high	51 Å²	51	77.1 Å²	77.1	22%	0.222	36%	0.357	C	S	.	.	S	Bend	trans	-70.1	145.5	176.4	-70.2	172.8	-179.9	167.6	0	110.2	N817 E829 K833	N817-K820 HydrophobicContact CB-CD 4.04Å; N817-K820 WeakPolarHBondContact O-CB 3.42Å; N817-K820 PolarHBondContact O-N 3.38Å; N817-K820 VanDerWaalsContact O-N 3.08Å; N817-K820 PolarHBondContact OD1-NZ 2.9Å; K820-E829 HydrophobicContact CB-CB 4.43Å; K820-E829 HydrophobicContact CD-CB 4.17Å; K820-E829 HydrophobicContact CD-CG 4.06Å; K820-E829 HydrophobicContact CG-CG 4.43Å; K820-K833 HydrophobicContact CB-CB 4.12Å; K820-K833 WeakPolarHBondContact O-CD 3.13Å; K820-K833 VanDerWaalsContact O-CE 3.25Å; K820-K833 WeakPolarHBondContact O-CE 3.42Å; K820-K833 WeakPolarHBondContact O-CG 3.41Å
821	R	87.1	Confident	91.4	Very high	188 Å²	188	77.9 Å²	77.9	71%	0.709	37%	0.366	S	S	*	.			trans	-78.4	127.1	-173.2	-65.8	-179	178.8	179.6	0.2	111.5	N823 S824	R821-N823 PolarHBondContact O-N 3.47Å; R821-S824 WeakPolarHBondContact O-CB 3.36Å; R821-S824 PolarHBondContact O-N 2.61Å
822	K	86.8	Confident	91.3	Very high	49 Å²	49	77.6 Å²	77.6	21%	0.213	36%	0.363	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.1	-24.8	171.7	-176.7	168.9	175.8	175	0	113.4	K830 K833 L834 L837 D867 E870	K822-K830 VanDerWaalsContact O-CD 3.26Å; K822-K830 WeakPolarHBondContact O-CD 3.42Å; K822-K830 WeakPolarHBondContact O-CE 3.29Å; K822-K830 WeakPolarHBondContact O-CG 3.2Å; K822-K830 PolarHBondContact O-NZ 3.22Å; K822-K830 VanDerWaalsContact O-NZ 3.15Å; K822-K833 HydrophobicContact CB-CG 4.34Å; K822-L834 HydrophobicContact CG-CD2 4.19Å; K822-L837 HydrophobicContact CD-CD1 4.08Å; K822-D867 VanDerWaalsContact CD-OD1 3.25Å; K822-D867 WeakPolarHBondContact CD-OD1 3.49Å; K822-E870 IonicContact NZ-OE1 2.69Å; K822-E870 PolarHBondContact NZ-OE1 3.02Å; K822-E870 IonicContact NZ-OE2 3.77Å; K822-E870 PolarHBondContact NZ-OE2 2.79Å
823	N	86.9	Confident	91.2	Very high	126 Å²	126	72.5 Å²	72.5	67%	0.674	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-116.9	36.9	173.2	-68.7	-39.5	0	0	0	113.1	R821 K830	R821-N823 PolarHBondContact O-N 3.47Å; N823-K830 PolarHBondContact OD1-NZ 3.23Å; N823-K830 VanDerWaalsContact OD1-NZ 3.15Å
824	S	85.3	Confident	91.1	Very high	21 Å²	21	73.4 Å²	73.4	15%	0.147	35%	0.347	C	S	.	.			trans	-61.6	146.3	167.2	-168.7	0	0	0	0	111	R821 N826 E829	R821-S824 WeakPolarHBondContact O-CB 3.36Å; R821-S824 PolarHBondContact O-N 2.61Å; S824-N826 PolarHBondContact OG-N 3.17Å; S824-E829 WeakPolarHBondContact CB-OE2 3.46Å; S824-E829 PolarHBondContact OG-OE2 2.9Å
825	Y	85.4	Confident	91	Very high	229 Å²	229	68.2 Å²	68.2	90%	0.898	34%	0.336	S	S	*	.	S	Bend	trans	-70.3	-25.3	171.1	-44.5	-76.4	0	0	0	111.3	L827	Y825-L827 PolarHBondContact O-N 3.49Å
826	N	89	Confident	91	Very high	67 Å²	67	68.2 Å²	68.2	36%	0.358	34%	0.337	S	S	.	.	S	Bend	trans	-76.3	116.1	172.2	-176.3	-2.8	0	0	0	109.5	S824 E828 E829 K830	S824-N826 PolarHBondContact OG-N 3.17Å; N826-E828 PolarHBondContact O-N 2.81Å; N826-E828 WeakPolarHBondContact OD1-CB 3.44Å; N826-E828 PolarHBondContact OD1-N 3.12Å; N826-E829 HydrophobicContact CB-CB 4.16Å; N826-E829 HydrophobicContact CB-CG 4.08Å; N826-E829 VanDerWaalsContact CB-OE1 3.29Å; N826-E829 WeakPolarHBondContact CB-OE1 3.21Å; N826-E829 WeakPolarHBondContact ND2-CG 3.42Å; N826-E829 PolarHBondContact ND2-OE1 3.49Å; N826-K830 WeakPolarHBondContact O-CB 3.45Å; N826-K830 PolarHBondContact O-N 2.94Å; N826-K830 VanDerWaalsContact O-N 3.13Å
827	L	89.4	Confident	91.1	Very high	144 Å²	144	66.3 Å²	66.3	75%	0.754	32%	0.323	S	S	*	.	H	α-helix	trans	-62.7	-30.1	179.6	-66.9	174.1	0	0	0	112.4	Y825 A831	Y825-L827 PolarHBondContact O-N 3.49Å; L827-A831 WeakPolarHBondContact O-CB 3.15Å; L827-A831 PolarHBondContact O-N 3.49Å
828	E	90.7	Very high	91.1	Very high	123 Å²	123	73.4 Å²	73.4	58%	0.575	35%	0.348	S	S	*	.	H	α-helix	trans	-72.3	-51.3	-179.4	-162.2	-166.8	136.1	0	0	111.4	N826 K830 A831 Q832	N826-E828 PolarHBondContact O-N 2.81Å; N826-E828 WeakPolarHBondContact OD1-CB 3.44Å; N826-E828 PolarHBondContact OD1-N 3.12Å; E828-K830 PolarHBondContact O-N 3.3Å; E828-A831 PolarHBondContact O-N 3.4Å; E828-A831 VanDerWaalsContact O-N 3.12Å; E828-Q832 WeakPolarHBondContact O-CB 3.43Å; E828-Q832 VanDerWaalsContact O-CG 3.27Å; E828-Q832 WeakPolarHBondContact O-CG 3.46Å; E828-Q832 PolarHBondContact O-N 3.1Å; E828-Q832 PolarHBondContact OE1-NE2 3.04Å
829	E	89.5	Confident	91.3	Very high	64 Å²	64	77.4 Å²	77.4	30%	0.299	37%	0.366	S	S	.	.	H	α-helix	trans	-54.9	-42.7	173.3	-74.9	162.1	-138.3	0	0	111.8	K820 S824 N826 Q832 K833	K820-E829 HydrophobicContact CB-CB 4.43Å; K820-E829 HydrophobicContact CD-CB 4.17Å; K820-E829 HydrophobicContact CD-CG 4.06Å; K820-E829 HydrophobicContact CG-CG 4.43Å; S824-E829 WeakPolarHBondContact CB-OE2 3.46Å; S824-E829 PolarHBondContact OG-OE2 2.9Å; N826-E829 HydrophobicContact CB-CB 4.16Å; N826-E829 HydrophobicContact CB-CG 4.08Å; N826-E829 VanDerWaalsContact CB-OE1 3.29Å; N826-E829 WeakPolarHBondContact CB-OE1 3.21Å; N826-E829 WeakPolarHBondContact ND2-CG 3.42Å; N826-E829 PolarHBondContact ND2-OE1 3.49Å; E829-Q832 PolarHBondContact O-N 2.88Å; E829-K833 WeakPolarHBondContact O-CB 3.37Å; E829-K833 PolarHBondContact O-N 3.16Å
830	K	91	Very high	91.4	Very high	65 Å²	65	76.5 Å²	76.5	28%	0.283	36%	0.361	S	S	.	.	H	α-helix	trans	-63.4	-44.6	177.6	176.6	161.5	-178	149.5	0	111.5	K822 N823 N826 E828 L834	K822-K830 VanDerWaalsContact O-CD 3.26Å; K822-K830 WeakPolarHBondContact O-CD 3.42Å; K822-K830 WeakPolarHBondContact O-CE 3.29Å; K822-K830 WeakPolarHBondContact O-CG 3.2Å; K822-K830 PolarHBondContact O-NZ 3.22Å; K822-K830 VanDerWaalsContact O-NZ 3.15Å; N823-K830 PolarHBondContact OD1-NZ 3.23Å; N823-K830 VanDerWaalsContact OD1-NZ 3.15Å; N826-K830 WeakPolarHBondContact O-CB 3.45Å; N826-K830 PolarHBondContact O-N 2.94Å; N826-K830 VanDerWaalsContact O-N 3.13Å; E828-K830 PolarHBondContact O-N 3.3Å; K830-L834 HydrophobicContact CG-CD1 3.89Å; K830-L834 WeakPolarHBondContact O-CB 3.4Å; K830-L834 WeakPolarHBondContact O-CD1 3.37Å; K830-L834 WeakPolarHBondContact O-CG 3.25Å; K830-L834 PolarHBondContact O-N 3.26Å
831	A	92.8	Very high	91.7	Very high	59 Å²	59	75.2 Å²	75.2	49%	0.488	36%	0.358	S	S	.	.	H	α-helix	trans	-63.9	-41.1	176	0	0	0	0	0	111.9	L827 E828 L834 A835	L827-A831 WeakPolarHBondContact O-CB 3.15Å; L827-A831 PolarHBondContact O-N 3.49Å; E828-A831 PolarHBondContact O-N 3.4Å; E828-A831 VanDerWaalsContact O-N 3.12Å; A831-L834 PolarHBondContact O-N 3.46Å; A831-A835 WeakPolarHBondContact O-CB 3.15Å; A831-A835 PolarHBondContact O-N 2.74Å
832	Q	93	Very high	92	Very high	51 Å²	51	71.4 Å²	71.4	24%	0.238	35%	0.352	C	S	.	.	H	α-helix	trans	-64.5	-47.5	178	-74.2	166.5	-5.5	0	0	112.4	N817 E828 E829 L834 A835 D836	N817-Q832 HydrophobicContact CB-CB 4.02Å; E828-Q832 WeakPolarHBondContact O-CB 3.43Å; E828-Q832 VanDerWaalsContact O-CG 3.27Å; E828-Q832 WeakPolarHBondContact O-CG 3.46Å; E828-Q832 PolarHBondContact O-N 3.1Å; E828-Q832 PolarHBondContact OE1-NE2 3.04Å; E829-Q832 PolarHBondContact O-N 2.88Å; Q832-L834 PolarHBondContact O-N 3.28Å; Q832-A835 PolarHBondContact O-N 2.79Å; Q832-D836 PolarHBondContact O-N 3.2Å; Q832-D836 VanDerWaalsContact O-N 3.13Å
833	K	93.9	Very high	92.5	Very high	3 Å²	3	69.6 Å²	69.6	1%	0.013	34%	0.344	C	S	.	.	H	α-helix	trans	-58.8	-46.1	172.9	171.8	61.5	164.3	176.2	0	111.6	I818 K820 K822 E829 A835 D836 L837 D867	I818-K833 WeakPolarHBondContact O-CE 3.47Å; I818-K833 PolarHBondContact O-NZ 3.01Å; K820-K833 HydrophobicContact CB-CB 4.12Å; K820-K833 WeakPolarHBondContact O-CD 3.13Å; K820-K833 VanDerWaalsContact O-CE 3.25Å; K820-K833 WeakPolarHBondContact O-CE 3.42Å; K820-K833 WeakPolarHBondContact O-CG 3.41Å; K822-K833 HydrophobicContact CB-CG 4.34Å; E829-K833 WeakPolarHBondContact O-CB 3.37Å; E829-K833 PolarHBondContact O-N 3.16Å; K833-A835 VanDerWaalsContact C-N 3.3Å; K833-A835 PolarHBondContact O-N 2.72Å; K833-D836 PolarHBondContact O-N 2.85Å; K833-L837 HydrophobicContact CD-CD1 4.19Å; K833-L837 HydrophobicContact CD-CG 4.08Å; K833-L837 HydrophobicContact CG-CD1 4.23Å; K833-L837 HydrophobicContact CG-CG 4.49Å; K833-L837 WeakPolarHBondContact O-CG 3.34Å; K833-L837 PolarHBondContact O-N 2.82Å; K833-D867 WeakPolarHBondContact CE-OD2 3.35Å; K833-D867 IonicContact NZ-OD2 3.85Å; K833-D867 PolarHBondContact NZ-OD2 3.29Å
834	L	94	Very high	92.9	Very high	52 Å²	52	63.7 Å²	63.7	27%	0.272	31%	0.312	S	S	.	.	H	α-helix	trans	-66.4	-29.8	178.8	-72.2	169.9	0	0	0	112.8	K822 K830 A831 Q832 R838	K822-L834 HydrophobicContact CG-CD2 4.19Å; K830-L834 HydrophobicContact CG-CD1 3.89Å; K830-L834 WeakPolarHBondContact O-CB 3.4Å; K830-L834 WeakPolarHBondContact O-CD1 3.37Å; K830-L834 WeakPolarHBondContact O-CG 3.25Å; K830-L834 PolarHBondContact O-N 3.26Å; A831-L834 PolarHBondContact O-N 3.46Å; Q832-L834 PolarHBondContact O-N 3.28Å; L834-R838 VanDerWaalsContact O-CG 3.3Å; L834-R838 WeakPolarHBondContact O-CG 3.49Å; L834-R838 PolarHBondContact O-N 2.65Å; L834-R838 VanDerWaalsContact O-N 3.16Å
835	A	95.1	Very high	93.3	Very high	41 Å²	41	66.3 Å²	66.3	34%	0.339	32%	0.321	S	S	.	.	H	α-helix	trans	-68	-43.5	173.1	0	0	0	0	0	111.7	A831 Q832 K833 R838 K839	A831-A835 WeakPolarHBondContact O-CB 3.15Å; A831-A835 PolarHBondContact O-N 2.74Å; Q832-A835 PolarHBondContact O-N 2.79Å; K833-A835 VanDerWaalsContact C-N 3.3Å; K833-A835 PolarHBondContact O-N 2.72Å; A835-R838 PolarHBondContact O-N 3.24Å; A835-K839 WeakPolarHBondContact O-CG 3.28Å; A835-K839 PolarHBondContact O-N 3.06Å; A835-K839 VanDerWaalsContact O-N 3.16Å
836	D	95.8	Very high	93.7	Very high	1 Å²	1	61.1 Å²	61.1	1%	0.005	31%	0.307	C	S	.	.	H	α-helix	trans	-72	-34	178.3	-76.4	-4.9	0	0	0	112.5	L815 P816 N817 Q832 K833 R838 K839 L840	L815-D836 HydrophobicContact CD2-CB 4.01Å; P816-D836 VanDerWaalsContact CD-OD2 3.28Å; P816-D836 WeakPolarHBondContact CD-OD2 3.43Å; N817-D836 WeakPolarHBondContact CA-OD2 3.43Å; N817-D836 WeakPolarHBondContact CB-OD2 3.28Å; N817-D836 PolarHBondContact N-OD2 2.86Å; N817-D836 PolarHBondContact ND2-OD2 2.86Å; Q832-D836 PolarHBondContact O-N 3.2Å; Q832-D836 VanDerWaalsContact O-N 3.13Å; K833-D836 PolarHBondContact O-N 2.85Å; D836-R838 VanDerWaalsContact C-N 3.34Å; D836-R838 PolarHBondContact O-N 3.04Å; D836-K839 PolarHBondContact O-N 3.19Å; D836-K839 WeakPolarHBondContact OD1-CE 3.27Å; D836-K839 IonicContact OD1-NZ 3.99Å; D836-K839 PolarHBondContact OD1-NZ 3.25Å; D836-L840 WeakPolarHBondContact O-CB 3.31Å; D836-L840 PolarHBondContact O-N 3.22Å
837	L	95.6	Very high	93.9	Very high	10 Å²	10	60.3 Å²	60.3	5%	0.052	30%	0.3	C	S	.	.	H	α-helix	trans	-63	-36.5	170.5	-71.9	-180	0	0	0	112.8	I818 K822 K833 L840 S841 D867 I871	I818-L837 HydrophobicContact CD1-CD2 3.77Å; K822-L837 HydrophobicContact CD-CD1 4.08Å; K833-L837 HydrophobicContact CD-CD1 4.19Å; K833-L837 HydrophobicContact CD-CG 4.08Å; K833-L837 HydrophobicContact CG-CD1 4.23Å; K833-L837 HydrophobicContact CG-CG 4.49Å; K833-L837 WeakPolarHBondContact O-CG 3.34Å; K833-L837 PolarHBondContact O-N 2.82Å; L837-L840 PolarHBondContact O-N 2.7Å; L837-S841 PolarHBondContact O-N 2.88Å; L837-D867 HydrophobicContact CD1-CB 4.37Å; L837-D867 HydrophobicContact CD2-CB 3.77Å; L837-I871 HydrophobicContact CB-CD1 4.19Å; L837-I871 HydrophobicContact CD2-CD1 3.93Å; L837-I871 WeakPolarHBondContact O-CD1 3.3Å
838	R	95.4	Very high	94.1	Very high	174 Å²	174	55.7 Å²	55.7	66%	0.657	27%	0.274	S	S	*	.	H	α-helix	trans	-64.7	-49.9	174	-74.8	168.9	-174.6	169.2	2	111.7	L834 A835 D836 L840 S841 D842	L834-R838 VanDerWaalsContact O-CG 3.3Å; L834-R838 WeakPolarHBondContact O-CG 3.49Å; L834-R838 PolarHBondContact O-N 2.65Å; L834-R838 VanDerWaalsContact O-N 3.16Å; A835-R838 PolarHBondContact O-N 3.24Å; D836-R838 VanDerWaalsContact C-N 3.34Å; D836-R838 PolarHBondContact O-N 3.04Å; R838-L840 PolarHBondContact O-N 3.06Å; R838-S841 WeakPolarHBondContact O-CA 3.28Å; R838-S841 WeakPolarHBondContact O-CB 3.34Å; R838-S841 PolarHBondContact O-N 3.05Å; R838-D842 PolarHBondContact O-N 3.28Å
839	K	96.1	Very high	94.3	Very high	89 Å²	89	49.9 Å²	49.9	39%	0.387	25%	0.247	S	C	.	.	H	α-helix	trans	-53.5	-42.6	175.1	-63.5	170.9	-169	164.7	0	111.6	L813 A835 D836 D842 F843	L813-K839 HydrophobicContact CD1-CB 4.32Å; L813-K839 HydrophobicContact CD1-CD 4.45Å; L813-K839 HydrophobicContact CD2-CB 3.95Å; A835-K839 WeakPolarHBondContact O-CG 3.28Å; A835-K839 PolarHBondContact O-N 3.06Å; A835-K839 VanDerWaalsContact O-N 3.16Å; D836-K839 PolarHBondContact O-N 3.19Å; D836-K839 WeakPolarHBondContact OD1-CE 3.27Å; D836-K839 IonicContact OD1-NZ 3.99Å; D836-K839 PolarHBondContact OD1-NZ 3.25Å; K839-D842 PolarHBondContact O-N 3.19Å; K839-F843 WeakPolarHBondContact O-CB 3.46Å; K839-F843 PolarHBondContact O-N 2.97Å
840	L	95.9	Very high	94.5	Very high	0 Å²	0	47 Å²	47	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-66.6	-39.5	178.5	-176.6	56.2	0	0	0	112.2	L786 L815 I818 D836 L837 R838 F843 I844 I868	L786-L840 HydrophobicContact CD2-CD1 4.25Å; L815-L840 HydrophobicContact CD1-CD1 4.32Å; L815-L840 HydrophobicContact CD1-CD2 4.2Å; L815-L840 HydrophobicContact CD2-CB 4.47Å; I818-L840 HydrophobicContact CD1-CD2 4.41Å; D836-L840 WeakPolarHBondContact O-CB 3.31Å; D836-L840 PolarHBondContact O-N 3.22Å; L837-L840 PolarHBondContact O-N 2.7Å; R838-L840 PolarHBondContact O-N 3.06Å; L840-F843 PolarHBondContact O-N 2.97Å; L840-I844 HydrophobicContact CD1-CD1 4.12Å; L840-I844 HydrophobicContact CD1-CG1 4.32Å; L840-I844 HydrophobicContact CG-CD1 4.03Å; L840-I844 WeakPolarHBondContact O-CB 3.37Å; L840-I844 VanDerWaalsContact O-CG1 3.25Å; L840-I844 WeakPolarHBondContact O-CG1 3.18Å; L840-I844 PolarHBondContact O-N 2.55Å; L840-I868 HydrophobicContact CD2-CD1 3.9Å; L840-I868 HydrophobicContact CD2-CG1 3.8Å
841	S	95.8	Very high	94.7	Very high	23 Å²	23	43.9 Å²	43.9	16%	0.161	22%	0.22	C	C	.	.	H	α-helix	trans	-62.5	-47.9	172.3	-173.2	0	0	0	0	112.1	L837 R838 F843 I844 K845	L837-S841 PolarHBondContact O-N 2.88Å; R838-S841 WeakPolarHBondContact O-CA 3.28Å; R838-S841 WeakPolarHBondContact O-CB 3.34Å; R838-S841 PolarHBondContact O-N 3.05Å; S841-F843 VanDerWaalsContact C-N 3.29Å; S841-F843 PolarHBondContact O-N 3.06Å; S841-I844 PolarHBondContact O-N 3.44Å; S841-K845 VanDerWaalsContact O-CB 3.29Å; S841-K845 WeakPolarHBondContact O-CB 3.44Å; S841-K845 PolarHBondContact O-N 3.38Å
842	D	95.5	Very high	94.9	Very high	108 Å²	108	41.1 Å²	41.1	58%	0.578	20%	0.196	S	C	*	.	H	α-helix	trans	-60.9	-38.7	176.8	-64	-40.3	0	0	0	111.6	R838 K839 K845 M846	R838-D842 PolarHBondContact O-N 3.28Å; K839-D842 PolarHBondContact O-N 3.19Å; D842-K845 PolarHBondContact O-N 3.1Å; D842-M846 VanDerWaalsContact O-CB 3.3Å; D842-M846 WeakPolarHBondContact O-CB 3.38Å; D842-M846 PolarHBondContact O-N 3.22Å
843	F	95.9	Very high	95.1	Very high	12 Å²	12	38.7 Å²	38.7	5%	0.053	19%	0.185	C	C	.	.	H	α-helix	trans	-70.2	-44.3	178.6	-171.7	-111.5	0	0	0	112.9	L786 V802 D811 L813 K839 L840 S841 K845 M846 K847	L786-F843 HydrophobicContact CD1-CD1 4.25Å; L786-F843 HydrophobicContact CD1-CE1 3.81Å; V802-F843 HydrophobicContact CG2-CD1 4.43Å; V802-F843 HydrophobicContact CG2-CE1 3.68Å; V802-F843 HydrophobicContact CG2-CZ 4.04Å; D811-F843 HydrophobicContact CB-CE2 3.65Å; D811-F843 HydrophobicContact CB-CZ 3.84Å; L813-F843 HydrophobicContact CB-CD1 4.17Å; L813-F843 HydrophobicContact CB-CD2 4.15Å; L813-F843 HydrophobicContact CB-CE1 4.05Å; L813-F843 HydrophobicContact CB-CE2 4.04Å; L813-F843 HydrophobicContact CB-CG 4.22Å; L813-F843 HydrophobicContact CB-CZ 3.99Å; L813-F843 HydrophobicContact CD2-CB 3.82Å; L813-F843 HydrophobicContact CD2-CD1 4.19Å; L813-F843 HydrophobicContact CD2-CD2 4.42Å; L813-F843 HydrophobicContact CD2-CG 3.94Å; K839-F843 WeakPolarHBondContact O-CB 3.46Å; K839-F843 PolarHBondContact O-N 2.97Å; L840-F843 PolarHBondContact O-N 2.97Å; S841-F843 VanDerWaalsContact C-N 3.29Å; S841-F843 PolarHBondContact O-N 3.06Å; F843-K845 VanDerWaalsContact C-N 3.32Å; F843-K845 PolarHBondContact O-N 2.88Å; F843-M846 HydrophobicContact CD2-CE 4.01Å; F843-M846 PolarHBondContact O-N 2.74Å; F843-K847 HydrophobicContact CE2-CG 4.46Å; F843-K847 PolarHBondContact O-N 2.94Å
844	I	95.7	Very high	95.3	Very high	1 Å²	1	38.5 Å²	38.5	1%	0.005	19%	0.185	C	C	.	.	H	α-helix	trans	-60	-44.8	171.2	-71.8	165.6	0	0	0	109.9	L786 L840 S841 M846 K847 K848 P849 I868 I871 L872 L875 F881	L786-I844 HydrophobicContact CD2-CD1 4.09Å; L786-I844 HydrophobicContact CD2-CG1 3.62Å; L840-I844 HydrophobicContact CD1-CD1 4.12Å; L840-I844 HydrophobicContact CD1-CG1 4.32Å; L840-I844 HydrophobicContact CG-CD1 4.03Å; L840-I844 WeakPolarHBondContact O-CB 3.37Å; L840-I844 VanDerWaalsContact O-CG1 3.25Å; L840-I844 WeakPolarHBondContact O-CG1 3.18Å; L840-I844 PolarHBondContact O-N 2.55Å; S841-I844 PolarHBondContact O-N 3.44Å; I844-M846 VanDerWaalsContact C-N 3.31Å; I844-M846 PolarHBondContact O-N 2.8Å; I844-K847 PolarHBondContact O-N 3.04Å; I844-K848 WeakPolarHBondContact O-CA 3.37Å; I844-K848 PolarHBondContact O-N 3.43Å; I844-P849 HydrophobicContact CG2-CG 4.45Å; I844-I868 HydrophobicContact CD1-CG2 4.41Å; I844-I871 HydrophobicContact CD1-CG2 4.24Å; I844-L872 HydrophobicContact CG2-CD2 3.79Å; I844-L875 HydrophobicContact CB-CD1 4.31Å; I844-L875 HydrophobicContact CG2-CD1 3.73Å; I844-F881 HydrophobicContact CG2-CE1 4.48Å
845	K	93.7	Very high	95.4	Very high	77 Å²	77	36.1 Å²	36.1	34%	0.335	17%	0.173	S	C	.	.	H	α-helix	trans	-61.6	-38.8	178.2	-174.6	176.9	178.3	176.6	0	112.4	S841 D842 F843 L875 E879 F881	S841-K845 VanDerWaalsContact O-CB 3.29Å; S841-K845 WeakPolarHBondContact O-CB 3.44Å; S841-K845 PolarHBondContact O-N 3.38Å; D842-K845 PolarHBondContact O-N 3.1Å; F843-K845 VanDerWaalsContact C-N 3.32Å; F843-K845 PolarHBondContact O-N 2.88Å; K845-L875 HydrophobicContact CB-CD2 4.26Å; K845-L875 HydrophobicContact CD-CD2 4.36Å; K845-L875 HydrophobicContact CG-CD2 4.45Å; K845-E879 HydrophobicContact CD-CG 4.37Å; K845-E879 WeakPolarHBondContact CE-OE2 3.34Å; K845-E879 IonicContact NZ-OE1 2.61Å; K845-E879 PolarHBondContact NZ-OE1 2.87Å; K845-E879 IonicContact NZ-OE2 2.69Å; K845-E879 PolarHBondContact NZ-OE2 3.46Å; K845-F881 HydrophobicContact CB-CZ 4.41Å; K845-F881 HydrophobicContact CG-CE2 4.46Å; K845-F881 HydrophobicContact CG-CZ 4.2Å
846	M	93.7	Very high	95.4	Very high	120 Å²	120	34.2 Å²	34.2	59%	0.591	16%	0.156	S	C	*	.	H	α-helix	trans	-73.5	-43.4	179.2	178.8	170.4	65.9	0	0	113.4	D842 F843 I844	D842-M846 VanDerWaalsContact O-CB 3.3Å; D842-M846 WeakPolarHBondContact O-CB 3.38Å; D842-M846 PolarHBondContact O-N 3.22Å; F843-M846 HydrophobicContact CD2-CE 4.01Å; F843-M846 PolarHBondContact O-N 2.74Å; I844-M846 VanDerWaalsContact C-N 3.31Å; I844-M846 PolarHBondContact O-N 2.8Å
847	K	93.9	Very high	95.3	Very high	49 Å²	49	35.6 Å²	35.6	21%	0.213	16%	0.163	C	C	.	.	H	α-helix	trans	-100.9	-10.7	-170.1	-63.6	-74.9	168.9	158.2	0	114.7	V802 S810 D811 F843 I844	V802-K847 HydrophobicContact CB-CB 4.29Å; V802-K847 HydrophobicContact CG1-CB 4.09Å; V802-K847 HydrophobicContact CG2-CB 3.95Å; V802-K847 HydrophobicContact CG2-CG 4.35Å; S810-K847 PolarHBondContact O-NZ 2.94Å; D811-K847 HydrophobicContact CB-CD 4.05Å; D811-K847 VanDerWaalsContact CB-CE 3.47Å; D811-K847 HydrophobicContact CB-CG 4.41Å; D811-K847 WeakPolarHBondContact OD2-CE 3.44Å; D811-K847 IonicContact OD2-NZ 3.17Å; D811-K847 PolarHBondContact OD2-NZ 2.95Å; F843-K847 HydrophobicContact CE2-CG 4.46Å; F843-K847 PolarHBondContact O-N 2.94Å; I844-K847 PolarHBondContact O-N 3.04Å
848	K	93	Very high	95.1	Very high	48 Å²	48	36 Å²	36	21%	0.209	17%	0.167	C	C	.	.			trans	46.4	59.1	171.8	-64.8	-173.6	175.5	-178.7	0	113.9	E776 W777 R784 I844 F881	E776-K848 HydrophobicContact CG-CD 4.17Å; E776-K848 IonicContact OE1-NZ 2.64Å; E776-K848 PolarHBondContact OE1-NZ 3.49Å; E776-K848 IonicContact OE2-NZ 2.79Å; E776-K848 PolarHBondContact OE2-NZ 2.95Å; W777-K848 HydrophobicContact CH2-CB 3.55Å; W777-K848 HydrophobicContact CH2-CD 4.35Å; W777-K848 HydrophobicContact CH2-CG 3.94Å; W777-K848 HydrophobicContact CZ2-CB 3.94Å; W777-K848 HydrophobicContact CZ2-CD 3.86Å; W777-K848 HydrophobicContact CZ2-CG 3.95Å; W777-K848 HydrophobicContact CZ3-CB 3.98Å; R784-K848 VanDerWaalsContact CZ-O 3.29Å; R784-K848 PolarHBondContact NE-O 3.27Å; R784-K848 PolarHBondContact NH2-O 2.81Å; I844-K848 WeakPolarHBondContact O-CA 3.37Å; I844-K848 PolarHBondContact O-N 3.43Å; K848-F881 HydrophobicContact CD-CZ 4.3Å; K848-F881 HydrophobicContact CG-CE1 4.01Å; K848-F881 HydrophobicContact CG-CZ 3.87Å
849	P	94.6	Very high	94.8	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	15%	0.153	C	C	.	.			trans	-68.5	146.2	176.6	31.7	-36.4	0	0	0	111.4	L786 I844 V852 I884	L786-P849 HydrophobicContact CB-CB 3.7Å; L786-P849 HydrophobicContact CB-CG 3.83Å; L786-P849 HydrophobicContact CD2-CG 4.32Å; I844-P849 HydrophobicContact CG2-CG 4.45Å; P849-V852 HydrophobicContact CG-CG2 4.42Å; P849-I884 WeakPolarHBondContact O-CD1 3.32Å
850	H	93.9	Very high	94.6	Very high	4 Å²	4	30.3 Å²	30.3	2%	0.019	15%	0.146	C	C	.	.	S	Bend	trans	-84.6	-17.5	-179.9	-52.6	86	0	0	0	113.1	P766 W777 I783 R784	P766-H850 HydrophobicContact CG-CB 4.24Å; W777-H850 AromaticContact CE3-CD2 3.96Å; I783-H850 HydrophobicContact CB-CB 4.41Å; I783-H850 HydrophobicContact CG2-CB 4.26Å; R784-H850 PolarHBondContact N-CE1 2.66Å; R784-H850 PolarHBondContact N-ND1 2.73Å; R784-H850 PolarHBondContact NH2-NE2 2.73Å; R784-H850 PolarHBondContact O-N 3.49Å; R784-H850 PolarHBondContact O-ND1 3.04Å; R784-H850 VanDerWaalsContact O-ND1 3.14Å
851	I	95.5	Very high	94.5	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.9	144.5	175.6	176.6	165.6	0	0	0	108.4	Y764 I783 V785 L786 V853 E887 M924	Y764-I851 HydrophobicContact CD1-CB 4.09Å; Y764-I851 HydrophobicContact CD1-CD1 3.82Å; Y764-I851 HydrophobicContact CD1-CG2 3.79Å; Y764-I851 HydrophobicContact CD2-CD1 4.27Å; Y764-I851 HydrophobicContact CE1-CB 3.76Å; Y764-I851 HydrophobicContact CE1-CD1 3.59Å; Y764-I851 HydrophobicContact CE1-CG1 4.21Å; Y764-I851 HydrophobicContact CE1-CG2 4Å; Y764-I851 HydrophobicContact CE2-CD1 4.09Å; Y764-I851 HydrophobicContact CG-CD1 4.15Å; I783-I851 HydrophobicContact CD1-CG2 4.28Å; V785-I851 HydrophobicContact CB-CG2 4.39Å; V785-I851 HydrophobicContact CG1-CG2 4.11Å; V785-I851 HydrophobicContact CG2-CG2 3.84Å; L786-I851 PolarHBondContact N-O 3.04Å; L786-I851 VanDerWaalsContact N-O 3.08Å; I851-V853 HydrophobicContact CD1-CG2 4.38Å; I851-V853 HydrophobicContact CG1-CG2 4.11Å; I851-E887 HydrophobicContact CD1-CB 4.43Å; I851-E887 HydrophobicContact CD1-CG 3.95Å; I851-M924 HydrophobicContact CD1-CG 4.21Å; I851-M924 HydrophobicContact CD1-SD 3.87Å; I851-M924 HydrophobicContact CG2-CG 4.23Å
852	V	97.4	Very high	94.4	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	135.8	170	-173	0	0	0	0	109.2	L786 P849 I868 L872 I884 E885 V886 E887	L786-V852 HydrophobicContact CB-CG1 4.34Å; L786-V852 HydrophobicContact CB-CG2 4.29Å; L786-V852 HydrophobicContact CD2-CG1 3.88Å; L786-V852 HydrophobicContact CD2-CG2 3.99Å; L786-V852 HydrophobicContact CG-CG1 4.04Å; L786-V852 CarbonylContact O-C 3.5Å; L786-V852 WeakPolarHBondContact O-CA 3.39Å; P849-V852 HydrophobicContact CG-CG2 4.42Å; V852-I868 HydrophobicContact CG1-CD1 4.25Å; V852-I868 HydrophobicContact CG1-CG2 4.23Å; V852-I868 HydrophobicContact CG2-CG2 4.45Å; V852-L872 HydrophobicContact CG2-CD1 4.29Å; V852-I884 HydrophobicContact CG2-CG2 4.13Å; V852-E885 PolarHBondContact N-O 3.03Å; V852-V886 HydrophobicContact CB-CB 4.46Å; V852-V886 HydrophobicContact CB-CG1 4.1Å; V852-V886 HydrophobicContact CB-CG2 4.23Å; V852-V886 HydrophobicContact CG1-CG1 4.2Å; V852-V886 CarbonylContact O-C 3.46Å; V852-V886 WeakPolarHBondContact O-CA 3.47Å; V852-E887 PolarHBondContact O-N 3.42Å
853	V	97.3	Very high	94.2	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	125.5	-172	176.4	0	0	0	0	109.1	V785 L786 G787 L788 I851 I889 L920 M924	V785-V853 HydrophobicContact CG1-CB 4.39Å; V785-V853 HydrophobicContact CG1-CG2 3.69Å; L786-V853 PolarHBondContact O-N 3.16Å; G787-V853 CarbonylContact C-O 3.4Å; G787-V853 WeakPolarHBondContact CA-O 3.46Å; L788-V853 PolarHBondContact N-O 3.33Å; I851-V853 HydrophobicContact CD1-CG2 4.38Å; I851-V853 HydrophobicContact CG1-CG2 4.11Å; V853-I889 HydrophobicContact CG1-CD1 3.38Å; V853-I889 HydrophobicContact CG1-CG1 3.56Å; V853-I889 HydrophobicContact CG1-CG2 4.29Å; V853-L920 HydrophobicContact CG1-CB 4.28Å; V853-M924 HydrophobicContact CG2-CB 4.04Å; V853-M924 HydrophobicContact CG2-CG 3.89Å; V853-M924 HydrophobicContact CG2-SD 4.32Å
854	I	97.8	Very high	94.2	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	129.9	-179.7	-58.9	166.6	0	0	0	109.4	L788 Y790 A856 A861 I864 Q865 I868 V886 E887 I888 I889	L788-I854 HydrophobicContact CD2-CG2 4.5Å; Y790-I854 HydrophobicContact CE1-CG2 4.09Å; I854-A856 PolarHBondContact O-N 3.31Å; I854-A861 HydrophobicContact CG2-CB 3.89Å; I854-I864 HydrophobicContact CD1-CB 4.34Å; I854-I864 HydrophobicContact CD1-CG2 3.91Å; I854-I864 HydrophobicContact CG1-CG2 4.42Å; I854-Q865 HydrophobicContact CD1-CB 3.75Å; I854-Q865 HydrophobicContact CD1-CG 4.22Å; I854-I868 HydrophobicContact CD1-CD1 4.27Å; I854-V886 HydrophobicContact CD1-CG1 3.71Å; I854-V886 HydrophobicContact CG1-CG1 4.31Å; I854-E887 PolarHBondContact N-O 3.38Å; I854-I888 HydrophobicContact CB-CG1 4.3Å; I854-I888 WeakPolarHBondContact O-CA 3.19Å; I854-I889 PolarHBondContact O-N 3.01Å
855	G	96.7	Very high	94.2	Very high	2 Å²	2	31.6 Å²	31.6	2%	0.021	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65	127.6	172.3	0	0	0	0	0	112.1	L788 Y790 E857	L788-G855 PolarHBondContact O-N 3.27Å; Y790-G855 VanDerWaalsContact CE1-O 3.3Å; Y790-G855 WeakPolarHBondContact CE1-O 3.48Å; G855-E857 VanDerWaalsContact C-N 3.31Å; G855-E857 PolarHBondContact O-N 3.12Å
856	A	94.7	Very high	94.3	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	16%	0.156	C	C	.	.			trans	-77.7	70.5	-178.3	0	0	0	0	0	112.3	I854 I888 I889 N891 M1154 L1155 K1157	I854-A856 PolarHBondContact O-N 3.31Å; A856-I888 HydrophobicContact CB-CG2 3.68Å; A856-I889 WeakPolarHBondContact CB-O 3.15Å; A856-I889 PolarHBondContact N-O 3.43Å; A856-N891 PolarHBondContact O-OD1 3.1Å; A856-M1154 HydrophobicContact CB-CB 3.96Å; A856-M1154 HydrophobicContact CB-SD 4.47Å; A856-M1154 VanDerWaalsContact O-O 3.08Å; A856-L1155 HydrophobicContact CB-CD2 3.68Å; A856-K1157 VanDerWaalsContact O-CE 3.3Å; A856-K1157 WeakPolarHBondContact O-CE 3.29Å; A856-K1157 PolarHBondContact O-NZ 2.78Å
857	E	92.5	Very high	94.3	Very high	31 Å²	31	25.9 Å²	25.9	15%	0.145	13%	0.133	C	C	.	.	S	Bend	trans	-90	-50.6	-177.2	-171.1	59.2	-167.9	0	0	114.2	Y790 P792 G855 N891 K895	Y790-E857 HydrophobicContact CE1-CB 4.37Å; Y790-E857 HydrophobicContact CE2-CB 4.13Å; P792-E857 HydrophobicContact CG-CG 3.81Å; G855-E857 VanDerWaalsContact C-N 3.31Å; G855-E857 PolarHBondContact O-N 3.12Å; E857-N891 PolarHBondContact OE2-ND2 3.08Å; E857-K895 IonicContact OE1-NZ 2.72Å; E857-K895 PolarHBondContact OE1-NZ 3.32Å; E857-K895 WeakPolarHBondContact OE2-CE 3.28Å; E857-K895 IonicContact OE2-NZ 2.73Å; E857-K895 PolarHBondContact OE2-NZ 2.87Å
858	S	91.9	Very high	94.4	Very high	18 Å²	18	23.6 Å²	23.6	13%	0.126	12%	0.123	C	C	.	.	S	Bend	trans	-138.2	175.2	173.6	83.4	0	0	0	0	110.9	Y790 D860 A861 L1155	Y790-S858 PolarHBondContact OH-N 3.41Å; Y790-S858 PolarHBondContact OH-O 3.46Å; S858-D860 PolarHBondContact O-N 3.35Å; S858-D860 WeakPolarHBondContact OG-CB 3.48Å; S858-D860 PolarHBondContact OG-N 3.34Å; S858-D860 PolarHBondContact OG-OD2 2.92Å; S858-D860 VanDerWaalsContact OG-OD2 3.04Å; S858-A861 WeakPolarHBondContact O-CB 3.44Å; S858-A861 PolarHBondContact O-N 3.26Å; S858-L1155 WeakPolarHBondContact O-CD2 3.5Å
859	R	90.3	Very high	94.6	Very high	97 Å²	97	25.4 Å²	25.4	37%	0.366	13%	0.131	S	C	.	.	T	Hydrogen-bonded Turn	trans	-50	-23.6	170.3	-171.8	177	-178.8	158.3	9.9	113.9	A861 Q862 R1278 F1279	R859-A861 PolarHBondContact O-N 2.7Å; R859-Q862 WeakPolarHBondContact O-CB 3.24Å; R859-Q862 PolarHBondContact O-N 2.78Å; R859-R1278 PolarHBondContact NH2-O 2.81Å; R859-F1279 VanDerWaalsContact NH1-CB 3.32Å; R859-F1279 PolarHBondContact NH1-O 3.41Å; R859-F1279 VanDerWaalsContact NH1-O 3.1Å
860	D	91.6	Very high	94.6	Very high	46 Å²	46	29.7 Å²	29.7	25%	0.246	15%	0.151	C	C	.	.	H	α-helix	trans	-65.9	-16.3	179.4	-63.3	-71.6	0	0	0	113.8	Y790 L819 S858 Q862 N863 I864	Y790-D860 HydrophobicContact CE2-CB 4.35Å; L819-D860 HydrophobicContact CD2-CB 4.02Å; S858-D860 PolarHBondContact O-N 3.35Å; S858-D860 WeakPolarHBondContact OG-CB 3.48Å; S858-D860 PolarHBondContact OG-N 3.34Å; S858-D860 PolarHBondContact OG-OD2 2.92Å; S858-D860 VanDerWaalsContact OG-OD2 3.04Å; D860-Q862 PolarHBondContact O-N 3.13Å; D860-N863 WeakPolarHBondContact O-CA 3.24Å; D860-N863 WeakPolarHBondContact O-CB 3.33Å; D860-N863 PolarHBondContact O-N 2.9Å; D860-N863 PolarHBondContact OD1-ND2 3.48Å; D860-I864 WeakPolarHBondContact O-CG1 3.43Å; D860-I864 PolarHBondContact O-N 3.2Å
861	A	94.1	Very high	94.6	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-53.5	-36.2	165.2	0	0	0	0	0	112.1	Y790 I854 S858 R859 I864 Q865 I888 L1155	Y790-A861 HydrophobicContact CE1-CB 4.17Å; Y790-A861 WeakPolarHBondContact OH-CB 3.41Å; Y790-A861 PolarHBondContact OH-N 3.22Å; I854-A861 HydrophobicContact CG2-CB 3.89Å; S858-A861 WeakPolarHBondContact O-CB 3.44Å; S858-A861 PolarHBondContact O-N 3.26Å; R859-A861 PolarHBondContact O-N 2.7Å; A861-I864 PolarHBondContact O-N 3.37Å; A861-Q865 VanDerWaalsContact O-CB 3.25Å; A861-Q865 WeakPolarHBondContact O-CB 3.08Å; A861-Q865 PolarHBondContact O-N 3.05Å; A861-I888 HydrophobicContact CB-CD1 4.01Å; A861-I888 HydrophobicContact CB-CG1 4.33Å; A861-I888 HydrophobicContact CB-CG2 4.28Å; A861-L1155 HydrophobicContact CB-CD2 3.83Å
862	Q	92.4	Very high	94.6	Very high	46 Å²	46	30.5 Å²	30.5	22%	0.215	16%	0.155	C	C	.	.	H	α-helix	trans	-68.1	-36.1	176.1	-62.3	178.1	-19.1	0	0	112	R859 D860 A866 I888 L1155 F1279	R859-Q862 WeakPolarHBondContact O-CB 3.24Å; R859-Q862 PolarHBondContact O-N 2.78Å; D860-Q862 PolarHBondContact O-N 3.13Å; Q862-A866 WeakPolarHBondContact O-CB 3.47Å; Q862-A866 PolarHBondContact O-N 2.82Å; Q862-I888 HydrophobicContact CG-CD1 4.39Å; Q862-L1155 HydrophobicContact CG-CD1 3.85Å; Q862-F1279 VanDerWaalsContact NE2-CZ 3.28Å
863	N	92.5	Very high	94.5	Very high	87 Å²	87	36 Å²	36	47%	0.465	18%	0.18	S	C	.	.	H	α-helix	trans	-67.2	-45.7	176	-64.1	-39.9	0	0	0	110.2	D860 A866 D867	D860-N863 WeakPolarHBondContact O-CA 3.24Å; D860-N863 WeakPolarHBondContact O-CB 3.33Å; D860-N863 PolarHBondContact O-N 2.9Å; D860-N863 PolarHBondContact OD1-ND2 3.48Å; N863-A866 PolarHBondContact O-N 2.8Å; N863-D867 PolarHBondContact O-N 2.96Å
864	I	94.9	Very high	94.3	Very high	2 Å²	2	41.3 Å²	41.3	1%	0.01	21%	0.205	C	C	.	.	H	α-helix	trans	-62.7	-44.7	175.8	-61.1	167.9	0	0	0	110.6	L788 Y790 I818 L819 I854 D860 A861 A866 D867 I868	L788-I864 HydrophobicContact CD1-CG2 4.05Å; L788-I864 HydrophobicContact CD2-CD1 4.34Å; L788-I864 HydrophobicContact CD2-CG2 4.31Å; Y790-I864 HydrophobicContact CD1-CD1 3.63Å; Y790-I864 HydrophobicContact CD2-CD1 4.37Å; Y790-I864 HydrophobicContact CE1-CD1 3.82Å; Y790-I864 HydrophobicContact CG-CD1 3.95Å; I818-I864 HydrophobicContact CG1-CG1 4.34Å; I818-I864 HydrophobicContact CG2-CD1 4.3Å; L819-I864 HydrophobicContact CD2-CD1 4.04Å; I854-I864 HydrophobicContact CD1-CB 4.34Å; I854-I864 HydrophobicContact CD1-CG2 3.91Å; I854-I864 HydrophobicContact CG1-CG2 4.42Å; D860-I864 WeakPolarHBondContact O-CG1 3.43Å; D860-I864 PolarHBondContact O-N 3.2Å; A861-I864 PolarHBondContact O-N 3.37Å; I864-A866 VanDerWaalsContact C-N 3.32Å; I864-A866 PolarHBondContact O-N 2.86Å; I864-D867 PolarHBondContact O-N 3.09Å; I864-I868 HydrophobicContact CG2-CD1 3.71Å; I864-I868 HydrophobicContact CG2-CG1 4.32Å; I864-I868 WeakPolarHBondContact O-CG1 3.42Å; I864-I868 PolarHBondContact O-N 2.94Å
865	Q	95.3	Very high	94.1	Very high	37 Å²	37	41.7 Å²	41.7	17%	0.173	21%	0.207	C	C	.	.	H	α-helix	trans	-60.3	-40.6	177.8	-165.3	-161.1	49.6	0	0	111.7	I854 A861 K869 V886 I888	I854-Q865 HydrophobicContact CD1-CB 3.75Å; I854-Q865 HydrophobicContact CD1-CG 4.22Å; A861-Q865 VanDerWaalsContact O-CB 3.25Å; A861-Q865 WeakPolarHBondContact O-CB 3.08Å; A861-Q865 PolarHBondContact O-N 3.05Å; Q865-K869 VanDerWaalsContact CD-NZ 3.27Å; Q865-K869 HydrophobicContact CG-CD 4.17Å; Q865-K869 VanDerWaalsContact NE2-NZ 3.14Å; Q865-K869 WeakPolarHBondContact O-CB 3.43Å; Q865-K869 VanDerWaalsContact O-CG 3.29Å; Q865-K869 WeakPolarHBondContact O-CG 3.24Å; Q865-K869 PolarHBondContact O-N 2.96Å; Q865-V886 HydrophobicContact CG-CB 4.11Å; Q865-V886 HydrophobicContact CG-CG1 3.78Å; Q865-V886 PolarHBondContact NE2-O 3.43Å; Q865-I888 HydrophobicContact CB-CD1 4.1Å; Q865-I888 HydrophobicContact CB-CG1 4.43Å; Q865-I888 HydrophobicContact CG-CD1 4.35Å; Q865-I888 HydrophobicContact CG-CG1 4.42Å
866	A	95.3	Very high	93.8	Very high	58 Å²	58	45.4 Å²	45.4	48%	0.479	22%	0.224	S	C	.	.	H	α-helix	trans	-65.6	-46.6	176.2	0	0	0	0	0	112.3	Q862 N863 I864 I868 K869 E870	Q862-A866 WeakPolarHBondContact O-CB 3.47Å; Q862-A866 PolarHBondContact O-N 2.82Å; N863-A866 PolarHBondContact O-N 2.8Å; I864-A866 VanDerWaalsContact C-N 3.32Å; I864-A866 PolarHBondContact O-N 2.86Å; A866-I868 VanDerWaalsContact C-N 3.33Å; A866-I868 PolarHBondContact O-N 3.42Å; A866-K869 PolarHBondContact O-N 3.44Å; A866-E870 PolarHBondContact O-N 3.2Å
867	D	95.2	Very high	93.6	Very high	19 Å²	19	50.3 Å²	50.3	10%	0.102	25%	0.254	C	S	.	.	H	α-helix	trans	-61.6	-38.7	176.6	-77.6	-54.8	0	0	0	112.3	K822 K833 L837 N863 I864 E870 I871	K822-D867 VanDerWaalsContact CD-OD1 3.25Å; K822-D867 WeakPolarHBondContact CD-OD1 3.49Å; K833-D867 WeakPolarHBondContact CE-OD2 3.35Å; K833-D867 IonicContact NZ-OD2 3.85Å; K833-D867 PolarHBondContact NZ-OD2 3.29Å; L837-D867 HydrophobicContact CD1-CB 4.37Å; L837-D867 HydrophobicContact CD2-CB 3.77Å; N863-D867 PolarHBondContact O-N 2.96Å; I864-D867 PolarHBondContact O-N 3.09Å; D867-E870 PolarHBondContact O-N 3.14Å; D867-I871 WeakPolarHBondContact O-CG1 3.39Å; D867-I871 PolarHBondContact O-N 2.95Å; D867-I871 VanDerWaalsContact O-N 3.16Å
868	I	96	Very high	93.5	Very high	1 Å²	1	52.7 Å²	52.7	1%	0.005	27%	0.274	C	S	.	.	H	α-helix	trans	-73.2	-38.6	178.3	-65.1	176.1	0	0	0	111.4	L788 L840 I844 V852 I854 I864 A866 E870 I871 L872 V886	L788-I868 HydrophobicContact CD1-CD1 4.01Å; L840-I868 HydrophobicContact CD2-CD1 3.9Å; L840-I868 HydrophobicContact CD2-CG1 3.8Å; I844-I868 HydrophobicContact CD1-CG2 4.41Å; V852-I868 HydrophobicContact CG1-CD1 4.25Å; V852-I868 HydrophobicContact CG1-CG2 4.23Å; V852-I868 HydrophobicContact CG2-CG2 4.45Å; I854-I868 HydrophobicContact CD1-CD1 4.27Å; I864-I868 HydrophobicContact CG2-CD1 3.71Å; I864-I868 HydrophobicContact CG2-CG1 4.32Å; I864-I868 WeakPolarHBondContact O-CG1 3.42Å; I864-I868 PolarHBondContact O-N 2.94Å; A866-I868 VanDerWaalsContact C-N 3.33Å; A866-I868 PolarHBondContact O-N 3.42Å; I868-E870 VanDerWaalsContact C-N 3.26Å; I868-E870 PolarHBondContact O-N 2.81Å; I868-I871 WeakPolarHBondContact O-CB 3.48Å; I868-I871 PolarHBondContact O-N 3.34Å; I868-L872 HydrophobicContact CG2-CD1 3.99Å; I868-L872 HydrophobicContact CG2-CG 4.31Å; I868-L872 WeakPolarHBondContact O-CG 3.39Å; I868-L872 PolarHBondContact O-N 2.84Å; I868-V886 HydrophobicContact CB-CG1 4.37Å; I868-V886 HydrophobicContact CG2-CG1 4.11Å; I868-V886 HydrophobicContact CG2-CG2 3.77Å
869	K	96.2	Very high	93.2	Very high	86 Å²	86	56.3 Å²	56.3	37%	0.374	29%	0.289	S	S	.	.	H	α-helix	trans	-62.7	-33.3	173.8	-76.6	175.8	178.6	175.1	0	112	Q865 A866 H873 V886	Q865-K869 VanDerWaalsContact CD-NZ 3.27Å; Q865-K869 HydrophobicContact CG-CD 4.17Å; Q865-K869 VanDerWaalsContact NE2-NZ 3.14Å; Q865-K869 WeakPolarHBondContact O-CB 3.43Å; Q865-K869 VanDerWaalsContact O-CG 3.29Å; Q865-K869 WeakPolarHBondContact O-CG 3.24Å; Q865-K869 PolarHBondContact O-N 2.96Å; A866-K869 PolarHBondContact O-N 3.44Å; K869-H873 WeakPolarHBondContact O-CB 3.4Å; K869-H873 PolarHBondContact O-N 3.32Å; K869-H873 VanDerWaalsContact O-N 3.07Å; K869-V886 HydrophobicContact CG-CB 4.11Å; K869-V886 HydrophobicContact CG-CG2 3.82Å
870	E	94.8	Very high	92.9	Very high	89 Å²	89	59.4 Å²	59.4	42%	0.416	31%	0.308	S	S	.	.	H	α-helix	trans	-66	-46.6	171.8	-159.5	-179.3	147.2	0	0	111.5	K822 A866 D867 I868 L872 H873 E874	K822-E870 IonicContact NZ-OE1 2.69Å; K822-E870 PolarHBondContact NZ-OE1 3.02Å; K822-E870 IonicContact NZ-OE2 3.77Å; K822-E870 PolarHBondContact NZ-OE2 2.79Å; A866-E870 PolarHBondContact O-N 3.2Å; D867-E870 PolarHBondContact O-N 3.14Å; I868-E870 VanDerWaalsContact C-N 3.26Å; I868-E870 PolarHBondContact O-N 2.81Å; E870-L872 PolarHBondContact O-N 2.67Å; E870-H873 PolarHBondContact O-N 3.38Å; E870-E874 WeakPolarHBondContact O-CG 3.45Å; E870-E874 PolarHBondContact O-N 2.88Å
871	I	95.2	Very high	92.8	Very high	9 Å²	9	57.8 Å²	57.8	5%	0.046	30%	0.299	C	S	.	.	H	α-helix	trans	-57.3	-45.6	174.4	-72.6	167.7	0	0	0	111.8	L837 I844 D867 I868 E874 L875	L837-I871 HydrophobicContact CB-CD1 4.19Å; L837-I871 HydrophobicContact CD2-CD1 3.93Å; L837-I871 WeakPolarHBondContact O-CD1 3.3Å; I844-I871 HydrophobicContact CD1-CG2 4.24Å; D867-I871 WeakPolarHBondContact O-CG1 3.39Å; D867-I871 PolarHBondContact O-N 2.95Å; D867-I871 VanDerWaalsContact O-N 3.16Å; I868-I871 WeakPolarHBondContact O-CB 3.48Å; I868-I871 PolarHBondContact O-N 3.34Å; I871-E874 PolarHBondContact O-N 3.2Å; I871-L875 HydrophobicContact CG2-CD1 4Å; I871-L875 WeakPolarHBondContact O-CG 3.45Å; I871-L875 PolarHBondContact O-N 3.39Å
872	L	95	Very high	92.6	Very high	13 Å²	13	58 Å²	58	7%	0.068	30%	0.3	C	S	.	.	H	α-helix	trans	-68.3	-36.2	-178.3	-71.3	172.2	0	0	0	112.3	I844 V852 I868 E870 L875 E876 I884 V886	I844-L872 HydrophobicContact CG2-CD2 3.79Å; V852-L872 HydrophobicContact CG2-CD1 4.29Å; I868-L872 HydrophobicContact CG2-CD1 3.99Å; I868-L872 HydrophobicContact CG2-CG 4.31Å; I868-L872 WeakPolarHBondContact O-CG 3.39Å; I868-L872 PolarHBondContact O-N 2.84Å; E870-L872 PolarHBondContact O-N 2.67Å; L872-L875 PolarHBondContact O-N 2.86Å; L872-E876 WeakPolarHBondContact O-CB 3.37Å; L872-E876 PolarHBondContact O-N 3Å; L872-I884 HydrophobicContact CD1-CB 4.08Å; L872-I884 HydrophobicContact CD1-CG2 3.92Å; L872-I884 HydrophobicContact CD2-CB 4.1Å; L872-I884 HydrophobicContact CD2-CD1 4.03Å; L872-I884 HydrophobicContact CD2-CG2 4.26Å; L872-V886 HydrophobicContact CD1-CG2 3.3Å
873	H	94.8	Very high	92.5	Very high	115 Å²	115	59.3 Å²	59.3	53%	0.532	31%	0.312	S	S	.	.	H	α-helix	trans	-70.6	-33.1	174	-171.9	50.8	0	0	0	112.5	K869 E870 E876 T877	K869-H873 WeakPolarHBondContact O-CB 3.4Å; K869-H873 PolarHBondContact O-N 3.32Å; K869-H873 VanDerWaalsContact O-N 3.07Å; E870-H873 PolarHBondContact O-N 3.38Å; H873-E876 IonicContact CE1-OE2 3.95Å; H873-E876 IonicContact CG-OE2 3.92Å; H873-E876 IonicContact ND1-OE2 2.66Å; H873-E876 PolarHBondContact ND1-OE2 3.41Å; H873-T877 WeakPolarHBondContact O-CB 3.49Å; H873-T877 PolarHBondContact O-N 3.14Å; H873-T877 VanDerWaalsContact O-N 3.08Å; H873-T877 PolarHBondContact O-OG1 2.84Å
874	E	93.3	Very high	92.5	Very high	112 Å²	112	56 Å²	56	52%	0.523	29%	0.294	S	S	.	.	H	α-helix	trans	-62.4	-43.8	168.3	-74.4	-176.2	170.9	0	0	111.2	E870 I871 T877 S878	E870-E874 WeakPolarHBondContact O-CG 3.45Å; E870-E874 PolarHBondContact O-N 2.88Å; I871-E874 PolarHBondContact O-N 3.2Å; E874-T877 PolarHBondContact O-N 3.15Å; E874-S878 VanDerWaalsContact O-CB 3.27Å; E874-S878 WeakPolarHBondContact O-CB 3.22Å; E874-S878 PolarHBondContact O-N 3.07Å; E874-S878 PolarHBondContact O-OG 3.34Å
875	L	92.5	Very high	92.4	Very high	7 Å²	7	59.1 Å²	59.1	4%	0.037	31%	0.309	C	S	.	.	H	α-helix	trans	-70.6	-38.2	178.2	-71.2	171.8	0	0	0	113.6	I844 K845 I871 L872 T877 E879 Q880 F881	I844-L875 HydrophobicContact CB-CD1 4.31Å; I844-L875 HydrophobicContact CG2-CD1 3.73Å; K845-L875 HydrophobicContact CB-CD2 4.26Å; K845-L875 HydrophobicContact CD-CD2 4.36Å; K845-L875 HydrophobicContact CG-CD2 4.45Å; I871-L875 HydrophobicContact CG2-CD1 4Å; I871-L875 WeakPolarHBondContact O-CG 3.45Å; I871-L875 PolarHBondContact O-N 3.39Å; L872-L875 PolarHBondContact O-N 2.86Å; L875-T877 VanDerWaalsContact C-N 3.32Å; L875-T877 PolarHBondContact O-N 3.01Å; L875-E879 HydrophobicContact CD2-CG 4.07Å; L875-E879 CarbonylContact O-C 3.46Å; L875-E879 WeakPolarHBondContact O-CA 3.43Å; L875-E879 PolarHBondContact O-N 3.44Å; L875-Q880 PolarHBondContact O-N 3.38Å; L875-F881 HydrophobicContact CB-CB 4.32Å; L875-F881 HydrophobicContact CB-CD1 4.44Å; L875-F881 HydrophobicContact CB-CD2 4.38Å; L875-F881 HydrophobicContact CB-CG 4.12Å; L875-F881 PolarHBondContact O-N 2.95Å
876	E	90.4	Very high	92.5	Very high	80 Å²	80	57.3 Å²	57.3	37%	0.374	30%	0.301	S	S	.	.	H	α-helix	trans	-54.5	-49.9	169.4	176.9	-173	-155.9	0	0	110.1	L872 H873 Q880	L872-E876 WeakPolarHBondContact O-CB 3.37Å; L872-E876 PolarHBondContact O-N 3Å; H873-E876 IonicContact CE1-OE2 3.95Å; H873-E876 IonicContact CG-OE2 3.92Å; H873-E876 IonicContact ND1-OE2 2.66Å; H873-E876 PolarHBondContact ND1-OE2 3.41Å; E876-Q880 WeakPolarHBondContact O-CA 3.3Å; E876-Q880 PolarHBondContact O-N 3.39Å
877	T	91.2	Very high	92.5	Very high	104 Å²	104	55.1 Å²	55.1	64%	0.638	28%	0.28	S	S	*	.	H	α-helix	trans	-73.9	-33.1	-175.8	-55.5	0	0	0	0	113.6	H873 E874 L875	H873-T877 WeakPolarHBondContact O-CB 3.49Å; H873-T877 PolarHBondContact O-N 3.14Å; H873-T877 VanDerWaalsContact O-N 3.08Å; H873-T877 PolarHBondContact O-OG1 2.84Å; E874-T877 PolarHBondContact O-N 3.15Å; L875-T877 VanDerWaalsContact C-N 3.32Å; L875-T877 PolarHBondContact O-N 3.01Å
878	S	90.7	Very high	92.5	Very high	80 Å²	80	54.3 Å²	54.3	56%	0.559	28%	0.276	S	S	*	.	H	α-helix	trans	-101.2	-33.6	-172	59.8	0	0	0	0	115	E874	E874-S878 VanDerWaalsContact O-CB 3.27Å; E874-S878 WeakPolarHBondContact O-CB 3.22Å; E874-S878 PolarHBondContact O-N 3.07Å; E874-S878 PolarHBondContact O-OG 3.34Å
879	E	85.8	Confident	92.5	Very high	94 Å²	94	54.8 Å²	54.8	44%	0.439	28%	0.279	S	S	.	.	H	α-helix	trans	-122.1	7.6	-172.4	-58.3	-76.6	161.9	0	0	112.4	K845 L875 F881	K845-E879 HydrophobicContact CD-CG 4.37Å; K845-E879 WeakPolarHBondContact CE-OE2 3.34Å; K845-E879 IonicContact NZ-OE1 2.61Å; K845-E879 PolarHBondContact NZ-OE1 2.87Å; K845-E879 IonicContact NZ-OE2 2.69Å; K845-E879 PolarHBondContact NZ-OE2 3.46Å; L875-E879 HydrophobicContact CD2-CG 4.07Å; L875-E879 CarbonylContact O-C 3.46Å; L875-E879 WeakPolarHBondContact O-CA 3.43Å; L875-E879 PolarHBondContact O-N 3.44Å; E879-F881 VanDerWaalsContact C-N 3.31Å; E879-F881 HydrophobicContact CB-CD2 3.75Å; E879-F881 HydrophobicContact CB-CE2 3.88Å; E879-F881 PolarHBondContact O-N 2.84Å
880	Q	83.9	Confident	92.3	Very high	162 Å²	162	52.3 Å²	52.3	76%	0.757	27%	0.269	S	S	*	.			trans	58.8	37.4	179	-56.2	-179.9	-0.1	0	0	113.5	F772 L875 E876	F772-Q880 WeakPolarHBondContact CE1-O 3.29Å; L875-Q880 PolarHBondContact O-N 3.38Å; E876-Q880 WeakPolarHBondContact O-CA 3.3Å; E876-Q880 PolarHBondContact O-N 3.39Å
881	F	89.4	Confident	92.3	Very high	13 Å²	13	48.2 Å²	48.2	6%	0.057	25%	0.25	C	S	.	.			trans	-66.6	145.2	172.1	-85.7	-129.2	0	0	0	110.6	W777 I844 K845 K848 L875 E879 I884	W777-F881 AromaticContact CH2-CD1 3.7Å; W777-F881 HydrophobicContact CH2-CD1 3.7Å; W777-F881 AromaticContact CH2-CE1 3.75Å; W777-F881 HydrophobicContact CH2-CE1 3.75Å; W777-F881 HydrophobicContact CH2-CG 4.47Å; W777-F881 AromaticContact CZ2-CD1 3.84Å; W777-F881 HydrophobicContact CZ2-CD1 3.84Å; W777-F881 AromaticContact CZ2-CE1 3.9Å; W777-F881 HydrophobicContact CZ2-CE1 3.9Å; W777-F881 HydrophobicContact CZ2-CG 4.22Å; W777-F881 HydrophobicContact CZ2-CZ 4.33Å; I844-F881 HydrophobicContact CG2-CE1 4.48Å; K845-F881 HydrophobicContact CB-CZ 4.41Å; K845-F881 HydrophobicContact CG-CE2 4.46Å; K845-F881 HydrophobicContact CG-CZ 4.2Å; K848-F881 HydrophobicContact CD-CZ 4.3Å; K848-F881 HydrophobicContact CG-CE1 4.01Å; K848-F881 HydrophobicContact CG-CZ 3.87Å; L875-F881 HydrophobicContact CB-CB 4.32Å; L875-F881 HydrophobicContact CB-CD1 4.44Å; L875-F881 HydrophobicContact CB-CD2 4.38Å; L875-F881 HydrophobicContact CB-CG 4.12Å; L875-F881 PolarHBondContact O-N 2.95Å; E879-F881 VanDerWaalsContact C-N 3.31Å; E879-F881 HydrophobicContact CB-CD2 3.75Å; E879-F881 HydrophobicContact CB-CE2 3.88Å; E879-F881 PolarHBondContact O-N 2.84Å; F881-I884 HydrophobicContact CD1-CD1 3.88Å
882	P	89	Confident	92.3	Very high	3 Å²	3	50 Å²	50	2%	0.019	26%	0.259	C	S	.	.			trans	-64.9	161.1	169.3	29.9	-34.9	0	0	0	110.6	L768 F772 W777 I884	L768-P882 HydrophobicContact CD2-CB 3.87Å; L768-P882 HydrophobicContact CD2-CG 4.06Å; F772-P882 HydrophobicContact CD1-CB 4.12Å; F772-P882 HydrophobicContact CD1-CG 4.43Å; F772-P882 HydrophobicContact CD2-CB 4.15Å; F772-P882 HydrophobicContact CE1-CB 4.22Å; F772-P882 HydrophobicContact CE2-CB 4.25Å; F772-P882 HydrophobicContact CG-CB 4.08Å; F772-P882 HydrophobicContact CZ-CB 4.28Å; W777-P882 HydrophobicContact CD2-CG 3.71Å; W777-P882 HydrophobicContact CE3-CG 3.84Å; W777-P882 HydrophobicContact CG-CG 4.21Å; W777-P882 HydrophobicContact CH2-CG 4.2Å; W777-P882 HydrophobicContact CZ2-CG 4.1Å; W777-P882 HydrophobicContact CZ3-CG 4.08Å; P882-I884 HydrophobicContact CG-CG1 4.49Å; P882-I884 PolarHBondContact O-N 3.27Å
883	P	90.3	Very high	92.3	Very high	74 Å²	74	49.4 Å²	49.4	48%	0.481	26%	0.255	S	S	.	.			trans	-66.3	96.5	175.9	27.4	-34.8	0	0	0	110.8	P769	P769-P883 HydrophobicContact CG-CG 4.32Å
884	I	93	Very high	92.3	Very high	17 Å²	17	44 Å²	44	9%	0.087	23%	0.23	C	C	.	.			trans	-84.5	130.6	177.7	-67.7	157.9	0	0	0	109.5	W777 P849 V852 L872 F881 P882	W777-I884 HydrophobicContact CH2-CD1 3.85Å; W777-I884 HydrophobicContact CZ3-CD1 3.98Å; W777-I884 HydrophobicContact CZ3-CG1 4.48Å; P849-I884 WeakPolarHBondContact O-CD1 3.32Å; V852-I884 HydrophobicContact CG2-CG2 4.13Å; L872-I884 HydrophobicContact CD1-CB 4.08Å; L872-I884 HydrophobicContact CD1-CG2 3.92Å; L872-I884 HydrophobicContact CD2-CB 4.1Å; L872-I884 HydrophobicContact CD2-CD1 4.03Å; L872-I884 HydrophobicContact CD2-CG2 4.26Å; F881-I884 HydrophobicContact CD1-CD1 3.88Å; P882-I884 HydrophobicContact CG-CG1 4.49Å; P882-I884 PolarHBondContact O-N 3.27Å
885	E	94.1	Very high	92.4	Very high	68 Å²	68	42 Å²	42	32%	0.318	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	151.2	177.7	-73.5	-77.2	-152.9	0	0	112.3	V852 K1145	V852-E885 PolarHBondContact N-O 3.03Å; E885-K1145 IonicContact OE1-NZ 3.26Å; E885-K1145 PolarHBondContact OE1-NZ 3.27Å; E885-K1145 IonicContact OE2-NZ 2.73Å; E885-K1145 PolarHBondContact OE2-NZ 3.32Å
886	V	95.9	Very high	92.6	Very high	0 Å²	0	43 Å²	43	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	102.1	177.1	-169	0	0	0	0	108.7	V852 I854 Q865 I868 K869 L872	V852-V886 HydrophobicContact CB-CB 4.46Å; V852-V886 HydrophobicContact CB-CG1 4.1Å; V852-V886 HydrophobicContact CB-CG2 4.23Å; V852-V886 HydrophobicContact CG1-CG1 4.2Å; V852-V886 CarbonylContact O-C 3.46Å; V852-V886 WeakPolarHBondContact O-CA 3.47Å; I854-V886 HydrophobicContact CD1-CG1 3.71Å; I854-V886 HydrophobicContact CG1-CG1 4.31Å; Q865-V886 HydrophobicContact CG-CB 4.11Å; Q865-V886 HydrophobicContact CG-CG1 3.78Å; Q865-V886 PolarHBondContact NE2-O 3.43Å; I868-V886 HydrophobicContact CB-CG1 4.37Å; I868-V886 HydrophobicContact CG2-CG1 4.11Å; I868-V886 HydrophobicContact CG2-CG2 3.77Å; K869-V886 HydrophobicContact CG-CB 4.11Å; K869-V886 HydrophobicContact CG-CG2 3.82Å; L872-V886 HydrophobicContact CD1-CG2 3.3Å
887	E	95.3	Very high	92.8	Very high	11 Å²	11	39.2 Å²	39.2	5%	0.051	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	152.4	-177.4	-62	-52	142.3	0	0	112.1	I851 V852 I854 I889 Y1143 K1145	I851-E887 HydrophobicContact CD1-CB 4.43Å; I851-E887 HydrophobicContact CD1-CG 3.95Å; V852-E887 PolarHBondContact O-N 3.42Å; I854-E887 PolarHBondContact N-O 3.38Å; E887-I889 HydrophobicContact CB-CG2 4.44Å; E887-Y1143 HydrophobicContact CG-CE1 4.33Å; E887-K1145 VanDerWaalsContact OE1-CD 3.29Å; E887-K1145 WeakPolarHBondContact OE1-CD 3.44Å; E887-K1145 WeakPolarHBondContact OE1-CE 3.46Å; E887-K1145 IonicContact OE1-NZ 3.1Å; E887-K1145 PolarHBondContact OE1-NZ 3.24Å
888	I	96.5	Very high	93	Very high	2 Å²	2	34.3 Å²	34.3	1%	0.01	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	123.9	172.9	-66.2	171.5	0	0	0	106.3	I854 A856 A861 Q862 Q865 L1151 L1155	I854-I888 HydrophobicContact CB-CG1 4.3Å; I854-I888 WeakPolarHBondContact O-CA 3.19Å; A856-I888 HydrophobicContact CB-CG2 3.68Å; A861-I888 HydrophobicContact CB-CD1 4.01Å; A861-I888 HydrophobicContact CB-CG1 4.33Å; A861-I888 HydrophobicContact CB-CG2 4.28Å; Q862-I888 HydrophobicContact CG-CD1 4.39Å; Q865-I888 HydrophobicContact CB-CD1 4.1Å; Q865-I888 HydrophobicContact CB-CG1 4.43Å; Q865-I888 HydrophobicContact CG-CD1 4.35Å; Q865-I888 HydrophobicContact CG-CG1 4.42Å; I888-L1151 HydrophobicContact CB-CD1 3.98Å; I888-L1151 HydrophobicContact CD1-CD1 4.24Å; I888-L1151 HydrophobicContact CG2-CD1 3.73Å; I888-L1155 HydrophobicContact CG2-CD2 3.98Å
889	I	94.6	Very high	93.1	Very high	12 Å²	12	35.9 Å²	35.9	6%	0.062	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	154.5	-177.1	74.8	171.6	0	0	0	112	V853 I854 A856 E887 N891 L920 K923	V853-I889 HydrophobicContact CG1-CD1 3.38Å; V853-I889 HydrophobicContact CG1-CG1 3.56Å; V853-I889 HydrophobicContact CG1-CG2 4.29Å; I854-I889 PolarHBondContact O-N 3.01Å; A856-I889 WeakPolarHBondContact CB-O 3.15Å; A856-I889 PolarHBondContact N-O 3.43Å; E887-I889 HydrophobicContact CB-CG2 4.44Å; I889-N891 PolarHBondContact O-N 3.4Å; I889-L920 HydrophobicContact CD1-CD2 3.86Å; I889-L920 HydrophobicContact CG1-CD2 3.69Å; I889-K923 HydrophobicContact CD1-CD 4.13Å
890	D	93.5	Very high	93.3	Very high	33 Å²	33	31.5 Å²	31.5	18%	0.176	16%	0.159	C	C	.	.			trans	-52.2	133.9	170	162.1	58.4	0	0	0	112	E892 K923 M1154	D890-E892 VanDerWaalsContact OD1-CB 3.28Å; D890-E892 WeakPolarHBondContact OD1-CB 3.37Å; D890-E892 PolarHBondContact OD1-N 3.01Å; D890-E892 PolarHBondContact OD2-N 3.43Å; D890-K923 PolarHBondContact O-NZ 3.03Å; D890-K923 IonicContact OD2-NZ 3.19Å; D890-K923 PolarHBondContact OD2-NZ 2.73Å; D890-M1154 HydrophobicContact CB-SD 3.82Å; D890-M1154 PolarHBondContact N-SD 2.98Å; D890-M1154 VanDerWaalsContact N-SD 3.44Å
891	N	94.4	Very high	93.5	Very high	3 Å²	3	28.8 Å²	28.8	2%	0.016	15%	0.145	C	C	.	.			trans	-109.3	6.5	-179.2	66.2	-28	0	0	0	114.6	A856 E857 I889 A894 K895 L920 K1157	A856-N891 PolarHBondContact O-OD1 3.1Å; E857-N891 PolarHBondContact OE2-ND2 3.08Å; I889-N891 PolarHBondContact O-N 3.4Å; N891-A894 PolarHBondContact O-N 3.12Å; N891-A894 VanDerWaalsContact O-N 3.16Å; N891-K895 PolarHBondContact O-N 3.37Å; N891-L920 HydrophobicContact CB-CD2 4.01Å; N891-K1157 PolarHBondContact OD1-NZ 2.85Å
892	E	93.6	Very high	93.5	Very high	48 Å²	48	29.6 Å²	29.6	22%	0.224	15%	0.148	C	C	.	.	H	α-helix	trans	-55.6	-55.2	-179.9	-167.7	-174.7	173.7	0	0	112.2	D890 A894 K895 I896 L944 R945	D890-E892 VanDerWaalsContact OD1-CB 3.28Å; D890-E892 WeakPolarHBondContact OD1-CB 3.37Å; D890-E892 PolarHBondContact OD1-N 3.01Å; D890-E892 PolarHBondContact OD2-N 3.43Å; E892-A894 VanDerWaalsContact C-N 3.27Å; E892-A894 PolarHBondContact O-N 3.25Å; E892-K895 PolarHBondContact O-N 3.03Å; E892-I896 PolarHBondContact O-N 2.92Å; E892-L944 HydrophobicContact CB-CD2 4.49Å; E892-L944 HydrophobicContact CG-CD2 3.99Å; E892-R945 WeakPolarHBondContact OE1-CB 3.31Å; E892-R945 PolarHBondContact OE1-N 3.21Å
893	L	95.2	Very high	93.6	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-51.7	-45	173.5	174.4	60.7	0	0	0	112.4	K895 I896 Y897 K923 E930 Y931 L934 L944	L893-K895 PolarHBondContact O-N 3.18Å; L893-I896 PolarHBondContact O-N 3.12Å; L893-Y897 WeakPolarHBondContact O-CB 3.38Å; L893-Y897 PolarHBondContact O-N 3.44Å; L893-K923 HydrophobicContact CD2-CD 3.97Å; L893-K923 HydrophobicContact CD2-CG 4.15Å; L893-E930 HydrophobicContact CD2-CB 4.18Å; L893-E930 HydrophobicContact CD2-CG 3.82Å; L893-Y931 HydrophobicContact CB-CE1 4.11Å; L893-Y931 HydrophobicContact CD1-CD1 3.85Å; L893-Y931 HydrophobicContact CD1-CE1 4.12Å; L893-Y931 HydrophobicContact CD1-CG 4.44Å; L893-Y931 HydrophobicContact CD2-CD1 3.84Å; L893-Y931 HydrophobicContact CD2-CD2 3.92Å; L893-Y931 HydrophobicContact CD2-CE1 3.85Å; L893-Y931 HydrophobicContact CD2-CE2 3.9Å; L893-Y931 HydrophobicContact CD2-CG 3.86Å; L893-Y931 HydrophobicContact CG-CD1 4.33Å; L893-Y931 HydrophobicContact CG-CE1 4.25Å; L893-L934 HydrophobicContact CD1-CD1 3.58Å; L893-L934 HydrophobicContact CD1-CG 3.92Å; L893-L944 HydrophobicContact CB-CD2 4.47Å
894	A	96.4	Very high	93.6	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-69.4	-33.8	-175.5	0	0	0	0	0	112.2	N891 E892 A898 Q916 L920	N891-A894 PolarHBondContact O-N 3.12Å; N891-A894 VanDerWaalsContact O-N 3.16Å; E892-A894 VanDerWaalsContact C-N 3.27Å; E892-A894 PolarHBondContact O-N 3.25Å; A894-A898 WeakPolarHBondContact O-CB 3.17Å; A894-A898 PolarHBondContact O-N 2.8Å; A894-Q916 HydrophobicContact CB-CB 4.34Å; A894-Q916 WeakPolarHBondContact O-CG 3.5Å; A894-L920 HydrophobicContact CB-CD2 4.15Å; A894-L920 HydrophobicContact CB-CG 3.87Å
895	K	94.9	Very high	93.4	Very high	70 Å²	70	33.6 Å²	33.6	30%	0.304	17%	0.168	S	C	.	.	H	α-helix	trans	-65.3	-43	173.3	-79.6	-176.7	169.3	-174.2	0	112.1	E857 N891 E892 L893 A898	E857-K895 IonicContact OE1-NZ 2.72Å; E857-K895 PolarHBondContact OE1-NZ 3.32Å; E857-K895 WeakPolarHBondContact OE2-CE 3.28Å; E857-K895 IonicContact OE2-NZ 2.73Å; E857-K895 PolarHBondContact OE2-NZ 2.87Å; N891-K895 PolarHBondContact O-N 3.37Å; E892-K895 PolarHBondContact O-N 3.03Å; L893-K895 PolarHBondContact O-N 3.18Å; K895-A898 PolarHBondContact O-N 3.13Å
896	I	95.6	Very high	93.2	Very high	29 Å²	29	32.6 Å²	32.6	15%	0.149	16%	0.164	C	C	.	.	H	α-helix	trans	-67	-49.9	178.4	-59.5	164.9	0	0	0	109.3	E892 L893 A898 N899 S900 L934 C943 L944	E892-I896 PolarHBondContact O-N 2.92Å; L893-I896 PolarHBondContact O-N 3.12Å; I896-A898 VanDerWaalsContact C-N 3.25Å; I896-A898 PolarHBondContact O-N 2.87Å; I896-N899 CarbonylContact O-C 3.52Å; I896-N899 PolarHBondContact O-N 2.89Å; I896-S900 PolarHBondContact O-N 2.81Å; I896-L934 HydrophobicContact CB-CD1 4.08Å; I896-L934 HydrophobicContact CB-CD2 4.44Å; I896-L934 HydrophobicContact CD1-CD1 4.45Å; I896-L934 HydrophobicContact CG2-CD1 3.72Å; I896-L934 HydrophobicContact CG2-CD2 3.81Å; I896-L934 HydrophobicContact CG2-CG 4.42Å; I896-C943 HydrophobicContact CD1-CB 4.04Å; I896-C943 HydrophobicContact CG1-CB 4.41Å; I896-C943 HydrophobicContact CG2-CB 4.14Å; I896-L944 HydrophobicContact CD1-CB 4.39Å; I896-L944 HydrophobicContact CD1-CD2 3.66Å; I896-L944 HydrophobicContact CD1-CG 3.69Å
897	Y	95.4	Very high	93	Very high	1 Å²	1	33.8 Å²	33.8	0%	0.004	17%	0.169	C	C	.	.	H	α-helix	trans	-58.7	-31.8	176.1	174.3	-90.8	0	0	0	113.5	L893 N899 S900 K902 G903 D906 F907 R922 Q933	L893-Y897 WeakPolarHBondContact O-CB 3.38Å; L893-Y897 PolarHBondContact O-N 3.44Å; Y897-N899 PolarHBondContact O-N 2.79Å; Y897-S900 WeakPolarHBondContact CA-OG 3.24Å; Y897-S900 PolarHBondContact O-N 3.33Å; Y897-S900 PolarHBondContact O-OG 3.19Å; Y897-K902 HydrophobicContact CE2-CG 4.11Å; Y897-G903 WeakPolarHBondContact O-CA 3.3Å; Y897-D906 WeakPolarHBondContact OH-CB 3.31Å; Y897-D906 PolarHBondContact OH-OD2 2.81Å; Y897-F907 HydrophobicContact CE1-CD2 4.48Å; Y897-F907 HydrophobicContact CE1-CE2 4.36Å; Y897-F907 WeakPolarHBondContact OH-CE2 3.25Å; Y897-R922 PolarHBondContact OH-NH1 3.13Å; Y897-Q933 HydrophobicContact CD2-CB 3.85Å; Y897-Q933 HydrophobicContact CD2-CG 4.44Å; Y897-Q933 HydrophobicContact CE2-CB 4.03Å; Y897-Q933 HydrophobicContact CE2-CG 4.29Å
898	A	95	Very high	92.7	Very high	1 Å²	1	40.1 Å²	40.1	1%	0.008	20%	0.197	C	C	.	.	H	α-helix	trans	-66.9	-23.6	176.7	0	0	0	0	0	114	A894 K895 I896 P912 K915 Q916	A894-A898 WeakPolarHBondContact O-CB 3.17Å; A894-A898 PolarHBondContact O-N 2.8Å; K895-A898 PolarHBondContact O-N 3.13Å; I896-A898 VanDerWaalsContact C-N 3.25Å; I896-A898 PolarHBondContact O-N 2.87Å; A898-P912 HydrophobicContact CB-CB 4.28Å; A898-P912 WeakPolarHBondContact CB-O 3.35Å; A898-K915 HydrophobicContact CB-CB 3.8Å; A898-K915 HydrophobicContact CB-CD 4.47Å; A898-K915 WeakPolarHBondContact O-CD 3.32Å; A898-K915 PolarHBondContact O-NZ 2.8Å; A898-Q916 HydrophobicContact CB-CG 3.57Å
899	N	92.2	Very high	92.5	Very high	113 Å²	113	48.7 Å²	48.7	60%	0.604	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-109.2	4.3	-179.2	-58.4	-16.9	0	0	0	112.3	I896 Y897	I896-N899 CarbonylContact O-C 3.52Å; I896-N899 PolarHBondContact O-N 2.89Å; Y897-N899 PolarHBondContact O-N 2.79Å
900	S	91.1	Very high	92.5	Very high	2 Å²	2	50.6 Å²	50.6	1%	0.014	24%	0.244	C	C	.	.	S	Bend	trans	-81	156.9	-178.8	57.1	0	0	0	0	113.2	I896 Y897 K902 G903 E904 E940	I896-S900 PolarHBondContact O-N 2.81Å; Y897-S900 WeakPolarHBondContact CA-OG 3.24Å; Y897-S900 PolarHBondContact O-N 3.33Å; Y897-S900 PolarHBondContact O-OG 3.19Å; S900-K902 PolarHBondContact O-N 3.28Å; S900-G903 PolarHBondContact O-N 3.05Å; S900-G903 VanDerWaalsContact O-N 3.13Å; S900-G903 PolarHBondContact OG-N 3.4Å; S900-E904 WeakPolarHBondContact O-CB 3.32Å; S900-E904 WeakPolarHBondContact O-CG 3.47Å; S900-E904 PolarHBondContact O-N 2.96Å; S900-E940 WeakPolarHBondContact CA-OE1 3.36Å; S900-E940 WeakPolarHBondContact CB-OE1 3.48Å; S900-E940 WeakPolarHBondContact CB-OE2 3.48Å
901	K	89	Confident	92.5	Very high	104 Å²	104	51.5 Å²	51.5	45%	0.452	25%	0.251	S	S	.	.	H	α-helix	trans	-59.5	-34.2	169.2	-59.2	-177.9	-164.8	177.3	0	110.6	S905 D938 E940	K901-S905 WeakPolarHBondContact O-CB 3.43Å; K901-S905 PolarHBondContact O-N 3.19Å; K901-S905 PolarHBondContact O-OG 3.47Å; K901-D938 WeakPolarHBondContact CD-OD2 3.46Å; K901-D938 WeakPolarHBondContact CE-OD2 3.48Å; K901-D938 IonicContact NZ-OD1 2.58Å; K901-D938 PolarHBondContact NZ-OD1 2.94Å; K901-D938 IonicContact NZ-OD2 2.67Å; K901-D938 PolarHBondContact NZ-OD2 2.87Å; K901-E940 PolarHBondContact N-OE1 3.26Å
902	K	88.6	Confident	92.6	Very high	30 Å²	30	54.5 Å²	54.5	13%	0.13	27%	0.271	C	S	.	.	H	α-helix	trans	-65.2	-46.4	173.3	-176.9	52.3	177.1	160.4	0	112.6	Y897 S900 E904 S905 D906 Q933	Y897-K902 HydrophobicContact CE2-CG 4.11Å; S900-K902 PolarHBondContact O-N 3.28Å; K902-E904 VanDerWaalsContact C-N 3.34Å; K902-E904 PolarHBondContact O-N 2.62Å; K902-S905 WeakPolarHBondContact CA-OG 3.48Å; K902-S905 PolarHBondContact O-N 2.88Å; K902-S905 PolarHBondContact O-OG 3.03Å; K902-D906 WeakPolarHBondContact CE-OD1 3.11Å; K902-D906 WeakPolarHBondContact CE-OD2 3.3Å; K902-D906 IonicContact NZ-OD1 3.14Å; K902-D906 PolarHBondContact NZ-OD1 3.18Å; K902-D906 IonicContact NZ-OD2 2.74Å; K902-D906 WeakPolarHBondContact O-CB 3.43Å; K902-D906 VanDerWaalsContact O-CG 3.32Å; K902-D906 PolarHBondContact O-N 2.99Å; K902-Q933 HydrophobicContact CG-CB 4.36Å
903	G	90.3	Very high	92.7	Very high	0 Å²	0	53.2 Å²	53.2	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-73.9	-21.3	177.3	0	0	0	0	0	114.3	Y897 S900 F907 K915	Y897-G903 WeakPolarHBondContact O-CA 3.3Å; S900-G903 PolarHBondContact O-N 3.05Å; S900-G903 VanDerWaalsContact O-N 3.13Å; S900-G903 PolarHBondContact OG-N 3.4Å; G903-F907 PolarHBondContact O-N 3.18Å; G903-K915 WeakPolarHBondContact O-CD 3.5Å; G903-K915 WeakPolarHBondContact O-CE 3.38Å; G903-K915 PolarHBondContact O-NZ 3.08Å; G903-K915 VanDerWaalsContact O-NZ 3.15Å
904	E	90.9	Very high	92.7	Very high	110 Å²	110	53.2 Å²	53.2	51%	0.514	27%	0.266	S	S	.	.	H	α-helix	trans	-73.9	-46	166.5	-75.2	-174.6	168.5	0	0	112.6	S900 K902 F907 K908	S900-E904 WeakPolarHBondContact O-CB 3.32Å; S900-E904 WeakPolarHBondContact O-CG 3.47Å; S900-E904 PolarHBondContact O-N 2.96Å; K902-E904 VanDerWaalsContact C-N 3.34Å; K902-E904 PolarHBondContact O-N 2.62Å; E904-F907 CarbonylContact O-C 3.59Å; E904-F907 PolarHBondContact O-N 3.37Å; E904-K908 WeakPolarHBondContact O-CA 3.41Å; E904-K908 WeakPolarHBondContact O-CG 3.33Å; E904-K908 PolarHBondContact O-N 2.98Å
905	S	89.6	Confident	92.7	Very high	69 Å²	69	53.7 Å²	53.7	48%	0.483	27%	0.268	S	S	.	.	H	α-helix	trans	-64.6	-42.6	175.3	53.5	0	0	0	0	113	K901 K902 F907	K901-S905 WeakPolarHBondContact O-CB 3.43Å; K901-S905 PolarHBondContact O-N 3.19Å; K901-S905 PolarHBondContact O-OG 3.47Å; K902-S905 WeakPolarHBondContact CA-OG 3.48Å; K902-S905 PolarHBondContact O-N 2.88Å; K902-S905 PolarHBondContact O-OG 3.03Å; S905-F907 VanDerWaalsContact C-N 3.31Å; S905-F907 PolarHBondContact O-N 3.13Å
906	D	89.2	Confident	92.8	Very high	46 Å²	46	51.3 Å²	51.3	25%	0.246	26%	0.257	C	S	.	.	H	α-helix	trans	-64.4	-32.8	177.6	-77.2	-7.6	0	0	0	112.8	Y897 K902 R922	Y897-D906 WeakPolarHBondContact OH-CB 3.31Å; Y897-D906 PolarHBondContact OH-OD2 2.81Å; K902-D906 WeakPolarHBondContact CE-OD1 3.11Å; K902-D906 WeakPolarHBondContact CE-OD2 3.3Å; K902-D906 IonicContact NZ-OD1 3.14Å; K902-D906 PolarHBondContact NZ-OD1 3.18Å; K902-D906 IonicContact NZ-OD2 2.74Å; K902-D906 WeakPolarHBondContact O-CB 3.43Å; K902-D906 VanDerWaalsContact O-CG 3.32Å; K902-D906 PolarHBondContact O-N 2.99Å; D906-R922 IonicContact OD2-NH1 2.65Å
907	F	91.3	Very high	92.9	Very high	25 Å²	25	49.9 Å²	49.9	11%	0.11	25%	0.25	C	S	.	.	T	Hydrogen-bonded Turn	trans	-148.3	61.1	-169.8	-57.4	-68.4	0	0	0	113.9	I809 Y897 G903 E904 S905 E909 Y910 K915 A918	I809-F907 HydrophobicContact CG1-CE1 3.82Å; I809-F907 HydrophobicContact CG1-CZ 3.62Å; Y897-F907 HydrophobicContact CE1-CD2 4.48Å; Y897-F907 HydrophobicContact CE1-CE2 4.36Å; Y897-F907 WeakPolarHBondContact OH-CE2 3.25Å; G903-F907 PolarHBondContact O-N 3.18Å; E904-F907 CarbonylContact O-C 3.59Å; E904-F907 PolarHBondContact O-N 3.37Å; S905-F907 VanDerWaalsContact C-N 3.31Å; S905-F907 PolarHBondContact O-N 3.13Å; F907-E909 PolarHBondContact O-N 3.46Å; F907-E909 VanDerWaalsContact O-N 3.11Å; F907-Y910 HydrophobicContact CB-CD2 3.75Å; F907-Y910 HydrophobicContact CB-CG 3.8Å; F907-Y910 AromaticContact CD1-CD2 3.46Å; F907-Y910 HydrophobicContact CD1-CD2 3.46Å; F907-Y910 VanDerWaalsContact CD1-CD2 3.46Å; F907-Y910 AromaticContact CD1-CE2 3.37Å; F907-Y910 HydrophobicContact CD1-CE2 3.37Å; F907-Y910 HydrophobicContact CD1-CG 4.18Å; F907-Y910 HydrophobicContact CD2-CD2 4.42Å; F907-Y910 HydrophobicContact CE1-CD2 4.1Å; F907-Y910 AromaticContact CE1-CE2 3.66Å; F907-Y910 HydrophobicContact CE1-CE2 3.66Å; F907-Y910 AromaticContact CG-CD2 3.65Å; F907-Y910 HydrophobicContact CG-CD2 3.65Å; F907-Y910 HydrophobicContact CG-CE2 4.06Å; F907-Y910 HydrophobicContact CG-CG 4.22Å; F907-Y910 PolarHBondContact O-N 3.18Å; F907-K915 HydrophobicContact CB-CG 4.22Å; F907-K915 HydrophobicContact CD2-CG 4.45Å; F907-K915 WeakPolarHBondContact O-CE 3.24Å; F907-A918 HydrophobicContact CE2-CB 4.16Å; F907-A918 HydrophobicContact CZ-CB 4.34Å
908	K	90.1	Very high	93	Very high	144 Å²	144	49.9 Å²	49.9	63%	0.626	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.3	-37.3	-177.9	-63.1	180	-173.5	176.6	0	114.7	E205 E904	E205-K908 IonicContact OE1-NZ 2.74Å; E205-K908 PolarHBondContact OE1-NZ 2.81Å; E904-K908 WeakPolarHBondContact O-CA 3.41Å; E904-K908 WeakPolarHBondContact O-CG 3.33Å; E904-K908 PolarHBondContact O-N 2.98Å
909	E	92.1	Very high	93	Very high	182 Å²	182	49.9 Å²	49.9	85%	0.85	25%	0.25	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.3	-11.8	-177.9	-60.4	-171.2	163.1	0	0	114.5	F907	F907-E909 PolarHBondContact O-N 3.46Å; F907-E909 VanDerWaalsContact O-N 3.11Å
910	Y	94.1	Very high	93.3	Very high	53 Å²	53	44.5 Å²	44.5	21%	0.208	22%	0.221	C	C	.	.	S	Bend	trans	-85.9	133.5	-170.5	-72.9	9.3	0	0	0	111.7	I809 Y812 F907 L914 K915	I809-Y910 HydrophobicContact CG2-CE2 4.49Å; Y812-Y910 HydrophobicContact CE1-CE1 4.11Å; F907-Y910 HydrophobicContact CB-CD2 3.75Å; F907-Y910 HydrophobicContact CB-CG 3.8Å; F907-Y910 AromaticContact CD1-CD2 3.46Å; F907-Y910 HydrophobicContact CD1-CD2 3.46Å; F907-Y910 VanDerWaalsContact CD1-CD2 3.46Å; F907-Y910 AromaticContact CD1-CE2 3.37Å; F907-Y910 HydrophobicContact CD1-CE2 3.37Å; F907-Y910 HydrophobicContact CD1-CG 4.18Å; F907-Y910 HydrophobicContact CD2-CD2 4.42Å; F907-Y910 HydrophobicContact CE1-CD2 4.1Å; F907-Y910 AromaticContact CE1-CE2 3.66Å; F907-Y910 HydrophobicContact CE1-CE2 3.66Å; F907-Y910 AromaticContact CG-CD2 3.65Å; F907-Y910 HydrophobicContact CG-CD2 3.65Å; F907-Y910 HydrophobicContact CG-CE2 4.06Å; F907-Y910 HydrophobicContact CG-CG 4.22Å; F907-Y910 PolarHBondContact O-N 3.18Å; Y910-L914 HydrophobicContact CD1-CD2 3.95Å; Y910-L914 HydrophobicContact CD2-CD2 3.58Å; Y910-L914 HydrophobicContact CD2-CG 3.63Å; Y910-L914 HydrophobicContact CE1-CD2 4.29Å; Y910-L914 HydrophobicContact CE2-CD2 3.93Å; Y910-L914 HydrophobicContact CE2-CG 4.13Å; Y910-L914 HydrophobicContact CG-CD2 3.59Å; Y910-L914 HydrophobicContact CG-CG 4.01Å; Y910-K915 WeakPolarHBondContact O-CE 3.22Å
911	P	94.4	Very high	93.5	Very high	51 Å²	51	44.4 Å²	44.4	33%	0.331	22%	0.221	S	C	.	.			trans	-64.8	152.5	173.5	27.8	-34.2	0	0	0	110.8	F799 L913 L914 K915	F799-P911 HydrophobicContact CD1-CG 4.47Å; F799-P911 HydrophobicContact CE1-CG 3.85Å; F799-P911 HydrophobicContact CE2-CG 4.02Å; F799-P911 HydrophobicContact CZ-CG 3.6Å; P911-L913 VanDerWaalsContact C-N 3.31Å; P911-L913 PolarHBondContact O-N 3.01Å; P911-L913 VanDerWaalsContact O-N 3.13Å; P911-L914 HydrophobicContact CG-CB 3.92Å; P911-L914 WeakPolarHBondContact O-CA 3.39Å; P911-L914 WeakPolarHBondContact O-CB 3.43Å; P911-L914 PolarHBondContact O-N 3.06Å; P911-K915 PolarHBondContact O-N 3.33Å
912	P	94.8	Very high	93.9	Very high	67 Å²	67	40 Å²	40	44%	0.435	20%	0.201	S	C	.	.	H	α-helix	trans	-52.6	-41	-174.1	-30.8	36.2	0	0	0	114.7	A898 L914 K915 Q916	A898-P912 HydrophobicContact CB-CB 4.28Å; A898-P912 WeakPolarHBondContact CB-O 3.35Å; P912-L914 VanDerWaalsContact C-N 3.27Å; P912-L914 PolarHBondContact O-N 3.49Å; P912-K915 WeakPolarHBondContact O-CB 3.34Å; P912-K915 PolarHBondContact O-N 3Å; P912-Q916 WeakPolarHBondContact O-CG 3.45Å; P912-Q916 PolarHBondContact O-N 2.95Å
913	L	95.8	Very high	94.2	Very high	20 Å²	20	39.5 Å²	39.5	11%	0.105	20%	0.199	C	C	.	.	H	α-helix	trans	-62.6	-29.8	175.7	-73.8	178.2	0	0	0	113.7	A789 D791 V796 A797 F799 P911 A917	A789-L913 HydrophobicContact CB-CD2 4.27Å; A789-L913 WeakPolarHBondContact CB-O 3.44Å; D791-L913 HydrophobicContact CB-CD1 4.3Å; V796-L913 HydrophobicContact CG1-CD1 3.49Å; V796-L913 VanDerWaalsContact CG1-CD1 3.49Å; A797-L913 WeakPolarHBondContact O-CD1 3.37Å; F799-L913 HydrophobicContact CD2-CB 3.79Å; F799-L913 HydrophobicContact CD2-CD1 4.46Å; F799-L913 HydrophobicContact CE2-CB 4.5Å; P911-L913 VanDerWaalsContact C-N 3.31Å; P911-L913 PolarHBondContact O-N 3.01Å; P911-L913 VanDerWaalsContact O-N 3.13Å; L913-A917 WeakPolarHBondContact O-CB 3.35Å; L913-A917 PolarHBondContact O-N 3.43Å
914	L	96.7	Very high	94.5	Very high	1 Å²	1	39.9 Å²	39.9	1%	0.005	20%	0.201	C	C	.	.	H	α-helix	trans	-74.3	-38.3	174.8	-179.4	55.9	0	0	0	111.3	F799 A801 Y812 Y910 P911 P912 Q916 A917 A918	F799-L914 HydrophobicContact CB-CB 4.19Å; F799-L914 HydrophobicContact CB-CD1 4.26Å; F799-L914 HydrophobicContact CD1-CB 4.02Å; F799-L914 HydrophobicContact CD1-CD1 4.4Å; F799-L914 HydrophobicContact CD1-CD2 4.47Å; F799-L914 HydrophobicContact CG-CB 4.13Å; A801-L914 HydrophobicContact CB-CD1 3.96Å; Y812-L914 HydrophobicContact CD1-CD2 4.02Å; Y812-L914 HydrophobicContact CD2-CD1 4.37Å; Y812-L914 HydrophobicContact CD2-CD2 3.73Å; Y812-L914 HydrophobicContact CE1-CD2 4.33Å; Y812-L914 HydrophobicContact CE2-CD2 4.06Å; Y812-L914 HydrophobicContact CG-CD1 3.98Å; Y812-L914 HydrophobicContact CG-CD2 3.71Å; Y910-L914 HydrophobicContact CD1-CD2 3.95Å; Y910-L914 HydrophobicContact CD2-CD2 3.58Å; Y910-L914 HydrophobicContact CD2-CG 3.63Å; Y910-L914 HydrophobicContact CE1-CD2 4.29Å; Y910-L914 HydrophobicContact CE2-CD2 3.93Å; Y910-L914 HydrophobicContact CE2-CG 4.13Å; Y910-L914 HydrophobicContact CG-CD2 3.59Å; Y910-L914 HydrophobicContact CG-CG 4.01Å; P911-L914 HydrophobicContact CG-CB 3.92Å; P911-L914 WeakPolarHBondContact O-CA 3.39Å; P911-L914 WeakPolarHBondContact O-CB 3.43Å; P911-L914 PolarHBondContact O-N 3.06Å; P912-L914 VanDerWaalsContact C-N 3.27Å; P912-L914 PolarHBondContact O-N 3.49Å; L914-Q916 VanDerWaalsContact C-N 3.34Å; L914-A917 PolarHBondContact O-N 3.28Å; L914-A918 PolarHBondContact O-N 2.77Å
915	K	96.7	Very high	94.6	Very high	10 Å²	10	35.6 Å²	35.6	4%	0.043	18%	0.181	C	C	.	.	H	α-helix	trans	-62.1	-40.3	170.2	-58.7	178.4	-178.4	-176.5	0	111.7	A898 G903 F907 Y910 P911 P912 A918 S919	A898-K915 HydrophobicContact CB-CB 3.8Å; A898-K915 HydrophobicContact CB-CD 4.47Å; A898-K915 WeakPolarHBondContact O-CD 3.32Å; A898-K915 PolarHBondContact O-NZ 2.8Å; G903-K915 WeakPolarHBondContact O-CD 3.5Å; G903-K915 WeakPolarHBondContact O-CE 3.38Å; G903-K915 PolarHBondContact O-NZ 3.08Å; G903-K915 VanDerWaalsContact O-NZ 3.15Å; F907-K915 HydrophobicContact CB-CG 4.22Å; F907-K915 HydrophobicContact CD2-CG 4.45Å; F907-K915 WeakPolarHBondContact O-CE 3.24Å; Y910-K915 WeakPolarHBondContact O-CE 3.22Å; P911-K915 PolarHBondContact O-N 3.33Å; P912-K915 WeakPolarHBondContact O-CB 3.34Å; P912-K915 PolarHBondContact O-N 3Å; K915-A918 WeakPolarHBondContact O-CB 3.29Å; K915-A918 PolarHBondContact O-N 2.64Å; K915-S919 PolarHBondContact O-N 3.24Å
916	Q	96.9	Very high	94.8	Very high	19 Å²	19	33.7 Å²	33.7	9%	0.089	17%	0.166	C	C	.	.	H	α-helix	trans	-60.2	-45.7	172.2	-68.9	179	29.1	0	0	111.5	A789 A894 A898 P912 L914 A918 S919 L920	A789-Q916 HydrophobicContact CB-CB 3.72Å; A894-Q916 HydrophobicContact CB-CB 4.34Å; A894-Q916 WeakPolarHBondContact O-CG 3.5Å; A898-Q916 HydrophobicContact CB-CG 3.57Å; P912-Q916 WeakPolarHBondContact O-CG 3.45Å; P912-Q916 PolarHBondContact O-N 2.95Å; L914-Q916 VanDerWaalsContact C-N 3.34Å; Q916-A918 VanDerWaalsContact C-N 3.34Å; Q916-A918 PolarHBondContact O-N 3.42Å; Q916-S919 PolarHBondContact O-N 2.74Å; Q916-L920 WeakPolarHBondContact O-CB 3.48Å; Q916-L920 VanDerWaalsContact O-CG 3.25Å; Q916-L920 WeakPolarHBondContact O-CG 3.35Å; Q916-L920 PolarHBondContact O-N 2.93Å
917	A	97.4	Very high	95.1	Very high	0 Å²	0	32 Å²	32	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-62.3	-39.3	177.9	0	0	0	0	0	112.5	A789 A801 L913 L914 A921	A789-A917 HydrophobicContact CB-CB 4.1Å; A801-A917 HydrophobicContact CB-CB 4.23Å; L913-A917 WeakPolarHBondContact O-CB 3.35Å; L913-A917 PolarHBondContact O-N 3.43Å; L914-A917 PolarHBondContact O-N 3.28Å; A917-A921 PolarHBondContact O-N 2.89Å
918	A	96.3	Very high	95.3	Very high	1 Å²	1	30.9 Å²	30.9	1%	0.008	15%	0.152	C	C	.	.	H	α-helix	trans	-61.4	-49.1	172.2	0	0	0	0	0	112	I809 F907 L914 K915 Q916 A921 R922	I809-A918 HydrophobicContact CD1-CB 3.6Å; I809-A918 HydrophobicContact CG1-CB 4.09Å; F907-A918 HydrophobicContact CE2-CB 4.16Å; F907-A918 HydrophobicContact CZ-CB 4.34Å; L914-A918 PolarHBondContact O-N 2.77Å; K915-A918 WeakPolarHBondContact O-CB 3.29Å; K915-A918 PolarHBondContact O-N 2.64Å; Q916-A918 VanDerWaalsContact C-N 3.34Å; Q916-A918 PolarHBondContact O-N 3.42Å; A918-A921 WeakPolarHBondContact O-CB 3.4Å; A918-A921 PolarHBondContact O-N 3.47Å; A918-R922 WeakPolarHBondContact O-CG 3.12Å; A918-R922 PolarHBondContact O-N 3.28Å
919	S	96.5	Very high	95.5	Very high	0 Å²	0	25 Å²	25	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-66.1	-40.6	-179.3	-177.4	0	0	0	0	113	K915 Q916 A921 R922 K923 E930	K915-S919 PolarHBondContact O-N 3.24Å; Q916-S919 PolarHBondContact O-N 2.74Å; S919-A921 VanDerWaalsContact C-N 3.27Å; S919-A921 PolarHBondContact O-N 3.48Å; S919-R922 PolarHBondContact O-N 3.35Å; S919-K923 VanDerWaalsContact O-CB 3.31Å; S919-K923 WeakPolarHBondContact O-CB 3.46Å; S919-K923 PolarHBondContact O-N 2.78Å; S919-E930 WeakPolarHBondContact CA-OE1 3.43Å; S919-E930 WeakPolarHBondContact CB-OE1 3.28Å; S919-E930 PolarHBondContact OG-OE1 2.95Å
920	L	97	Very high	95.7	Very high	0 Å²	0	16.4 Å²	16.4	0%	0	9%	0.088	C	C	.	.	H	α-helix	trans	-57.1	-39.5	173	-74.3	167.1	0	0	0	112.3	A789 V853 I889 N891 A894 Q916	A789-L920 HydrophobicContact CB-CD1 4.06Å; V853-L920 HydrophobicContact CG1-CB 4.28Å; I889-L920 HydrophobicContact CD1-CD2 3.86Å; I889-L920 HydrophobicContact CG1-CD2 3.69Å; N891-L920 HydrophobicContact CB-CD2 4.01Å; A894-L920 HydrophobicContact CB-CD2 4.15Å; A894-L920 HydrophobicContact CB-CG 3.87Å; Q916-L920 WeakPolarHBondContact O-CB 3.48Å; Q916-L920 VanDerWaalsContact O-CG 3.25Å; Q916-L920 WeakPolarHBondContact O-CG 3.35Å; Q916-L920 PolarHBondContact O-N 2.93Å
921	A	96.9	Very high	95.7	Very high	0 Å²	0	14.1 Å²	14.1	0%	0	8%	0.079	C	C	.	.	H	α-helix	trans	-68.5	-44.3	176.4	0	0	0	0	0	111.9	V785 T803 A917 A918 S919 M924 Q925	V785-A921 HydrophobicContact CB-CB 4.06Å; V785-A921 HydrophobicContact CG1-CB 3.84Å; T803-A921 HydrophobicContact CG2-CB 3.61Å; A917-A921 PolarHBondContact O-N 2.89Å; A918-A921 WeakPolarHBondContact O-CB 3.4Å; A918-A921 PolarHBondContact O-N 3.47Å; S919-A921 VanDerWaalsContact C-N 3.27Å; S919-A921 PolarHBondContact O-N 3.48Å; A921-M924 PolarHBondContact O-N 3.04Å; A921-Q925 PolarHBondContact O-N 2.81Å
922	R	95.7	Very high	95.8	Very high	11 Å²	11	11.7 Å²	11.7	4%	0.042	6%	0.063	C	C	.	.	H	α-helix	trans	-68.2	-38.7	179	-68.4	172.7	167.6	174.1	-0.5	113.2	T803 G807 Y897 D906 A918 S919 M924 Q925 D926 E930 R985	T803-R922 HydrophobicContact CG2-CG 4.2Å; G807-R922 PolarHBondContact O-NE 2.82Å; Y897-R922 PolarHBondContact OH-NH1 3.13Å; D906-R922 IonicContact OD2-NH1 2.65Å; A918-R922 WeakPolarHBondContact O-CG 3.12Å; A918-R922 PolarHBondContact O-N 3.28Å; S919-R922 PolarHBondContact O-N 3.35Å; R922-M924 PolarHBondContact O-N 2.74Å; R922-M924 VanDerWaalsContact O-N 3.15Å; R922-Q925 WeakPolarHBondContact O-CA 3.13Å; R922-Q925 WeakPolarHBondContact O-CB 3.5Å; R922-Q925 PolarHBondContact O-N 3.21Å; R922-D926 PolarHBondContact O-N 3.36Å; R922-E930 VanDerWaalsContact CB-CD 3.49Å; R922-E930 HydrophobicContact CB-CG 4.28Å; R922-E930 WeakPolarHBondContact CB-OE2 3.39Å; R922-E930 WeakPolarHBondContact CD-OE2 3.31Å; R922-R985 VanDerWaalsContact CZ-CD 3.44Å
923	K	95.7	Very high	95.7	Very high	21 Å²	21	8.5 Å²	8.5	9%	0.091	4%	0.042	C	C	.	.	H	α-helix	trans	-55	-29.5	171.8	-171.5	178	-176.2	175.7	0	112.4	I889 D890 L893 S919 P927 E930	I889-K923 HydrophobicContact CD1-CD 4.13Å; D890-K923 PolarHBondContact O-NZ 3.03Å; D890-K923 IonicContact OD2-NZ 3.19Å; D890-K923 PolarHBondContact OD2-NZ 2.73Å; L893-K923 HydrophobicContact CD2-CD 3.97Å; L893-K923 HydrophobicContact CD2-CG 4.15Å; S919-K923 VanDerWaalsContact O-CB 3.31Å; S919-K923 WeakPolarHBondContact O-CB 3.46Å; S919-K923 PolarHBondContact O-N 2.78Å; K923-P927 WeakPolarHBondContact O-CG 3.45Å; K923-E930 HydrophobicContact CB-CB 4.37Å; K923-E930 HydrophobicContact CB-CG 4.12Å
924	M	95.4	Very high	95.6	Very high	7 Å²	7	7.5 Å²	7.5	3%	0.034	4%	0.037	C	C	.	.	H	α-helix	trans	-85.3	-22.1	175.8	-168.7	78.6	-69	0	0	113.4	Y764 V785 I851 V853 A921 R922 Y1143	Y764-M924 HydrophobicContact CG-CG 4.47Å; Y764-M924 HydrophobicContact CG-SD 4.29Å; Y764-M924 PolarHBondContact N-O 2.64Å; V785-M924 HydrophobicContact CG1-CB 4.28Å; I851-M924 HydrophobicContact CD1-CG 4.21Å; I851-M924 HydrophobicContact CD1-SD 3.87Å; I851-M924 HydrophobicContact CG2-CG 4.23Å; V853-M924 HydrophobicContact CG2-CB 4.04Å; V853-M924 HydrophobicContact CG2-CG 3.89Å; V853-M924 HydrophobicContact CG2-SD 4.32Å; A921-M924 PolarHBondContact O-N 3.04Å; R922-M924 PolarHBondContact O-N 2.74Å; R922-M924 VanDerWaalsContact O-N 3.15Å; M924-Y1143 HydrophobicContact CE-CD1 4.31Å; M924-Y1143 HydrophobicContact CE-CD2 3.54Å; M924-Y1143 HydrophobicContact CE-CE2 3.8Å; M924-Y1143 HydrophobicContact CE-CG 3.8Å; M924-Y1143 HydrophobicContact SD-CE2 4.44Å
925	Q	94	Very high	95.3	Very high	21 Å²	21	7.9 Å²	7.9	10%	0.098	4%	0.04	C	C	.	.	H	α-helix	trans	-74.8	-53.1	172.4	-65.8	-178.8	-42.3	0	0	111.2	P763 I783 V785 T803 T804 A921 R922	P763-Q925 VanDerWaalsContact CA-O 3.28Å; P763-Q925 WeakPolarHBondContact CA-O 3.43Å; P763-Q925 WeakPolarHBondContact CB-O 3.35Å; P763-Q925 VanDerWaalsContact CG-O 3.29Å; P763-Q925 WeakPolarHBondContact CG-O 3.5Å; I783-Q925 HydrophobicContact CG1-CG 4.45Å; I783-Q925 PolarHBondContact O-NE2 3.33Å; V785-Q925 HydrophobicContact CG2-CG 3.84Å; T803-Q925 PolarHBondContact OG1-NE2 3.05Å; T804-Q925 PolarHBondContact O-NE2 3.09Å; A921-Q925 PolarHBondContact O-N 2.81Å; R922-Q925 WeakPolarHBondContact O-CA 3.13Å; R922-Q925 WeakPolarHBondContact O-CB 3.5Å; R922-Q925 PolarHBondContact O-N 3.21Å
926	D	94.1	Very high	94.6	Very high	29 Å²	29	9.2 Å²	9.2	16%	0.155	5%	0.048	C	C	.	.			trans	-153.2	115.7	167.9	-163.6	-50.6	0	0	0	111.4	P763 R922 L928 V929 E930 R1140	P763-D926 HydrophobicContact CG-CB 4.2Å; P763-D926 WeakPolarHBondContact CG-OD2 3.38Å; R922-D926 PolarHBondContact O-N 3.36Å; D926-L928 VanDerWaalsContact C-N 3.35Å; D926-L928 PolarHBondContact O-N 3.31Å; D926-L928 WeakPolarHBondContact OD1-CB 3.25Å; D926-L928 PolarHBondContact OD1-N 3.38Å; D926-V929 HydrophobicContact CB-CB 4.26Å; D926-V929 HydrophobicContact CB-CG2 3.96Å; D926-V929 PolarHBondContact O-N 3.11Å; D926-E930 PolarHBondContact O-N 2.89Å; D926-R1140 VanDerWaalsContact CG-NH1 3.32Å; D926-R1140 IonicContact OD1-CZ 2.73Å; D926-R1140 IonicContact OD1-NH1 3.45Å; D926-R1140 PolarHBondContact OD1-NH1 2.97Å; D926-R1140 IonicContact OD1-NH2 2.8Å; D926-R1140 IonicContact OD2-CZ 2.62Å; D926-R1140 IonicContact OD2-NH1 3.43Å; D926-R1140 PolarHBondContact OD2-NH1 3.18Å; D926-R1140 VanDerWaalsContact OD2-NH1 3.11Å; D926-R1140 IonicContact OD2-NH2 3.19Å; D926-R1140 PolarHBondContact OD2-NH2 3.42Å
927	P	95	Very high	93.8	Very high	9 Å²	9	11.5 Å²	11.5	6%	0.058	7%	0.07	C	C	.	.	H	α-helix	trans	-59	-39.1	176.3	-25.4	34.4	0	0	0	114.1	V761 K923 V929 E930 Y931	V761-P927 HydrophobicContact CB-CG 4.1Å; V761-P927 HydrophobicContact CG1-CG 4.12Å; K923-P927 WeakPolarHBondContact O-CG 3.45Å; P927-V929 PolarHBondContact O-N 3.02Å; P927-E930 PolarHBondContact O-N 3.07Å; P927-Y931 HydrophobicContact CB-CD2 4.36Å; P927-Y931 WeakPolarHBondContact O-CB 3.07Å; P927-Y931 VanDerWaalsContact O-CD2 3.23Å; P927-Y931 WeakPolarHBondContact O-CD2 3.39Å; P927-Y931 PolarHBondContact O-N 3.39Å
928	L	95.5	Very high	93.2	Very high	3 Å²	3	14.2 Å²	14.2	2%	0.016	8%	0.084	C	C	.	.	H	α-helix	trans	-64.2	-42.8	-176	174.2	61.5	0	0	0	111.2	L759 D926 S932 F966 R969 V973 L989	L759-L928 HydrophobicContact CB-CD1 4.41Å; L759-L928 HydrophobicContact CD1-CD1 4.19Å; L759-L928 HydrophobicContact CD2-CD1 3.94Å; L759-L928 HydrophobicContact CG-CD1 4.4Å; D926-L928 VanDerWaalsContact C-N 3.35Å; D926-L928 PolarHBondContact O-N 3.31Å; D926-L928 WeakPolarHBondContact OD1-CB 3.25Å; D926-L928 PolarHBondContact OD1-N 3.38Å; L928-S932 PolarHBondContact O-N 2.86Å; L928-S932 PolarHBondContact O-OG 2.86Å; L928-F966 HydrophobicContact CD1-CD1 3.91Å; L928-F966 HydrophobicContact CD1-CE1 4.22Å; L928-R969 HydrophobicContact CD1-CB 4.21Å; L928-R969 HydrophobicContact CD2-CB 4.37Å; L928-V973 HydrophobicContact CD2-CB 4.31Å; L928-V973 HydrophobicContact CD2-CG2 3.92Å; L928-L989 HydrophobicContact CD1-CD2 4.07Å; L928-L989 HydrophobicContact CG-CD1 4.24Å; L928-L989 HydrophobicContact CG-CD2 4.09Å
929	V	94.6	Very high	92.8	Very high	19 Å²	19	15.7 Å²	15.7	12%	0.115	9%	0.092	C	C	.	.	H	α-helix	trans	-67.2	-41.7	176.7	-177.4	0	0	0	0	111	D926 P927 S932 Q933 T986 L989	D926-V929 HydrophobicContact CB-CB 4.26Å; D926-V929 HydrophobicContact CB-CG2 3.96Å; D926-V929 PolarHBondContact O-N 3.11Å; P927-V929 PolarHBondContact O-N 3.02Å; V929-S932 PolarHBondContact O-N 2.72Å; V929-S932 PolarHBondContact O-OG 2.6Å; V929-Q933 PolarHBondContact O-NE2 2.93Å; V929-T986 HydrophobicContact CG1-CG2 4.02Å; V929-T986 HydrophobicContact CG2-CG2 4.32Å; V929-L989 HydrophobicContact CG2-CD1 3.94Å
930	E	95.3	Very high	92.5	Very high	2 Å²	2	16.8 Å²	16.8	1%	0.009	10%	0.097	C	C	.	.	H	α-helix	trans	-72.9	-40	-177.4	-164.2	66.4	-177.1	0	0	112.4	L893 S919 R922 K923 D926 P927 S932 Q933	L893-E930 HydrophobicContact CD2-CB 4.18Å; L893-E930 HydrophobicContact CD2-CG 3.82Å; S919-E930 WeakPolarHBondContact CA-OE1 3.43Å; S919-E930 WeakPolarHBondContact CB-OE1 3.28Å; S919-E930 PolarHBondContact OG-OE1 2.95Å; R922-E930 VanDerWaalsContact CB-CD 3.49Å; R922-E930 HydrophobicContact CB-CG 4.28Å; R922-E930 WeakPolarHBondContact CB-OE2 3.39Å; R922-E930 WeakPolarHBondContact CD-OE2 3.31Å; K923-E930 HydrophobicContact CB-CB 4.37Å; K923-E930 HydrophobicContact CB-CG 4.12Å; D926-E930 PolarHBondContact O-N 2.89Å; P927-E930 PolarHBondContact O-N 3.07Å; E930-S932 VanDerWaalsContact C-N 3.26Å; E930-S932 PolarHBondContact O-N 2.98Å; E930-Q933 WeakPolarHBondContact O-CB 3.22Å; E930-Q933 WeakPolarHBondContact O-CG 3.44Å; E930-Q933 PolarHBondContact O-N 2.78Å; E930-Q933 VanDerWaalsContact O-N 3.13Å
931	Y	95.8	Very high	92.4	Very high	5 Å²	5	17 Å²	17	2%	0.02	10%	0.098	C	C	.	.	H	α-helix	trans	-63.1	-31.9	173.1	-84.6	-75.3	0	0	0	112.1	W758 L759 L893 P927 Q933 L934 L944	W758-Y931 HydrophobicContact CB-CD2 4.29Å; W758-Y931 HydrophobicContact CB-CE2 3.69Å; W758-Y931 HydrophobicContact CD2-CE1 4.1Å; W758-Y931 HydrophobicContact CD2-CE2 4.47Å; W758-Y931 AromaticContact CD2-CZ 3.75Å; W758-Y931 HydrophobicContact CE3-CD1 4.35Å; W758-Y931 AromaticContact CE3-CE1 3.53Å; W758-Y931 HydrophobicContact CE3-CE1 3.53Å; W758-Y931 AromaticContact CE3-CZ 3.69Å; W758-Y931 HydrophobicContact CG-CE2 4.17Å; W758-Y931 AromaticContact CG-CZ 3.89Å; W758-Y931 AromaticContact CZ3-CE1 3.88Å; W758-Y931 HydrophobicContact CZ3-CE1 3.88Å; L759-Y931 HydrophobicContact CD2-CD2 4.13Å; L759-Y931 HydrophobicContact CD2-CG 4.13Å; L893-Y931 HydrophobicContact CB-CE1 4.11Å; L893-Y931 HydrophobicContact CD1-CD1 3.85Å; L893-Y931 HydrophobicContact CD1-CE1 4.12Å; L893-Y931 HydrophobicContact CD1-CG 4.44Å; L893-Y931 HydrophobicContact CD2-CD1 3.84Å; L893-Y931 HydrophobicContact CD2-CD2 3.92Å; L893-Y931 HydrophobicContact CD2-CE1 3.85Å; L893-Y931 HydrophobicContact CD2-CE2 3.9Å; L893-Y931 HydrophobicContact CD2-CG 3.86Å; L893-Y931 HydrophobicContact CG-CD1 4.33Å; L893-Y931 HydrophobicContact CG-CE1 4.25Å; P927-Y931 HydrophobicContact CB-CD2 4.36Å; P927-Y931 WeakPolarHBondContact O-CB 3.07Å; P927-Y931 VanDerWaalsContact O-CD2 3.23Å; P927-Y931 WeakPolarHBondContact O-CD2 3.39Å; P927-Y931 PolarHBondContact O-N 3.39Å; Y931-Q933 PolarHBondContact O-N 3.4Å; Y931-L934 PolarHBondContact O-N 3.05Å; Y931-L944 HydrophobicContact CD1-CD1 3.76Å; Y931-L944 HydrophobicContact CE1-CD1 3.72Å; Y931-L944 HydrophobicContact CE1-CD2 4.32Å
932	S	94.7	Very high	92.2	Very high	0 Å²	0	18.3 Å²	18.3	0%	0	11%	0.105	C	C	.	.	G	3₁₀ helix	trans	-72.2	-7.4	175.7	69.7	0	0	0	0	114.8	L928 V929 E930 L934 C935 N988 L989	L928-S932 PolarHBondContact O-N 2.86Å; L928-S932 PolarHBondContact O-OG 2.86Å; V929-S932 PolarHBondContact O-N 2.72Å; V929-S932 PolarHBondContact O-OG 2.6Å; E930-S932 VanDerWaalsContact C-N 3.26Å; E930-S932 PolarHBondContact O-N 2.98Å; S932-L934 PolarHBondContact O-N 3Å; S932-C935 WeakPolarHBondContact O-CB 3.49Å; S932-C935 PolarHBondContact O-N 3.16Å; S932-N988 VanDerWaalsContact O-CB 3.25Å; S932-N988 WeakPolarHBondContact O-CB 3.46Å; S932-N988 PolarHBondContact O-ND2 2.78Å; S932-L989 VanDerWaalsContact CB-CD2 3.45Å; S932-L989 WeakPolarHBondContact OG-CD2 3.29Å; S932-L989 WeakPolarHBondContact OG-CG 3.24Å
933	Q	93.4	Very high	92.1	Very high	0 Å²	0	22 Å²	22	0%	0	13%	0.131	C	C	.	.	G	3₁₀ helix	trans	-68.8	-18.4	173.9	-57.1	-47	-74.4	0	0	112.7	Y897 K902 V929 E930 Y931 R985	Y897-Q933 HydrophobicContact CD2-CB 3.85Å; Y897-Q933 HydrophobicContact CD2-CG 4.44Å; Y897-Q933 HydrophobicContact CE2-CB 4.03Å; Y897-Q933 HydrophobicContact CE2-CG 4.29Å; K902-Q933 HydrophobicContact CG-CB 4.36Å; V929-Q933 PolarHBondContact O-NE2 2.93Å; E930-Q933 WeakPolarHBondContact O-CB 3.22Å; E930-Q933 WeakPolarHBondContact O-CG 3.44Å; E930-Q933 PolarHBondContact O-N 2.78Å; E930-Q933 VanDerWaalsContact O-N 3.13Å; Y931-Q933 PolarHBondContact O-N 3.4Å; Q933-R985 PolarHBondContact NE2-O 3.38Å
934	L	94	Very high	92	Very high	0 Å²	0	21 Å²	21	0%	0	13%	0.127	C	C	.	.	G	3₁₀ helix	trans	-93.2	2.3	174.1	-55	-172.9	0	0	0	113.4	L893 I896 Y931 S932 D936 E940 I941 L944	L893-L934 HydrophobicContact CD1-CD1 3.58Å; L893-L934 HydrophobicContact CD1-CG 3.92Å; I896-L934 HydrophobicContact CB-CD1 4.08Å; I896-L934 HydrophobicContact CB-CD2 4.44Å; I896-L934 HydrophobicContact CD1-CD1 4.45Å; I896-L934 HydrophobicContact CG2-CD1 3.72Å; I896-L934 HydrophobicContact CG2-CD2 3.81Å; I896-L934 HydrophobicContact CG2-CG 4.42Å; Y931-L934 PolarHBondContact O-N 3.05Å; S932-L934 PolarHBondContact O-N 3Å; L934-D936 VanDerWaalsContact C-N 3.32Å; L934-D936 PolarHBondContact O-N 3.39Å; L934-E940 HydrophobicContact CB-CB 4.12Å; L934-E940 HydrophobicContact CD2-CB 4.28Å; L934-I941 HydrophobicContact CB-CB 4.15Å; L934-I941 HydrophobicContact CB-CD1 4.17Å; L934-I941 WeakPolarHBondContact O-CB 3.41Å; L934-I941 PolarHBondContact O-N 3.41Å; L934-L944 HydrophobicContact CD1-CD1 3.99Å; L934-L944 HydrophobicContact CD1-CG 4.23Å
935	C	90.7	Very high	91.8	Very high	8 Å²	8	25.3 Å²	25.3	5%	0.054	14%	0.143	C	C	.	.			trans	-92.3	63.8	179.5	-65	0	0	0	0	110.5	S932 F966 Q991 Y992	S932-C935 WeakPolarHBondContact O-CB 3.49Å; S932-C935 PolarHBondContact O-N 3.16Å; C935-F966 VanDerWaalsContact SG-CZ 3.57Å; C935-Q991 PolarHBondContact O-NE2 2.91Å; C935-Y992 HydrophobicContact CB-CE2 4.02Å; C935-Y992 WeakPolarHBondContact CB-OH 3.34Å; C935-Y992 PolarHBondContact SG-OH 3.24Å
936	D	81.9	Confident	91.7	Very high	39 Å²	39	24.7 Å²	24.7	21%	0.209	14%	0.14	C	C	.	.	S	Bend	trans	-107.5	-173.4	179	75.9	-7.2	0	0	0	112.4	L934 D938 D939	L934-D936 VanDerWaalsContact C-N 3.32Å; L934-D936 PolarHBondContact O-N 3.39Å; D936-D938 PolarHBondContact O-N 3.31Å; D936-D938 PolarHBondContact OD1-N 3.24Å; D936-D939 PolarHBondContact O-N 3.21Å; D936-D939 PolarHBondContact OD1-N 3.3Å
937	A	80.7	Confident	91.5	Very high	67 Å²	67	24.7 Å²	24.7	55%	0.554	14%	0.139	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.5	7.2	-178.3	0	0	0	0	0	114.3
938	D	83.6	Confident	91.3	Very high	56 Å²	56	28.5 Å²	28.5	30%	0.299	16%	0.163	S	C	.	.	T	Hydrogen-bonded Turn	trans	-116.8	1.5	176.4	-63	-78.8	0	0	0	111.9	R274 K901 D936 E940	R274-D938 IonicContact CZ-OD1 2.66Å; R274-D938 IonicContact NE-OD1 2.66Å; R274-D938 VanDerWaalsContact NH2-CG 3.3Å; R274-D938 IonicContact NH2-OD1 2.79Å; R274-D938 PolarHBondContact NH2-OD1 3.35Å; R274-D938 IonicContact NH2-OD2 3.71Å; R274-D938 PolarHBondContact NH2-OD2 3.26Å; K901-D938 WeakPolarHBondContact CD-OD2 3.46Å; K901-D938 WeakPolarHBondContact CE-OD2 3.48Å; K901-D938 IonicContact NZ-OD1 2.58Å; K901-D938 PolarHBondContact NZ-OD1 2.94Å; K901-D938 IonicContact NZ-OD2 2.67Å; K901-D938 PolarHBondContact NZ-OD2 2.87Å; D936-D938 PolarHBondContact O-N 3.31Å; D936-D938 PolarHBondContact OD1-N 3.24Å; D938-E940 PolarHBondContact O-N 3.34Å
939	D	87.4	Confident	91.1	Very high	33 Å²	33	29.1 Å²	29.1	18%	0.176	17%	0.167	C	C	.	.			trans	55.6	39.8	177.3	-51.4	-63.1	0	0	0	114.9	D936 I941 L942 R955 L959	D936-D939 PolarHBondContact O-N 3.21Å; D936-D939 PolarHBondContact OD1-N 3.3Å; D939-I941 PolarHBondContact O-N 2.84Å; D939-L942 HydrophobicContact CB-CD1 3.75Å; D939-L942 HydrophobicContact CB-CG 4.08Å; D939-L942 WeakPolarHBondContact O-CB 3.09Å; D939-L942 WeakPolarHBondContact O-CG 3.34Å; D939-L942 PolarHBondContact O-N 3.49Å; D939-R955 IonicContact OD2-CZ 3.5Å; D939-R955 IonicContact OD2-NH1 2.7Å; D939-R955 PolarHBondContact OD2-NH1 3.48Å; D939-R955 IonicContact OD2-NH2 2.76Å; D939-R955 PolarHBondContact OD2-NH2 3.41Å; D939-L959 HydrophobicContact CB-CD1 4.29Å; D939-L959 WeakPolarHBondContact OD1-CD1 3.37Å; D939-L959 WeakPolarHBondContact OD1-CD2 3.37Å
940	E	91.6	Very high	91.1	Very high	23 Å²	23	29 Å²	29	11%	0.107	17%	0.165	C	C	.	.	G	3₁₀ helix	trans	-53.7	-23.3	178.3	-62.1	178.9	153.3	0	0	113.5	S900 K901 L934 D938 L942 C943	S900-E940 WeakPolarHBondContact CA-OE1 3.36Å; S900-E940 WeakPolarHBondContact CB-OE1 3.48Å; S900-E940 WeakPolarHBondContact CB-OE2 3.48Å; K901-E940 PolarHBondContact N-OE1 3.26Å; L934-E940 HydrophobicContact CB-CB 4.12Å; L934-E940 HydrophobicContact CD2-CB 4.28Å; D938-E940 PolarHBondContact O-N 3.34Å; E940-L942 PolarHBondContact O-N 2.81Å; E940-L942 VanDerWaalsContact O-N 3.12Å; E940-C943 VanDerWaalsContact O-CB 3.27Å; E940-C943 WeakPolarHBondContact O-CB 3.22Å; E940-C943 PolarHBondContact O-N 3.49Å
941	I	93.8	Very high	90.9	Very high	3 Å²	3	35.6 Å²	35.6	2%	0.015	20%	0.196	C	C	.	.	G	3₁₀ helix	trans	-54.3	-24.2	172.6	-166.6	65.9	0	0	0	113.5	L934 D939 L944 Y946 L959 F966	L934-I941 HydrophobicContact CB-CB 4.15Å; L934-I941 HydrophobicContact CB-CD1 4.17Å; L934-I941 WeakPolarHBondContact O-CB 3.41Å; L934-I941 PolarHBondContact O-N 3.41Å; D939-I941 PolarHBondContact O-N 2.84Å; I941-L944 HydrophobicContact CD1-CD1 4Å; I941-Y946 VanDerWaalsContact O-CE2 3.32Å; I941-Y946 WeakPolarHBondContact O-CE2 3.48Å; I941-Y946 PolarHBondContact O-OH 3.37Å; I941-L959 HydrophobicContact CG2-CD1 4.02Å; I941-F966 HydrophobicContact CD1-CE2 3.93Å; I941-F966 HydrophobicContact CD1-CZ 3.88Å; I941-F966 HydrophobicContact CG1-CE2 4.12Å
942	L	93.3	Very high	90.8	Very high	29 Å²	29	39.3 Å²	39.3	15%	0.152	21%	0.21	C	C	.	.	G	3₁₀ helix	trans	-77.4	-18.1	177.6	-60.9	177.3	0	0	0	113.3	D939 E940 L944 Q950 R955 L958 L962	D939-L942 HydrophobicContact CB-CD1 3.75Å; D939-L942 HydrophobicContact CB-CG 4.08Å; D939-L942 WeakPolarHBondContact O-CB 3.09Å; D939-L942 WeakPolarHBondContact O-CG 3.34Å; D939-L942 PolarHBondContact O-N 3.49Å; E940-L942 PolarHBondContact O-N 2.81Å; E940-L942 VanDerWaalsContact O-N 3.12Å; L942-L944 PolarHBondContact O-N 2.94Å; L942-Q950 PolarHBondContact O-NE2 3.18Å; L942-Q950 VanDerWaalsContact O-NE2 3.08Å; L942-R955 HydrophobicContact CD1-CG 3.77Å; L942-L958 HydrophobicContact CD2-CD2 4.03Å; L942-L958 HydrophobicContact CD2-CG 4.04Å; L942-L962 HydrophobicContact CD2-CD1 3.96Å
943	C	93.3	Very high	90.7	Very high	88 Å²	88	39.8 Å²	39.8	60%	0.595	21%	0.213	S	C	*	.	G	3₁₀ helix	trans	-72.7	-13	177.2	-63.6	0	0	0	0	113.4	I896 E940	I896-C943 HydrophobicContact CD1-CB 4.04Å; I896-C943 HydrophobicContact CG1-CB 4.41Å; I896-C943 HydrophobicContact CG2-CB 4.14Å; E940-C943 VanDerWaalsContact O-CB 3.27Å; E940-C943 WeakPolarHBondContact O-CB 3.22Å; E940-C943 PolarHBondContact O-N 3.49Å
944	L	93.3	Very high	90.7	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	22%	0.224	C	C	.	.	S	Bend	trans	-71.8	135.1	171	-76.8	163.6	0	0	0	110.7	W758 E892 L893 I896 Y931 L934 I941 L942 Y946 Q950	W758-L944 HydrophobicContact CH2-CD2 4.31Å; W758-L944 HydrophobicContact CZ3-CB 4.32Å; W758-L944 HydrophobicContact CZ3-CD1 4.16Å; W758-L944 HydrophobicContact CZ3-CD2 4.3Å; E892-L944 HydrophobicContact CB-CD2 4.49Å; E892-L944 HydrophobicContact CG-CD2 3.99Å; L893-L944 HydrophobicContact CB-CD2 4.47Å; I896-L944 HydrophobicContact CD1-CB 4.39Å; I896-L944 HydrophobicContact CD1-CD2 3.66Å; I896-L944 HydrophobicContact CD1-CG 3.69Å; Y931-L944 HydrophobicContact CD1-CD1 3.76Å; Y931-L944 HydrophobicContact CE1-CD1 3.72Å; Y931-L944 HydrophobicContact CE1-CD2 4.32Å; L934-L944 HydrophobicContact CD1-CD1 3.99Å; L934-L944 HydrophobicContact CD1-CG 4.23Å; I941-L944 HydrophobicContact CD1-CD1 4Å; L942-L944 PolarHBondContact O-N 2.94Å; L944-Y946 HydrophobicContact CB-CD2 4.44Å; L944-Y946 HydrophobicContact CB-CE1 4.32Å; L944-Y946 HydrophobicContact CB-CE2 3.76Å; L944-Y946 WeakPolarHBondContact CD1-OH 3.18Å; L944-Y946 WeakPolarHBondContact O-CD2 3.42Å; L944-Y946 WeakPolarHBondContact O-CE2 3.24Å; L944-Y946 PolarHBondContact O-N 2.93Å; L944-Q950 PolarHBondContact O-NE2 3.48Å; L944-Q950 PolarHBondContact O-OE1 2.86Å
945	R	91.3	Very high	90.7	Very high	97 Å²	97	47.7 Å²	47.7	37%	0.366	25%	0.247	S	C	.	.			trans	-84.1	79.5	-177	-169.1	45.3	153.8	-166.5	-15	111.6	K754 E892 H947 P948 E951	K754-R945 PolarHBondContact NZ-O 3.43Å; E892-R945 WeakPolarHBondContact OE1-CB 3.31Å; E892-R945 PolarHBondContact OE1-N 3.21Å; R945-H947 PolarHBondContact NH1-O 3Å; R945-P948 PolarHBondContact NH2-O 2.68Å; R945-E951 IonicContact CZ-OE1 3.52Å; R945-E951 IonicContact NH1-OE1 3.12Å; R945-E951 PolarHBondContact NH1-OE1 3.36Å; R945-E951 IonicContact NH2-OE1 2.63Å; R945-E951 PolarHBondContact NH2-OE1 2.79Å
946	Y	92.1	Very high	90.7	Very high	9 Å²	9	55.1 Å²	55.1	4%	0.035	28%	0.281	C	S	.	.			trans	-64.9	-52.5	175.2	-56.7	-78.9	0	0	0	112.7	C751 K754 L755 W758 I941 L944 L962	C751-Y946 HydrophobicContact CB-CG 4.32Å; K754-Y946 WeakPolarHBondContact CD-O 3.42Å; L755-Y946 HydrophobicContact CB-CD1 4.35Å; L755-Y946 HydrophobicContact CB-CE1 3.94Å; L755-Y946 HydrophobicContact CD1-CE1 4.23Å; W758-Y946 HydrophobicContact CE3-CE1 4.11Å; W758-Y946 HydrophobicContact CH2-CE1 4.48Å; W758-Y946 AromaticContact CZ3-CD1 3.92Å; W758-Y946 HydrophobicContact CZ3-CD1 3.92Å; W758-Y946 AromaticContact CZ3-CE1 3.54Å; W758-Y946 HydrophobicContact CZ3-CE1 3.54Å; I941-Y946 VanDerWaalsContact O-CE2 3.32Å; I941-Y946 WeakPolarHBondContact O-CE2 3.48Å; I941-Y946 PolarHBondContact O-OH 3.37Å; L944-Y946 HydrophobicContact CB-CD2 4.44Å; L944-Y946 HydrophobicContact CB-CE1 4.32Å; L944-Y946 HydrophobicContact CB-CE2 3.76Å; L944-Y946 WeakPolarHBondContact CD1-OH 3.18Å; L944-Y946 WeakPolarHBondContact O-CD2 3.42Å; L944-Y946 WeakPolarHBondContact O-CE2 3.24Å; L944-Y946 PolarHBondContact O-N 2.93Å; Y946-L962 HydrophobicContact CD1-CD2 4.23Å; Y946-L962 HydrophobicContact CD2-CD1 4.29Å; Y946-L962 HydrophobicContact CE1-CD2 3.98Å; Y946-L962 HydrophobicContact CE2-CD1 3.72Å; Y946-L962 HydrophobicContact CE2-CD2 4.32Å
947	H	90.7	Very high	91.2	Very high	28 Å²	28	55.6 Å²	55.6	13%	0.13	28%	0.282	C	S	.	.			trans	-142.6	145	-175.8	-170.9	-105.7	0	0	0	110.9	D656 V747 C751 R945 L949 Q950	D656-H947 IonicContact OD2-CE1 3.78Å; D656-H947 IonicContact OD2-NE2 3.52Å; V747-H947 HydrophobicContact CG1-CB 4.28Å; C751-H947 VanDerWaalsContact SG-CB 3.54Å; R945-H947 PolarHBondContact NH1-O 3Å; H947-L949 PolarHBondContact ND1-N 2.84Å; H947-L949 PolarHBondContact O-N 2.77Å; H947-Q950 HydrophobicContact CB-CB 4.39Å; H947-Q950 VanDerWaalsContact N-OE1 3.08Å; H947-Q950 PolarHBondContact O-N 3.46Å; H947-Q950 VanDerWaalsContact O-N 3.08Å; H947-Q950 PolarHBondContact O-OE1 2.9Å
948	P	89.8	Confident	91.9	Very high	89 Å²	89	52.8 Å²	52.8	58%	0.578	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.3	-18.5	178.8	-27.9	36.9	0	0	0	115.7	R945	R945-P948 PolarHBondContact NH2-O 2.68Å
949	L	92.6	Very high	92.3	Very high	17 Å²	17	51.8 Å²	51.8	9%	0.089	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	-117	20.3	178.9	-53.8	-178.5	0	0	0	113.6	D656 I659 K660 M663 V747 H947 E951 R952	D656-L949 HydrophobicContact CB-CD1 4Å; I659-L949 HydrophobicContact CB-CD1 4.35Å; I659-L949 HydrophobicContact CG2-CD1 3.95Å; K660-L949 HydrophobicContact CG-CD1 3.97Å; M663-L949 HydrophobicContact CE-CD2 4.23Å; M663-L949 HydrophobicContact SD-CD2 3.68Å; V747-L949 HydrophobicContact CG2-CB 4.38Å; H947-L949 PolarHBondContact ND1-N 2.84Å; H947-L949 PolarHBondContact O-N 2.77Å; L949-E951 PolarHBondContact O-N 2.9Å; L949-R952 PolarHBondContact O-N 3.48Å
950	Q	93	Very high	92.6	Very high	15 Å²	15	54.3 Å²	54.3	7%	0.07	26%	0.263	C	S	.	.	G	3₁₀ helix	trans	-61.6	-25.9	-178	82.4	-162.1	51.7	0	0	113.1	L942 L944 H947 R952 V953 L958	L942-Q950 PolarHBondContact O-NE2 3.18Å; L942-Q950 VanDerWaalsContact O-NE2 3.08Å; L944-Q950 PolarHBondContact O-NE2 3.48Å; L944-Q950 PolarHBondContact O-OE1 2.86Å; H947-Q950 HydrophobicContact CB-CB 4.39Å; H947-Q950 VanDerWaalsContact N-OE1 3.08Å; H947-Q950 PolarHBondContact O-N 3.46Å; H947-Q950 VanDerWaalsContact O-N 3.08Å; H947-Q950 PolarHBondContact O-OE1 2.9Å; Q950-R952 PolarHBondContact O-N 2.96Å; Q950-V953 PolarHBondContact O-N 2.91Å; Q950-L958 HydrophobicContact CB-CD2 4.13Å; Q950-L958 HydrophobicContact CG-CD2 4.36Å
951	E	91.9	Very high	92.6	Very high	141 Å²	141	55.5 Å²	55.5	66%	0.659	27%	0.268	S	S	*	.	G	3₁₀ helix	trans	-71.5	-10.4	174.6	-65.8	145.2	-109.5	0	0	113.6	R945 L949 V953	R945-E951 IonicContact CZ-OE1 3.52Å; R945-E951 IonicContact NH1-OE1 3.12Å; R945-E951 PolarHBondContact NH1-OE1 3.36Å; R945-E951 IonicContact NH2-OE1 2.63Å; R945-E951 PolarHBondContact NH2-OE1 2.79Å; L949-E951 PolarHBondContact O-N 2.9Å; E951-V953 VanDerWaalsContact C-N 3.34Å
952	R	92.6	Very high	92.7	Very high	83 Å²	83	55.4 Å²	55.4	31%	0.313	27%	0.268	S	S	.	.	G	3₁₀ helix	trans	-98.8	22	176.6	-58.3	-48.5	-159.5	112.9	-4	112.6	I659 M663 E666 Q744 L949 Q950	I659-R952 HydrophobicContact CG2-CB 3.81Å; I659-R952 HydrophobicContact CG2-CG 4.08Å; M663-R952 HydrophobicContact SD-CG 4.06Å; E666-R952 VanDerWaalsContact CD-NH1 3.34Å; E666-R952 IonicContact OE1-NH1 3.89Å; E666-R952 PolarHBondContact OE1-NH1 2.93Å; E666-R952 IonicContact OE2-CZ 2.68Å; E666-R952 VanDerWaalsContact OE2-CZ 3.24Å; E666-R952 IonicContact OE2-NH1 2.77Å; E666-R952 PolarHBondContact OE2-NH1 3.34Å; E666-R952 IonicContact OE2-NH2 2.66Å; E666-R952 PolarHBondContact OE2-NH2 2.98Å; Q744-R952 PolarHBondContact NE2-O 2.72Å; L949-R952 PolarHBondContact O-N 3.48Å; Q950-R952 PolarHBondContact O-N 2.96Å
953	V	93.3	Very high	92.7	Very high	11 Å²	11	55.2 Å²	55.2	7%	0.067	27%	0.269	C	S	.	.	S	Bend	trans	-126.9	141.4	176.4	175.8	0	0	0	0	107.8	Q744 V747 L748 Q950 E951 R955 L958	Q744-V953 HydrophobicContact CB-CG2 4.28Å; Q744-V953 HydrophobicContact CG-CG2 4.28Å; V747-V953 HydrophobicContact CB-CG2 3.83Å; V747-V953 HydrophobicContact CG1-CG2 3.61Å; L748-V953 HydrophobicContact CD1-CG1 4.05Å; L748-V953 HydrophobicContact CD2-CG1 3.6Å; L748-V953 HydrophobicContact CG-CG1 3.68Å; Q950-V953 PolarHBondContact O-N 2.91Å; E951-V953 VanDerWaalsContact C-N 3.34Å; V953-R955 PolarHBondContact O-N 3.05Å; V953-L958 HydrophobicContact CG1-CB 4.43Å
954	P	94.2	Very high	92.7	Very high	35 Å²	35	51.8 Å²	51.8	23%	0.227	25%	0.245	C	C	.	.			trans	-56.1	133.5	179.3	-25.8	35.7	0	0	0	112.2	E956 Q957 L958	P954-E956 VanDerWaalsContact C-N 3.31Å; P954-E956 PolarHBondContact O-N 3.19Å; P954-Q957 HydrophobicContact CB-CB 4.23Å; P954-Q957 PolarHBondContact O-N 3Å; P954-L958 PolarHBondContact O-N 3.23Å
955	R	93.8	Very high	92.7	Very high	131 Å²	131	52.6 Å²	52.6	49%	0.494	25%	0.248	S	C	.	.	H	α-helix	trans	-54.3	-46	-173.4	-173.9	-173.7	-178.3	-78.1	4.3	112.2	D939 L942 V953 L958 L959	D939-R955 IonicContact OD2-CZ 3.5Å; D939-R955 IonicContact OD2-NH1 2.7Å; D939-R955 PolarHBondContact OD2-NH1 3.48Å; D939-R955 IonicContact OD2-NH2 2.76Å; D939-R955 PolarHBondContact OD2-NH2 3.41Å; L942-R955 HydrophobicContact CD1-CG 3.77Å; V953-R955 PolarHBondContact O-N 3.05Å; R955-L958 PolarHBondContact O-N 3.2Å; R955-L959 WeakPolarHBondContact O-CB 3.48Å; R955-L959 PolarHBondContact O-N 3.34Å
956	E	91	Very high	93	Very high	163 Å²	163	48 Å²	48	76%	0.762	23%	0.231	S	C	*	.	H	α-helix	trans	-65.7	-43.4	-178.7	-56.3	-173.2	147.5	0	0	111.8	P954 L958 L959 E960	P954-E956 VanDerWaalsContact C-N 3.31Å; P954-E956 PolarHBondContact O-N 3.19Å; E956-L958 VanDerWaalsContact C-N 3.34Å; E956-L958 PolarHBondContact O-N 2.83Å; E956-L959 PolarHBondContact O-N 2.99Å; E956-E960 WeakPolarHBondContact O-CB 3.48Å; E956-E960 PolarHBondContact O-N 3.26Å
957	Q	91.9	Very high	93.1	Very high	49 Å²	49	47.8 Å²	47.8	23%	0.229	23%	0.23	C	C	.	.	H	α-helix	trans	-66.4	-36.3	178.2	-169	175.2	50.6	0	0	111.9	L748 P954 Q961	L748-Q957 HydrophobicContact CD1-CG 3.76Å; L748-Q957 HydrophobicContact CD2-CG 4.4Å; P954-Q957 HydrophobicContact CB-CB 4.23Å; P954-Q957 PolarHBondContact O-N 3Å; Q957-Q961 WeakPolarHBondContact O-CB 3.44Å; Q957-Q961 WeakPolarHBondContact O-CG 3.44Å; Q957-Q961 PolarHBondContact O-N 3.06Å
958	L	94.5	Very high	93.3	Very high	8 Å²	8	46.5 Å²	46.5	4%	0.042	22%	0.224	C	C	.	.	H	α-helix	trans	-65.6	-45.2	172.2	-179.6	59	0	0	0	111.3	L748 C751 L942 Q950 V953 P954 R955 E956 Q961 L962	L748-L958 HydrophobicContact CD2-CB 4.3Å; L748-L958 HydrophobicContact CD2-CD1 4.1Å; C751-L958 HydrophobicContact CB-CD1 3.88Å; L942-L958 HydrophobicContact CD2-CD2 4.03Å; L942-L958 HydrophobicContact CD2-CG 4.04Å; Q950-L958 HydrophobicContact CB-CD2 4.13Å; Q950-L958 HydrophobicContact CG-CD2 4.36Å; V953-L958 HydrophobicContact CG1-CB 4.43Å; P954-L958 PolarHBondContact O-N 3.23Å; R955-L958 PolarHBondContact O-N 3.2Å; E956-L958 VanDerWaalsContact C-N 3.34Å; E956-L958 PolarHBondContact O-N 2.83Å; L958-Q961 PolarHBondContact O-N 2.93Å; L958-L962 HydrophobicContact CD1-CD1 4.02Å; L958-L962 HydrophobicContact CD1-CG 4.1Å; L958-L962 HydrophobicContact CG-CD1 3.98Å; L958-L962 HydrophobicContact CG-CG 4.47Å; L958-L962 WeakPolarHBondContact O-CB 3.44Å; L958-L962 VanDerWaalsContact O-CG 3.24Å; L958-L962 WeakPolarHBondContact O-CG 3.35Å; L958-L962 PolarHBondContact O-N 3.42Å
959	L	93.7	Very high	93.5	Very high	36 Å²	36	43.3 Å²	43.3	19%	0.188	20%	0.201	C	C	.	.	H	α-helix	trans	-63.2	-43.1	179.2	-177.5	66.4	0	0	0	112.7	D939 I941 R955 E956 S963	D939-L959 HydrophobicContact CB-CD1 4.29Å; D939-L959 WeakPolarHBondContact OD1-CD1 3.37Å; D939-L959 WeakPolarHBondContact OD1-CD2 3.37Å; I941-L959 HydrophobicContact CG2-CD1 4.02Å; R955-L959 WeakPolarHBondContact O-CB 3.48Å; R955-L959 PolarHBondContact O-N 3.34Å; E956-L959 PolarHBondContact O-N 2.99Å; L959-S963 VanDerWaalsContact O-CB 3.3Å; L959-S963 WeakPolarHBondContact O-CB 3.38Å; L959-S963 PolarHBondContact O-N 3.32Å; L959-S963 PolarHBondContact O-OG 2.86Å
960	E	91.7	Very high	93.6	Very high	85 Å²	85	42.5 Å²	42.5	40%	0.397	20%	0.197	S	C	.	.	H	α-helix	trans	-56.8	-54.7	173.9	-174.6	-151.1	-148.5	0	0	110.2	E956 L962 S963 L964	E956-E960 WeakPolarHBondContact O-CB 3.48Å; E956-E960 PolarHBondContact O-N 3.26Å; E960-L962 VanDerWaalsContact C-N 3.34Å; E960-L962 PolarHBondContact O-N 2.95Å; E960-S963 CarbonylContact O-C 3.5Å; E960-S963 WeakPolarHBondContact O-CA 3.42Å; E960-S963 WeakPolarHBondContact O-CB 3.47Å; E960-S963 PolarHBondContact O-N 3.33Å; E960-L964 WeakPolarHBondContact O-CG 3.38Å; E960-L964 PolarHBondContact O-N 3.43Å
961	Q	92.3	Very high	93.6	Very high	48 Å²	48	41.8 Å²	41.8	22%	0.224	19%	0.193	C	C	.	.	H	α-helix	trans	-66.8	-33	-174.3	-67.3	-63.8	-49.2	0	0	112.8	L748 T752 Q957 L958	L748-Q961 HydrophobicContact CD2-CB 4.17Å; L748-Q961 HydrophobicContact CD2-CG 4.13Å; T752-Q961 HydrophobicContact CG2-CB 3.74Å; T752-Q961 WeakPolarHBondContact CG2-O 3.47Å; Q957-Q961 WeakPolarHBondContact O-CB 3.44Å; Q957-Q961 WeakPolarHBondContact O-CG 3.44Å; Q957-Q961 PolarHBondContact O-N 3.06Å; L958-Q961 PolarHBondContact O-N 2.93Å
962	L	95.2	Very high	93.7	Very high	2 Å²	2	37 Å²	37	1%	0.01	17%	0.171	C	C	.	.	H	α-helix	trans	-67.9	-41.1	169.3	-66.1	172.4	0	0	0	111.3	L755 L942 Y946 L958 E960 L964 Q965 F966	L755-L962 HydrophobicContact CB-CD2 3.96Å; L755-L962 HydrophobicContact CD2-CB 3.88Å; L755-L962 HydrophobicContact CD2-CD2 3.6Å; L755-L962 HydrophobicContact CD2-CG 4.31Å; L755-L962 HydrophobicContact CG-CD2 4.39Å; L942-L962 HydrophobicContact CD2-CD1 3.96Å; Y946-L962 HydrophobicContact CD1-CD2 4.23Å; Y946-L962 HydrophobicContact CD2-CD1 4.29Å; Y946-L962 HydrophobicContact CE1-CD2 3.98Å; Y946-L962 HydrophobicContact CE2-CD1 3.72Å; Y946-L962 HydrophobicContact CE2-CD2 4.32Å; L958-L962 HydrophobicContact CD1-CD1 4.02Å; L958-L962 HydrophobicContact CD1-CG 4.1Å; L958-L962 HydrophobicContact CG-CD1 3.98Å; L958-L962 HydrophobicContact CG-CG 4.47Å; L958-L962 WeakPolarHBondContact O-CB 3.44Å; L958-L962 VanDerWaalsContact O-CG 3.24Å; L958-L962 WeakPolarHBondContact O-CG 3.35Å; L958-L962 PolarHBondContact O-N 3.42Å; E960-L962 VanDerWaalsContact C-N 3.34Å; E960-L962 PolarHBondContact O-N 2.95Å; L962-L964 VanDerWaalsContact C-N 3.34Å; L962-L964 PolarHBondContact O-N 2.82Å; L962-Q965 WeakPolarHBondContact O-CB 3.33Å; L962-Q965 PolarHBondContact O-N 3.13Å; L962-Q965 VanDerWaalsContact O-N 3.07Å; L962-F966 PolarHBondContact O-N 3.28Å
963	S	93.7	Very high	93.7	Very high	24 Å²	24	34.2 Å²	34.2	17%	0.168	16%	0.163	C	C	.	.	H	α-helix	trans	-62.4	-36.8	176.6	-62.6	0	0	0	0	112.6	L959 E960 Q965 F966 I967	L959-S963 VanDerWaalsContact O-CB 3.3Å; L959-S963 WeakPolarHBondContact O-CB 3.38Å; L959-S963 PolarHBondContact O-N 3.32Å; L959-S963 PolarHBondContact O-OG 2.86Å; E960-S963 CarbonylContact O-C 3.5Å; E960-S963 WeakPolarHBondContact O-CA 3.42Å; E960-S963 WeakPolarHBondContact O-CB 3.47Å; E960-S963 PolarHBondContact O-N 3.33Å; S963-Q965 PolarHBondContact O-N 3.35Å; S963-F966 PolarHBondContact O-N 2.97Å; S963-F966 VanDerWaalsContact O-N 3.13Å; S963-I967 WeakPolarHBondContact O-CD1 3.34Å; S963-I967 VanDerWaalsContact O-CG1 3.29Å; S963-I967 WeakPolarHBondContact O-CG1 3.17Å; S963-I967 PolarHBondContact O-N 3.46Å
964	L	93.7	Very high	93.6	Very high	17 Å²	17	34.2 Å²	34.2	9%	0.089	17%	0.166	C	C	.	.	H	α-helix	trans	-57	-35.9	172.4	-62.9	-171.3	0	0	0	112.2	W384 E960 L962 I967 N968	W384-L964 HydrophobicContact CD2-CD1 4.13Å; W384-L964 HydrophobicContact CD2-CD2 3.99Å; W384-L964 HydrophobicContact CE3-CD1 4.26Å; W384-L964 HydrophobicContact CE3-CD2 3.81Å; W384-L964 HydrophobicContact CG-CD1 4.27Å; W384-L964 HydrophobicContact CH2-CD2 3.73Å; W384-L964 HydrophobicContact CZ2-CD2 3.89Å; W384-L964 HydrophobicContact CZ3-CD2 3.69Å; E960-L964 WeakPolarHBondContact O-CG 3.38Å; E960-L964 PolarHBondContact O-N 3.43Å; L962-L964 VanDerWaalsContact C-N 3.34Å; L962-L964 PolarHBondContact O-N 2.82Å; L964-I967 HydrophobicContact CD2-CD1 4.28Å; L964-I967 PolarHBondContact O-N 3.33Å; L964-N968 WeakPolarHBondContact O-CB 3.18Å; L964-N968 PolarHBondContact O-N 3.34Å; L964-N968 PolarHBondContact O-ND2 3.03Å; L964-N968 VanDerWaalsContact O-ND2 3.14Å
965	Q	94.2	Very high	93.5	Very high	17 Å²	17	33.3 Å²	33.3	8%	0.079	16%	0.158	C	C	.	.	H	α-helix	trans	-71.8	-37.9	176.6	-63.2	-56.6	-34.3	0	0	112.5	T752 L755 L962 S963 N968 R969	T752-Q965 HydrophobicContact CG2-CG 4.22Å; L755-Q965 HydrophobicContact CD2-CB 4.04Å; L755-Q965 HydrophobicContact CG-CB 4.41Å; L962-Q965 WeakPolarHBondContact O-CB 3.33Å; L962-Q965 PolarHBondContact O-N 3.13Å; L962-Q965 VanDerWaalsContact O-N 3.07Å; S963-Q965 PolarHBondContact O-N 3.35Å; Q965-N968 PolarHBondContact O-N 3.17Å; Q965-R969 WeakPolarHBondContact O-CG 3.34Å; Q965-R969 PolarHBondContact O-N 3.49Å
966	F	95.9	Very high	93.4	Very high	1 Å²	1	28.1 Å²	28.1	0%	0.004	14%	0.141	C	C	.	.	H	α-helix	trans	-62.3	-44.2	170.2	-80.5	-78.7	0	0	0	111.9	L755 L759 L928 C935 I941 L962 S963 N968 R969 T970 L989 Y992	L755-F966 HydrophobicContact CD1-CE2 4.29Å; L755-F966 HydrophobicContact CD1-CZ 4.38Å; L755-F966 HydrophobicContact CD2-CD2 4.04Å; L755-F966 HydrophobicContact CD2-CE2 3.79Å; L759-F966 HydrophobicContact CD1-CD1 3.84Å; L759-F966 HydrophobicContact CD1-CD2 4.32Å; L759-F966 HydrophobicContact CD1-CE1 3.94Å; L759-F966 HydrophobicContact CD1-CE2 4.4Å; L759-F966 HydrophobicContact CD1-CG 4.04Å; L759-F966 HydrophobicContact CD1-CZ 4.23Å; L759-F966 HydrophobicContact CD2-CD1 4.46Å; L759-F966 HydrophobicContact CD2-CE1 3.85Å; L759-F966 HydrophobicContact CD2-CZ 4.19Å; L928-F966 HydrophobicContact CD1-CD1 3.91Å; L928-F966 HydrophobicContact CD1-CE1 4.22Å; C935-F966 VanDerWaalsContact SG-CZ 3.57Å; I941-F966 HydrophobicContact CD1-CE2 3.93Å; I941-F966 HydrophobicContact CD1-CZ 3.88Å; I941-F966 HydrophobicContact CG1-CE2 4.12Å; L962-F966 PolarHBondContact O-N 3.28Å; S963-F966 PolarHBondContact O-N 2.97Å; S963-F966 VanDerWaalsContact O-N 3.13Å; F966-N968 PolarHBondContact O-N 3.29Å; F966-R969 PolarHBondContact O-N 2.83Å; F966-T970 WeakPolarHBondContact O-CB 3.3Å; F966-T970 PolarHBondContact O-N 2.85Å; F966-T970 PolarHBondContact O-OG1 3.08Å; F966-L989 HydrophobicContact CD1-CD2 4.41Å; F966-Y992 HydrophobicContact CB-CD1 3.92Å; F966-Y992 HydrophobicContact CB-CD2 3.64Å; F966-Y992 HydrophobicContact CB-CE1 4.09Å; F966-Y992 HydrophobicContact CB-CE2 3.82Å; F966-Y992 HydrophobicContact CB-CG 3.68Å; F966-Y992 HydrophobicContact CD1-CD2 4.27Å; F966-Y992 HydrophobicContact CD1-CE2 4.16Å; F966-Y992 HydrophobicContact CD2-CE2 4.45Å; F966-Y992 HydrophobicContact CG-CD2 4.12Å; F966-Y992 AromaticContact CG-CE2 3.91Å; F966-Y992 HydrophobicContact CG-CE2 3.91Å
967	I	95.7	Very high	93.3	Very high	3 Å²	3	20.7 Å²	20.7	2%	0.015	11%	0.106	C	C	.	.	H	α-helix	trans	-59.6	-48	177.1	-66.9	157.5	0	0	0	110.9	R292 P364 W384 S963 L964 R969 S971 Y992	R292-I967 VanDerWaalsContact CD-CD1 3.45Å; P364-I967 HydrophobicContact CG-CG2 3.56Å; W384-I967 HydrophobicContact CZ2-CG2 4.08Å; S963-I967 WeakPolarHBondContact O-CD1 3.34Å; S963-I967 VanDerWaalsContact O-CG1 3.29Å; S963-I967 WeakPolarHBondContact O-CG1 3.17Å; S963-I967 PolarHBondContact O-N 3.46Å; L964-I967 HydrophobicContact CD2-CD1 4.28Å; L964-I967 PolarHBondContact O-N 3.33Å; I967-R969 PolarHBondContact O-N 3.08Å; I967-S971 VanDerWaalsContact O-CB 3.27Å; I967-S971 WeakPolarHBondContact O-CB 3.19Å; I967-S971 PolarHBondContact O-N 3.42Å; I967-S971 PolarHBondContact O-OG 3.01Å; I967-Y992 WeakPolarHBondContact CA-O 3.38Å; I967-Y992 HydrophobicContact CG1-CD1 3.85Å; I967-Y992 HydrophobicContact CG1-CG 4.42Å
968	N	94.6	Very high	93.2	Very high	1 Å²	1	18.8 Å²	18.8	1%	0.005	10%	0.098	C	C	.	.	H	α-helix	trans	-62.5	-41.6	179.7	-72	-24.2	0	0	0	112.8	I380 W384 L964 Q965 F966 E972	I380-N968 HydrophobicContact CD1-CB 4.3Å; I380-N968 WeakPolarHBondContact CD1-OD1 3.41Å; W384-N968 PolarHBondContact NE1-ND2 2.84Å; W384-N968 PolarHBondContact NE1-OD1 2.7Å; L964-N968 WeakPolarHBondContact O-CB 3.18Å; L964-N968 PolarHBondContact O-N 3.34Å; L964-N968 PolarHBondContact O-ND2 3.03Å; L964-N968 VanDerWaalsContact O-ND2 3.14Å; Q965-N968 PolarHBondContact O-N 3.17Å; F966-N968 PolarHBondContact O-N 3.29Å; N968-E972 WeakPolarHBondContact O-CB 3.46Å; N968-E972 PolarHBondContact O-N 2.98Å
969	R	94.1	Very high	92.7	Very high	23 Å²	23	22.7 Å²	22.7	9%	0.087	12%	0.118	C	C	.	.	H	α-helix	trans	-80.5	-35.9	179.5	-62.8	-46.8	109.9	-161.1	4.2	113.4	L759 L928 Q965 F966 I967 S971 E972 V973	L759-R969 HydrophobicContact CB-CB 4.32Å; L759-R969 HydrophobicContact CB-CG 3.75Å; L759-R969 HydrophobicContact CD1-CG 4.37Å; L928-R969 HydrophobicContact CD1-CB 4.21Å; L928-R969 HydrophobicContact CD2-CB 4.37Å; Q965-R969 WeakPolarHBondContact O-CG 3.34Å; Q965-R969 PolarHBondContact O-N 3.49Å; F966-R969 PolarHBondContact O-N 2.83Å; I967-R969 PolarHBondContact O-N 3.08Å; R969-S971 VanDerWaalsContact C-N 3.34Å; R969-E972 WeakPolarHBondContact CD-OE2 3.37Å; R969-E972 IonicContact CZ-OE2 3.23Å; R969-E972 IonicContact NE-OE2 2.8Å; R969-E972 IonicContact NH1-OE1 2.73Å; R969-E972 PolarHBondContact NH1-OE1 3.44Å; R969-E972 VanDerWaalsContact NH1-OE1 3.1Å; R969-E972 IonicContact NH1-OE2 3.98Å; R969-E972 PolarHBondContact NH1-OE2 2.73Å; R969-E972 PolarHBondContact O-N 3.39Å; R969-V973 WeakPolarHBondContact O-CG2 3.23Å; R969-V973 PolarHBondContact O-N 3.4Å
970	T	94.7	Very high	92.5	Very high	0 Å²	0	21.1 Å²	21.1	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-64.4	-41.3	176.3	-54.9	0	0	0	0	110.6	F966 G974 L975 L989 I993	F966-T970 WeakPolarHBondContact O-CB 3.3Å; F966-T970 PolarHBondContact O-N 2.85Å; F966-T970 PolarHBondContact O-OG1 3.08Å; T970-G974 PolarHBondContact O-N 3.13Å; T970-L975 HydrophobicContact CG2-CD1 3.69Å; T970-L975 HydrophobicContact CG2-CD2 4.15Å; T970-L975 HydrophobicContact CG2-CG 3.82Å; T970-L989 HydrophobicContact CG2-CB 4.16Å; T970-I993 HydrophobicContact CG2-CD1 4.02Å; T970-I993 HydrophobicContact CG2-CG1 4.29Å
971	S	93.4	Very high	92.2	Very high	0 Å²	0	19 Å²	19	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-68.4	-32.2	174.2	-54.3	0	0	0	0	112.8	I967 R969 F1038	I967-S971 VanDerWaalsContact O-CB 3.27Å; I967-S971 WeakPolarHBondContact O-CB 3.19Å; I967-S971 PolarHBondContact O-N 3.42Å; I967-S971 PolarHBondContact O-OG 3.01Å; R969-S971 VanDerWaalsContact C-N 3.34Å; S971-F1038 WeakPolarHBondContact O-CD1 3.27Å; S971-F1038 WeakPolarHBondContact O-CE1 3.33Å
972	E	92.3	Very high	91.8	Very high	39 Å²	39	22.3 Å²	22.3	18%	0.182	12%	0.118	C	C	.	.	H	α-helix	trans	-68.1	-46.3	174.2	179.9	175.4	-119.5	0	0	112.3	F368 N968 R969 R1061	F368-E972 HydrophobicContact CZ-CB 3.86Å; F368-E972 HydrophobicContact CZ-CG 4.29Å; N968-E972 WeakPolarHBondContact O-CB 3.46Å; N968-E972 PolarHBondContact O-N 2.98Å; R969-E972 WeakPolarHBondContact CD-OE2 3.37Å; R969-E972 IonicContact CZ-OE2 3.23Å; R969-E972 IonicContact NE-OE2 2.8Å; R969-E972 IonicContact NH1-OE1 2.73Å; R969-E972 PolarHBondContact NH1-OE1 3.44Å; R969-E972 VanDerWaalsContact NH1-OE1 3.1Å; R969-E972 IonicContact NH1-OE2 3.98Å; R969-E972 PolarHBondContact NH1-OE2 2.73Å; R969-E972 PolarHBondContact O-N 3.39Å; E972-R1061 PolarHBondContact O-NE 3.45Å; E972-R1061 PolarHBondContact O-NH2 3.28Å
973	V	93.2	Very high	91.1	Very high	26 Å²	26	23 Å²	23	16%	0.158	12%	0.122	C	C	.	.	H	α-helix	trans	-73.2	-49	-178.2	178.6	0	0	0	0	110.8	L928 R969 R1061 R1140	L928-V973 HydrophobicContact CD2-CB 4.31Å; L928-V973 HydrophobicContact CD2-CG2 3.92Å; R969-V973 WeakPolarHBondContact O-CG2 3.23Å; R969-V973 PolarHBondContact O-N 3.4Å; V973-R1061 PolarHBondContact O-NH2 3.36Å; V973-R1140 HydrophobicContact CG2-CG 4.23Å
974	G	92.3	Very high	90.7	Very high	11 Å²	11	25 Å²	25	11%	0.113	14%	0.136	C	C	.	.			trans	85.6	154.7	-169.3	0	0	0	0	0	112.6	T970 F1038	T970-G974 PolarHBondContact O-N 3.13Å; G974-F1038 VanDerWaalsContact CA-O 3.3Å; G974-F1038 WeakPolarHBondContact CA-O 3.48Å
975	L	92	Very high	90.3	Very high	15 Å²	15	25.5 Å²	25.5	8%	0.079	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	137.8	-178.7	-62	-179.5	0	0	0	111.9	T970 M980 L989 I993 F1038 I1039 K1040	T970-L975 HydrophobicContact CG2-CD1 3.69Å; T970-L975 HydrophobicContact CG2-CD2 4.15Å; T970-L975 HydrophobicContact CG2-CG 3.82Å; L975-M980 HydrophobicContact CB-SD 3.7Å; L975-M980 HydrophobicContact CD1-CE 3.69Å; L975-M980 HydrophobicContact CD1-SD 3.89Å; L975-M980 HydrophobicContact CG-SD 4.33Å; L975-L989 HydrophobicContact CD1-CB 3.62Å; L975-L989 HydrophobicContact CD2-CB 3.93Å; L975-L989 HydrophobicContact CD2-CD1 3.79Å; L975-L989 HydrophobicContact CG-CB 4.42Å; L975-I993 HydrophobicContact CB-CD1 4.28Å; L975-I993 HydrophobicContact CD1-CD1 3.86Å; L975-I993 HydrophobicContact CD1-CG1 3.68Å; L975-I993 HydrophobicContact CG-CD1 3.96Å; L975-I993 HydrophobicContact CG-CG1 4.35Å; L975-F1038 PolarHBondContact N-O 3.08Å; L975-I1039 CarbonylContact O-C 3.55Å; L975-I1039 WeakPolarHBondContact O-CA 3.48Å; L975-K1040 PolarHBondContact O-N 2.99Å
976	D	90.8	Very high	90	Very high	23 Å²	23	25.5 Å²	25.5	12%	0.123	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	111.7	172.2	-172.2	-59.9	0	0	0	110.7	N978 L979 M980 K1040 D1042	D976-N978 VanDerWaalsContact C-N 3.34Å; D976-N978 PolarHBondContact O-N 2.68Å; D976-N978 WeakPolarHBondContact OD1-CA 3.21Å; D976-N978 WeakPolarHBondContact OD1-CB 3.48Å; D976-N978 PolarHBondContact OD1-N 3.26Å; D976-L979 HydrophobicContact CB-CB 3.95Å; D976-L979 WeakPolarHBondContact O-CB 3.33Å; D976-L979 PolarHBondContact O-N 3.04Å; D976-L979 PolarHBondContact OD1-N 3.31Å; D976-M980 VanDerWaalsContact O-CG 3.26Å; D976-M980 WeakPolarHBondContact O-CG 3.34Å; D976-M980 PolarHBondContact O-N 3.04Å; D976-K1040 WeakPolarHBondContact CA-O 3.38Å; D976-K1040 HydrophobicContact CB-CB 4.25Å; D976-K1040 HydrophobicContact CB-CG 4.47Å; D976-D1042 WeakPolarHBondContact OD2-CB 3.13Å; D976-D1042 PolarHBondContact OD2-N 2.9Å
977	I	89.4	Confident	89.7	Confident	6 Å²	6	27.1 Å²	27.1	3%	0.031	15%	0.146	C	C	.	.	H	α-helix	trans	-66.8	-34.2	-176	-75.8	-177.3	0	0	0	112.2	L979 M980 V981 L1004 L1008 L1021 I1039	I977-L979 VanDerWaalsContact C-N 3.31Å; I977-L979 PolarHBondContact O-N 3.19Å; I977-M980 HydrophobicContact CG1-SD 4.33Å; I977-M980 PolarHBondContact O-N 3.05Å; I977-M980 VanDerWaalsContact O-N 3.15Å; I977-V981 WeakPolarHBondContact O-CG2 3.31Å; I977-V981 PolarHBondContact O-N 2.87Å; I977-L1004 HydrophobicContact CD1-CD2 3.97Å; I977-L1008 HydrophobicContact CG2-CD1 3.36Å; I977-L1021 HydrophobicContact CD1-CD2 4.3Å; I977-I1039 HydrophobicContact CB-CG2 4.5Å; I977-I1039 HydrophobicContact CD1-CB 4.41Å; I977-I1039 HydrophobicContact CD1-CD1 3.76Å; I977-I1039 HydrophobicContact CD1-CG1 3.88Å; I977-I1039 HydrophobicContact CD1-CG2 3.64Å; I977-I1039 HydrophobicContact CG1-CG1 4.49Å; I977-I1039 HydrophobicContact CG1-CG2 3.94Å
978	N	89.1	Confident	89.4	Confident	10 Å²	10	28.5 Å²	28.5	5%	0.053	15%	0.153	C	C	.	.	H	α-helix	trans	-65.9	-38.6	176.8	-70.8	-47.7	0	0	0	110.5	D976 Q982 R1014 L1015	D976-N978 VanDerWaalsContact C-N 3.34Å; D976-N978 PolarHBondContact O-N 2.68Å; D976-N978 WeakPolarHBondContact OD1-CA 3.21Å; D976-N978 WeakPolarHBondContact OD1-CB 3.48Å; D976-N978 PolarHBondContact OD1-N 3.26Å; N978-Q982 WeakPolarHBondContact O-CG 3.38Å; N978-Q982 PolarHBondContact O-N 3.11Å; N978-Q982 PolarHBondContact O-NE2 2.94Å; N978-R1014 WeakPolarHBondContact OD1-CA 3.48Å; N978-L1015 PolarHBondContact ND2-O 2.9Å; N978-L1015 PolarHBondContact OD1-N 2.97Å
979	L	85.6	Confident	89.4	Confident	90 Å²	90	28.5 Å²	28.5	47%	0.471	15%	0.153	S	C	.	.	H	α-helix	trans	-64.9	-37.9	171.9	-175.7	61	0	0	0	111.8	D976 I977 Q982 N983	D976-L979 HydrophobicContact CB-CB 3.95Å; D976-L979 WeakPolarHBondContact O-CB 3.33Å; D976-L979 PolarHBondContact O-N 3.04Å; D976-L979 PolarHBondContact OD1-N 3.31Å; I977-L979 VanDerWaalsContact C-N 3.31Å; I977-L979 PolarHBondContact O-N 3.19Å; L979-Q982 CarbonylContact O-C 3.48Å; L979-Q982 PolarHBondContact O-N 3.06Å; L979-N983 HydrophobicContact CD1-CB 4.24Å; L979-N983 WeakPolarHBondContact O-CB 3.34Å; L979-N983 PolarHBondContact O-N 2.95Å
980	M	87.6	Confident	89.3	Confident	3 Å²	3	27.8 Å²	27.8	2%	0.015	15%	0.151	C	C	.	.	H	α-helix	trans	-69.7	-32.5	178.8	-64.8	164.6	82.1	0	0	114	L975 D976 I977 Q982 T986 L990	L975-M980 HydrophobicContact CB-SD 3.7Å; L975-M980 HydrophobicContact CD1-CE 3.69Å; L975-M980 HydrophobicContact CD1-SD 3.89Å; L975-M980 HydrophobicContact CG-SD 4.33Å; D976-M980 VanDerWaalsContact O-CG 3.26Å; D976-M980 WeakPolarHBondContact O-CG 3.34Å; D976-M980 PolarHBondContact O-N 3.04Å; I977-M980 HydrophobicContact CG1-SD 4.33Å; I977-M980 PolarHBondContact O-N 3.05Å; I977-M980 VanDerWaalsContact O-N 3.15Å; M980-Q982 VanDerWaalsContact C-N 3.28Å; M980-T986 WeakPolarHBondContact CA-OG1 3.48Å; M980-T986 WeakPolarHBondContact CE-O 3.35Å; M980-T986 WeakPolarHBondContact CG-OG1 3.35Å; M980-L990 HydrophobicContact CE-CB 3.5Å; M980-L990 HydrophobicContact CE-CD1 3.84Å; M980-L990 HydrophobicContact CE-CD2 4.3Å; M980-L990 HydrophobicContact CE-CG 4.06Å; M980-L990 HydrophobicContact SD-CD1 4.46Å
981	V	86.9	Confident	89.3	Confident	41 Å²	41	29.9 Å²	29.9	25%	0.248	16%	0.161	C	C	.	.	H	α-helix	trans	-65.1	-35.6	170.8	172.1	0	0	0	0	110.8	I977 L1005 L1008 K1009	I977-V981 WeakPolarHBondContact O-CG2 3.31Å; I977-V981 PolarHBondContact O-N 2.87Å; V981-L1005 HydrophobicContact CG2-CD1 3.91Å; V981-L1008 HydrophobicContact CG2-CB 3.95Å; V981-L1008 HydrophobicContact CG2-CD1 4.37Å; V981-K1009 HydrophobicContact CG1-CG 4.26Å
982	Q	83.3	Confident	89.3	Confident	117 Å²	117	30.8 Å²	30.8	55%	0.547	16%	0.164	S	C	.	.	H	α-helix	trans	-85.3	-33.5	-179.2	-71.2	168	95.2	0	0	114	N978 L979 M980	N978-Q982 WeakPolarHBondContact O-CG 3.38Å; N978-Q982 PolarHBondContact O-N 3.11Å; N978-Q982 PolarHBondContact O-NE2 2.94Å; L979-Q982 CarbonylContact O-C 3.48Å; L979-Q982 PolarHBondContact O-N 3.06Å; M980-Q982 VanDerWaalsContact C-N 3.28Å
983	N	81.4	Confident	89.5	Confident	17 Å²	17	28.9 Å²	28.9	9%	0.091	16%	0.156	C	C	.	.			trans	-121	97.3	-171.2	-164.9	-43.1	0	0	0	111.3	E806 L979 R985 T986	E806-N983 PolarHBondContact O-ND2 2.85Å; L979-N983 HydrophobicContact CD1-CB 4.24Å; L979-N983 WeakPolarHBondContact O-CB 3.34Å; L979-N983 PolarHBondContact O-N 2.95Å; N983-R985 PolarHBondContact O-N 3.49Å; N983-R985 WeakPolarHBondContact OD1-CB 3.44Å; N983-R985 WeakPolarHBondContact OD1-CG 3.34Å; N983-R985 PolarHBondContact OD1-N 3.25Å; N983-R985 PolarHBondContact OD1-NE 2.84Å; N983-T986 PolarHBondContact O-N 3.41Å; N983-T986 VanDerWaalsContact O-N 3.1Å; N983-T986 PolarHBondContact O-OG1 3Å
984	S	83.7	Confident	89.5	Confident	66 Å²	66	27.7 Å²	27.7	46%	0.462	15%	0.148	S	C	.	.	G	3₁₀ helix	trans	-49.3	-31.5	-174.6	-170	0	0	0	0	114.5	T986 I987	S984-T986 VanDerWaalsContact C-N 3.3Å; S984-T986 PolarHBondContact O-N 3.24Å; S984-I987 WeakPolarHBondContact O-CB 3.33Å; S984-I987 WeakPolarHBondContact O-CD1 3.4Å; S984-I987 WeakPolarHBondContact O-CG1 3.27Å; S984-I987 PolarHBondContact O-N 3.3Å
985	R	85.8	Confident	89.5	Confident	27 Å²	27	27.1 Å²	27.1	10%	0.102	14%	0.143	C	C	.	.	G	3₁₀ helix	trans	-64.8	-31.1	-176.2	-50.2	-176.7	-55.5	123.5	0.6	113	E806 R922 Q933 N983 I987	E806-R985 PolarHBondContact O-NH2 3.11Å; R922-R985 VanDerWaalsContact CZ-CD 3.44Å; Q933-R985 PolarHBondContact NE2-O 3.38Å; N983-R985 PolarHBondContact O-N 3.49Å; N983-R985 WeakPolarHBondContact OD1-CB 3.44Å; N983-R985 WeakPolarHBondContact OD1-CG 3.34Å; N983-R985 PolarHBondContact OD1-N 3.25Å; N983-R985 PolarHBondContact OD1-NE 2.84Å; R985-I987 VanDerWaalsContact C-N 3.35Å
986	T	87.7	Confident	89.6	Confident	17 Å²	17	26.4 Å²	26.4	10%	0.104	14%	0.139	C	C	.	.	G	3₁₀ helix	trans	-82.8	-11.5	-175.8	51.9	0	0	0	0	113.7	V929 M980 N983 S984 N988 L989	V929-T986 HydrophobicContact CG1-CG2 4.02Å; V929-T986 HydrophobicContact CG2-CG2 4.32Å; M980-T986 WeakPolarHBondContact CA-OG1 3.48Å; M980-T986 WeakPolarHBondContact CE-O 3.35Å; M980-T986 WeakPolarHBondContact CG-OG1 3.35Å; N983-T986 PolarHBondContact O-N 3.41Å; N983-T986 VanDerWaalsContact O-N 3.1Å; N983-T986 PolarHBondContact O-OG1 3Å; S984-T986 VanDerWaalsContact C-N 3.3Å; S984-T986 PolarHBondContact O-N 3.24Å; T986-N988 VanDerWaalsContact C-N 3.31Å; T986-N988 PolarHBondContact O-N 3.26Å; T986-L989 PolarHBondContact O-N 3.41Å
987	I	90.4	Very high	89.7	Confident	35 Å²	35	25.4 Å²	25.4	18%	0.179	13%	0.134	C	C	.	.	G	3₁₀ helix	trans	-54.7	-42.3	-175.6	-68.9	170.9	0	0	0	112.8	S984 R985 L989 L990 L1005	S984-I987 WeakPolarHBondContact O-CB 3.33Å; S984-I987 WeakPolarHBondContact O-CD1 3.4Å; S984-I987 WeakPolarHBondContact O-CG1 3.27Å; S984-I987 PolarHBondContact O-N 3.3Å; R985-I987 VanDerWaalsContact C-N 3.35Å; I987-L989 PolarHBondContact O-N 2.97Å; I987-L990 VanDerWaalsContact O-CB 3.3Å; I987-L990 WeakPolarHBondContact O-CB 3.29Å; I987-L990 PolarHBondContact O-N 3.09Å; I987-L1005 HydrophobicContact CB-CD2 4.21Å; I987-L1005 HydrophobicContact CD1-CD2 3.77Å; I987-L1005 HydrophobicContact CG1-CD2 3.71Å; I987-L1005 HydrophobicContact CG2-CD2 3.53Å
988	N	90.1	Very high	89.8	Confident	32 Å²	32	26.5 Å²	26.5	17%	0.171	14%	0.142	C	C	.	.	G	3₁₀ helix	trans	-62.1	-16.4	-174.8	-69.2	19.3	0	0	0	114.2	S932 T986 Q991	S932-N988 VanDerWaalsContact O-CB 3.25Å; S932-N988 WeakPolarHBondContact O-CB 3.46Å; S932-N988 PolarHBondContact O-ND2 2.78Å; T986-N988 VanDerWaalsContact C-N 3.31Å; T986-N988 PolarHBondContact O-N 3.26Å; N988-Q991 WeakPolarHBondContact O-CG 3.48Å; N988-Q991 PolarHBondContact O-NE2 3.26Å
989	L	93.4	Very high	89.9	Confident	1 Å²	1	27.1 Å²	27.1	1%	0.005	14%	0.143	C	C	.	.	G	3₁₀ helix	trans	-80.5	-16.3	174.9	-65.9	174.3	0	0	0	113.3	L928 V929 S932 F966 T970 L975 T986 I987 Q991 Y992	L928-L989 HydrophobicContact CD1-CD2 4.07Å; L928-L989 HydrophobicContact CG-CD1 4.24Å; L928-L989 HydrophobicContact CG-CD2 4.09Å; V929-L989 HydrophobicContact CG2-CD1 3.94Å; S932-L989 VanDerWaalsContact CB-CD2 3.45Å; S932-L989 WeakPolarHBondContact OG-CD2 3.29Å; S932-L989 WeakPolarHBondContact OG-CG 3.24Å; F966-L989 HydrophobicContact CD1-CD2 4.41Å; T970-L989 HydrophobicContact CG2-CB 4.16Å; L975-L989 HydrophobicContact CD1-CB 3.62Å; L975-L989 HydrophobicContact CD2-CB 3.93Å; L975-L989 HydrophobicContact CD2-CD1 3.79Å; L975-L989 HydrophobicContact CG-CB 4.42Å; T986-L989 PolarHBondContact O-N 3.41Å; I987-L989 PolarHBondContact O-N 2.97Å; L989-Q991 VanDerWaalsContact C-N 3.28Å; L989-Q991 PolarHBondContact O-N 3.36Å; L989-Y992 HydrophobicContact CD2-CD2 4.39Å; L989-Y992 PolarHBondContact O-N 3.47Å
990	L	93.1	Very high	90.2	Very high	8 Å²	8	23.5 Å²	23.5	4%	0.042	12%	0.124	C	C	.	.	G	3₁₀ helix	trans	-61.5	-35.7	-173.9	-166	50.7	0	0	0	113.2	M980 I987 Y992 I993 L996 G1001 L1005	M980-L990 HydrophobicContact CE-CB 3.5Å; M980-L990 HydrophobicContact CE-CD1 3.84Å; M980-L990 HydrophobicContact CE-CD2 4.3Å; M980-L990 HydrophobicContact CE-CG 4.06Å; M980-L990 HydrophobicContact SD-CD1 4.46Å; I987-L990 VanDerWaalsContact O-CB 3.3Å; I987-L990 WeakPolarHBondContact O-CB 3.29Å; I987-L990 PolarHBondContact O-N 3.09Å; L990-Y992 PolarHBondContact O-N 2.78Å; L990-I993 PolarHBondContact O-N 3.2Å; L990-L996 HydrophobicContact CD1-CD1 3.8Å; L990-L996 HydrophobicContact CG-CD1 4.29Å; L990-G1001 WeakPolarHBondContact CD2-O 3.4Å; L990-L1005 HydrophobicContact CD2-CB 4.01Å
991	Q	92.9	Very high	90.4	Very high	43 Å²	43	23.5 Å²	23.5	20%	0.201	12%	0.124	C	C	.	.	G	3₁₀ helix	trans	-65.8	-18.7	176.8	66.2	-170.3	-31.3	0	0	113.7	R292 C935 N988 L989 P998	R292-Q991 PolarHBondContact NH1-O 2.82Å; C935-Q991 PolarHBondContact O-NE2 2.91Å; N988-Q991 WeakPolarHBondContact O-CG 3.48Å; N988-Q991 PolarHBondContact O-NE2 3.26Å; L989-Q991 VanDerWaalsContact C-N 3.28Å; L989-Q991 PolarHBondContact O-N 3.36Å; Q991-P998 HydrophobicContact CB-CB 4.41Å
992	Y	95.2	Very high	90.5	Very high	19 Å²	19	26.8 Å²	26.8	8%	0.075	14%	0.137	C	C	.	.	G	3₁₀ helix	trans	-98	3.4	-179	-58.3	-52.6	0	0	0	113.2	C935 F966 I967 L989 L990	C935-Y992 HydrophobicContact CB-CE2 4.02Å; C935-Y992 WeakPolarHBondContact CB-OH 3.34Å; C935-Y992 PolarHBondContact SG-OH 3.24Å; F966-Y992 HydrophobicContact CB-CD1 3.92Å; F966-Y992 HydrophobicContact CB-CD2 3.64Å; F966-Y992 HydrophobicContact CB-CE1 4.09Å; F966-Y992 HydrophobicContact CB-CE2 3.82Å; F966-Y992 HydrophobicContact CB-CG 3.68Å; F966-Y992 HydrophobicContact CD1-CD2 4.27Å; F966-Y992 HydrophobicContact CD1-CE2 4.16Å; F966-Y992 HydrophobicContact CD2-CE2 4.45Å; F966-Y992 HydrophobicContact CG-CD2 4.12Å; F966-Y992 AromaticContact CG-CE2 3.91Å; F966-Y992 HydrophobicContact CG-CE2 3.91Å; I967-Y992 WeakPolarHBondContact CA-O 3.38Å; I967-Y992 HydrophobicContact CG1-CD1 3.85Å; I967-Y992 HydrophobicContact CG1-CG 4.42Å; L989-Y992 HydrophobicContact CD2-CD2 4.39Å; L989-Y992 PolarHBondContact O-N 3.47Å; L990-Y992 PolarHBondContact O-N 2.78Å
993	I	95.1	Very high	90.9	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	13%	0.128	C	C	.	.	S	Bend	trans	-71.1	136.1	167.3	-71.4	-72.4	0	0	0	109.8	R292 T970 L975 L990 G995 L996 C1035 F1038	R292-I993 PolarHBondContact NH2-O 2.89Å; T970-I993 HydrophobicContact CG2-CD1 4.02Å; T970-I993 HydrophobicContact CG2-CG1 4.29Å; L975-I993 HydrophobicContact CB-CD1 4.28Å; L975-I993 HydrophobicContact CD1-CD1 3.86Å; L975-I993 HydrophobicContact CD1-CG1 3.68Å; L975-I993 HydrophobicContact CG-CD1 3.96Å; L975-I993 HydrophobicContact CG-CG1 4.35Å; L990-I993 PolarHBondContact O-N 3.2Å; I993-G995 PolarHBondContact O-N 2.76Å; I993-L996 HydrophobicContact CB-CB 4.36Å; I993-L996 HydrophobicContact CB-CD1 4.11Å; I993-L996 HydrophobicContact CB-CG 4.4Å; I993-L996 HydrophobicContact CG2-CB 4.47Å; I993-L996 HydrophobicContact CG2-CD1 3.9Å; I993-L996 HydrophobicContact CG2-CG 4.06Å; I993-L996 PolarHBondContact O-N 2.76Å; I993-L996 VanDerWaalsContact O-O 3.09Å; I993-C1035 HydrophobicContact CG2-CB 3.81Å; I993-F1038 HydrophobicContact CD1-CB 3.89Å
994	C	93.7	Very high	91.3	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	13%	0.125	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51.8	132.8	171.6	-171.1	0	0	0	0	111.1	P364 L996 N1034 C1035 F1038	P364-C994 HydrophobicContact CB-CB 4.1Å; P364-C994 HydrophobicContact CG-CB 4.34Å; C994-L996 VanDerWaalsContact C-N 3.28Å; C994-L996 PolarHBondContact O-N 3.32Å; C994-N1034 VanDerWaalsContact CB-O 3.31Å; C994-N1034 WeakPolarHBondContact CB-O 3.36Å; C994-N1034 CarbonylContact O-C 3.59Å; C994-N1034 PolarHBondContact SG-O 3Å; C994-C1035 WeakPolarHBondContact O-CA 3.21Å; C994-C1035 WeakPolarHBondContact O-CB 2.8Å; C994-C1035 PolarHBondContact O-N 3.02Å; C994-F1038 HydrophobicContact CB-CD2 3.53Å; C994-F1038 HydrophobicContact CB-CE2 3.43Å; C994-F1038 VanDerWaalsContact CB-CE2 3.43Å; C994-F1038 HydrophobicContact CB-CZ 4.43Å
995	G	92.4	Very high	91.6	Very high	0 Å²	0	20.3 Å²	20.3	0%	0	11%	0.107	C	C	.	.	T	Hydrogen-bonded Turn	trans	86.6	-28.4	-172.7	0	0	0	0	0	115	E362 I993	E362-G995 WeakPolarHBondContact OE1-CA 3.45Å; E362-G995 PolarHBondContact OE1-N 3.37Å; I993-G995 PolarHBondContact O-N 2.76Å
996	L	93.9	Very high	91.7	Very high	0 Å²	0	22.8 Å²	22.8	0%	0	12%	0.118	C	C	.	.			trans	-102	159.2	-177.7	-56.3	-176.7	0	0	0	112.2	R292 L990 I993 C994 K1000 L1004 V1031 C1035	R292-L996 PolarHBondContact NH1-O 2.7Å; R292-L996 PolarHBondContact NH2-O 3.02Å; L990-L996 HydrophobicContact CD1-CD1 3.8Å; L990-L996 HydrophobicContact CG-CD1 4.29Å; I993-L996 HydrophobicContact CB-CB 4.36Å; I993-L996 HydrophobicContact CB-CD1 4.11Å; I993-L996 HydrophobicContact CB-CG 4.4Å; I993-L996 HydrophobicContact CG2-CB 4.47Å; I993-L996 HydrophobicContact CG2-CD1 3.9Å; I993-L996 HydrophobicContact CG2-CG 4.06Å; I993-L996 PolarHBondContact O-N 2.76Å; I993-L996 VanDerWaalsContact O-O 3.09Å; C994-L996 VanDerWaalsContact C-N 3.28Å; C994-L996 PolarHBondContact O-N 3.32Å; L996-K1000 HydrophobicContact CD2-CB 4Å; L996-L1004 HydrophobicContact CD1-CD2 4.03Å; L996-V1031 HydrophobicContact CD2-CG1 3.85Å; L996-C1035 HydrophobicContact CG-CB 4.35Å
997	G	92.4	Very high	91.8	Very high	1 Å²	1	24.8 Å²	24.8	1%	0.01	13%	0.128	C	C	.	.			trans	-141	-166.3	165.7	0	0	0	0	0	110	E291 R999 G1001	E291-G997 VanDerWaalsContact CD-CA 3.43Å; E291-G997 WeakPolarHBondContact OE2-CA 3.44Å; E291-G997 PolarHBondContact OE2-N 2.82Å; G997-R999 VanDerWaalsContact C-N 3.35Å; G997-R999 PolarHBondContact O-N 2.71Å; G997-G1001 WeakPolarHBondContact O-CA 3.2Å; G997-G1001 PolarHBondContact O-N 3.45Å
998	P	91.5	Very high	91.7	Very high	30 Å²	30	23.3 Å²	23.3	20%	0.195	12%	0.12	C	C	.	.	H	α-helix	trans	-58.1	-43.6	-178.7	21.9	-33	0	0	0	112.5	E291 Q991 Q1002	E291-P998 VanDerWaalsContact OE1-CD 3.22Å; E291-P998 WeakPolarHBondContact OE1-CD 3.42Å; E291-P998 WeakPolarHBondContact OE1-CG 3.29Å; Q991-P998 HydrophobicContact CB-CB 4.41Å; P998-Q1002 VanDerWaalsContact O-CB 3.27Å; P998-Q1002 WeakPolarHBondContact O-CB 3.48Å; P998-Q1002 WeakPolarHBondContact O-CG 3.46Å; P998-Q1002 PolarHBondContact O-N 2.81Å
999	R	91.3	Very high	91.5	Very high	22 Å²	22	26.8 Å²	26.8	8%	0.083	13%	0.134	C	C	.	.	H	α-helix	trans	-67.5	-52.6	-179.5	-82.3	155.5	-74.5	-109.4	-19.8	112.7	H276 D281 R285 E291 G997 A1003	H276-R999 HydrophobicContact CB-CG 3.52Å; D281-R999 HydrophobicContact CB-CG 4.32Å; D281-R999 VanDerWaalsContact OD1-CD 3.3Å; D281-R999 WeakPolarHBondContact OD1-CD 3.46Å; D281-R999 IonicContact OD1-CZ 2.71Å; D281-R999 IonicContact OD1-NE 3.56Å; D281-R999 IonicContact OD1-NH1 3.2Å; D281-R999 PolarHBondContact OD1-NH1 3.39Å; R285-R999 HydrophobicContact CG-CB 3.74Å; R285-R999 HydrophobicContact CG-CG 4.39Å; E291-R999 WeakPolarHBondContact OE1-CB 3.34Å; E291-R999 IonicContact OE1-CZ 3.66Å; E291-R999 PolarHBondContact OE1-N 2.81Å; E291-R999 VanDerWaalsContact OE1-N 3.14Å; E291-R999 IonicContact OE1-NE 2.71Å; E291-R999 PolarHBondContact OE1-NE 3.42Å; E291-R999 IonicContact OE1-NH2 3.33Å; E291-R999 PolarHBondContact OE1-NH2 3.33Å; E291-R999 PolarHBondContact OE2-N 2.92Å; G997-R999 VanDerWaalsContact C-N 3.35Å; G997-R999 PolarHBondContact O-N 2.71Å; R999-A1003 WeakPolarHBondContact O-CB 3.4Å; R999-A1003 PolarHBondContact O-N 3.21Å
1000	K	93.1	Very high	91.2	Very high	15 Å²	15	32.1 Å²	32.1	7%	0.065	16%	0.159	C	C	.	.	H	α-helix	trans	-67.6	-37.3	-178.2	-68.9	-171.9	-178.9	-62.3	0	111.6	I284 R285 T287 I289 E291 L996 L1004 V1031	I284-K1000 VanDerWaalsContact O-CE 3.24Å; I284-K1000 WeakPolarHBondContact O-CE 3.27Å; I284-K1000 PolarHBondContact O-NZ 3.17Å; R285-K1000 PolarHBondContact O-NZ 3.4Å; T287-K1000 PolarHBondContact O-NZ 3.17Å; I289-K1000 VanDerWaalsContact O-CE 3.24Å; I289-K1000 WeakPolarHBondContact O-CE 3.39Å; E291-K1000 HydrophobicContact CB-CD 4.26Å; E291-K1000 HydrophobicContact CB-CG 4.49Å; E291-K1000 PolarHBondContact OE2-N 2.81Å; L996-K1000 HydrophobicContact CD2-CB 4Å; K1000-L1004 WeakPolarHBondContact O-CB 3.4Å; K1000-L1004 PolarHBondContact O-N 3.16Å; K1000-V1031 HydrophobicContact CD-CG1 4.5Å; K1000-V1031 HydrophobicContact CD-CG2 4.2Å
1001	G	91.7	Very high	90.7	Very high	2 Å²	2	33.8 Å²	33.8	2%	0.021	17%	0.171	C	C	.	.	H	α-helix	trans	-65	-48.7	176	0	0	0	0	0	112.9	L990 G997 A1003 L1004 L1005	L990-G1001 WeakPolarHBondContact CD2-O 3.4Å; G997-G1001 WeakPolarHBondContact O-CA 3.2Å; G997-G1001 PolarHBondContact O-N 3.45Å; G1001-A1003 VanDerWaalsContact C-N 3.34Å; G1001-A1003 PolarHBondContact O-N 3Å; G1001-L1004 PolarHBondContact O-N 2.76Å; G1001-L1005 WeakPolarHBondContact O-CB 3.12Å; G1001-L1005 PolarHBondContact O-N 2.71Å
1002	Q	89.2	Confident	90	Very high	110 Å²	110	38.6 Å²	38.6	51%	0.514	20%	0.198	S	C	.	.	H	α-helix	trans	-62.5	-39.5	176.5	-72.6	174.3	12.8	0	0	112.2	P998 L1005 K1006	P998-Q1002 VanDerWaalsContact O-CB 3.27Å; P998-Q1002 WeakPolarHBondContact O-CB 3.48Å; P998-Q1002 WeakPolarHBondContact O-CG 3.46Å; P998-Q1002 PolarHBondContact O-N 2.81Å; Q1002-L1005 PolarHBondContact O-N 3.1Å; Q1002-K1006 VanDerWaalsContact O-CB 3.23Å; Q1002-K1006 WeakPolarHBondContact O-CB 3.18Å; Q1002-K1006 PolarHBondContact O-N 3.06Å
1003	A	90.1	Very high	89	Confident	44 Å²	44	42.3 Å²	42.3	36%	0.364	22%	0.216	S	C	.	.	H	α-helix	trans	-61.8	-48.2	176.2	0	0	0	0	0	112.4	R999 G1001 L1005 K1006 L1007	R999-A1003 WeakPolarHBondContact O-CB 3.4Å; R999-A1003 PolarHBondContact O-N 3.21Å; G1001-A1003 VanDerWaalsContact C-N 3.34Å; G1001-A1003 PolarHBondContact O-N 3Å; A1003-L1005 PolarHBondContact O-N 2.83Å; A1003-K1006 PolarHBondContact O-N 3.34Å; A1003-L1007 WeakPolarHBondContact O-CB 3.31Å; A1003-L1007 PolarHBondContact O-N 2.92Å
1004	L	90.3	Very high	88.4	Confident	5 Å²	5	48.2 Å²	48.2	3%	0.026	24%	0.239	C	C	.	.	H	α-helix	trans	-57.5	-47.7	176	176.4	60.8	0	0	0	111.8	I977 L996 K1000 G1001 L1007 L1008 L1021 C1025 L1027	I977-L1004 HydrophobicContact CD1-CD2 3.97Å; L996-L1004 HydrophobicContact CD1-CD2 4.03Å; K1000-L1004 WeakPolarHBondContact O-CB 3.4Å; K1000-L1004 PolarHBondContact O-N 3.16Å; G1001-L1004 PolarHBondContact O-N 2.76Å; L1004-L1007 PolarHBondContact O-N 3.46Å; L1004-L1008 HydrophobicContact CD1-CD1 4.18Å; L1004-L1008 HydrophobicContact CG-CD1 4.34Å; L1004-L1008 WeakPolarHBondContact O-CG 3.3Å; L1004-L1008 PolarHBondContact O-N 3.28Å; L1004-L1021 HydrophobicContact CD1-CD2 4.24Å; L1004-C1025 HydrophobicContact CD1-CB 3.5Å; L1004-C1025 VanDerWaalsContact CD1-CB 3.5Å; L1004-L1027 HydrophobicContact CD2-CD1 4.42Å
1005	L	89.5	Confident	88.1	Confident	16 Å²	16	48.3 Å²	48.3	8%	0.084	24%	0.239	C	C	.	.	H	α-helix	trans	-66	-40.3	179.5	-178.3	66.7	0	0	0	112.4	V981 I987 L990 G1001 Q1002 A1003 L1008 K1009	V981-L1005 HydrophobicContact CG2-CD1 3.91Å; I987-L1005 HydrophobicContact CB-CD2 4.21Å; I987-L1005 HydrophobicContact CD1-CD2 3.77Å; I987-L1005 HydrophobicContact CG1-CD2 3.71Å; I987-L1005 HydrophobicContact CG2-CD2 3.53Å; L990-L1005 HydrophobicContact CD2-CB 4.01Å; G1001-L1005 WeakPolarHBondContact O-CB 3.12Å; G1001-L1005 PolarHBondContact O-N 2.71Å; Q1002-L1005 PolarHBondContact O-N 3.1Å; A1003-L1005 PolarHBondContact O-N 2.83Å; L1005-L1008 PolarHBondContact O-N 3.43Å; L1005-K1009 HydrophobicContact CG-CD 4.37Å; L1005-K1009 WeakPolarHBondContact O-CB 3.34Å; L1005-K1009 WeakPolarHBondContact O-CG 3.45Å; L1005-K1009 PolarHBondContact O-N 3.14Å
1006	K	88.6	Confident	87.8	Confident	78 Å²	78	50.9 Å²	50.9	34%	0.339	25%	0.251	S	S	.	.	H	α-helix	trans	-61.5	-45.5	177.3	-179.8	176	177.6	176	0	111.1	Y216 Q1002 A1003 L1008 K1009 Q1010	Y216-K1006 PolarHBondContact OH-NZ 3.46Å; Q1002-K1006 VanDerWaalsContact O-CB 3.23Å; Q1002-K1006 WeakPolarHBondContact O-CB 3.18Å; Q1002-K1006 PolarHBondContact O-N 3.06Å; A1003-K1006 PolarHBondContact O-N 3.34Å; K1006-L1008 PolarHBondContact O-N 2.94Å; K1006-K1009 PolarHBondContact O-N 3.31Å; K1006-Q1010 HydrophobicContact CG-CG 4.36Å; K1006-Q1010 WeakPolarHBondContact O-CB 3.33Å; K1006-Q1010 WeakPolarHBondContact O-CG 3.16Å; K1006-Q1010 PolarHBondContact O-N 2.95Å
1007	L	89.8	Confident	87.6	Confident	59 Å²	59	52.1 Å²	52.1	31%	0.309	26%	0.258	S	S	.	.	H	α-helix	trans	-62.8	-41.7	178.8	-179.1	57.3	0	0	0	112.4	A1003 L1004 Q1010 S1011 C1025	A1003-L1007 WeakPolarHBondContact O-CB 3.31Å; A1003-L1007 PolarHBondContact O-N 2.92Å; L1004-L1007 PolarHBondContact O-N 3.46Å; L1007-Q1010 PolarHBondContact O-N 2.79Å; L1007-S1011 VanDerWaalsContact O-CB 3.31Å; L1007-S1011 WeakPolarHBondContact O-CB 3.43Å; L1007-S1011 PolarHBondContact O-N 3.49Å; L1007-S1011 PolarHBondContact O-OG 3.07Å; L1007-C1025 HydrophobicContact CD2-CB 4.35Å
1008	L	87.9	Confident	87.5	Confident	5 Å²	5	52.2 Å²	52.2	3%	0.026	26%	0.258	C	S	.	.	H	α-helix	trans	-66.9	-41.2	175.9	-70.1	168.2	0	0	0	112	I977 V981 L1004 L1005 K1006 S1011 N1012	I977-L1008 HydrophobicContact CG2-CD1 3.36Å; V981-L1008 HydrophobicContact CG2-CB 3.95Å; V981-L1008 HydrophobicContact CG2-CD1 4.37Å; L1004-L1008 HydrophobicContact CD1-CD1 4.18Å; L1004-L1008 HydrophobicContact CG-CD1 4.34Å; L1004-L1008 WeakPolarHBondContact O-CG 3.3Å; L1004-L1008 PolarHBondContact O-N 3.28Å; L1005-L1008 PolarHBondContact O-N 3.43Å; K1006-L1008 PolarHBondContact O-N 2.94Å; L1008-S1011 PolarHBondContact O-OG 3.42Å; L1008-N1012 WeakPolarHBondContact O-CA 3.23Å; L1008-N1012 PolarHBondContact O-N 3.47Å
1009	K	87.5	Confident	87.4	Confident	104 Å²	104	54.8 Å²	54.8	45%	0.452	27%	0.273	S	S	.	.	H	α-helix	trans	-65.2	-41.6	174.2	-74.5	-175.3	175	-169.7	0	112.9	V981 L1005 K1006 N1012	V981-K1009 HydrophobicContact CG1-CG 4.26Å; L1005-K1009 HydrophobicContact CG-CD 4.37Å; L1005-K1009 WeakPolarHBondContact O-CB 3.34Å; L1005-K1009 WeakPolarHBondContact O-CG 3.45Å; L1005-K1009 PolarHBondContact O-N 3.14Å; K1006-K1009 PolarHBondContact O-N 3.31Å; K1009-N1012 PolarHBondContact O-N 3.27Å
1010	Q	86.6	Confident	87.3	Confident	113 Å²	113	55 Å²	55	53%	0.528	28%	0.275	S	S	.	.	H	α-helix	trans	-70.4	-40.8	179.8	-75.4	180	-52.8	0	0	112.8	K1006 L1007 N1012	K1006-Q1010 HydrophobicContact CG-CG 4.36Å; K1006-Q1010 WeakPolarHBondContact O-CB 3.33Å; K1006-Q1010 WeakPolarHBondContact O-CG 3.16Å; K1006-Q1010 PolarHBondContact O-N 2.95Å; L1007-Q1010 PolarHBondContact O-N 2.79Å; Q1010-N1012 VanDerWaalsContact C-N 3.31Å
1011	S	82.6	Confident	87.2	Confident	44 Å²	44	54.3 Å²	54.3	31%	0.308	27%	0.272	S	S	.	.	H	α-helix	trans	-74.3	-22.1	176.4	59.9	0	0	0	0	113.2	L1007 L1008 Q1013	L1007-S1011 VanDerWaalsContact O-CB 3.31Å; L1007-S1011 WeakPolarHBondContact O-CB 3.43Å; L1007-S1011 PolarHBondContact O-N 3.49Å; L1007-S1011 PolarHBondContact O-OG 3.07Å; L1008-S1011 PolarHBondContact O-OG 3.42Å; S1011-Q1013 PolarHBondContact O-N 3.43Å
1012	N	78.4	Confident	87.1	Confident	143 Å²	143	56.8 Å²	56.8	77%	0.765	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.3	32.3	-171.9	-165	26	0	0	0	112.8	L1008 K1009 Q1010	L1008-N1012 WeakPolarHBondContact O-CA 3.23Å; L1008-N1012 PolarHBondContact O-N 3.47Å; K1009-N1012 PolarHBondContact O-N 3.27Å; Q1010-N1012 VanDerWaalsContact C-N 3.31Å
1013	Q	73.9	Confident	87.1	Confident	98 Å²	98	56 Å²	56	46%	0.458	29%	0.289	S	S	.	.			trans	-93.7	139.1	175.6	-65.6	-179.4	20.6	0	0	109.6	S1011	S1011-Q1013 PolarHBondContact O-N 3.43Å
1014	R	82.6	Confident	86.9	Confident	123 Å²	123	55.9 Å²	55.9	46%	0.464	28%	0.284	S	S	.	.			trans	-83.6	144.2	165.1	-70	-177.4	172.1	-140.5	-11.3	108.4	N978 E1016	N978-R1014 WeakPolarHBondContact OD1-CA 3.48Å; R1014-E1016 PolarHBondContact O-N 2.93Å
1015	L	87.2	Confident	86.8	Confident	3 Å²	3	56 Å²	56	2%	0.016	29%	0.286	C	S	.	.			trans	-78.5	110.2	173.1	-164.9	73.8	0	0	0	108.2	N978 Q1020 L1021 I1039 I1041	N978-L1015 PolarHBondContact ND2-O 2.9Å; N978-L1015 PolarHBondContact OD1-N 2.97Å; L1015-Q1020 HydrophobicContact CD1-CB 3.58Å; L1015-L1021 HydrophobicContact CD1-CD2 4.09Å; L1015-L1021 HydrophobicContact CD1-CG 4.26Å; L1015-L1021 HydrophobicContact CD2-CD2 3.75Å; L1015-L1021 HydrophobicContact CD2-CG 4.02Å; L1015-I1039 HydrophobicContact CD2-CG2 4.36Å; L1015-I1041 HydrophobicContact CB-CD1 4.47Å; L1015-I1041 HydrophobicContact CD2-CD1 3.71Å; L1015-I1041 HydrophobicContact CD2-CG1 4.1Å; L1015-I1041 HydrophobicContact CG-CD1 3.82Å; L1015-I1041 WeakPolarHBondContact O-CG2 3.36Å
1016	E	86.5	Confident	86.7	Confident	54 Å²	54	62.5 Å²	62.5	25%	0.252	32%	0.315	S	S	.	.			trans	-88.8	-30.1	-175.6	-56.2	172.5	131.8	0	0	111.9	R1014 Q1020 L1046 T1050	R1014-E1016 PolarHBondContact O-N 2.93Å; E1016-Q1020 PolarHBondContact OE2-NE2 2.86Å; E1016-L1046 WeakPolarHBondContact O-CD1 3.42Å; E1016-T1050 VanDerWaalsContact CD-OG1 3.27Å; E1016-T1050 VanDerWaalsContact OE1-CB 3.22Å; E1016-T1050 WeakPolarHBondContact OE1-CB 3.49Å; E1016-T1050 PolarHBondContact OE1-OG1 3.25Å
1017	N	88.2	Confident	86.8	Confident	26 Å²	26	59.8 Å²	59.8	14%	0.139	30%	0.304	C	S	.	.	S	Bend	trans	-151.3	160.1	174	58.8	66.6	0	0	0	111.4	T1019 Q1020 D1058	N1017-T1019 PolarHBondContact O-N 3.26Å; N1017-T1019 VanDerWaalsContact OD1-CB 3.31Å; N1017-T1019 WeakPolarHBondContact OD1-CB 3.3Å; N1017-T1019 PolarHBondContact OD1-N 2.97Å; N1017-Q1020 WeakPolarHBondContact O-CB 3.34Å; N1017-Q1020 PolarHBondContact O-N 3.32Å; N1017-Q1020 PolarHBondContact OD1-N 3.19Å; N1017-D1058 WeakPolarHBondContact CA-OD2 3.49Å; N1017-D1058 VanDerWaalsContact CB-OD2 3.29Å; N1017-D1058 WeakPolarHBondContact CB-OD2 3.45Å
1018	R	91.1	Very high	86.9	Confident	2 Å²	2	58 Å²	58	1%	0.008	30%	0.3	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-29.9	-178.6	-75.4	177.4	176.1	156.3	-9.3	112.5	Q1020 L1021 F1032 S1036 I1039 I1041 L1057 D1058 S1060 V1062 Y1067 Y1136	R1018-Q1020 PolarHBondContact O-N 2.93Å; R1018-L1021 WeakPolarHBondContact O-CB 3.39Å; R1018-L1021 WeakPolarHBondContact O-CG 3.36Å; R1018-L1021 PolarHBondContact O-N 3.01Å; R1018-F1032 WeakPolarHBondContact O-CE2 3.38Å; R1018-S1036 WeakPolarHBondContact CD-O 3.4Å; R1018-S1036 PolarHBondContact NE-O 2.95Å; R1018-I1039 VanDerWaalsContact CZ-O 3.25Å; R1018-I1039 PolarHBondContact NE-O 2.99Å; R1018-I1039 PolarHBondContact NH2-O 3.23Å; R1018-I1041 HydrophobicContact CG-CD1 4.09Å; R1018-L1057 PolarHBondContact NH1-O 2.87Å; R1018-D1058 WeakPolarHBondContact CD-OD1 3.24Å; R1018-D1058 HydrophobicContact CG-CB 4.17Å; R1018-D1058 WeakPolarHBondContact CG-OD1 3.48Å; R1018-D1058 PolarHBondContact N-OD2 3.27Å; R1018-S1060 PolarHBondContact NH1-O 2.79Å; R1018-S1060 PolarHBondContact NH2-O 3.42Å; R1018-V1062 PolarHBondContact NH1-O 2.59Å; R1018-Y1067 WeakPolarHBondContact CD-OH 3.3Å; R1018-Y1067 PolarHBondContact NH1-OH 3.16Å; R1018-Y1136 PolarHBondContact NH2-OH 3.13Å
1019	T	88.3	Confident	87.1	Confident	85 Å²	85	61.9 Å²	61.9	52%	0.521	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-29	179.4	-48.4	0	0	0	0	112.7	N1017 L1021 V1022 T1023	N1017-T1019 PolarHBondContact O-N 3.26Å; N1017-T1019 VanDerWaalsContact OD1-CB 3.31Å; N1017-T1019 WeakPolarHBondContact OD1-CB 3.3Å; N1017-T1019 PolarHBondContact OD1-N 2.97Å; T1019-L1021 PolarHBondContact O-N 3.37Å; T1019-V1022 PolarHBondContact O-N 3.4Å; T1019-T1023 HydrophobicContact CG2-CG2 4.33Å; T1019-T1023 PolarHBondContact O-N 3.18Å; T1019-T1023 VanDerWaalsContact O-N 3.14Å; T1019-T1023 PolarHBondContact O-OG1 2.98Å
1020	Q	90.1	Very high	87.4	Confident	26 Å²	26	61.3 Å²	61.3	12%	0.121	32%	0.321	C	S	.	.	H	α-helix	trans	-62.8	-19.6	174	-72.4	171	-13	0	0	113.6	L1015 E1016 N1017 R1018 V1022 T1023 V1024 C1025	L1015-Q1020 HydrophobicContact CD1-CB 3.58Å; E1016-Q1020 PolarHBondContact OE2-NE2 2.86Å; N1017-Q1020 WeakPolarHBondContact O-CB 3.34Å; N1017-Q1020 PolarHBondContact O-N 3.32Å; N1017-Q1020 PolarHBondContact OD1-N 3.19Å; R1018-Q1020 PolarHBondContact O-N 2.93Å; Q1020-V1022 PolarHBondContact O-N 3.23Å; Q1020-T1023 WeakPolarHBondContact CA-OG1 3.31Å; Q1020-T1023 PolarHBondContact O-N 3Å; Q1020-V1024 HydrophobicContact CB-CB 4.32Å; Q1020-V1024 HydrophobicContact CB-CG2 4Å; Q1020-V1024 HydrophobicContact CG-CG2 3.98Å; Q1020-V1024 WeakPolarHBondContact O-CA 3.28Å; Q1020-V1024 WeakPolarHBondContact O-CB 3.43Å; Q1020-V1024 PolarHBondContact O-N 2.97Å; Q1020-C1025 PolarHBondContact O-N 2.92Å
1021	L	90.5	Very high	87.8	Confident	0 Å²	0	56.1 Å²	56.1	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-60.8	-30.1	170.7	-64.9	171.1	0	0	0	112.4	I977 L1004 L1015 R1018 T1019 C1025 H1026 L1027 F1032 I1039	I977-L1021 HydrophobicContact CD1-CD2 4.3Å; L1004-L1021 HydrophobicContact CD1-CD2 4.24Å; L1015-L1021 HydrophobicContact CD1-CD2 4.09Å; L1015-L1021 HydrophobicContact CD1-CG 4.26Å; L1015-L1021 HydrophobicContact CD2-CD2 3.75Å; L1015-L1021 HydrophobicContact CD2-CG 4.02Å; R1018-L1021 WeakPolarHBondContact O-CB 3.39Å; R1018-L1021 WeakPolarHBondContact O-CG 3.36Å; R1018-L1021 PolarHBondContact O-N 3.01Å; T1019-L1021 PolarHBondContact O-N 3.37Å; L1021-C1025 CarbonylContact O-C 3.43Å; L1021-C1025 WeakPolarHBondContact O-CB 3.32Å; L1021-H1026 PolarHBondContact O-N 2.71Å; L1021-L1027 HydrophobicContact CB-CD1 4.23Å; L1021-L1027 HydrophobicContact CD2-CD1 4.45Å; L1021-L1027 WeakPolarHBondContact O-CB 3.29Å; L1021-L1027 WeakPolarHBondContact O-CG 3.41Å; L1021-L1027 PolarHBondContact O-N 2.78Å; L1021-F1032 HydrophobicContact CB-CD2 3.97Å; L1021-F1032 HydrophobicContact CB-CE2 4.13Å; L1021-F1032 HydrophobicContact CD1-CD2 4.34Å; L1021-F1032 HydrophobicContact CD1-CE2 4.21Å; L1021-I1039 HydrophobicContact CD1-CD1 3.61Å; L1021-I1039 HydrophobicContact CD1-CG2 4.35Å; L1021-I1039 HydrophobicContact CD2-CD1 4.36Å
1022	V	91	Very high	88.4	Confident	54 Å²	54	55.5 Å²	55.5	33%	0.327	29%	0.288	S	S	.	.	H	α-helix	trans	-89.9	-49.2	175.1	-175.6	0	0	0	0	110.5	T1019 Q1020 H1026 F1032	T1019-V1022 PolarHBondContact O-N 3.4Å; Q1020-V1022 PolarHBondContact O-N 3.23Å; V1022-H1026 WeakPolarHBondContact O-CA 3.26Å; V1022-H1026 PolarHBondContact O-N 2.67Å; V1022-F1032 HydrophobicContact CG2-CB 3.96Å; V1022-F1032 HydrophobicContact CG2-CD1 3.9Å; V1022-F1032 HydrophobicContact CG2-CD2 3.52Å; V1022-F1032 HydrophobicContact CG2-CE1 4.29Å; V1022-F1032 HydrophobicContact CG2-CE2 3.95Å; V1022-F1032 HydrophobicContact CG2-CG 3.49Å; V1022-F1032 VanDerWaalsContact CG2-CG 3.49Å; V1022-F1032 HydrophobicContact CG2-CZ 4.31Å
1023	T	88.6	Confident	89.2	Confident	93 Å²	93	51.2 Å²	51.2	57%	0.571	27%	0.265	S	S	*	.	H	α-helix	trans	-82	-21.7	-169.8	61.5	0	0	0	0	115	T1019 Q1020	T1019-T1023 HydrophobicContact CG2-CG2 4.33Å; T1019-T1023 PolarHBondContact O-N 3.18Å; T1019-T1023 VanDerWaalsContact O-N 3.14Å; T1019-T1023 PolarHBondContact O-OG1 2.98Å; Q1020-T1023 WeakPolarHBondContact CA-OG1 3.31Å; Q1020-T1023 PolarHBondContact O-N 3Å
1024	V	86.3	Confident	90.2	Very high	42 Å²	42	46.6 Å²	46.6	26%	0.255	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-116.7	-41.6	179.2	-177.5	0	0	0	0	111.2	Q1020	Q1020-V1024 HydrophobicContact CB-CB 4.32Å; Q1020-V1024 HydrophobicContact CB-CG2 4Å; Q1020-V1024 HydrophobicContact CG-CG2 3.98Å; Q1020-V1024 WeakPolarHBondContact O-CA 3.28Å; Q1020-V1024 WeakPolarHBondContact O-CB 3.43Å; Q1020-V1024 PolarHBondContact O-N 2.97Å
1025	C	87.2	Confident	90.8	Very high	9 Å²	9	40.7 Å²	40.7	6%	0.061	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.8	0.2	-178.5	-50.7	0	0	0	0	114.6	L1004 L1007 Q1020 L1021 L1027	L1004-C1025 HydrophobicContact CD1-CB 3.5Å; L1004-C1025 VanDerWaalsContact CD1-CB 3.5Å; L1007-C1025 HydrophobicContact CD2-CB 4.35Å; Q1020-C1025 PolarHBondContact O-N 2.92Å; L1021-C1025 CarbonylContact O-C 3.43Å; L1021-C1025 WeakPolarHBondContact O-CB 3.32Å; C1025-L1027 PolarHBondContact O-N 2.83Å; C1025-L1027 VanDerWaalsContact O-N 3.1Å
1026	H	87.8	Confident	91.1	Very high	152 Å²	152	40.6 Å²	40.6	70%	0.704	22%	0.22	S	C	*	.			trans	53	28.4	176.9	-53.4	-64.9	0	0	0	114.9	L1021 V1022 G1028	L1021-H1026 PolarHBondContact O-N 2.71Å; V1022-H1026 WeakPolarHBondContact O-CA 3.26Å; V1022-H1026 PolarHBondContact O-N 2.67Å; H1026-G1028 PolarHBondContact O-N 3.12Å
1027	L	89.9	Confident	91.4	Very high	21 Å²	21	38 Å²	38	11%	0.11	21%	0.209	C	C	.	.			trans	-69.8	128.6	172.2	-62.1	-171.9	0	0	0	109.9	L1004 L1021 C1025 V1031	L1004-L1027 HydrophobicContact CD2-CD1 4.42Å; L1021-L1027 HydrophobicContact CB-CD1 4.23Å; L1021-L1027 HydrophobicContact CD2-CD1 4.45Å; L1021-L1027 WeakPolarHBondContact O-CB 3.29Å; L1021-L1027 WeakPolarHBondContact O-CG 3.41Å; L1021-L1027 PolarHBondContact O-N 2.78Å; C1025-L1027 PolarHBondContact O-N 2.83Å; C1025-L1027 VanDerWaalsContact O-N 3.1Å; L1027-V1031 HydrophobicContact CD1-CG1 4.41Å; L1027-V1031 HydrophobicContact CD2-CG1 4.37Å
1028	G	91.7	Very high	91.7	Very high	21 Å²	21	36.9 Å²	36.9	22%	0.216	20%	0.203	C	C	.	.			trans	-66.8	159.4	177	0	0	0	0	0	113	D288 H1026 R1030 V1031 F1032	D288-G1028 VanDerWaalsContact CG-C 3.47Å; D288-G1028 VanDerWaalsContact CG-CA 3.46Å; D288-G1028 VanDerWaalsContact OD1-CA 3.3Å; D288-G1028 WeakPolarHBondContact OD1-CA 3.33Å; H1026-G1028 PolarHBondContact O-N 3.12Å; G1028-R1030 VanDerWaalsContact C-N 3.33Å; G1028-R1030 PolarHBondContact O-N 2.78Å; G1028-V1031 PolarHBondContact O-N 2.81Å; G1028-F1032 WeakPolarHBondContact O-CB 3.4Å; G1028-F1032 PolarHBondContact O-N 2.86Å
1029	P	93.3	Very high	91.8	Very high	86 Å²	86	36.9 Å²	36.9	56%	0.558	20%	0.202	S	C	*	.	H	α-helix	trans	-53.9	-39.5	-175.6	-29	36.2	0	0	0	115.4	D288 I1033	D288-P1029 VanDerWaalsContact OD2-CD 3.26Å; D288-P1029 WeakPolarHBondContact OD2-CD 3.42Å; D288-P1029 VanDerWaalsContact OD2-N 3.11Å; P1029-I1033 WeakPolarHBondContact O-CB 3.33Å; P1029-I1033 WeakPolarHBondContact O-CD1 3.48Å; P1029-I1033 VanDerWaalsContact O-CG1 3.25Å; P1029-I1033 WeakPolarHBondContact O-CG1 3.42Å; P1029-I1033 PolarHBondContact O-N 3.2Å
1030	R	93.3	Very high	91.9	Very high	93 Å²	93	35.4 Å²	35.4	35%	0.351	19%	0.189	S	C	.	.	H	α-helix	trans	-69.3	-46.4	-179.2	-60.3	-66.1	-176.7	176.3	-2.6	111.1	D288 Q359 G1028 N1034	D288-R1030 WeakPolarHBondContact O-CB 3.34Å; D288-R1030 PolarHBondContact OD1-N 2.93Å; D288-R1030 WeakPolarHBondContact OD2-CB 3.11Å; D288-R1030 WeakPolarHBondContact OD2-CG 3.26Å; D288-R1030 PolarHBondContact OD2-N 2.7Å; Q359-R1030 PolarHBondContact O-NH1 2.97Å; G1028-R1030 VanDerWaalsContact C-N 3.33Å; G1028-R1030 PolarHBondContact O-N 2.78Å; R1030-N1034 PolarHBondContact O-N 3.19Å; R1030-N1034 PolarHBondContact O-ND2 3.4Å
1031	V	94.6	Very high	91.9	Very high	3 Å²	3	34.2 Å²	34.2	2%	0.018	18%	0.183	C	C	.	.	H	α-helix	trans	-64.2	-41.8	176.1	174.3	0	0	0	0	110.7	D288 L996 K1000 L1027 G1028 N1034 C1035	D288-V1031 WeakPolarHBondContact OD1-CG2 3.42Å; D288-V1031 PolarHBondContact OD1-N 3.44Å; L996-V1031 HydrophobicContact CD2-CG1 3.85Å; K1000-V1031 HydrophobicContact CD-CG1 4.5Å; K1000-V1031 HydrophobicContact CD-CG2 4.2Å; L1027-V1031 HydrophobicContact CD1-CG1 4.41Å; L1027-V1031 HydrophobicContact CD2-CG1 4.37Å; G1028-V1031 PolarHBondContact O-N 2.81Å; V1031-N1034 PolarHBondContact O-N 3.36Å; V1031-C1035 PolarHBondContact O-N 2.82Å; V1031-C1035 PolarHBondContact O-SG 3.46Å
1032	F	95.3	Very high	91.7	Very high	32 Å²	32	36.6 Å²	36.6	14%	0.14	20%	0.196	C	C	.	.	H	α-helix	trans	-62.3	-45.3	178.4	174.6	-104.2	0	0	0	113.6	R1018 L1021 V1022 G1028 N1034 C1035 S1036 P1064	R1018-F1032 WeakPolarHBondContact O-CE2 3.38Å; L1021-F1032 HydrophobicContact CB-CD2 3.97Å; L1021-F1032 HydrophobicContact CB-CE2 4.13Å; L1021-F1032 HydrophobicContact CD1-CD2 4.34Å; L1021-F1032 HydrophobicContact CD1-CE2 4.21Å; V1022-F1032 HydrophobicContact CG2-CB 3.96Å; V1022-F1032 HydrophobicContact CG2-CD1 3.9Å; V1022-F1032 HydrophobicContact CG2-CD2 3.52Å; V1022-F1032 HydrophobicContact CG2-CE1 4.29Å; V1022-F1032 HydrophobicContact CG2-CE2 3.95Å; V1022-F1032 HydrophobicContact CG2-CG 3.49Å; V1022-F1032 VanDerWaalsContact CG2-CG 3.49Å; V1022-F1032 HydrophobicContact CG2-CZ 4.31Å; G1028-F1032 WeakPolarHBondContact O-CB 3.4Å; G1028-F1032 PolarHBondContact O-N 2.86Å; F1032-N1034 VanDerWaalsContact C-N 3.3Å; F1032-N1034 PolarHBondContact O-N 2.69Å; F1032-C1035 PolarHBondContact O-N 3.48Å; F1032-S1036 WeakPolarHBondContact O-CB 3.42Å; F1032-S1036 PolarHBondContact O-N 2.91Å; F1032-S1036 PolarHBondContact O-OG 2.73Å; F1032-P1064 HydrophobicContact CZ-CG 4.33Å
1033	I	95.1	Very high	91.3	Very high	53 Å²	53	35 Å²	35	27%	0.272	19%	0.187	S	C	.	.	H	α-helix	trans	-59.8	-44.5	175	-70.8	164.8	0	0	0	109.9	L361 F365 P1029 C1035 H1063	L361-I1033 HydrophobicContact CD2-CG2 3.76Å; F365-I1033 HydrophobicContact CD2-CG2 4.32Å; F365-I1033 VanDerWaalsContact CD2-O 3.24Å; F365-I1033 WeakPolarHBondContact CD2-O 3.45Å; F365-I1033 HydrophobicContact CE1-CG2 4.39Å; F365-I1033 HydrophobicContact CE2-CG2 3.64Å; F365-I1033 WeakPolarHBondContact CE2-O 3.35Å; F365-I1033 HydrophobicContact CZ-CG2 3.68Å; P1029-I1033 WeakPolarHBondContact O-CB 3.33Å; P1029-I1033 WeakPolarHBondContact O-CD1 3.48Å; P1029-I1033 VanDerWaalsContact O-CG1 3.25Å; P1029-I1033 WeakPolarHBondContact O-CG1 3.42Å; P1029-I1033 PolarHBondContact O-N 3.2Å; I1033-C1035 PolarHBondContact O-N 3.27Å; I1033-H1063 PolarHBondContact O-NE2 3.46Å
1034	N	95.1	Very high	90.8	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-65.4	-36.3	179.9	-82.7	-83	0	0	0	113.7	Q360 L361 E362 C994 R1030 V1031 F1032 F1038	Q360-N1034 PolarHBondContact O-ND2 3.36Å; L361-N1034 WeakPolarHBondContact CA-OD1 3.48Å; E362-N1034 PolarHBondContact N-OD1 3.48Å; C994-N1034 VanDerWaalsContact CB-O 3.31Å; C994-N1034 WeakPolarHBondContact CB-O 3.36Å; C994-N1034 CarbonylContact O-C 3.59Å; C994-N1034 PolarHBondContact SG-O 3Å; R1030-N1034 PolarHBondContact O-N 3.19Å; R1030-N1034 PolarHBondContact O-ND2 3.4Å; V1031-N1034 PolarHBondContact O-N 3.36Å; F1032-N1034 VanDerWaalsContact C-N 3.3Å; F1032-N1034 PolarHBondContact O-N 2.69Å; N1034-F1038 VanDerWaalsContact O-CD2 3.3Å; N1034-F1038 WeakPolarHBondContact O-CD2 3.49Å; N1034-F1038 WeakPolarHBondContact O-CE2 3.46Å
1035	C	94.9	Very high	90.2	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-96.5	-32.7	-171.2	74.5	0	0	0	0	115.3	I993 C994 L996 V1031 F1032 I1033 G1037 F1038 I1039	I993-C1035 HydrophobicContact CG2-CB 3.81Å; C994-C1035 WeakPolarHBondContact O-CA 3.21Å; C994-C1035 WeakPolarHBondContact O-CB 2.8Å; C994-C1035 PolarHBondContact O-N 3.02Å; L996-C1035 HydrophobicContact CG-CB 4.35Å; V1031-C1035 PolarHBondContact O-N 2.82Å; V1031-C1035 PolarHBondContact O-SG 3.46Å; F1032-C1035 PolarHBondContact O-N 3.48Å; I1033-C1035 PolarHBondContact O-N 3.27Å; C1035-G1037 PolarHBondContact O-N 3.36Å; C1035-F1038 PolarHBondContact O-N 3.45Å; C1035-I1039 HydrophobicContact CB-CD1 4.01Å; C1035-I1039 PolarHBondContact O-N 3.06Å
1036	S	94.1	Very high	89.7	Confident	0 Å²	0	36.1 Å²	36.1	0%	0	20%	0.2	C	C	.	.	G	3₁₀ helix	trans	-62.2	-42.3	-159.4	58.8	0	0	0	0	114.5	R1018 F1032 F1038 I1039 H1063	R1018-S1036 WeakPolarHBondContact CD-O 3.4Å; R1018-S1036 PolarHBondContact NE-O 2.95Å; F1032-S1036 WeakPolarHBondContact O-CB 3.42Å; F1032-S1036 PolarHBondContact O-N 2.91Å; F1032-S1036 PolarHBondContact O-OG 2.73Å; S1036-F1038 PolarHBondContact O-N 2.94Å; S1036-I1039 PolarHBondContact O-N 2.95Å; S1036-I1039 VanDerWaalsContact O-N 3.17Å; S1036-H1063 PolarHBondContact OG-NE2 2.93Å; S1036-H1063 VanDerWaalsContact OG-NE2 3.08Å
1037	G	92.1	Very high	88.5	Confident	1 Å²	1	31.5 Å²	31.5	1%	0.01	19%	0.193	C	C	.	.	G	3₁₀ helix	trans	-67.3	-13.3	176.6	0	0	0	0	0	115.2	Y369 C1035 Y1136	Y369-G1037 VanDerWaalsContact OH-C 3.3Å; Y369-G1037 PolarHBondContact OH-O 2.88Å; Y369-G1037 VanDerWaalsContact OH-O 3.09Å; C1035-G1037 PolarHBondContact O-N 3.36Å; G1037-Y1136 PolarHBondContact O-OH 2.86Å
1038	F	94.9	Very high	87.2	Confident	2 Å²	2	39.1 Å²	39.1	1%	0.009	23%	0.234	C	C	.	.	G	3₁₀ helix	trans	-97.8	-11	176.3	-54.8	-63.3	0	0	0	113	P364 F368 Y369 S971 G974 L975 I993 C994 N1034 C1035 S1036	P364-F1038 HydrophobicContact CB-CE2 4.48Å; P364-F1038 HydrophobicContact CB-CZ 4.17Å; F368-F1038 HydrophobicContact CB-CE1 3.99Å; F368-F1038 HydrophobicContact CB-CZ 4.01Å; F368-F1038 AromaticContact CD2-CE1 3.87Å; F368-F1038 HydrophobicContact CD2-CE1 3.87Å; F368-F1038 HydrophobicContact CD2-CZ 4.12Å; F368-F1038 AromaticContact CG-CE1 3.88Å; F368-F1038 HydrophobicContact CG-CE1 3.88Å; F368-F1038 HydrophobicContact CG-CZ 4.25Å; Y369-F1038 HydrophobicContact CD2-CZ 4.23Å; Y369-F1038 HydrophobicContact CE2-CD1 4.5Å; Y369-F1038 HydrophobicContact CE2-CD2 4.49Å; Y369-F1038 AromaticContact CE2-CE1 3.82Å; Y369-F1038 HydrophobicContact CE2-CE1 3.82Å; Y369-F1038 AromaticContact CE2-CE2 3.8Å; Y369-F1038 HydrophobicContact CE2-CE2 3.8Å; Y369-F1038 AromaticContact CE2-CZ 3.44Å; Y369-F1038 HydrophobicContact CE2-CZ 3.44Å; Y369-F1038 VanDerWaalsContact CE2-CZ 3.44Å; S971-F1038 WeakPolarHBondContact O-CD1 3.27Å; S971-F1038 WeakPolarHBondContact O-CE1 3.33Å; G974-F1038 VanDerWaalsContact CA-O 3.3Å; G974-F1038 WeakPolarHBondContact CA-O 3.48Å; L975-F1038 PolarHBondContact N-O 3.08Å; I993-F1038 HydrophobicContact CD1-CB 3.89Å; C994-F1038 HydrophobicContact CB-CD2 3.53Å; C994-F1038 HydrophobicContact CB-CE2 3.43Å; C994-F1038 VanDerWaalsContact CB-CE2 3.43Å; C994-F1038 HydrophobicContact CB-CZ 4.43Å; N1034-F1038 VanDerWaalsContact O-CD2 3.3Å; N1034-F1038 WeakPolarHBondContact O-CD2 3.49Å; N1034-F1038 WeakPolarHBondContact O-CE2 3.46Å; C1035-F1038 PolarHBondContact O-N 3.45Å; S1036-F1038 PolarHBondContact O-N 2.94Å
1039	I	93.4	Very high	86	Confident	1 Å²	1	42 Å²	42	1%	0.005	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	111.7	174.2	-67.7	165.3	0	0	0	108.3	L975 I977 L1015 R1018 L1021 C1035 S1036	L975-I1039 CarbonylContact O-C 3.55Å; L975-I1039 WeakPolarHBondContact O-CA 3.48Å; I977-I1039 HydrophobicContact CB-CG2 4.5Å; I977-I1039 HydrophobicContact CD1-CB 4.41Å; I977-I1039 HydrophobicContact CD1-CD1 3.76Å; I977-I1039 HydrophobicContact CD1-CG1 3.88Å; I977-I1039 HydrophobicContact CD1-CG2 3.64Å; I977-I1039 HydrophobicContact CG1-CG1 4.49Å; I977-I1039 HydrophobicContact CG1-CG2 3.94Å; L1015-I1039 HydrophobicContact CD2-CG2 4.36Å; R1018-I1039 VanDerWaalsContact CZ-O 3.25Å; R1018-I1039 PolarHBondContact NE-O 2.99Å; R1018-I1039 PolarHBondContact NH2-O 3.23Å; L1021-I1039 HydrophobicContact CD1-CD1 3.61Å; L1021-I1039 HydrophobicContact CD1-CG2 4.35Å; L1021-I1039 HydrophobicContact CD2-CD1 4.36Å; C1035-I1039 HydrophobicContact CB-CD1 4.01Å; C1035-I1039 PolarHBondContact O-N 3.06Å; S1036-I1039 PolarHBondContact O-N 2.95Å; S1036-I1039 VanDerWaalsContact O-N 3.17Å
1040	K	91	Very high	84.8	Confident	55 Å²	55	39.3 Å²	39.3	24%	0.239	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	146.9	169.9	-179.2	-179.9	177.9	-148.2	0	109.9	L975 D976 D1042 Y1136	L975-K1040 PolarHBondContact O-N 2.99Å; D976-K1040 WeakPolarHBondContact CA-O 3.38Å; D976-K1040 HydrophobicContact CB-CB 4.25Å; D976-K1040 HydrophobicContact CB-CG 4.47Å; K1040-D1042 IonicContact NZ-OD2 2.77Å; K1040-Y1136 HydrophobicContact CB-CD2 3.84Å; K1040-Y1136 HydrophobicContact CB-CE1 4.33Å; K1040-Y1136 HydrophobicContact CB-CE2 3.45Å; K1040-Y1136 VanDerWaalsContact CB-CE2 3.45Å; K1040-Y1136 HydrophobicContact CB-CG 4.46Å; K1040-Y1136 HydrophobicContact CD-CD2 3.73Å; K1040-Y1136 HydrophobicContact CD-CE2 4.26Å; K1040-Y1136 HydrophobicContact CD-CG 4.04Å; K1040-Y1136 HydrophobicContact CG-CD2 3.54Å; K1040-Y1136 HydrophobicContact CG-CE2 3.6Å; K1040-Y1136 HydrophobicContact CG-CG 4.27Å
1041	I	90.4	Very high	83.6	Confident	0 Å²	0	45 Å²	45	0%	0	26%	0.263	C	S	.	.			trans	-123.7	122.9	158	-58.9	176.2	0	0	0	107.7	L1015 R1018 T1043 L1046 D1058 G1059	L1015-I1041 HydrophobicContact CB-CD1 4.47Å; L1015-I1041 HydrophobicContact CD2-CD1 3.71Å; L1015-I1041 HydrophobicContact CD2-CG1 4.1Å; L1015-I1041 HydrophobicContact CG-CD1 3.82Å; L1015-I1041 WeakPolarHBondContact O-CG2 3.36Å; R1018-I1041 HydrophobicContact CG-CD1 4.09Å; I1041-T1043 VanDerWaalsContact C-N 3.33Å; I1041-T1043 PolarHBondContact O-N 2.81Å; I1041-L1046 HydrophobicContact CG2-CD1 3.52Å; I1041-D1058 HydrophobicContact CB-CB 4.19Å; I1041-D1058 HydrophobicContact CD1-CB 4.31Å; I1041-D1058 PolarHBondContact N-O 2.55Å; I1041-D1058 VanDerWaalsContact N-O 3.09Å; I1041-G1059 WeakPolarHBondContact O-CA 3.07Å
1042	D	85	Confident	82.4	Confident	51 Å²	51	46.6 Å²	46.6	27%	0.273	28%	0.277	S	S	.	.			trans	-72.5	86.2	173.2	-163.6	-17.1	0	0	0	112.1	D976 K1040 S1044 S1045	D976-D1042 WeakPolarHBondContact OD2-CB 3.13Å; D976-D1042 PolarHBondContact OD2-N 2.9Å; K1040-D1042 IonicContact NZ-OD2 2.77Å; D1042-S1044 PolarHBondContact O-N 2.86Å; D1042-S1044 WeakPolarHBondContact OD1-CB 3.3Å; D1042-S1044 PolarHBondContact OD1-N 3.29Å; D1042-S1044 VanDerWaalsContact OD1-N 3.16Å; D1042-S1044 PolarHBondContact OD1-OG 2.89Å; D1042-S1045 WeakPolarHBondContact O-CB 3.22Å; D1042-S1045 PolarHBondContact O-N 3.41Å; D1042-S1045 PolarHBondContact O-OG 2.94Å
1043	T	82.6	Confident	81.4	Confident	21 Å²	21	51.2 Å²	51.2	13%	0.129	29%	0.294	C	S	.	.	G	3₁₀ helix	trans	-57.5	-28.2	177.4	53.4	0	0	0	0	113.4	I1041 S1045 L1046 G1047 V1054 D1058	I1041-T1043 VanDerWaalsContact C-N 3.33Å; I1041-T1043 PolarHBondContact O-N 2.81Å; T1043-S1045 PolarHBondContact O-N 2.7Å; T1043-L1046 PolarHBondContact O-N 2.87Å; T1043-L1046 VanDerWaalsContact O-N 3.09Å; T1043-G1047 PolarHBondContact O-N 2.88Å; T1043-V1054 HydrophobicContact CG2-CG1 3.64Å; T1043-D1058 HydrophobicContact CG2-CB 4.44Å
1044	S	78.1	Confident	80.6	Confident	105 Å²	105	50.2 Å²	50.2	73%	0.734	29%	0.291	S	S	*	.	G	3₁₀ helix	trans	-67.1	-22.2	175.3	80.7	0	0	0	0	113.2	D1042	D1042-S1044 PolarHBondContact O-N 2.86Å; D1042-S1044 WeakPolarHBondContact OD1-CB 3.3Å; D1042-S1044 PolarHBondContact OD1-N 3.29Å; D1042-S1044 VanDerWaalsContact OD1-N 3.16Å; D1042-S1044 PolarHBondContact OD1-OG 2.89Å
1045	S	75	Confident	80.2	Confident	58 Å²	58	50.9 Å²	50.9	41%	0.406	29%	0.294	S	S	.	.	G	3₁₀ helix	trans	-86.1	-11.4	174.2	78.7	0	0	0	0	114	D1042 T1043	D1042-S1045 WeakPolarHBondContact O-CB 3.22Å; D1042-S1045 PolarHBondContact O-N 3.41Å; D1042-S1045 PolarHBondContact O-OG 2.94Å; T1043-S1045 PolarHBondContact O-N 2.7Å
1046	L	76.2	Confident	79.8	Confident	3 Å²	3	52.1 Å²	52.1	2%	0.016	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.3	-29.9	-172.8	-71.1	174.1	0	0	0	114.3	E1016 I1041 T1043 D1048 S1049 V1054	E1016-L1046 WeakPolarHBondContact O-CD1 3.42Å; I1041-L1046 HydrophobicContact CG2-CD1 3.52Å; T1043-L1046 PolarHBondContact O-N 2.87Å; T1043-L1046 VanDerWaalsContact O-N 3.09Å; L1046-D1048 VanDerWaalsContact C-N 3.33Å; L1046-D1048 PolarHBondContact O-N 2.72Å; L1046-D1048 VanDerWaalsContact O-N 3.11Å; L1046-S1049 WeakPolarHBondContact CA-OG 3.47Å; L1046-S1049 WeakPolarHBondContact O-CA 3.32Å; L1046-S1049 PolarHBondContact O-N 2.95Å; L1046-S1049 PolarHBondContact O-OG 3.4Å; L1046-V1054 HydrophobicContact CB-CG2 4.25Å
1047	G	61.9	Low	79.7	Confident	55 Å²	55	52.2 Å²	52.2	57%	0.567	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.9	-34.9	-163.4	0	0	0	0	0	117.4	T1043	T1043-G1047 PolarHBondContact O-N 2.88Å
1048	D	63.7	Low	79.6	Confident	182 Å²	182	52.3 Å²	52.3	97%	0.973	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.3	-2.2	177.3	-75	-30.3	0	0	0	113.8	L1046	L1046-D1048 VanDerWaalsContact C-N 3.33Å; L1046-D1048 PolarHBondContact O-N 2.72Å; L1046-D1048 VanDerWaalsContact O-N 3.11Å
1049	S	66.9	Low	79.4	Confident	80 Å²	80	52.4 Å²	52.4	56%	0.559	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-120.5	-10.7	-159.2	73.6	0	0	0	0	116.4	L1046	L1046-S1049 WeakPolarHBondContact CA-OG 3.47Å; L1046-S1049 WeakPolarHBondContact O-CA 3.32Å; L1046-S1049 PolarHBondContact O-N 2.95Å; L1046-S1049 PolarHBondContact O-OG 3.4Å
1050	T	68.1	Low	79.3	Confident	31 Å²	31	52.3 Å²	52.3	19%	0.19	30%	0.303	C	S	.	.			trans	-128.9	152.3	178.7	-175.4	0	0	0	0	112.4	E1016 A1052 V1054	E1016-T1050 VanDerWaalsContact CD-OG1 3.27Å; E1016-T1050 VanDerWaalsContact OE1-CB 3.22Å; E1016-T1050 WeakPolarHBondContact OE1-CB 3.49Å; E1016-T1050 PolarHBondContact OE1-OG1 3.25Å; T1050-A1052 HydrophobicContact CG2-CB 4.46Å; T1050-A1052 WeakPolarHBondContact OG1-CB 3.43Å; T1050-A1052 PolarHBondContact OG1-N 2.86Å; T1050-V1054 HydrophobicContact CG2-CG2 3.62Å
1051	E	68.1	Low	79.4	Confident	211 Å²	211	50.5 Å²	50.5	99%	0.986	30%	0.295	S	S	*	.	S	Bend	trans	-91.5	-4.3	168.6	-63	-177.7	179.4	0	0	111.9
1052	A	69.5	Low	79.6	Confident	37 Å²	37	50.7 Å²	50.7	31%	0.306	30%	0.296	S	S	.	.	S	Bend	trans	-78.9	156.2	178.7	0	0	0	0	0	112.5	T1050 V1054	T1050-A1052 HydrophobicContact CG2-CB 4.46Å; T1050-A1052 WeakPolarHBondContact OG1-CB 3.43Å; T1050-A1052 PolarHBondContact OG1-N 2.86Å; A1052-V1054 PolarHBondContact O-N 3.41Å
1053	Y	72.7	Confident	80	Confident	130 Å²	130	48.4 Å²	48.4	51%	0.51	28%	0.283	S	S	.	.			trans	-65.2	116.1	169.3	173.8	-101.6	0	0	0	110	E1055 A1088	Y1053-E1055 HydrophobicContact CD1-CB 4.37Å; Y1053-E1055 HydrophobicContact CE1-CB 3.83Å; Y1053-E1055 HydrophobicContact CE1-CG 4.5Å; Y1053-E1055 PolarHBondContact OH-OE2 3.21Å; Y1053-A1088 HydrophobicContact CE2-CB 4.25Å
1054	V	79.4	Confident	80.5	Confident	32 Å²	32	49.1 Å²	49.1	19%	0.194	29%	0.288	C	S	.	.			trans	-88.5	108.6	174.3	-178.8	0	0	0	0	108.2	T1043 L1046 T1050 A1052 V1056	T1043-V1054 HydrophobicContact CG2-CG1 3.64Å; L1046-V1054 HydrophobicContact CB-CG2 4.25Å; T1050-V1054 HydrophobicContact CG2-CG2 3.62Å; A1052-V1054 PolarHBondContact O-N 3.41Å; V1054-V1056 PolarHBondContact O-N 2.64Å
1055	E	85.6	Confident	81	Confident	14 Å²	14	47.9 Å²	47.9	7%	0.065	27%	0.271	C	S	.	.			trans	-78.1	108.4	175.2	176.4	52.3	-91.5	0	0	109.3	Y1053 L1057 D1058 Y1067 R1071	Y1053-E1055 HydrophobicContact CD1-CB 4.37Å; Y1053-E1055 HydrophobicContact CE1-CB 3.83Å; Y1053-E1055 HydrophobicContact CE1-CG 4.5Å; Y1053-E1055 PolarHBondContact OH-OE2 3.21Å; E1055-L1057 HydrophobicContact CG-CB 4.1Å; E1055-L1057 PolarHBondContact O-N 3.04Å; E1055-L1057 VanDerWaalsContact O-N 3.1Å; E1055-L1057 WeakPolarHBondContact OE1-CG 3.43Å; E1055-L1057 PolarHBondContact OE1-N 3Å; E1055-D1058 WeakPolarHBondContact O-CB 3.5Å; E1055-D1058 PolarHBondContact O-N 3.11Å; E1055-Y1067 HydrophobicContact CG-CD2 3.85Å; E1055-Y1067 HydrophobicContact CG-CE2 3.51Å; E1055-R1071 IonicContact OE2-CZ 2.64Å; E1055-R1071 IonicContact OE2-NH1 3.81Å; E1055-R1071 PolarHBondContact OE2-NH1 3.1Å
1056	V	87.2	Confident	81.8	Confident	25 Å²	25	45.4 Å²	45.4	15%	0.152	25%	0.253	C	S	.	.	G	3₁₀ helix	trans	-60.5	-27	-173.9	-164.2	0	0	0	0	111.5	V1054 D1058 G1059 E1092 L1095	V1054-V1056 PolarHBondContact O-N 2.64Å; V1056-D1058 VanDerWaalsContact C-N 3.27Å; V1056-D1058 PolarHBondContact O-N 3.14Å; V1056-G1059 PolarHBondContact O-N 3.15Å; V1056-G1059 VanDerWaalsContact O-N 3.09Å; V1056-E1092 HydrophobicContact CG2-CG 4.33Å; V1056-L1095 HydrophobicContact CB-CD1 4.43Å; V1056-L1095 HydrophobicContact CG1-CD1 3.43Å; V1056-L1095 VanDerWaalsContact CG1-CD1 3.43Å
1057	L	91.6	Very high	82.6	Confident	3 Å²	3	46.2 Å²	46.2	2%	0.016	26%	0.256	C	S	.	.	G	3₁₀ helix	trans	-66.1	-20.3	175.5	-61.5	174.4	0	0	0	114.3	R1018 E1055 G1059 S1060 V1062 Y1067 A1070 L1091 L1132	R1018-L1057 PolarHBondContact NH1-O 2.87Å; E1055-L1057 HydrophobicContact CG-CB 4.1Å; E1055-L1057 PolarHBondContact O-N 3.04Å; E1055-L1057 VanDerWaalsContact O-N 3.1Å; E1055-L1057 WeakPolarHBondContact OE1-CG 3.43Å; E1055-L1057 PolarHBondContact OE1-N 3Å; L1057-G1059 PolarHBondContact O-N 2.91Å; L1057-S1060 WeakPolarHBondContact O-CB 3.29Å; L1057-S1060 PolarHBondContact O-N 3.03Å; L1057-S1060 PolarHBondContact O-OG 3.41Å; L1057-V1062 HydrophobicContact CD2-CG2 4.43Å; L1057-Y1067 HydrophobicContact CB-CD1 3.96Å; L1057-Y1067 HydrophobicContact CB-CD2 4.44Å; L1057-Y1067 HydrophobicContact CB-CE1 3.64Å; L1057-Y1067 HydrophobicContact CB-CE2 4.17Å; L1057-Y1067 HydrophobicContact CB-CG 4.34Å; L1057-Y1067 HydrophobicContact CD1-CD1 3.68Å; L1057-Y1067 HydrophobicContact CD1-CD2 4.25Å; L1057-Y1067 HydrophobicContact CD1-CE1 4.27Å; L1057-Y1067 HydrophobicContact CD1-CG 3.66Å; L1057-Y1067 HydrophobicContact CG-CD1 4.46Å; L1057-A1070 HydrophobicContact CD1-CB 3.81Å; L1057-A1070 HydrophobicContact CD2-CB 3.92Å; L1057-L1091 HydrophobicContact CD1-CD1 4.03Å; L1057-L1091 HydrophobicContact CD2-CD1 4.27Å; L1057-L1091 HydrophobicContact CD2-CD2 4.02Å; L1057-L1091 HydrophobicContact CG-CD1 3.99Å; L1057-L1132 HydrophobicContact CD2-CD2 3.9Å
1058	D	91.4	Very high	83.9	Confident	3 Å²	3	49.6 Å²	49.6	2%	0.016	26%	0.257	C	S	.	.	G	3₁₀ helix	trans	-65.5	-19.8	171.9	-69.9	-10.6	0	0	0	112	N1017 R1018 I1041 T1043 E1055 V1056 S1060 Y1067	N1017-D1058 WeakPolarHBondContact CA-OD2 3.49Å; N1017-D1058 VanDerWaalsContact CB-OD2 3.29Å; N1017-D1058 WeakPolarHBondContact CB-OD2 3.45Å; R1018-D1058 WeakPolarHBondContact CD-OD1 3.24Å; R1018-D1058 HydrophobicContact CG-CB 4.17Å; R1018-D1058 WeakPolarHBondContact CG-OD1 3.48Å; R1018-D1058 PolarHBondContact N-OD2 3.27Å; I1041-D1058 HydrophobicContact CB-CB 4.19Å; I1041-D1058 HydrophobicContact CD1-CB 4.31Å; I1041-D1058 PolarHBondContact N-O 2.55Å; I1041-D1058 VanDerWaalsContact N-O 3.09Å; T1043-D1058 HydrophobicContact CG2-CB 4.44Å; E1055-D1058 WeakPolarHBondContact O-CB 3.5Å; E1055-D1058 PolarHBondContact O-N 3.11Å; V1056-D1058 VanDerWaalsContact C-N 3.27Å; V1056-D1058 PolarHBondContact O-N 3.14Å; D1058-S1060 PolarHBondContact O-N 2.59Å; D1058-Y1067 WeakPolarHBondContact OD1-CE2 3.45Å; D1058-Y1067 PolarHBondContact OD1-OH 2.89Å
1059	G	89.3	Confident	85.1	Confident	3 Å²	3	42.1 Å²	42.1	3%	0.031	22%	0.215	C	C	.	.	G	3₁₀ helix	trans	-79.1	14.1	168.1	0	0	0	0	0	114.8	I1041 V1056 L1057 L1135 Y1136	I1041-G1059 WeakPolarHBondContact O-CA 3.07Å; V1056-G1059 PolarHBondContact O-N 3.15Å; V1056-G1059 VanDerWaalsContact O-N 3.09Å; L1057-G1059 PolarHBondContact O-N 2.91Å; G1059-L1135 WeakPolarHBondContact O-CB 3.44Å; G1059-Y1136 WeakPolarHBondContact O-CD2 3.43Å
1060	S	92	Very high	86.3	Confident	0 Å²	0	38.3 Å²	38.3	0%	0	19%	0.189	C	C	.	.	S	Bend	trans	-139.3	165.1	-176.3	80.3	0	0	0	0	113.7	R1018 L1057 D1058 V1062 Y1136	R1018-S1060 PolarHBondContact NH1-O 2.79Å; R1018-S1060 PolarHBondContact NH2-O 3.42Å; L1057-S1060 WeakPolarHBondContact O-CB 3.29Å; L1057-S1060 PolarHBondContact O-N 3.03Å; L1057-S1060 PolarHBondContact O-OG 3.41Å; D1058-S1060 PolarHBondContact O-N 2.59Å; S1060-V1062 PolarHBondContact O-N 2.93Å; S1060-V1062 VanDerWaalsContact OG-CB 3.26Å; S1060-V1062 WeakPolarHBondContact OG-CB 3.32Å; S1060-V1062 VanDerWaalsContact OG-CG2 3.3Å; S1060-V1062 WeakPolarHBondContact OG-CG2 3.36Å; S1060-V1062 PolarHBondContact OG-N 3.03Å; S1060-V1062 VanDerWaalsContact OG-N 3.08Å; S1060-Y1136 WeakPolarHBondContact O-CE2 3.4Å
1061	R	93.6	Very high	87.3	Confident	17 Å²	17	39.5 Å²	39.5	6%	0.064	19%	0.19	C	C	.	.	S	Bend	trans	-76.2	7.6	168.1	-59.8	-176.7	-173.9	82.2	7.7	114.3	Y369 E972 V973 H1063 E1131 Y1136 K1137	Y369-R1061 WeakPolarHBondContact CE1-O 3.5Å; E972-R1061 PolarHBondContact O-NE 3.45Å; E972-R1061 PolarHBondContact O-NH2 3.28Å; V973-R1061 PolarHBondContact O-NH2 3.36Å; R1061-H1063 PolarHBondContact O-N 2.97Å; R1061-E1131 HydrophobicContact CB-CG 3.94Å; R1061-E1131 IonicContact CZ-OE1 2.94Å; R1061-E1131 PolarHBondContact N-OE2 3.02Å; R1061-E1131 IonicContact NH1-OE1 3.12Å; R1061-E1131 PolarHBondContact NH1-OE1 3.15Å; R1061-E1131 IonicContact NH1-OE2 2.69Å; R1061-Y1136 HydrophobicContact CB-CE1 4.49Å; R1061-Y1136 HydrophobicContact CG-CD1 3.61Å; R1061-Y1136 HydrophobicContact CG-CE1 3.32Å; R1061-Y1136 HydrophobicContact CG-CG 4.33Å; R1061-Y1136 PolarHBondContact NH1-O 3.18Å; R1061-Y1136 PolarHBondContact NH2-O 3.48Å; R1061-K1137 PolarHBondContact NH1-O 2.66Å; R1061-K1137 PolarHBondContact NH2-O 3.18Å; R1061-K1137 VanDerWaalsContact NH2-O 3.08Å
1062	V	93.7	Very high	88.3	Confident	4 Å²	4	33.7 Å²	33.7	2%	0.024	16%	0.161	C	C	.	.			trans	-63.2	132.6	168.5	-177	0	0	0	0	107.6	R1018 L1057 S1060 T1066 Y1067 A1070 I1128 E1131	R1018-V1062 PolarHBondContact NH1-O 2.59Å; L1057-V1062 HydrophobicContact CD2-CG2 4.43Å; S1060-V1062 PolarHBondContact O-N 2.93Å; S1060-V1062 VanDerWaalsContact OG-CB 3.26Å; S1060-V1062 WeakPolarHBondContact OG-CB 3.32Å; S1060-V1062 VanDerWaalsContact OG-CG2 3.3Å; S1060-V1062 WeakPolarHBondContact OG-CG2 3.36Å; S1060-V1062 PolarHBondContact OG-N 3.03Å; S1060-V1062 VanDerWaalsContact OG-N 3.08Å; V1062-T1066 WeakPolarHBondContact CG1-OG1 3.43Å; V1062-Y1067 HydrophobicContact CB-CE1 4.27Å; V1062-Y1067 HydrophobicContact CG1-CD1 3.77Å; V1062-Y1067 HydrophobicContact CG1-CE1 4.01Å; V1062-Y1067 WeakPolarHBondContact O-CE1 3.38Å; V1062-A1070 HydrophobicContact CG1-CB 4.2Å; V1062-I1128 HydrophobicContact CG1-CG1 4.19Å; V1062-I1128 HydrophobicContact CG2-CB 4.44Å; V1062-I1128 HydrophobicContact CG2-CG1 4.11Å; V1062-I1128 HydrophobicContact CG2-CG2 4.26Å; V1062-E1131 HydrophobicContact CG2-CB 4.3Å
1063	H	94.1	Very high	89.2	Confident	3 Å²	3	32 Å²	32	1%	0.014	15%	0.147	C	C	.	.			trans	-85.7	144.5	179.9	-173.2	-96.9	0	0	0	110.4	F365 Y369 I1033 S1036 R1061 E1065 T1066 Y1067	F365-H1063 AromaticContact CE2-CD2 3.94Å; F365-H1063 AromaticContact CE2-CE1 3.97Å; F365-H1063 AromaticContact CE2-NE2 3.64Å; Y369-H1063 HydrophobicContact CD1-CB 3.85Å; Y369-H1063 HydrophobicContact CE1-CB 3.89Å; Y369-H1063 HydrophobicContact CG-CB 4.32Å; I1033-H1063 PolarHBondContact O-NE2 3.46Å; S1036-H1063 PolarHBondContact OG-NE2 2.93Å; S1036-H1063 VanDerWaalsContact OG-NE2 3.08Å; R1061-H1063 PolarHBondContact O-N 2.97Å; H1063-E1065 WeakPolarHBondContact ND1-CB 3.19Å; H1063-E1065 VanDerWaalsContact ND1-CG 3.32Å; H1063-E1065 WeakPolarHBondContact ND1-CG 3.28Å; H1063-E1065 PolarHBondContact ND1-N 2.62Å; H1063-E1065 VanDerWaalsContact ND1-N 3.12Å; H1063-E1065 PolarHBondContact O-N 3.32Å; H1063-T1066 PolarHBondContact N-OG1 3.4Å; H1063-T1066 WeakPolarHBondContact O-CA 3.27Å; H1063-T1066 PolarHBondContact O-N 3.12Å; H1063-T1066 PolarHBondContact O-OG1 3.17Å; H1063-Y1067 VanDerWaalsContact O-CD1 3.27Å; H1063-Y1067 WeakPolarHBondContact O-CD1 3.4Å
1064	P	92.3	Very high	90	Very high	35 Å²	35	25.8 Å²	25.8	23%	0.227	12%	0.123	C	C	.	.	G	3₁₀ helix	trans	-50	-31.9	176.5	-32.1	37.6	0	0	0	115.3	F1032 T1066 Y1067	F1032-P1064 HydrophobicContact CZ-CG 4.33Å; P1064-T1066 PolarHBondContact O-N 3.38Å; P1064-Y1067 HydrophobicContact CB-CE2 4.37Å; P1064-Y1067 HydrophobicContact CG-CE1 4.36Å; P1064-Y1067 HydrophobicContact CG-CE2 4.34Å; P1064-Y1067 PolarHBondContact O-N 3.14Å
1065	E	90.1	Very high	90.4	Very high	79 Å²	79	25.4 Å²	25.4	37%	0.369	12%	0.119	S	C	.	.	G	3₁₀ helix	trans	-61.4	-11	173.9	88.9	-178.9	175.4	0	0	114.3	R370 H1063	R370-E1065 IonicContact CZ-OE1 3.76Å; R370-E1065 IonicContact CZ-OE2 2.72Å; R370-E1065 IonicContact NE-OE1 2.68Å; R370-E1065 PolarHBondContact NE-OE1 3.35Å; R370-E1065 IonicContact NH2-OE1 3.68Å; R370-E1065 PolarHBondContact NH2-OE1 3.15Å; R370-E1065 IonicContact NH2-OE2 3.43Å; R370-E1065 PolarHBondContact NH2-OE2 3.44Å; H1063-E1065 WeakPolarHBondContact ND1-CB 3.19Å; H1063-E1065 VanDerWaalsContact ND1-CG 3.32Å; H1063-E1065 WeakPolarHBondContact ND1-CG 3.28Å; H1063-E1065 PolarHBondContact ND1-N 2.62Å; H1063-E1065 VanDerWaalsContact ND1-N 3.12Å; H1063-E1065 PolarHBondContact O-N 3.32Å
1066	T	91.5	Very high	90.6	Very high	6 Å²	6	28.1 Å²	28.1	4%	0.037	13%	0.134	C	C	.	.	G	3₁₀ helix	trans	-123.7	2.9	-172.4	65.6	0	0	0	0	114.5	V1062 H1063 P1064 E1068 W1069 A1070 T1124	V1062-T1066 WeakPolarHBondContact CG1-OG1 3.43Å; H1063-T1066 PolarHBondContact N-OG1 3.4Å; H1063-T1066 WeakPolarHBondContact O-CA 3.27Å; H1063-T1066 PolarHBondContact O-N 3.12Å; H1063-T1066 PolarHBondContact O-OG1 3.17Å; P1064-T1066 PolarHBondContact O-N 3.38Å; T1066-E1068 VanDerWaalsContact C-N 3.27Å; T1066-E1068 PolarHBondContact O-N 2.71Å; T1066-W1069 HydrophobicContact CG2-CE3 3.7Å; T1066-W1069 HydrophobicContact CG2-CH2 4.33Å; T1066-W1069 HydrophobicContact CG2-CZ3 3.48Å; T1066-W1069 VanDerWaalsContact CG2-CZ3 3.48Å; T1066-W1069 WeakPolarHBondContact O-CB 3.45Å; T1066-W1069 PolarHBondContact O-N 3.02Å; T1066-A1070 PolarHBondContact O-N 2.66Å; T1066-T1124 HydrophobicContact CG2-CG2 4.1Å
1067	Y	92.2	Very high	90.6	Very high	20 Å²	20	27.5 Å²	27.5	8%	0.078	13%	0.132	C	C	.	.	H	α-helix	trans	-60.8	-32.4	-175	-75.9	4.7	0	0	0	113.7	R1018 E1055 L1057 D1058 V1062 H1063 P1064 W1069 A1070 R1071	R1018-Y1067 WeakPolarHBondContact CD-OH 3.3Å; R1018-Y1067 PolarHBondContact NH1-OH 3.16Å; E1055-Y1067 HydrophobicContact CG-CD2 3.85Å; E1055-Y1067 HydrophobicContact CG-CE2 3.51Å; L1057-Y1067 HydrophobicContact CB-CD1 3.96Å; L1057-Y1067 HydrophobicContact CB-CD2 4.44Å; L1057-Y1067 HydrophobicContact CB-CE1 3.64Å; L1057-Y1067 HydrophobicContact CB-CE2 4.17Å; L1057-Y1067 HydrophobicContact CB-CG 4.34Å; L1057-Y1067 HydrophobicContact CD1-CD1 3.68Å; L1057-Y1067 HydrophobicContact CD1-CD2 4.25Å; L1057-Y1067 HydrophobicContact CD1-CE1 4.27Å; L1057-Y1067 HydrophobicContact CD1-CG 3.66Å; L1057-Y1067 HydrophobicContact CG-CD1 4.46Å; D1058-Y1067 WeakPolarHBondContact OD1-CE2 3.45Å; D1058-Y1067 PolarHBondContact OD1-OH 2.89Å; V1062-Y1067 HydrophobicContact CB-CE1 4.27Å; V1062-Y1067 HydrophobicContact CG1-CD1 3.77Å; V1062-Y1067 HydrophobicContact CG1-CE1 4.01Å; V1062-Y1067 WeakPolarHBondContact O-CE1 3.38Å; H1063-Y1067 VanDerWaalsContact O-CD1 3.27Å; H1063-Y1067 WeakPolarHBondContact O-CD1 3.4Å; P1064-Y1067 HydrophobicContact CB-CE2 4.37Å; P1064-Y1067 HydrophobicContact CG-CE1 4.36Å; P1064-Y1067 HydrophobicContact CG-CE2 4.34Å; P1064-Y1067 PolarHBondContact O-N 3.14Å; Y1067-W1069 VanDerWaalsContact C-N 3.31Å; Y1067-W1069 PolarHBondContact O-N 3.14Å; Y1067-A1070 PolarHBondContact O-N 2.86Å; Y1067-R1071 WeakPolarHBondContact O-CG 3.25Å; Y1067-R1071 PolarHBondContact O-N 3.22Å
1068	E	89.2	Confident	90.2	Very high	126 Å²	126	27.9 Å²	27.9	59%	0.589	13%	0.134	S	C	*	.	H	α-helix	trans	-66.4	-32.4	175.1	-63.3	-169.9	174.7	0	0	113	T1066 K1072	T1066-E1068 VanDerWaalsContact C-N 3.27Å; T1066-E1068 PolarHBondContact O-N 2.71Å; E1068-K1072 WeakPolarHBondContact O-CG 3.2Å; E1068-K1072 PolarHBondContact O-N 3.08Å
1069	W	89.4	Confident	89.8	Confident	25 Å²	25	36.7 Å²	36.7	10%	0.095	18%	0.175	C	C	.	.	H	α-helix	trans	-73.9	-40.5	176.8	-52.6	-23.5	0	0	0	110.8	T1066 Y1067 R1071 K1072 M1073 L1113 F1118 K1121 T1124 I1128	T1066-W1069 HydrophobicContact CG2-CE3 3.7Å; T1066-W1069 HydrophobicContact CG2-CH2 4.33Å; T1066-W1069 HydrophobicContact CG2-CZ3 3.48Å; T1066-W1069 VanDerWaalsContact CG2-CZ3 3.48Å; T1066-W1069 WeakPolarHBondContact O-CB 3.45Å; T1066-W1069 PolarHBondContact O-N 3.02Å; Y1067-W1069 VanDerWaalsContact C-N 3.31Å; Y1067-W1069 PolarHBondContact O-N 3.14Å; W1069-R1071 PolarHBondContact O-N 3.42Å; W1069-K1072 PolarHBondContact O-N 3.03Å; W1069-M1073 WeakPolarHBondContact O-CB 3.47Å; W1069-M1073 VanDerWaalsContact O-CG 3.27Å; W1069-M1073 WeakPolarHBondContact O-CG 3.35Å; W1069-M1073 PolarHBondContact O-N 2.91Å; W1069-L1113 HydrophobicContact CD2-CD1 4.19Å; W1069-L1113 HydrophobicContact CG-CD1 4.27Å; W1069-F1118 HydrophobicContact CZ2-CB 4.35Å; W1069-F1118 HydrophobicContact CZ2-CD1 4.32Å; W1069-F1118 HydrophobicContact CZ2-CG 4.46Å; W1069-K1121 HydrophobicContact CE3-CG 4.44Å; W1069-K1121 HydrophobicContact CH2-CD 3.67Å; W1069-K1121 HydrophobicContact CH2-CG 3.82Å; W1069-K1121 HydrophobicContact CZ2-CG 4.45Å; W1069-K1121 HydrophobicContact CZ3-CB 4.37Å; W1069-K1121 HydrophobicContact CZ3-CD 3.7Å; W1069-K1121 HydrophobicContact CZ3-CG 3.8Å; W1069-T1124 HydrophobicContact CE3-CG2 4.34Å; W1069-T1124 HydrophobicContact CZ3-CG2 4.17Å; W1069-I1128 HydrophobicContact CB-CD1 4.43Å
1070	A	91	Very high	89.4	Confident	0 Å²	0	40.7 Å²	40.7	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-61.9	-41.4	173.3	0	0	0	0	0	112.3	L1057 V1062 T1066 Y1067 A1074 I1128	L1057-A1070 HydrophobicContact CD1-CB 3.81Å; L1057-A1070 HydrophobicContact CD2-CB 3.92Å; V1062-A1070 HydrophobicContact CG1-CB 4.2Å; T1066-A1070 PolarHBondContact O-N 2.66Å; Y1067-A1070 PolarHBondContact O-N 2.86Å; A1070-A1074 PolarHBondContact O-N 3.07Å; A1070-A1074 VanDerWaalsContact O-N 3.11Å; A1070-I1128 HydrophobicContact CB-CG2 3.78Å
1071	R	90.4	Very high	88.5	Confident	57 Å²	57	47.5 Å²	47.5	22%	0.215	23%	0.226	C	C	.	.	H	α-helix	trans	-61.8	-45.4	173	-78.3	-176	-74.5	-102.9	5.9	112.7	E1055 Y1067 W1069 A1074 I1075 P1087 L1091	E1055-R1071 IonicContact OE2-CZ 2.64Å; E1055-R1071 IonicContact OE2-NH1 3.81Å; E1055-R1071 PolarHBondContact OE2-NH1 3.1Å; Y1067-R1071 WeakPolarHBondContact O-CG 3.25Å; Y1067-R1071 PolarHBondContact O-N 3.22Å; W1069-R1071 PolarHBondContact O-N 3.42Å; R1071-A1074 PolarHBondContact O-N 3.08Å; R1071-I1075 PolarHBondContact O-N 2.84Å; R1071-I1075 VanDerWaalsContact O-N 3.13Å; R1071-P1087 HydrophobicContact CB-CB 4.06Å; R1071-P1087 HydrophobicContact CG-CB 4.02Å; R1071-L1091 HydrophobicContact CG-CD1 3.63Å; R1071-L1091 HydrophobicContact CG-CG 4.47Å
1072	K	87.9	Confident	87.3	Confident	89 Å²	89	53.6 Å²	53.6	39%	0.387	26%	0.26	S	S	.	.	H	α-helix	trans	-62.8	-49.6	175.9	-75.8	174.2	176.1	179	0	112	E1068 W1069 A1074 I1075 D1076 F1109	E1068-K1072 WeakPolarHBondContact O-CG 3.2Å; E1068-K1072 PolarHBondContact O-N 3.08Å; W1069-K1072 PolarHBondContact O-N 3.03Å; K1072-A1074 PolarHBondContact O-N 3.48Å; K1072-A1074 VanDerWaalsContact O-N 3.09Å; K1072-I1075 PolarHBondContact O-N 2.85Å; K1072-D1076 PolarHBondContact O-N 2.98Å; K1072-F1109 HydrophobicContact CB-CE2 4.34Å; K1072-F1109 HydrophobicContact CB-CZ 3.92Å
1073	M	89.5	Confident	86.1	Confident	0 Å²	0	62.6 Å²	62.6	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-53.6	-33.5	175.1	-74.2	172.1	58.8	0	0	113	W1069 A1077 L1104 L1106 F1109 L1125 I1128 R1129	W1069-M1073 WeakPolarHBondContact O-CB 3.47Å; W1069-M1073 VanDerWaalsContact O-CG 3.27Å; W1069-M1073 WeakPolarHBondContact O-CG 3.35Å; W1069-M1073 PolarHBondContact O-N 2.91Å; M1073-A1077 WeakPolarHBondContact O-CB 3.42Å; M1073-A1077 PolarHBondContact O-N 2.85Å; M1073-A1077 VanDerWaalsContact O-N 3.07Å; M1073-L1104 HydrophobicContact CB-CD2 4.14Å; M1073-L1104 HydrophobicContact CG-CD2 4.2Å; M1073-L1106 HydrophobicContact CE-CD2 3.83Å; M1073-F1109 HydrophobicContact CG-CE1 4.33Å; M1073-F1109 HydrophobicContact CG-CZ 4.26Å; M1073-L1125 HydrophobicContact CG-CD2 4.23Å; M1073-L1125 HydrophobicContact SD-CB 4.42Å; M1073-L1125 HydrophobicContact SD-CD2 3.47Å; M1073-L1125 WeakPolarHBondContact SD-CD2 3.37Å; M1073-I1128 HydrophobicContact CE-CB 4.16Å; M1073-I1128 HydrophobicContact CE-CG2 3.76Å; M1073-I1128 HydrophobicContact SD-CB 4.09Å; M1073-I1128 HydrophobicContact SD-CD1 4.41Å; M1073-I1128 HydrophobicContact SD-CG2 3.66Å; M1073-R1129 HydrophobicContact CE-CB 4.12Å
1074	A	88.8	Confident	84.6	Confident	0 Å²	0	71.7 Å²	71.7	0%	0	34%	0.344	C	S	.	.	H	α-helix	trans	-73.9	-38.9	175.6	0	0	0	0	0	113	A1070 R1071 K1072 M1078 A1090 L1091 I1094	A1070-A1074 PolarHBondContact O-N 3.07Å; A1070-A1074 VanDerWaalsContact O-N 3.11Å; R1071-A1074 PolarHBondContact O-N 3.08Å; K1072-A1074 PolarHBondContact O-N 3.48Å; K1072-A1074 VanDerWaalsContact O-N 3.09Å; A1074-M1078 VanDerWaalsContact O-CB 3.26Å; A1074-M1078 WeakPolarHBondContact O-CB 3.38Å; A1074-M1078 WeakPolarHBondContact O-CG 3.42Å; A1074-M1078 PolarHBondContact O-N 3.43Å; A1074-A1090 HydrophobicContact CB-CB 4.23Å; A1074-L1091 HydrophobicContact CB-CD2 3.78Å; A1074-L1091 HydrophobicContact CB-CG 3.98Å; A1074-I1094 HydrophobicContact CB-CB 4.47Å; A1074-I1094 HydrophobicContact CB-CG1 4.1Å
1075	I	88.8	Confident	83.4	Confident	25 Å²	25	71.9 Å²	71.9	13%	0.128	35%	0.345	C	S	.	.	H	α-helix	trans	-64.2	-50.4	173.5	-67.1	167.7	0	0	0	110.3	R1071 K1072 A1077 M1078 E1079 Y1080 T1085 P1087 A1090	R1071-I1075 PolarHBondContact O-N 2.84Å; R1071-I1075 VanDerWaalsContact O-N 3.13Å; K1072-I1075 PolarHBondContact O-N 2.85Å; I1075-A1077 PolarHBondContact O-N 2.86Å; I1075-M1078 WeakPolarHBondContact O-CB 3.49Å; I1075-M1078 PolarHBondContact O-N 3.42Å; I1075-M1078 VanDerWaalsContact O-N 3.08Å; I1075-E1079 PolarHBondContact O-N 3.24Å; I1075-Y1080 PolarHBondContact O-N 3.4Å; I1075-T1085 HydrophobicContact CG1-CG2 4.29Å; I1075-P1087 HydrophobicContact CD1-CB 4.18Å; I1075-A1090 HydrophobicContact CG1-CB 4.13Å
1076	D	88.1	Confident	82.8	Confident	70 Å²	70	73.1 Å²	73.1	37%	0.374	35%	0.354	S	S	.	.	H	α-helix	trans	-58.5	-48.7	179.7	-69.3	29.4	0	0	0	111.7	K1072 M1078 E1079 L1104 F1109	K1072-D1076 PolarHBondContact O-N 2.98Å; D1076-M1078 PolarHBondContact O-N 2.92Å; D1076-E1079 PolarHBondContact O-N 2.87Å; D1076-E1079 VanDerWaalsContact O-N 3.15Å; D1076-L1104 HydrophobicContact CB-CD1 3.79Å; D1076-L1104 HydrophobicContact CB-CD2 4.43Å; D1076-F1109 WeakPolarHBondContact OD2-CD2 3.27Å; D1076-F1109 VanDerWaalsContact OD2-CE2 3.25Å; D1076-F1109 WeakPolarHBondContact OD2-CE2 3.45Å
1077	A	87.5	Confident	82.3	Confident	12 Å²	12	75 Å²	75	10%	0.099	37%	0.366	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.8	-8.3	179	0	0	0	0	0	114	M1073 I1075 I1094 R1100 L1101 L1104	M1073-A1077 WeakPolarHBondContact O-CB 3.42Å; M1073-A1077 PolarHBondContact O-N 2.85Å; M1073-A1077 VanDerWaalsContact O-N 3.07Å; I1075-A1077 PolarHBondContact O-N 2.86Å; A1077-I1094 HydrophobicContact CB-CD1 3.86Å; A1077-R1100 WeakPolarHBondContact O-CB 3.43Å; A1077-L1101 HydrophobicContact CB-CD2 3.91Å; A1077-L1104 HydrophobicContact CB-CD2 4.4Å
1078	M	84.4	Confident	81.7	Confident	12 Å²	12	74.5 Å²	74.5	6%	0.059	37%	0.366	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.7	-6.6	174	-78.3	-60.2	-59.4	0	0	113.6	A1074 I1075 D1076 Y1080 E1093 I1094 R1100	A1074-M1078 VanDerWaalsContact O-CB 3.26Å; A1074-M1078 WeakPolarHBondContact O-CB 3.38Å; A1074-M1078 WeakPolarHBondContact O-CG 3.42Å; A1074-M1078 PolarHBondContact O-N 3.43Å; I1075-M1078 WeakPolarHBondContact O-CB 3.49Å; I1075-M1078 PolarHBondContact O-N 3.42Å; I1075-M1078 VanDerWaalsContact O-N 3.08Å; D1076-M1078 PolarHBondContact O-N 2.92Å; M1078-Y1080 HydrophobicContact CB-CD1 4.5Å; M1078-Y1080 HydrophobicContact CB-CD2 3.36Å; M1078-Y1080 HydrophobicContact CB-CE2 3.7Å; M1078-Y1080 HydrophobicContact CB-CG 3.83Å; M1078-Y1080 HydrophobicContact CE-CD2 4.39Å; M1078-Y1080 HydrophobicContact CE-CE1 4.14Å; M1078-Y1080 HydrophobicContact CE-CE2 3.62Å; M1078-Y1080 VanDerWaalsContact CE-CZ 3.47Å; M1078-Y1080 WeakPolarHBondContact CE-OH 3.04Å; M1078-Y1080 HydrophobicContact CG-CD2 4.03Å; M1078-Y1080 HydrophobicContact CG-CE2 3.93Å; M1078-Y1080 PolarHBondContact O-N 3.49Å; M1078-E1093 HydrophobicContact CE-CB 4.28Å; M1078-E1093 HydrophobicContact CE-CG 3.9Å; M1078-E1093 VanDerWaalsContact CE-OE1 3.28Å; M1078-E1093 WeakPolarHBondContact CE-OE1 3.41Å; M1078-E1093 VanDerWaalsContact CE-OE2 3.27Å; M1078-E1093 WeakPolarHBondContact CE-OE2 3.44Å; M1078-E1093 HydrophobicContact SD-CB 4.4Å; M1078-E1093 HydrophobicContact SD-CG 4.19Å; M1078-I1094 HydrophobicContact CG-CD1 3.89Å; M1078-I1094 HydrophobicContact CG-CG1 3.71Å; M1078-I1094 HydrophobicContact SD-CD1 3.89Å; M1078-I1094 HydrophobicContact SD-CG1 3.99Å; M1078-R1100 PolarHBondContact SD-NH1 3.24Å
1079	E	83.1	Confident	81.4	Confident	187 Å²	187	69.6 Å²	69.6	87%	0.874	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	53	35.3	-170	-58.5	-171.9	161	0	0	112.7	I1075 D1076	I1075-E1079 PolarHBondContact O-N 3.24Å; D1076-E1079 PolarHBondContact O-N 2.87Å; D1076-E1079 VanDerWaalsContact O-N 3.15Å
1080	Y	80.5	Confident	81.2	Confident	88 Å²	88	68.5 Å²	68.5	35%	0.345	35%	0.345	S	S	.	.			trans	-84.4	133.9	-179.9	-80.7	-33.3	0	0	0	112.3	I1075 M1078 D1082 T1085 A1090 E1093	I1075-Y1080 PolarHBondContact O-N 3.4Å; M1078-Y1080 HydrophobicContact CB-CD1 4.5Å; M1078-Y1080 HydrophobicContact CB-CD2 3.36Å; M1078-Y1080 HydrophobicContact CB-CE2 3.7Å; M1078-Y1080 HydrophobicContact CB-CG 3.83Å; M1078-Y1080 HydrophobicContact CE-CD2 4.39Å; M1078-Y1080 HydrophobicContact CE-CE1 4.14Å; M1078-Y1080 HydrophobicContact CE-CE2 3.62Å; M1078-Y1080 VanDerWaalsContact CE-CZ 3.47Å; M1078-Y1080 WeakPolarHBondContact CE-OH 3.04Å; M1078-Y1080 HydrophobicContact CG-CD2 4.03Å; M1078-Y1080 HydrophobicContact CG-CE2 3.93Å; M1078-Y1080 PolarHBondContact O-N 3.49Å; Y1080-D1082 PolarHBondContact O-N 3.05Å; Y1080-T1085 WeakPolarHBondContact CB-OG1 3.33Å; Y1080-T1085 HydrophobicContact CD2-CG2 3.49Å; Y1080-T1085 VanDerWaalsContact CD2-CG2 3.49Å; Y1080-T1085 HydrophobicContact CE2-CG2 4.14Å; Y1080-T1085 HydrophobicContact CG-CG2 3.91Å; Y1080-A1090 HydrophobicContact CD2-CB 4.12Å; Y1080-A1090 HydrophobicContact CE2-CB 4.14Å; Y1080-E1093 PolarHBondContact OH-OE2 3.41Å
1081	D	73.5	Confident	81	Confident	143 Å²	143	68.5 Å²	68.5	77%	0.765	35%	0.346	S	S	*	.			trans	-64.4	131.6	173.3	-72.6	-49.6	0	0	0	110.8	E1083 T1085	D1081-E1083 PolarHBondContact O-N 3.37Å; D1081-T1085 PolarHBondContact O-OG1 3.08Å
1082	D	67.5	Low	80.7	Confident	144 Å²	144	71.1 Å²	71.1	77%	0.77	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.3	-24.6	-173.3	-78.3	-51.4	0	0	0	115	Y1080	Y1080-D1082 PolarHBondContact O-N 3.05Å
1083	E	68.1	Low	80.6	Confident	193 Å²	193	70 Å²	70	90%	0.902	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.4	-17.7	-164.8	-62.6	-166.4	160.6	0	0	115.4	D1081	D1081-E1083 PolarHBondContact O-N 3.37Å
1084	E	62.6	Low	80.6	Confident	194 Å²	194	70 Å²	70	91%	0.907	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-126.1	-0.5	-175.4	-66.8	-161.1	145.6	0	0	115.7
1085	T	67.3	Low	80.5	Confident	40 Å²	40	72.4 Å²	72.4	25%	0.245	37%	0.369	C	S	.	.			trans	-92.6	133.2	-165.8	-62.9	0	0	0	0	114.8	I1075 Y1080 D1081 P1087 A1090	I1075-T1085 HydrophobicContact CG1-CG2 4.29Å; Y1080-T1085 WeakPolarHBondContact CB-OG1 3.33Å; Y1080-T1085 HydrophobicContact CD2-CG2 3.49Å; Y1080-T1085 VanDerWaalsContact CD2-CG2 3.49Å; Y1080-T1085 HydrophobicContact CE2-CG2 4.14Å; Y1080-T1085 HydrophobicContact CG-CG2 3.91Å; D1081-T1085 PolarHBondContact O-OG1 3.08Å; T1085-P1087 WeakPolarHBondContact O-CD 3.43Å; T1085-A1090 HydrophobicContact CG2-CB 4.44Å
1086	N	78.2	Confident	80.3	Confident	105 Å²	105	79 Å²	79	56%	0.561	40%	0.399	S	S	*	.			trans	-79.9	115.5	169.3	174.6	15.5	0	0	0	110.6	A1088 G1089 A1090	N1086-A1088 VanDerWaalsContact C-N 3.26Å; N1086-A1088 PolarHBondContact O-N 2.86Å; N1086-A1088 PolarHBondContact OD1-N 3.26Å; N1086-A1088 VanDerWaalsContact OD1-N 3.15Å; N1086-G1089 PolarHBondContact O-N 3.2Å; N1086-A1090 PolarHBondContact O-N 3.45Å
1087	P	80.3	Confident	80.4	Confident	45 Å²	45	76.7 Å²	76.7	29%	0.292	39%	0.388	S	S	.	.	H	α-helix	trans	-65.6	-24	-176.5	26.4	-35.6	0	0	0	114.2	R1071 I1075 T1085 L1091	R1071-P1087 HydrophobicContact CB-CB 4.06Å; R1071-P1087 HydrophobicContact CG-CB 4.02Å; I1075-P1087 HydrophobicContact CD1-CB 4.18Å; T1085-P1087 WeakPolarHBondContact O-CD 3.43Å; P1087-L1091 PolarHBondContact O-N 2.83Å
1088	A	80	Confident	80.3	Confident	10 Å²	10	77.8 Å²	77.8	8%	0.083	39%	0.394	C	S	.	.	H	α-helix	trans	-69.9	-43.6	175.6	0	0	0	0	0	111.3	Y1053 N1086 A1090 L1091 E1092	Y1053-A1088 HydrophobicContact CE2-CB 4.25Å; N1086-A1088 VanDerWaalsContact C-N 3.26Å; N1086-A1088 PolarHBondContact O-N 2.86Å; N1086-A1088 PolarHBondContact OD1-N 3.26Å; N1086-A1088 VanDerWaalsContact OD1-N 3.15Å; A1088-A1090 VanDerWaalsContact C-N 3.32Å; A1088-A1090 PolarHBondContact O-N 2.93Å; A1088-L1091 WeakPolarHBondContact O-CB 2.91Å; A1088-L1091 PolarHBondContact O-N 3.34Å; A1088-L1091 VanDerWaalsContact O-N 3.17Å; A1088-E1092 WeakPolarHBondContact O-CG 3.17Å; A1088-E1092 PolarHBondContact O-N 3.2Å
1089	G	82.4	Confident	80.5	Confident	23 Å²	23	82 Å²	82	24%	0.237	41%	0.414	C	S	.	.	H	α-helix	trans	-65.6	-34.2	176.1	0	0	0	0	0	113	N1086 L1091 E1092 E1093	N1086-G1089 PolarHBondContact O-N 3.2Å; G1089-L1091 VanDerWaalsContact C-N 3.34Å; G1089-E1092 PolarHBondContact O-N 3.37Å; G1089-E1093 PolarHBondContact O-N 2.91Å
1090	A	85.2	Confident	80.7	Confident	1 Å²	1	76.9 Å²	76.9	1%	0.008	39%	0.387	C	S	.	.	H	α-helix	trans	-63.8	-38.1	172.5	0	0	0	0	0	112.3	A1074 I1075 Y1080 T1085 N1086 A1088 I1094	A1074-A1090 HydrophobicContact CB-CB 4.23Å; I1075-A1090 HydrophobicContact CG1-CB 4.13Å; Y1080-A1090 HydrophobicContact CD2-CB 4.12Å; Y1080-A1090 HydrophobicContact CE2-CB 4.14Å; T1085-A1090 HydrophobicContact CG2-CB 4.44Å; N1086-A1090 PolarHBondContact O-N 3.45Å; A1088-A1090 VanDerWaalsContact C-N 3.32Å; A1088-A1090 PolarHBondContact O-N 2.93Å; A1090-I1094 VanDerWaalsContact O-CB 3.29Å; A1090-I1094 WeakPolarHBondContact O-CB 3.32Å; A1090-I1094 WeakPolarHBondContact O-CG1 3.25Å; A1090-I1094 PolarHBondContact O-N 2.94Å; A1090-I1094 VanDerWaalsContact O-N 3.11Å
1091	L	87	Confident	81	Confident	1 Å²	1	72.7 Å²	72.7	1%	0.005	37%	0.37	C	S	.	.	H	α-helix	trans	-67.1	-42.3	173.1	-80.2	168.3	0	0	0	112.3	L1057 R1071 A1074 P1087 A1088 G1089 I1094 L1095 L1132	L1057-L1091 HydrophobicContact CD1-CD1 4.03Å; L1057-L1091 HydrophobicContact CD2-CD1 4.27Å; L1057-L1091 HydrophobicContact CD2-CD2 4.02Å; L1057-L1091 HydrophobicContact CG-CD1 3.99Å; R1071-L1091 HydrophobicContact CG-CD1 3.63Å; R1071-L1091 HydrophobicContact CG-CG 4.47Å; A1074-L1091 HydrophobicContact CB-CD2 3.78Å; A1074-L1091 HydrophobicContact CB-CG 3.98Å; P1087-L1091 PolarHBondContact O-N 2.83Å; A1088-L1091 WeakPolarHBondContact O-CB 2.91Å; A1088-L1091 PolarHBondContact O-N 3.34Å; A1088-L1091 VanDerWaalsContact O-N 3.17Å; G1089-L1091 VanDerWaalsContact C-N 3.34Å; L1091-I1094 PolarHBondContact O-N 2.71Å; L1091-L1095 VanDerWaalsContact O-CG 3.29Å; L1091-L1095 WeakPolarHBondContact O-CG 3.13Å; L1091-L1095 PolarHBondContact O-N 2.95Å; L1091-L1132 HydrophobicContact CD2-CD1 4.42Å; L1091-L1132 HydrophobicContact CD2-CD2 3.87Å
1092	E	84.3	Confident	81.6	Confident	112 Å²	112	72.7 Å²	72.7	52%	0.523	36%	0.363	S	S	.	.	H	α-helix	trans	-60.2	-49.9	176.5	-70.9	169.5	176	0	0	111.6	V1056 A1088 G1089 I1094 L1095 E1096	V1056-E1092 HydrophobicContact CG2-CG 4.33Å; A1088-E1092 WeakPolarHBondContact O-CG 3.17Å; A1088-E1092 PolarHBondContact O-N 3.2Å; G1089-E1092 PolarHBondContact O-N 3.37Å; E1092-I1094 VanDerWaalsContact C-N 3.33Å; E1092-I1094 PolarHBondContact O-N 2.68Å; E1092-L1095 PolarHBondContact O-N 2.81Å; E1092-L1095 VanDerWaalsContact O-N 3.16Å; E1092-E1096 PolarHBondContact O-N 2.73Å
1093	E	86.1	Confident	82.4	Confident	64 Å²	64	73 Å²	73	30%	0.299	37%	0.365	S	S	.	.	H	α-helix	trans	-66.9	-31.6	179	-167.8	175.3	162.1	0	0	112.7	M1078 Y1080 G1089 L1095 E1096 S1097 R1100	M1078-E1093 HydrophobicContact CE-CB 4.28Å; M1078-E1093 HydrophobicContact CE-CG 3.9Å; M1078-E1093 VanDerWaalsContact CE-OE1 3.28Å; M1078-E1093 WeakPolarHBondContact CE-OE1 3.41Å; M1078-E1093 VanDerWaalsContact CE-OE2 3.27Å; M1078-E1093 WeakPolarHBondContact CE-OE2 3.44Å; M1078-E1093 HydrophobicContact SD-CB 4.4Å; M1078-E1093 HydrophobicContact SD-CG 4.19Å; Y1080-E1093 PolarHBondContact OH-OE2 3.41Å; G1089-E1093 PolarHBondContact O-N 2.91Å; E1093-L1095 VanDerWaalsContact C-N 3.34Å; E1093-E1096 PolarHBondContact O-N 3.24Å; E1093-S1097 WeakPolarHBondContact O-CB 3.34Å; E1093-S1097 PolarHBondContact O-N 3.23Å; E1093-S1097 PolarHBondContact O-OG 3.38Å; E1093-R1100 IonicContact OE1-CZ 2.67Å; E1093-R1100 IonicContact OE1-NH1 3.13Å; E1093-R1100 IonicContact OE1-NH2 2.95Å; E1093-R1100 PolarHBondContact OE1-NH2 3.48Å
1094	I	88.7	Confident	83.3	Confident	0 Å²	0	65.3 Å²	65.3	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-69.5	-30	173.8	-78	-72.1	0	0	0	112.5	A1074 A1077 M1078 A1090 L1091 E1092 S1097 P1098 R1100 L1101	A1074-I1094 HydrophobicContact CB-CB 4.47Å; A1074-I1094 HydrophobicContact CB-CG1 4.1Å; A1077-I1094 HydrophobicContact CB-CD1 3.86Å; M1078-I1094 HydrophobicContact CG-CD1 3.89Å; M1078-I1094 HydrophobicContact CG-CG1 3.71Å; M1078-I1094 HydrophobicContact SD-CD1 3.89Å; M1078-I1094 HydrophobicContact SD-CG1 3.99Å; A1090-I1094 VanDerWaalsContact O-CB 3.29Å; A1090-I1094 WeakPolarHBondContact O-CB 3.32Å; A1090-I1094 WeakPolarHBondContact O-CG1 3.25Å; A1090-I1094 PolarHBondContact O-N 2.94Å; A1090-I1094 VanDerWaalsContact O-N 3.11Å; L1091-I1094 PolarHBondContact O-N 2.71Å; E1092-I1094 VanDerWaalsContact C-N 3.33Å; E1092-I1094 PolarHBondContact O-N 2.68Å; I1094-S1097 CarbonylContact O-C 3.59Å; I1094-S1097 VanDerWaalsContact O-C 3.3Å; I1094-S1097 PolarHBondContact O-N 2.96Å; I1094-P1098 VanDerWaalsContact O-CA 3.22Å; I1094-P1098 WeakPolarHBondContact O-CA 3.29Å; I1094-P1098 VanDerWaalsContact O-N 3.08Å; I1094-R1100 HydrophobicContact CD1-CB 4.11Å; I1094-L1101 HydrophobicContact CD1-CD2 4.39Å; I1094-L1101 HydrophobicContact CD1-CG 4.35Å; I1094-L1101 HydrophobicContact CG2-CD1 3.68Å; I1094-L1101 HydrophobicContact CG2-CD2 4Å; I1094-L1101 HydrophobicContact CG2-CG 3.84Å
1095	L	85.8	Confident	84.6	Confident	51 Å²	51	60.6 Å²	60.6	27%	0.267	31%	0.311	S	S	.	.	H	α-helix	trans	-74.7	-27.2	173.1	-70.2	165.2	0	0	0	112.2	V1056 L1091 E1092 E1093 L1132 L1135	V1056-L1095 HydrophobicContact CB-CD1 4.43Å; V1056-L1095 HydrophobicContact CG1-CD1 3.43Å; V1056-L1095 VanDerWaalsContact CG1-CD1 3.43Å; L1091-L1095 VanDerWaalsContact O-CG 3.29Å; L1091-L1095 WeakPolarHBondContact O-CG 3.13Å; L1091-L1095 PolarHBondContact O-N 2.95Å; E1092-L1095 PolarHBondContact O-N 2.81Å; E1092-L1095 VanDerWaalsContact O-N 3.16Å; E1093-L1095 VanDerWaalsContact C-N 3.34Å; L1095-L1132 HydrophobicContact CD2-CD2 4.43Å; L1095-L1132 WeakPolarHBondContact CD2-O 3.26Å; L1095-L1135 HydrophobicContact CD1-CD1 4.48Å; L1095-L1135 HydrophobicContact CD2-CD1 4.04Å; L1095-L1135 HydrophobicContact CD2-CD2 3.93Å; L1095-L1135 HydrophobicContact CD2-CG 3.93Å
1096	E	86.4	Confident	85.7	Confident	164 Å²	164	58.8 Å²	58.8	77%	0.766	30%	0.3	S	S	*	.	H	α-helix	trans	-76.7	-34.4	167.7	-64.1	-164.7	159.7	0	0	112.9	E1092 E1093 P1098	E1092-E1096 PolarHBondContact O-N 2.73Å; E1093-E1096 PolarHBondContact O-N 3.24Å; E1096-P1098 WeakPolarHBondContact O-CD 3.44Å
1097	S	88.4	Confident	86.2	Confident	21 Å²	21	57.2 Å²	57.2	15%	0.147	29%	0.292	C	S	.	.			trans	-120.2	52.9	-174.8	-50	0	0	0	0	114.2	E1093 I1094 E1099 R1100	E1093-S1097 WeakPolarHBondContact O-CB 3.34Å; E1093-S1097 PolarHBondContact O-N 3.23Å; E1093-S1097 PolarHBondContact O-OG 3.38Å; I1094-S1097 CarbonylContact O-C 3.59Å; I1094-S1097 VanDerWaalsContact O-C 3.3Å; I1094-S1097 PolarHBondContact O-N 2.96Å; S1097-E1099 PolarHBondContact O-N 3.02Å; S1097-R1100 PolarHBondContact O-N 3.48Å
1098	P	86.6	Confident	86.7	Confident	35 Å²	35	57.6 Å²	57.6	23%	0.227	30%	0.299	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68	-5.7	-169.2	28.2	-36.8	0	0	0	114.5	I1094 E1096	I1094-P1098 VanDerWaalsContact O-CA 3.22Å; I1094-P1098 WeakPolarHBondContact O-CA 3.29Å; I1094-P1098 VanDerWaalsContact O-N 3.08Å; E1096-P1098 WeakPolarHBondContact O-CD 3.44Å
1099	E	88.5	Confident	87.1	Confident	100 Å²	100	58.4 Å²	58.4	47%	0.467	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-28.4	171.1	66.6	-74.7	171.2	0	0	114.7	S1097 L1101 K1102	S1097-E1099 PolarHBondContact O-N 3.02Å; E1099-L1101 PolarHBondContact O-N 3.5Å; E1099-K1102 HydrophobicContact CB-CD 4.36Å; E1099-K1102 VanDerWaalsContact O-CB 3.29Å; E1099-K1102 WeakPolarHBondContact O-CB 3.28Å; E1099-K1102 WeakPolarHBondContact O-CD 3.35Å; E1099-K1102 WeakPolarHBondContact O-CG 3.45Å; E1099-K1102 PolarHBondContact O-N 2.8Å
1100	R	87.2	Confident	87.4	Confident	80 Å²	80	57.7 Å²	57.7	30%	0.302	29%	0.292	S	S	.	.	G	3₁₀ helix	trans	-62.3	-31.4	-179.2	-55.4	-168.2	-159.6	-173.6	19.1	112.6	A1077 M1078 E1093 I1094 S1097 K1102 D1103	A1077-R1100 WeakPolarHBondContact O-CB 3.43Å; M1078-R1100 PolarHBondContact SD-NH1 3.24Å; E1093-R1100 IonicContact OE1-CZ 2.67Å; E1093-R1100 IonicContact OE1-NH1 3.13Å; E1093-R1100 IonicContact OE1-NH2 2.95Å; E1093-R1100 PolarHBondContact OE1-NH2 3.48Å; I1094-R1100 HydrophobicContact CD1-CB 4.11Å; S1097-R1100 PolarHBondContact O-N 3.48Å; R1100-K1102 PolarHBondContact O-N 3.02Å; R1100-D1103 PolarHBondContact O-N 3.4Å
1101	L	86.6	Confident	87.7	Confident	1 Å²	1	61.9 Å²	61.9	1%	0.005	32%	0.317	C	S	.	.	G	3₁₀ helix	trans	-59.2	-7.1	173.5	-68.9	174.5	0	0	0	114.9	A1077 I1094 E1099 R1129 L1132	A1077-L1101 HydrophobicContact CB-CD2 3.91Å; I1094-L1101 HydrophobicContact CD1-CD2 4.39Å; I1094-L1101 HydrophobicContact CD1-CG 4.35Å; I1094-L1101 HydrophobicContact CG2-CD1 3.68Å; I1094-L1101 HydrophobicContact CG2-CD2 4Å; I1094-L1101 HydrophobicContact CG2-CG 3.84Å; E1099-L1101 PolarHBondContact O-N 3.5Å; L1101-R1129 HydrophobicContact CB-CG 3.99Å; L1101-R1129 VanDerWaalsContact O-CD 3.22Å; L1101-R1129 WeakPolarHBondContact O-CD 3.32Å; L1101-L1132 HydrophobicContact CD1-CB 3.6Å; L1101-L1132 HydrophobicContact CD1-CD1 4.32Å; L1101-L1132 HydrophobicContact CD2-CD1 4.47Å
1102	K	86.3	Confident	87.7	Confident	142 Å²	142	65 Å²	65	62%	0.617	33%	0.332	S	S	*	.	G	3₁₀ helix	trans	-87.5	-22.1	175.7	-62	164.7	-169.1	152.2	0	113.1	E1099 R1100	E1099-K1102 HydrophobicContact CB-CD 4.36Å; E1099-K1102 VanDerWaalsContact O-CB 3.29Å; E1099-K1102 WeakPolarHBondContact O-CB 3.28Å; E1099-K1102 WeakPolarHBondContact O-CD 3.35Å; E1099-K1102 WeakPolarHBondContact O-CG 3.45Å; E1099-K1102 PolarHBondContact O-N 2.8Å; R1100-K1102 PolarHBondContact O-N 3.02Å
1103	D	84.4	Confident	87.9	Confident	150 Å²	150	60 Å²	60	80%	0.802	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.6	-13.1	-177	-60.3	-43	0	0	0	111.9	R1100	R1100-D1103 PolarHBondContact O-N 3.4Å
1104	L	87.6	Confident	87.9	Confident	32 Å²	32	62 Å²	62	17%	0.168	32%	0.318	C	S	.	.	S	Bend	trans	-75.8	124.5	174.2	-175.2	63.8	0	0	0	112.3	M1073 D1076 A1077 L1106	M1073-L1104 HydrophobicContact CB-CD2 4.14Å; M1073-L1104 HydrophobicContact CG-CD2 4.2Å; D1076-L1104 HydrophobicContact CB-CD1 3.79Å; D1076-L1104 HydrophobicContact CB-CD2 4.43Å; A1077-L1104 HydrophobicContact CB-CD2 4.4Å; L1104-L1106 HydrophobicContact CD2-CD2 3.75Å; L1104-L1106 HydrophobicContact CG-CD2 3.98Å; L1104-L1106 PolarHBondContact O-N 3.28Å
1105	D	89.6	Confident	88	Confident	96 Å²	96	71.2 Å²	71.2	51%	0.513	35%	0.353	S	S	.	.			trans	-80.2	94.5	175.3	-169.8	-22.1	0	0	0	111.2	D1107 A1108 F1109	D1105-D1107 VanDerWaalsContact C-N 3.3Å; D1105-D1107 PolarHBondContact O-N 3.38Å; D1105-D1107 PolarHBondContact OD1-N 3.15Å; D1105-A1108 HydrophobicContact CB-CB 4Å; D1105-A1108 PolarHBondContact O-N 2.87Å; D1105-A1108 PolarHBondContact OD1-N 3.13Å; D1105-F1109 PolarHBondContact O-N 2.82Å
1106	L	89.6	Confident	88.1	Confident	2 Å²	2	73.5 Å²	73.5	1%	0.01	36%	0.362	C	S	.	.	H	α-helix	trans	-70.2	-22.9	179	-59	-175.7	0	0	0	113.8	M1073 L1104 A1110 L1125 Y1126 R1129	M1073-L1106 HydrophobicContact CE-CD2 3.83Å; L1104-L1106 HydrophobicContact CD2-CD2 3.75Å; L1104-L1106 HydrophobicContact CG-CD2 3.98Å; L1104-L1106 PolarHBondContact O-N 3.28Å; L1106-A1110 VanDerWaalsContact O-CB 3.28Å; L1106-A1110 WeakPolarHBondContact O-CB 3.38Å; L1106-A1110 PolarHBondContact O-N 3.05Å; L1106-L1125 HydrophobicContact CB-CB 4.38Å; L1106-L1125 HydrophobicContact CD1-CB 4.34Å; L1106-L1125 HydrophobicContact CD2-CB 4.4Å; L1106-Y1126 HydrophobicContact CB-CE1 4.19Å; L1106-Y1126 HydrophobicContact CD1-CD1 3.61Å; L1106-Y1126 HydrophobicContact CD1-CE1 3.75Å; L1106-Y1126 HydrophobicContact CD1-CG 4.19Å; L1106-Y1126 HydrophobicContact CG-CE1 4.42Å; L1106-R1129 HydrophobicContact CD1-CB 3.92Å; L1106-R1129 HydrophobicContact CD1-CG 4.3Å
1107	D	90.2	Very high	88	Confident	72 Å²	72	68.8 Å²	68.8	39%	0.385	36%	0.357	S	S	.	.	H	α-helix	trans	-73.7	-40.1	176.8	-67.9	0.4	0	0	0	109	D1105 A1110 V1111 Y1126 M1708	D1105-D1107 VanDerWaalsContact C-N 3.3Å; D1105-D1107 PolarHBondContact O-N 3.38Å; D1105-D1107 PolarHBondContact OD1-N 3.15Å; D1107-A1110 PolarHBondContact O-N 2.84Å; D1107-V1111 WeakPolarHBondContact O-CG2 3.07Å; D1107-V1111 PolarHBondContact O-N 3.03Å; D1107-Y1126 WeakPolarHBondContact OD1-CE2 3.32Å; D1107-Y1126 PolarHBondContact OD1-OH 2.67Å; D1107-M1708 VanDerWaalsContact OD2-CE 3.31Å; D1107-M1708 WeakPolarHBondContact OD2-CE 3.38Å
1108	A	90.1	Very high	87.7	Confident	53 Å²	53	72.5 Å²	72.5	44%	0.438	37%	0.371	S	S	.	.	H	α-helix	trans	-64.8	-43.6	171.6	0	0	0	0	0	112.5	D1105 A1110 V1111 E1112	D1105-A1108 HydrophobicContact CB-CB 4Å; D1105-A1108 PolarHBondContact O-N 2.87Å; D1105-A1108 PolarHBondContact OD1-N 3.13Å; A1108-A1110 VanDerWaalsContact C-N 3.32Å; A1108-A1110 PolarHBondContact O-N 3.08Å; A1108-V1111 PolarHBondContact O-N 2.9Å; A1108-E1112 PolarHBondContact O-N 3.21Å; A1108-E1112 VanDerWaalsContact O-N 3.14Å
1109	F	88.2	Confident	87.3	Confident	27 Å²	27	72 Å²	72	12%	0.118	37%	0.372	C	S	.	.	H	α-helix	trans	-63.1	-37.6	176.3	-166.5	-83.1	0	0	0	111.9	K1072 M1073 D1076 D1105 E1112 L1113 L1125	K1072-F1109 HydrophobicContact CB-CE2 4.34Å; K1072-F1109 HydrophobicContact CB-CZ 3.92Å; M1073-F1109 HydrophobicContact CG-CE1 4.33Å; M1073-F1109 HydrophobicContact CG-CZ 4.26Å; D1076-F1109 WeakPolarHBondContact OD2-CD2 3.27Å; D1076-F1109 VanDerWaalsContact OD2-CE2 3.25Å; D1076-F1109 WeakPolarHBondContact OD2-CE2 3.45Å; D1105-F1109 PolarHBondContact O-N 2.82Å; F1109-E1112 PolarHBondContact O-N 3.4Å; F1109-L1113 HydrophobicContact CD1-CD1 4.04Å; F1109-L1113 HydrophobicContact CD1-CG 4.1Å; F1109-L1113 HydrophobicContact CE1-CD1 3.81Å; F1109-L1113 HydrophobicContact CE1-CD2 4.31Å; F1109-L1113 HydrophobicContact CE1-CG 3.94Å; F1109-L1113 PolarHBondContact O-N 3.45Å; F1109-L1125 HydrophobicContact CD1-CD1 3.75Å; F1109-L1125 HydrophobicContact CD1-CD2 3.62Å; F1109-L1125 HydrophobicContact CD1-CG 4.35Å; F1109-L1125 HydrophobicContact CE1-CD2 3.68Å
1110	A	89.1	Confident	87	Confident	7 Å²	7	69.2 Å²	69.2	6%	0.058	36%	0.364	C	S	.	.	H	α-helix	trans	-62.1	-42.5	174.6	0	0	0	0	0	112.6	L1106 D1107 A1108 E1112 L1113 E1114 L1125	L1106-A1110 VanDerWaalsContact O-CB 3.28Å; L1106-A1110 WeakPolarHBondContact O-CB 3.38Å; L1106-A1110 PolarHBondContact O-N 3.05Å; D1107-A1110 PolarHBondContact O-N 2.84Å; A1108-A1110 VanDerWaalsContact C-N 3.32Å; A1108-A1110 PolarHBondContact O-N 3.08Å; A1110-E1112 VanDerWaalsContact C-N 3.32Å; A1110-E1112 PolarHBondContact O-N 3.41Å; A1110-L1113 PolarHBondContact O-N 3.47Å; A1110-E1114 WeakPolarHBondContact O-CB 3.23Å; A1110-E1114 PolarHBondContact O-N 3.3Å; A1110-L1125 HydrophobicContact CB-CD1 3.78Å
1111	V	91.3	Very high	87	Confident	90 Å²	90	66.4 Å²	66.4	55%	0.545	35%	0.354	S	S	.	.	H	α-helix	trans	-65.2	-35.6	177.3	170.2	0	0	0	0	111.6	D1107 A1108 E1114 R1115	D1107-V1111 WeakPolarHBondContact O-CG2 3.07Å; D1107-V1111 PolarHBondContact O-N 3.03Å; A1108-V1111 PolarHBondContact O-N 2.9Å; V1111-E1114 PolarHBondContact O-N 3.45Å; V1111-R1115 VanDerWaalsContact O-CB 3.26Å; V1111-R1115 WeakPolarHBondContact O-CB 3.2Å; V1111-R1115 PolarHBondContact O-N 3.27Å
1112	E	87.2	Confident	87.1	Confident	67 Å²	67	68 Å²	68	31%	0.313	37%	0.365	S	S	.	.	H	α-helix	trans	-71.9	-37.9	176	-173.5	56	-149.3	0	0	112.3	A1108 F1109 A1110 R1115 Q1116	A1108-E1112 PolarHBondContact O-N 3.21Å; A1108-E1112 VanDerWaalsContact O-N 3.14Å; F1109-E1112 PolarHBondContact O-N 3.4Å; A1110-E1112 VanDerWaalsContact C-N 3.32Å; A1110-E1112 PolarHBondContact O-N 3.41Å; E1112-R1115 VanDerWaalsContact CD-NH1 3.3Å; E1112-R1115 PolarHBondContact O-N 2.94Å; E1112-R1115 IonicContact OE1-CZ 2.72Å; E1112-R1115 IonicContact OE1-NH1 2.7Å; E1112-R1115 PolarHBondContact OE1-NH1 2.73Å; E1112-R1115 WeakPolarHBondContact OE2-CD 3.46Å; E1112-R1115 IonicContact OE2-CZ 3.3Å; E1112-R1115 IonicContact OE2-NE 2.97Å; E1112-R1115 IonicContact OE2-NH1 3.13Å; E1112-R1115 PolarHBondContact OE2-NH1 2.75Å; E1112-Q1116 WeakPolarHBondContact O-CB 3.46Å; E1112-Q1116 VanDerWaalsContact O-CG 3.28Å; E1112-Q1116 WeakPolarHBondContact O-CG 3.47Å; E1112-Q1116 PolarHBondContact O-N 2.95Å; E1112-Q1116 PolarHBondContact OE1-NE2 3.26Å
1113	L	87.4	Confident	87.3	Confident	5 Å²	5	63.8 Å²	63.8	3%	0.026	35%	0.349	C	S	.	.	H	α-helix	trans	-62.5	-41.4	170	-75	-174.8	0	0	0	112.4	W1069 F1109 A1110 Q1116 G1117 F1118 K1121 L1125	W1069-L1113 HydrophobicContact CD2-CD1 4.19Å; W1069-L1113 HydrophobicContact CG-CD1 4.27Å; F1109-L1113 HydrophobicContact CD1-CD1 4.04Å; F1109-L1113 HydrophobicContact CD1-CG 4.1Å; F1109-L1113 HydrophobicContact CE1-CD1 3.81Å; F1109-L1113 HydrophobicContact CE1-CD2 4.31Å; F1109-L1113 HydrophobicContact CE1-CG 3.94Å; F1109-L1113 PolarHBondContact O-N 3.45Å; A1110-L1113 PolarHBondContact O-N 3.47Å; L1113-Q1116 PolarHBondContact O-N 2.93Å; L1113-G1117 PolarHBondContact O-N 2.87Å; L1113-F1118 HydrophobicContact CB-CB 4.42Å; L1113-F1118 HydrophobicContact CD2-CD2 3.96Å; L1113-F1118 PolarHBondContact O-N 3.19Å; L1113-K1121 HydrophobicContact CD1-CB 4.09Å; L1113-K1121 HydrophobicContact CD1-CG 4.24Å; L1113-L1125 HydrophobicContact CD1-CD1 4.31Å; L1113-L1125 HydrophobicContact CD1-CD2 4.26Å
1114	E	87.7	Confident	87.7	Confident	106 Å²	106	57.3 Å²	57.3	50%	0.495	32%	0.315	S	S	.	.	H	α-helix	trans	-63.2	-45.4	176.4	-178.4	165.3	-127	0	0	111.2	A1110 V1111 Q1116 G1117	A1110-E1114 WeakPolarHBondContact O-CB 3.23Å; A1110-E1114 PolarHBondContact O-N 3.3Å; V1111-E1114 PolarHBondContact O-N 3.45Å; E1114-Q1116 VanDerWaalsContact C-N 3.25Å; E1114-Q1116 PolarHBondContact O-N 2.95Å; E1114-G1117 PolarHBondContact O-N 3.16Å
1115	R	90.4	Very high	87.9	Confident	195 Å²	195	55.8 Å²	55.8	74%	0.736	31%	0.307	S	S	*	.	H	α-helix	trans	-60.4	-30.8	173.5	175.2	179.5	164.3	-132.9	-9.1	113.3	V1111 E1112 G1117	V1111-R1115 VanDerWaalsContact O-CB 3.26Å; V1111-R1115 WeakPolarHBondContact O-CB 3.2Å; V1111-R1115 PolarHBondContact O-N 3.27Å; E1112-R1115 VanDerWaalsContact CD-NH1 3.3Å; E1112-R1115 PolarHBondContact O-N 2.94Å; E1112-R1115 IonicContact OE1-CZ 2.72Å; E1112-R1115 IonicContact OE1-NH1 2.7Å; E1112-R1115 PolarHBondContact OE1-NH1 2.73Å; E1112-R1115 WeakPolarHBondContact OE2-CD 3.46Å; E1112-R1115 IonicContact OE2-CZ 3.3Å; E1112-R1115 IonicContact OE2-NE 2.97Å; E1112-R1115 IonicContact OE2-NH1 3.13Å; E1112-R1115 PolarHBondContact OE2-NH1 2.75Å; R1115-G1117 VanDerWaalsContact C-N 3.26Å
1116	Q	88.3	Confident	88.1	Confident	98 Å²	98	52.9 Å²	52.9	46%	0.458	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.7	-2.7	174	-71.3	173.4	25.9	0	0	113.5	E1112 L1113 E1114 F1118	E1112-Q1116 WeakPolarHBondContact O-CB 3.46Å; E1112-Q1116 VanDerWaalsContact O-CG 3.28Å; E1112-Q1116 WeakPolarHBondContact O-CG 3.47Å; E1112-Q1116 PolarHBondContact O-N 2.95Å; E1112-Q1116 PolarHBondContact OE1-NE2 3.26Å; L1113-Q1116 PolarHBondContact O-N 2.93Å; E1114-Q1116 VanDerWaalsContact C-N 3.25Å; E1114-Q1116 PolarHBondContact O-N 2.95Å; Q1116-F1118 HydrophobicContact CB-CD2 3.81Å; Q1116-F1118 HydrophobicContact CB-CE2 3.83Å
1117	G	84	Confident	88.2	Confident	65 Å²	65	55.1 Å²	55.1	67%	0.67	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	92.8	5.2	175.7	0	0	0	0	0	115.1	L1113 E1114 R1115 G1119	L1113-G1117 PolarHBondContact O-N 2.87Å; E1114-G1117 PolarHBondContact O-N 3.16Å; R1115-G1117 VanDerWaalsContact C-N 3.26Å; G1117-G1119 PolarHBondContact O-N 2.96Å
1118	F	81	Confident	88.3	Confident	99 Å²	99	51.9 Å²	51.9	43%	0.434	28%	0.284	S	S	.	.	S	Bend	trans	-78.6	-8.3	175.1	-59.8	-73.8	0	0	0	113	W1069 L1113 Q1116 K1121	W1069-F1118 HydrophobicContact CZ2-CB 4.35Å; W1069-F1118 HydrophobicContact CZ2-CD1 4.32Å; W1069-F1118 HydrophobicContact CZ2-CG 4.46Å; L1113-F1118 HydrophobicContact CB-CB 4.42Å; L1113-F1118 HydrophobicContact CD2-CD2 3.96Å; L1113-F1118 PolarHBondContact O-N 3.19Å; Q1116-F1118 HydrophobicContact CB-CD2 3.81Å; Q1116-F1118 HydrophobicContact CB-CE2 3.83Å; F1118-K1121 WeakPolarHBondContact O-CE 3.32Å
1119	G	79.5	Confident	88.4	Confident	24 Å²	24	51.4 Å²	51.4	25%	0.247	27%	0.27	C	S	.	.			trans	74	177.1	-174.3	0	0	0	0	0	113.1	G1117 K1121	G1117-G1119 PolarHBondContact O-N 2.96Å; G1119-K1121 PolarHBondContact O-N 3.48Å
1120	S	81.8	Confident	88.6	Confident	43 Å²	43	53 Å²	53	30%	0.301	28%	0.28	S	S	.	.			trans	-54.8	130.3	171.1	178.3	0	0	0	0	111.3	E372	E372-S1120 WeakPolarHBondContact CG-O 3.21Å; E372-S1120 PolarHBondContact OE2-OG 3.32Å
1121	K	86.3	Confident	88.7	Confident	21 Å²	21	53.1 Å²	53.1	9%	0.091	28%	0.279	C	S	.	.			trans	-130.7	21.8	172.5	-59.3	-61.8	163.9	-169.8	0	112.2	E372 Y373 W1069 L1113 F1118 G1119 I1123 T1124 L1125	E372-K1121 WeakPolarHBondContact OE1-CA 3.44Å; Y373-K1121 PolarHBondContact OH-NZ 2.77Å; Y373-K1121 VanDerWaalsContact OH-NZ 3.14Å; W1069-K1121 HydrophobicContact CE3-CG 4.44Å; W1069-K1121 HydrophobicContact CH2-CD 3.67Å; W1069-K1121 HydrophobicContact CH2-CG 3.82Å; W1069-K1121 HydrophobicContact CZ2-CG 4.45Å; W1069-K1121 HydrophobicContact CZ3-CB 4.37Å; W1069-K1121 HydrophobicContact CZ3-CD 3.7Å; W1069-K1121 HydrophobicContact CZ3-CG 3.8Å; L1113-K1121 HydrophobicContact CD1-CB 4.09Å; L1113-K1121 HydrophobicContact CD1-CG 4.24Å; F1118-K1121 WeakPolarHBondContact O-CE 3.32Å; G1119-K1121 PolarHBondContact O-N 3.48Å; K1121-I1123 PolarHBondContact O-N 2.89Å; K1121-T1124 WeakPolarHBondContact O-CB 3.43Å; K1121-T1124 PolarHBondContact O-N 2.8Å; K1121-T1124 VanDerWaalsContact O-N 3.15Å; K1121-L1125 HydrophobicContact CB-CD1 4.48Å; K1121-L1125 HydrophobicContact CB-CG 4.44Å; K1121-L1125 VanDerWaalsContact O-CG 3.27Å; K1121-L1125 WeakPolarHBondContact O-CG 3.4Å; K1121-L1125 PolarHBondContact O-N 3.45Å
1122	S	89.1	Confident	88.7	Confident	35 Å²	35	49 Å²	49	25%	0.245	25%	0.254	C	S	.	.	H	α-helix	trans	-50	-54.4	-174.3	61.9	0	0	0	0	113.4	E372 L1125 Y1126	E372-S1122 PolarHBondContact OE1-N 3.49Å; E372-S1122 VanDerWaalsContact OE1-N 3.14Å; E372-S1122 PolarHBondContact OE2-N 3.06Å; E372-S1122 VanDerWaalsContact OE2-N 3.16Å; E372-S1122 PolarHBondContact OE2-OG 2.93Å; S1122-L1125 PolarHBondContact O-N 3.39Å; S1122-Y1126 WeakPolarHBondContact O-CD2 3.49Å; S1122-Y1126 PolarHBondContact O-N 3.07Å; S1122-Y1126 VanDerWaalsContact O-N 3.17Å
1123	I	91.6	Very high	88.8	Confident	53 Å²	53	48.3 Å²	48.3	27%	0.272	26%	0.257	S	S	.	.	H	α-helix	trans	-66.3	-43	179.5	-48.1	179.2	0	0	0	109.9	K371 E372 K375 K1121 L1125 Y1126 D1127	K371-I1123 HydrophobicContact CB-CB 4.39Å; K371-I1123 HydrophobicContact CB-CD1 4.2Å; K371-I1123 HydrophobicContact CB-CG2 4.03Å; K371-I1123 HydrophobicContact CD-CG2 3.82Å; E372-I1123 VanDerWaalsContact OE1-CA 3.32Å; E372-I1123 WeakPolarHBondContact OE1-CA 3.47Å; E372-I1123 VanDerWaalsContact OE1-CB 3.23Å; E372-I1123 WeakPolarHBondContact OE1-CB 3.33Å; E372-I1123 PolarHBondContact OE1-N 3.37Å; K375-I1123 HydrophobicContact CB-CD1 4.46Å; K1121-I1123 PolarHBondContact O-N 2.89Å; I1123-L1125 VanDerWaalsContact C-N 3.32Å; I1123-L1125 PolarHBondContact O-N 2.91Å; I1123-Y1126 PolarHBondContact O-N 3.21Å; I1123-Y1126 VanDerWaalsContact O-N 3.15Å; I1123-D1127 PolarHBondContact O-N 3.2Å
1124	T	91.7	Very high	88.8	Confident	14 Å²	14	50.9 Å²	50.9	9%	0.086	28%	0.275	C	S	.	.	H	α-helix	trans	-57.9	-42.4	177.3	-57.1	0	0	0	0	112.1	E372 T1066 W1069 K1121 D1127 I1128	E372-T1124 PolarHBondContact OE1-N 2.93Å; E372-T1124 VanDerWaalsContact OE1-N 3.12Å; T1066-T1124 HydrophobicContact CG2-CG2 4.1Å; W1069-T1124 HydrophobicContact CE3-CG2 4.34Å; W1069-T1124 HydrophobicContact CZ3-CG2 4.17Å; K1121-T1124 WeakPolarHBondContact O-CB 3.43Å; K1121-T1124 PolarHBondContact O-N 2.8Å; K1121-T1124 VanDerWaalsContact O-N 3.15Å; T1124-D1127 PolarHBondContact O-N 3.04Å; T1124-I1128 HydrophobicContact CG2-CD1 4.06Å; T1124-I1128 VanDerWaalsContact O-CG1 3.28Å; T1124-I1128 WeakPolarHBondContact O-CG1 3.46Å; T1124-I1128 PolarHBondContact O-N 2.67Å
1125	L	92.4	Very high	88.9	Confident	0 Å²	0	49 Å²	49	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-66.3	-39.6	176.4	-64.6	162.2	0	0	0	111.6	M1073 L1106 F1109 A1110 L1113 K1121 S1122 I1123 I1128 R1129	M1073-L1125 HydrophobicContact CG-CD2 4.23Å; M1073-L1125 HydrophobicContact SD-CB 4.42Å; M1073-L1125 HydrophobicContact SD-CD2 3.47Å; M1073-L1125 WeakPolarHBondContact SD-CD2 3.37Å; L1106-L1125 HydrophobicContact CB-CB 4.38Å; L1106-L1125 HydrophobicContact CD1-CB 4.34Å; L1106-L1125 HydrophobicContact CD2-CB 4.4Å; F1109-L1125 HydrophobicContact CD1-CD1 3.75Å; F1109-L1125 HydrophobicContact CD1-CD2 3.62Å; F1109-L1125 HydrophobicContact CD1-CG 4.35Å; F1109-L1125 HydrophobicContact CE1-CD2 3.68Å; A1110-L1125 HydrophobicContact CB-CD1 3.78Å; L1113-L1125 HydrophobicContact CD1-CD1 4.31Å; L1113-L1125 HydrophobicContact CD1-CD2 4.26Å; K1121-L1125 HydrophobicContact CB-CD1 4.48Å; K1121-L1125 HydrophobicContact CB-CG 4.44Å; K1121-L1125 VanDerWaalsContact O-CG 3.27Å; K1121-L1125 WeakPolarHBondContact O-CG 3.4Å; K1121-L1125 PolarHBondContact O-N 3.45Å; S1122-L1125 PolarHBondContact O-N 3.39Å; I1123-L1125 VanDerWaalsContact C-N 3.32Å; I1123-L1125 PolarHBondContact O-N 2.91Å; L1125-I1128 PolarHBondContact O-N 2.98Å; L1125-R1129 WeakPolarHBondContact O-CB 3.39Å; L1125-R1129 PolarHBondContact O-N 2.99Å
1126	Y	92.8	Very high	88.8	Confident	34 Å²	34	40.8 Å²	40.8	13%	0.133	24%	0.237	C	C	.	.	H	α-helix	trans	-64.1	-37.8	172.7	-77.3	-62.8	0	0	0	112.6	L1106 D1107 S1122 I1123 N1130 M1708	L1106-Y1126 HydrophobicContact CB-CE1 4.19Å; L1106-Y1126 HydrophobicContact CD1-CD1 3.61Å; L1106-Y1126 HydrophobicContact CD1-CE1 3.75Å; L1106-Y1126 HydrophobicContact CD1-CG 4.19Å; L1106-Y1126 HydrophobicContact CG-CE1 4.42Å; D1107-Y1126 WeakPolarHBondContact OD1-CE2 3.32Å; D1107-Y1126 PolarHBondContact OD1-OH 2.67Å; S1122-Y1126 WeakPolarHBondContact O-CD2 3.49Å; S1122-Y1126 PolarHBondContact O-N 3.07Å; S1122-Y1126 VanDerWaalsContact O-N 3.17Å; I1123-Y1126 PolarHBondContact O-N 3.21Å; I1123-Y1126 VanDerWaalsContact O-N 3.15Å; Y1126-N1130 WeakPolarHBondContact O-CB 3.46Å; Y1126-N1130 PolarHBondContact O-N 3.01Å; Y1126-N1130 VanDerWaalsContact O-N 3.08Å; Y1126-N1130 PolarHBondContact O-ND2 2.83Å; Y1126-N1130 PolarHBondContact O-OD1 3.41Å; Y1126-M1708 VanDerWaalsContact OH-CE 3.26Å; Y1126-M1708 WeakPolarHBondContact OH-CE 3.47Å
1127	D	91.9	Very high	88.8	Confident	49 Å²	49	41.1 Å²	41.1	26%	0.262	24%	0.237	S	C	.	.	H	α-helix	trans	-64.5	-47.4	173.2	-71.6	-58.1	0	0	0	111.5	K371 I1123 T1124 R1129 N1130 E1131	K371-D1127 WeakPolarHBondContact CD-OD2 3.48Å; K371-D1127 WeakPolarHBondContact CE-OD2 3.43Å; K371-D1127 IonicContact NZ-OD1 3.78Å; K371-D1127 PolarHBondContact NZ-OD1 3.46Å; K371-D1127 IonicContact NZ-OD2 2.76Å; K371-D1127 PolarHBondContact NZ-OD2 2.67Å; I1123-D1127 PolarHBondContact O-N 3.2Å; T1124-D1127 PolarHBondContact O-N 3.04Å; D1127-R1129 VanDerWaalsContact C-N 3.34Å; D1127-R1129 PolarHBondContact O-N 3.3Å; D1127-N1130 WeakPolarHBondContact O-CB 3.02Å; D1127-N1130 PolarHBondContact O-N 2.65Å; D1127-N1130 VanDerWaalsContact O-N 3.09Å; D1127-E1131 PolarHBondContact O-N 3.43Å
1128	I	92.9	Very high	89.1	Confident	5 Å²	5	40.2 Å²	40.2	3%	0.026	22%	0.216	C	C	.	.	H	α-helix	trans	-56.4	-47.8	175.6	-68.6	165.1	0	0	0	110.3	V1062 W1069 A1070 M1073 T1124 L1125 N1130 E1131 L1132	V1062-I1128 HydrophobicContact CG1-CG1 4.19Å; V1062-I1128 HydrophobicContact CG2-CB 4.44Å; V1062-I1128 HydrophobicContact CG2-CG1 4.11Å; V1062-I1128 HydrophobicContact CG2-CG2 4.26Å; W1069-I1128 HydrophobicContact CB-CD1 4.43Å; A1070-I1128 HydrophobicContact CB-CG2 3.78Å; M1073-I1128 HydrophobicContact CE-CB 4.16Å; M1073-I1128 HydrophobicContact CE-CG2 3.76Å; M1073-I1128 HydrophobicContact SD-CB 4.09Å; M1073-I1128 HydrophobicContact SD-CD1 4.41Å; M1073-I1128 HydrophobicContact SD-CG2 3.66Å; T1124-I1128 HydrophobicContact CG2-CD1 4.06Å; T1124-I1128 VanDerWaalsContact O-CG1 3.28Å; T1124-I1128 WeakPolarHBondContact O-CG1 3.46Å; T1124-I1128 PolarHBondContact O-N 2.67Å; L1125-I1128 PolarHBondContact O-N 2.98Å; I1128-N1130 VanDerWaalsContact C-N 3.28Å; I1128-N1130 PolarHBondContact O-N 2.71Å; I1128-E1131 PolarHBondContact O-N 3.43Å; I1128-L1132 HydrophobicContact CG2-CD1 3.87Å; I1128-L1132 HydrophobicContact CG2-CG 4.26Å; I1128-L1132 WeakPolarHBondContact O-CB 3.27Å; I1128-L1132 WeakPolarHBondContact O-CG 3.33Å; I1128-L1132 PolarHBondContact O-N 2.94Å
1129	R	92.8	Very high	89.5	Confident	43 Å²	43	40.3 Å²	40.3	16%	0.162	22%	0.215	C	C	.	.	H	α-helix	trans	-57.4	-40.6	176.5	-168.6	-166.7	61	-177.5	2.4	112.1	M1073 L1101 L1106 L1125 D1127 S1133 Q1709	M1073-R1129 HydrophobicContact CE-CB 4.12Å; L1101-R1129 HydrophobicContact CB-CG 3.99Å; L1101-R1129 VanDerWaalsContact O-CD 3.22Å; L1101-R1129 WeakPolarHBondContact O-CD 3.32Å; L1106-R1129 HydrophobicContact CD1-CB 3.92Å; L1106-R1129 HydrophobicContact CD1-CG 4.3Å; L1125-R1129 WeakPolarHBondContact O-CB 3.39Å; L1125-R1129 PolarHBondContact O-N 2.99Å; D1127-R1129 VanDerWaalsContact C-N 3.34Å; D1127-R1129 PolarHBondContact O-N 3.3Å; R1129-S1133 WeakPolarHBondContact O-CB 3.25Å; R1129-S1133 PolarHBondContact O-N 2.95Å; R1129-S1133 PolarHBondContact O-OG 3.08Å; R1129-Q1709 VanDerWaalsContact NH2-OE1 3.09Å
1130	N	91.5	Very high	90.2	Very high	61 Å²	61	39.8 Å²	39.8	33%	0.326	21%	0.205	S	C	.	.	H	α-helix	trans	-70.5	-37.5	-178.9	-66.6	-26	0	0	0	112.3	Y1126 D1127 I1128 S1133 C1134	Y1126-N1130 WeakPolarHBondContact O-CB 3.46Å; Y1126-N1130 PolarHBondContact O-N 3.01Å; Y1126-N1130 VanDerWaalsContact O-N 3.08Å; Y1126-N1130 PolarHBondContact O-ND2 2.83Å; Y1126-N1130 PolarHBondContact O-OD1 3.41Å; D1127-N1130 WeakPolarHBondContact O-CB 3.02Å; D1127-N1130 PolarHBondContact O-N 2.65Å; D1127-N1130 VanDerWaalsContact O-N 3.09Å; I1128-N1130 VanDerWaalsContact C-N 3.28Å; I1128-N1130 PolarHBondContact O-N 2.71Å; N1130-S1133 PolarHBondContact O-N 3.18Å; N1130-C1134 PolarHBondContact O-N 3.45Å
1131	E	92.1	Very high	90.8	Very high	8 Å²	8	40.7 Å²	40.7	4%	0.037	21%	0.209	C	C	.	.	H	α-helix	trans	-72.5	-43.1	175.4	-72.8	-70.7	136.9	0	0	112	R1061 V1062 D1127 I1128 S1133 C1134 L1135 Y1136	R1061-E1131 HydrophobicContact CB-CG 3.94Å; R1061-E1131 IonicContact CZ-OE1 2.94Å; R1061-E1131 PolarHBondContact N-OE2 3.02Å; R1061-E1131 IonicContact NH1-OE1 3.12Å; R1061-E1131 PolarHBondContact NH1-OE1 3.15Å; R1061-E1131 IonicContact NH1-OE2 2.69Å; V1062-E1131 HydrophobicContact CG2-CB 4.3Å; D1127-E1131 PolarHBondContact O-N 3.43Å; I1128-E1131 PolarHBondContact O-N 3.43Å; E1131-S1133 PolarHBondContact O-N 3.38Å; E1131-C1134 CarbonylContact O-C 3.49Å; E1131-C1134 PolarHBondContact O-N 3.12Å; E1131-L1135 WeakPolarHBondContact O-CA 3.48Å; E1131-L1135 PolarHBondContact O-N 2.83Å; E1131-Y1136 WeakPolarHBondContact OE2-CA 3.48Å; E1131-Y1136 PolarHBondContact OE2-N 2.89Å
1132	L	90.9	Very high	91.2	Very high	3 Å²	3	43.7 Å²	43.7	2%	0.016	23%	0.23	C	C	.	.	H	α-helix	trans	-62.2	-28.4	171.6	-67.7	177.4	0	0	0	112.2	L1057 L1091 L1095 L1101 I1128 C1134	L1057-L1132 HydrophobicContact CD2-CD2 3.9Å; L1091-L1132 HydrophobicContact CD2-CD1 4.42Å; L1091-L1132 HydrophobicContact CD2-CD2 3.87Å; L1095-L1132 HydrophobicContact CD2-CD2 4.43Å; L1095-L1132 WeakPolarHBondContact CD2-O 3.26Å; L1101-L1132 HydrophobicContact CD1-CB 3.6Å; L1101-L1132 HydrophobicContact CD1-CD1 4.32Å; L1101-L1132 HydrophobicContact CD2-CD1 4.47Å; I1128-L1132 HydrophobicContact CG2-CD1 3.87Å; I1128-L1132 HydrophobicContact CG2-CG 4.26Å; I1128-L1132 WeakPolarHBondContact O-CB 3.27Å; I1128-L1132 WeakPolarHBondContact O-CG 3.33Å; I1128-L1132 PolarHBondContact O-N 2.94Å; L1132-C1134 VanDerWaalsContact C-N 3.34Å
1133	S	89.7	Confident	91.4	Very high	53 Å²	53	44.4 Å²	44.4	37%	0.371	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74	-21.6	172.6	-60.9	0	0	0	0	113.9	R1129 N1130 E1131	R1129-S1133 WeakPolarHBondContact O-CB 3.25Å; R1129-S1133 PolarHBondContact O-N 2.95Å; R1129-S1133 PolarHBondContact O-OG 3.08Å; N1130-S1133 PolarHBondContact O-N 3.18Å; E1131-S1133 PolarHBondContact O-N 3.38Å
1134	C	86.6	Confident	91.4	Very high	59 Å²	59	47 Å²	47	40%	0.399	25%	0.247	S	C	.	.	S	Bend	trans	-169.5	89.4	-177.5	-168.5	0	0	0	0	111	N1130 E1131 L1132 Y1136 K1137	N1130-C1134 PolarHBondContact O-N 3.45Å; E1131-C1134 CarbonylContact O-C 3.49Å; E1131-C1134 PolarHBondContact O-N 3.12Å; L1132-C1134 VanDerWaalsContact C-N 3.34Å; C1134-Y1136 PolarHBondContact O-N 2.96Å; C1134-K1137 HydrophobicContact CB-CB 4.15Å; C1134-K1137 HydrophobicContact CB-CD 4.06Å; C1134-K1137 WeakPolarHBondContact O-CB 3.26Å; C1134-K1137 PolarHBondContact O-N 3.33Å
1135	L	88.8	Confident	91.3	Very high	66 Å²	66	51 Å²	51	35%	0.346	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.8	127	-175.2	-66.9	175.8	0	0	0	113.5	G1059 L1095 E1131 K1137	G1059-L1135 WeakPolarHBondContact O-CB 3.44Å; L1095-L1135 HydrophobicContact CD1-CD1 4.48Å; L1095-L1135 HydrophobicContact CD2-CD1 4.04Å; L1095-L1135 HydrophobicContact CD2-CD2 3.93Å; L1095-L1135 HydrophobicContact CD2-CG 3.93Å; E1131-L1135 WeakPolarHBondContact O-CA 3.48Å; E1131-L1135 PolarHBondContact O-N 2.83Å; L1135-K1137 PolarHBondContact O-N 3.01Å
1136	Y	89.1	Confident	91.3	Very high	24 Å²	24	52.8 Å²	52.8	9%	0.094	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	52.5	22.2	177.4	-101.6	-68.8	0	0	0	115.8	R1018 G1037 K1040 G1059 S1060 R1061 E1131 C1134 D1138	R1018-Y1136 PolarHBondContact NH2-OH 3.13Å; G1037-Y1136 PolarHBondContact O-OH 2.86Å; K1040-Y1136 HydrophobicContact CB-CD2 3.84Å; K1040-Y1136 HydrophobicContact CB-CE1 4.33Å; K1040-Y1136 HydrophobicContact CB-CE2 3.45Å; K1040-Y1136 VanDerWaalsContact CB-CE2 3.45Å; K1040-Y1136 HydrophobicContact CB-CG 4.46Å; K1040-Y1136 HydrophobicContact CD-CD2 3.73Å; K1040-Y1136 HydrophobicContact CD-CE2 4.26Å; K1040-Y1136 HydrophobicContact CD-CG 4.04Å; K1040-Y1136 HydrophobicContact CG-CD2 3.54Å; K1040-Y1136 HydrophobicContact CG-CE2 3.6Å; K1040-Y1136 HydrophobicContact CG-CG 4.27Å; G1059-Y1136 WeakPolarHBondContact O-CD2 3.43Å; S1060-Y1136 WeakPolarHBondContact O-CE2 3.4Å; R1061-Y1136 HydrophobicContact CB-CE1 4.49Å; R1061-Y1136 HydrophobicContact CG-CD1 3.61Å; R1061-Y1136 HydrophobicContact CG-CE1 3.32Å; R1061-Y1136 HydrophobicContact CG-CG 4.33Å; R1061-Y1136 PolarHBondContact NH1-O 3.18Å; R1061-Y1136 PolarHBondContact NH2-O 3.48Å; E1131-Y1136 WeakPolarHBondContact OE2-CA 3.48Å; E1131-Y1136 PolarHBondContact OE2-N 2.89Å; C1134-Y1136 PolarHBondContact O-N 2.96Å; Y1136-D1138 PolarHBondContact O-N 3.3Å
1137	K	89.5	Confident	91.2	Very high	105 Å²	105	53.3 Å²	53.3	46%	0.457	28%	0.283	S	S	.	.			trans	-41.6	125.8	-179.4	-179.2	175.7	-177.2	173.5	0	113.3	R1061 C1134 L1135 Y1139	R1061-K1137 PolarHBondContact NH1-O 2.66Å; R1061-K1137 PolarHBondContact NH2-O 3.18Å; R1061-K1137 VanDerWaalsContact NH2-O 3.08Å; C1134-K1137 HydrophobicContact CB-CB 4.15Å; C1134-K1137 HydrophobicContact CB-CD 4.06Å; C1134-K1137 WeakPolarHBondContact O-CB 3.26Å; C1134-K1137 PolarHBondContact O-N 3.33Å; L1135-K1137 PolarHBondContact O-N 3.01Å; K1137-Y1139 HydrophobicContact CD-CE1 4.21Å; K1137-Y1139 VanDerWaalsContact O-CD2 3.26Å; K1137-Y1139 WeakPolarHBondContact O-CD2 3.47Å; K1137-Y1139 WeakPolarHBondContact O-CE2 3.46Å; K1137-Y1139 PolarHBondContact O-N 3.05Å
1138	D	89.1	Confident	91.2	Very high	45 Å²	45	53.1 Å²	53.1	24%	0.241	29%	0.289	C	S	.	.			trans	-70.4	121.5	175.2	-166.4	-13	0	0	0	110.4	Y1136 R1140	Y1136-D1138 PolarHBondContact O-N 3.3Å; D1138-R1140 WeakPolarHBondContact OD1-CB 3.44Å; D1138-R1140 VanDerWaalsContact OD1-CG 3.3Å; D1138-R1140 WeakPolarHBondContact OD1-CG 3.48Å; D1138-R1140 PolarHBondContact OD1-N 3.14Å; D1138-R1140 IonicContact OD1-NE 3.4Å; D1138-R1140 PolarHBondContact OD1-NE 3.45Å; D1138-R1140 VanDerWaalsContact OD1-NE 3.08Å; D1138-R1140 IonicContact OD2-CZ 2.76Å; D1138-R1140 VanDerWaalsContact OD2-CZ 3.29Å; D1138-R1140 IonicContact OD2-NE 3.16Å; D1138-R1140 PolarHBondContact OD2-NE 3.02Å; D1138-R1140 IonicContact OD2-NH2 2.69Å; D1138-R1140 PolarHBondContact OD2-NH2 3.33Å
1139	Y	89.7	Confident	91	Very high	102 Å²	102	57.8 Å²	57.8	40%	0.4	31%	0.31	S	S	.	.			trans	-92.2	-6.4	-179.9	-68.1	-72.2	0	0	0	113.4	K1137	K1137-Y1139 HydrophobicContact CD-CE1 4.21Å; K1137-Y1139 VanDerWaalsContact O-CD2 3.26Å; K1137-Y1139 WeakPolarHBondContact O-CD2 3.47Å; K1137-Y1139 WeakPolarHBondContact O-CE2 3.46Å; K1137-Y1139 PolarHBondContact O-N 3.05Å
1140	R	94.2	Very high	90.9	Very high	13 Å²	13	60.9 Å²	60.9	5%	0.049	33%	0.327	C	S	.	.	S	Bend	trans	-60.4	159.4	178.4	-70.9	-179.8	-66.5	179.7	-6.7	112.6	L759 K760 A762 D926 V973 D1138 P1142	L759-R1140 WeakPolarHBondContact O-CD 3.29Å; K760-R1140 WeakPolarHBondContact O-CB 3.14Å; A762-R1140 HydrophobicContact CB-CB 3.76Å; D926-R1140 VanDerWaalsContact CG-NH1 3.32Å; D926-R1140 IonicContact OD1-CZ 2.73Å; D926-R1140 IonicContact OD1-NH1 3.45Å; D926-R1140 PolarHBondContact OD1-NH1 2.97Å; D926-R1140 IonicContact OD1-NH2 2.8Å; D926-R1140 IonicContact OD2-CZ 2.62Å; D926-R1140 IonicContact OD2-NH1 3.43Å; D926-R1140 PolarHBondContact OD2-NH1 3.18Å; D926-R1140 VanDerWaalsContact OD2-NH1 3.11Å; D926-R1140 IonicContact OD2-NH2 3.19Å; D926-R1140 PolarHBondContact OD2-NH2 3.42Å; V973-R1140 HydrophobicContact CG2-CG 4.23Å; D1138-R1140 WeakPolarHBondContact OD1-CB 3.44Å; D1138-R1140 VanDerWaalsContact OD1-CG 3.3Å; D1138-R1140 WeakPolarHBondContact OD1-CG 3.48Å; D1138-R1140 PolarHBondContact OD1-N 3.14Å; D1138-R1140 IonicContact OD1-NE 3.4Å; D1138-R1140 PolarHBondContact OD1-NE 3.45Å; D1138-R1140 VanDerWaalsContact OD1-NE 3.08Å; D1138-R1140 IonicContact OD2-CZ 2.76Å; D1138-R1140 VanDerWaalsContact OD2-CZ 3.29Å; D1138-R1140 IonicContact OD2-NE 3.16Å; D1138-R1140 PolarHBondContact OD2-NE 3.02Å; D1138-R1140 IonicContact OD2-NH2 2.69Å; D1138-R1140 PolarHBondContact OD2-NH2 3.33Å; R1140-P1142 WeakPolarHBondContact O-CD 3.4Å
1141	T	94.5	Very high	90.9	Very high	61 Å²	61	59.8 Å²	59.8	37%	0.374	32%	0.321	S	S	.	.	B	Isolated β-bridge	trans	-71.8	124.4	-179.4	-51.5	0	0	0	0	109.5	K760 V761 A762	K760-T1141 WeakPolarHBondContact O-CB 3.27Å; K760-T1141 PolarHBondContact O-N 2.92Å; V761-T1141 WeakPolarHBondContact CA-O 3.43Å; A762-T1141 PolarHBondContact N-O 3.46Å
1142	P	93.9	Very high	90.9	Very high	84 Å²	84	59.8 Å²	59.8	55%	0.545	32%	0.32	S	S	.	.	P	Polyproline II helix	trans	-56.2	141.3	173.6	-25.1	34.9	0	0	0	111.7	R1140 T1144	R1140-P1142 WeakPolarHBondContact O-CD 3.4Å; P1142-T1144 PolarHBondContact O-N 2.95Å
1143	Y	93.4	Very high	90.8	Very high	51 Å²	51	62 Å²	62	20%	0.2	33%	0.332	C	S	.	.	P	Polyproline II helix	trans	-53.8	135.9	178.4	174.2	-95.8	0	0	0	112.6	V761 Y764 E887 M924	V761-Y1143 HydrophobicContact CG1-CD2 4.29Å; Y764-Y1143 AromaticContact CD2-CD1 3.78Å; Y764-Y1143 HydrophobicContact CD2-CD1 3.78Å; Y764-Y1143 HydrophobicContact CD2-CG 4.33Å; Y764-Y1143 HydrophobicContact CE2-CD1 4.15Å; E887-Y1143 HydrophobicContact CG-CE1 4.33Å; M924-Y1143 HydrophobicContact CE-CD1 4.31Å; M924-Y1143 HydrophobicContact CE-CD2 3.54Å; M924-Y1143 HydrophobicContact CE-CE2 3.8Å; M924-Y1143 HydrophobicContact CE-CG 3.8Å; M924-Y1143 HydrophobicContact SD-CE2 4.44Å
1144	T	91.8	Very high	90.9	Very high	108 Å²	108	61.1 Å²	61.1	66%	0.663	32%	0.323	S	S	*	.			trans	-119	137.4	174.3	51.8	0	0	0	0	109.9	P1142	P1142-T1144 PolarHBondContact O-N 2.95Å
1145	K	90.8	Very high	91.1	Very high	97 Å²	97	58.7 Å²	58.7	42%	0.422	31%	0.306	S	S	.	.	P	Polyproline II helix	trans	-60.3	145.4	174.8	-52.5	-169.2	-178	-146	0	110.8	E885 E887	E885-K1145 IonicContact OE1-NZ 3.26Å; E885-K1145 PolarHBondContact OE1-NZ 3.27Å; E885-K1145 IonicContact OE2-NZ 2.73Å; E885-K1145 PolarHBondContact OE2-NZ 3.32Å; E887-K1145 VanDerWaalsContact OE1-CD 3.29Å; E887-K1145 WeakPolarHBondContact OE1-CD 3.44Å; E887-K1145 WeakPolarHBondContact OE1-CE 3.46Å; E887-K1145 IonicContact OE1-NZ 3.1Å; E887-K1145 PolarHBondContact OE1-NZ 3.24Å
1146	P	90.8	Very high	91.2	Very high	38 Å²	38	56.6 Å²	56.6	25%	0.247	30%	0.295	C	S	.	.	P	Polyproline II helix	trans	-58	142.3	176.2	-22.4	32.4	0	0	0	112.4	E1150 M1154	P1146-E1150 HydrophobicContact CB-CB 4.23Å; P1146-M1154 HydrophobicContact CB-CE 3.7Å; P1146-M1154 HydrophobicContact CG-CE 3.68Å
1147	S	92.2	Very high	91.2	Very high	44 Å²	44	60.3 Å²	60.3	31%	0.308	31%	0.312	S	S	.	.	P	Polyproline II helix	trans	-67.1	166.3	167.1	64	0	0	0	0	111.8	E1149 E1150 L1151	S1147-E1149 PolarHBondContact O-N 3.18Å; S1147-E1150 VanDerWaalsContact CB-OE2 3.24Å; S1147-E1150 WeakPolarHBondContact CB-OE2 3.45Å; S1147-E1150 PolarHBondContact N-OE2 3.15Å; S1147-E1150 PolarHBondContact O-N 2.93Å; S1147-E1150 WeakPolarHBondContact OG-CG 3.45Å; S1147-E1150 PolarHBondContact OG-N 3.05Å; S1147-E1150 PolarHBondContact OG-OE2 3.44Å; S1147-L1151 VanDerWaalsContact O-CB 3.22Å; S1147-L1151 WeakPolarHBondContact O-CB 3.44Å; S1147-L1151 PolarHBondContact O-N 3.02Å
1148	A	91.1	Very high	91	Very high	46 Å²	46	57.1 Å²	57.1	38%	0.38	30%	0.299	S	S	.	.	H	α-helix	trans	-61.7	-28.7	175	0	0	0	0	0	112.7	F1152 I1276	A1148-F1152 WeakPolarHBondContact O-CB 3.17Å; A1148-F1152 PolarHBondContact O-N 3.39Å; A1148-I1276 HydrophobicContact CB-CG2 4.44Å; A1148-I1276 VanDerWaalsContact O-CG2 3.29Å; A1148-I1276 WeakPolarHBondContact O-CG2 3.35Å
1149	E	89.6	Confident	90.7	Very high	103 Å²	103	58.3 Å²	58.3	48%	0.481	31%	0.308	S	S	.	.	H	α-helix	trans	-73.5	-51.7	177.3	-56.3	-177.9	147	0	0	110.3	S1147 L1151 F1152 D1153 I1276	S1147-E1149 PolarHBondContact O-N 3.18Å; E1149-L1151 VanDerWaalsContact C-N 3.29Å; E1149-L1151 PolarHBondContact O-N 2.92Å; E1149-F1152 WeakPolarHBondContact O-CA 3.39Å; E1149-F1152 WeakPolarHBondContact O-CB 3.31Å; E1149-F1152 PolarHBondContact O-N 2.86Å; E1149-D1153 PolarHBondContact O-N 3.04Å; E1149-I1276 HydrophobicContact CG-CD1 4.08Å
1150	E	90.1	Very high	90.3	Very high	108 Å²	108	56.4 Å²	56.4	51%	0.505	31%	0.308	S	S	.	.	H	α-helix	trans	-61.2	-37.4	175.4	-68.1	159.9	128.9	0	0	112.1	P1146 S1147 F1152 M1154	P1146-E1150 HydrophobicContact CB-CB 4.23Å; S1147-E1150 VanDerWaalsContact CB-OE2 3.24Å; S1147-E1150 WeakPolarHBondContact CB-OE2 3.45Å; S1147-E1150 PolarHBondContact N-OE2 3.15Å; S1147-E1150 PolarHBondContact O-N 2.93Å; S1147-E1150 WeakPolarHBondContact OG-CG 3.45Å; S1147-E1150 PolarHBondContact OG-N 3.05Å; S1147-E1150 PolarHBondContact OG-OE2 3.44Å; E1150-F1152 VanDerWaalsContact C-N 3.3Å; E1150-F1152 PolarHBondContact O-N 2.7Å; E1150-M1154 VanDerWaalsContact O-CB 3.3Å; E1150-M1154 WeakPolarHBondContact O-CB 3.16Å; E1150-M1154 VanDerWaalsContact O-CG 3.23Å; E1150-M1154 WeakPolarHBondContact O-CG 3.3Å; E1150-M1154 PolarHBondContact O-N 3.42Å
1151	L	91.8	Very high	89.3	Confident	38 Å²	38	60.9 Å²	60.9	20%	0.199	33%	0.333	C	S	.	.	H	α-helix	trans	-69.1	-27.5	174.8	-172	64.2	0	0	0	112.4	I888 S1147 E1149 M1154 L1155	I888-L1151 HydrophobicContact CB-CD1 3.98Å; I888-L1151 HydrophobicContact CD1-CD1 4.24Å; I888-L1151 HydrophobicContact CG2-CD1 3.73Å; S1147-L1151 VanDerWaalsContact O-CB 3.22Å; S1147-L1151 WeakPolarHBondContact O-CB 3.44Å; S1147-L1151 PolarHBondContact O-N 3.02Å; E1149-L1151 VanDerWaalsContact C-N 3.29Å; E1149-L1151 PolarHBondContact O-N 2.92Å; L1151-M1154 HydrophobicContact CD1-CE 4.28Å; L1151-L1155 HydrophobicContact CD1-CD1 3.65Å; L1151-L1155 HydrophobicContact CD1-CG 4.04Å; L1151-L1155 HydrophobicContact CG-CD1 3.86Å; L1151-L1155 HydrophobicContact CG-CG 4.48Å; L1151-L1155 VanDerWaalsContact O-CB 3.31Å; L1151-L1155 WeakPolarHBondContact O-CB 3.23Å; L1151-L1155 WeakPolarHBondContact O-CD1 3.36Å; L1151-L1155 WeakPolarHBondContact O-CG 3.47Å; L1151-L1155 PolarHBondContact O-N 3.4Å
1152	F	91.5	Very high	88.7	Confident	7 Å²	7	59.5 Å²	59.5	3%	0.031	33%	0.326	C	S	.	.	H	α-helix	trans	-71.4	-53.3	172.8	-179.5	-85.1	0	0	0	110.7	A1148 E1149 E1150 M1154 L1155 T1156 F1163 L1240 I1274 I1276 F1279	A1148-F1152 WeakPolarHBondContact O-CB 3.17Å; A1148-F1152 PolarHBondContact O-N 3.39Å; E1149-F1152 WeakPolarHBondContact O-CA 3.39Å; E1149-F1152 WeakPolarHBondContact O-CB 3.31Å; E1149-F1152 PolarHBondContact O-N 2.86Å; E1150-F1152 VanDerWaalsContact C-N 3.3Å; E1150-F1152 PolarHBondContact O-N 2.7Å; F1152-M1154 PolarHBondContact O-N 2.91Å; F1152-L1155 PolarHBondContact O-N 2.99Å; F1152-T1156 HydrophobicContact CD1-CG2 4.39Å; F1152-T1156 HydrophobicContact CD2-CG2 4.39Å; F1152-T1156 HydrophobicContact CE1-CG2 4.21Å; F1152-T1156 HydrophobicContact CE2-CG2 4.22Å; F1152-T1156 HydrophobicContact CG-CG2 4.47Å; F1152-T1156 HydrophobicContact CZ-CG2 4.13Å; F1152-T1156 WeakPolarHBondContact O-CB 3.44Å; F1152-T1156 WeakPolarHBondContact O-CG2 3.43Å; F1152-T1156 PolarHBondContact O-N 3.09Å; F1152-T1156 PolarHBondContact O-OG1 3.08Å; F1152-F1163 HydrophobicContact CE1-CD1 4.13Å; F1152-F1163 HydrophobicContact CZ-CD1 4.18Å; F1152-F1163 HydrophobicContact CZ-CE1 4.13Å; F1152-L1240 HydrophobicContact CE2-CD1 4.22Å; F1152-L1240 HydrophobicContact CE2-CD2 4.3Å; F1152-L1240 HydrophobicContact CZ-CD1 3.73Å; F1152-I1274 HydrophobicContact CE2-CG2 4.16Å; F1152-I1274 HydrophobicContact CZ-CG2 3.86Å; F1152-I1276 HydrophobicContact CB-CG2 3.67Å; F1152-I1276 HydrophobicContact CD2-CG2 4.06Å; F1152-I1276 HydrophobicContact CG-CG2 4.02Å; F1152-F1279 HydrophobicContact CB-CE1 4.19Å; F1152-F1279 HydrophobicContact CB-CZ 4.09Å; F1152-F1279 AromaticContact CD2-CD1 3.74Å; F1152-F1279 HydrophobicContact CD2-CD1 3.74Å; F1152-F1279 HydrophobicContact CD2-CD2 4.45Å; F1152-F1279 AromaticContact CD2-CE1 3.83Å; F1152-F1279 HydrophobicContact CD2-CE1 3.83Å; F1152-F1279 HydrophobicContact CD2-CE2 4.5Å; F1152-F1279 HydrophobicContact CD2-CG 4.06Å; F1152-F1279 HydrophobicContact CD2-CZ 4.21Å; F1152-F1279 HydrophobicContact CE2-CD1 4.18Å; F1152-F1279 HydrophobicContact CE2-CG 4.44Å; F1152-F1279 HydrophobicContact CG-CE1 4.26Å
1153	D	89.8	Confident	88.3	Confident	49 Å²	49	56.1 Å²	56.1	26%	0.262	30%	0.302	S	S	.	.	H	α-helix	trans	-56.5	-49.5	178.7	-69	-0.4	0	0	0	111	E1149 L1155 T1156 K1157 E1158	E1149-D1153 PolarHBondContact O-N 3.04Å; D1153-L1155 VanDerWaalsContact C-N 3.32Å; D1153-L1155 PolarHBondContact O-N 3.32Å; D1153-T1156 PolarHBondContact O-N 3.28Å; D1153-K1157 WeakPolarHBondContact O-CA 3.32Å; D1153-K1157 PolarHBondContact O-N 3.18Å; D1153-E1158 WeakPolarHBondContact CA-O 3.37Å; D1153-E1158 WeakPolarHBondContact CB-O 3.42Å
1154	M	90.5	Very high	88	Confident	36 Å²	36	56.7 Å²	56.7	18%	0.177	31%	0.305	C	S	.	.	H	α-helix	trans	-61.4	-32.9	179.9	-75.6	-170.4	-60.2	0	0	114.5	A856 D890 P1146 E1150 L1151 F1152 K1157	A856-M1154 HydrophobicContact CB-CB 3.96Å; A856-M1154 HydrophobicContact CB-SD 4.47Å; A856-M1154 VanDerWaalsContact O-O 3.08Å; D890-M1154 HydrophobicContact CB-SD 3.82Å; D890-M1154 PolarHBondContact N-SD 2.98Å; D890-M1154 VanDerWaalsContact N-SD 3.44Å; P1146-M1154 HydrophobicContact CB-CE 3.7Å; P1146-M1154 HydrophobicContact CG-CE 3.68Å; E1150-M1154 VanDerWaalsContact O-CB 3.3Å; E1150-M1154 WeakPolarHBondContact O-CB 3.16Å; E1150-M1154 VanDerWaalsContact O-CG 3.23Å; E1150-M1154 WeakPolarHBondContact O-CG 3.3Å; E1150-M1154 PolarHBondContact O-N 3.42Å; L1151-M1154 HydrophobicContact CD1-CE 4.28Å; F1152-M1154 PolarHBondContact O-N 2.91Å; M1154-K1157 WeakPolarHBondContact O-CD 3.25Å; M1154-K1157 WeakPolarHBondContact O-CE 3.41Å; M1154-K1157 PolarHBondContact O-NZ 3.47Å; M1154-K1157 VanDerWaalsContact O-NZ 3.13Å
1155	L	91.9	Very high	87.9	Confident	8 Å²	8	55.1 Å²	55.1	4%	0.042	30%	0.295	C	S	.	.	H	α-helix	trans	-98.7	-13.1	-175	-63.3	-179.3	0	0	0	114.4	A856 S858 A861 Q862 I888 L1151 F1152 D1153 F1279	A856-L1155 HydrophobicContact CB-CD2 3.68Å; S858-L1155 WeakPolarHBondContact O-CD2 3.5Å; A861-L1155 HydrophobicContact CB-CD2 3.83Å; Q862-L1155 HydrophobicContact CG-CD1 3.85Å; I888-L1155 HydrophobicContact CG2-CD2 3.98Å; L1151-L1155 HydrophobicContact CD1-CD1 3.65Å; L1151-L1155 HydrophobicContact CD1-CG 4.04Å; L1151-L1155 HydrophobicContact CG-CD1 3.86Å; L1151-L1155 HydrophobicContact CG-CG 4.48Å; L1151-L1155 VanDerWaalsContact O-CB 3.31Å; L1151-L1155 WeakPolarHBondContact O-CB 3.23Å; L1151-L1155 WeakPolarHBondContact O-CD1 3.36Å; L1151-L1155 WeakPolarHBondContact O-CG 3.47Å; L1151-L1155 PolarHBondContact O-N 3.4Å; F1152-L1155 PolarHBondContact O-N 2.99Å; D1153-L1155 VanDerWaalsContact C-N 3.32Å; D1153-L1155 PolarHBondContact O-N 3.32Å; L1155-F1279 HydrophobicContact CB-CE1 4Å; L1155-F1279 HydrophobicContact CD1-CE1 4.33Å; L1155-F1279 HydrophobicContact CD1-CZ 4.14Å
1156	T	90.6	Very high	87.7	Confident	21 Å²	21	50.6 Å²	50.6	13%	0.129	28%	0.275	C	S	.	.	H	α-helix	trans	-100.3	-16.3	170.6	57.4	0	0	0	0	112.5	F1152 D1153 E1158 L1240 F1279	F1152-T1156 HydrophobicContact CD1-CG2 4.39Å; F1152-T1156 HydrophobicContact CD2-CG2 4.39Å; F1152-T1156 HydrophobicContact CE1-CG2 4.21Å; F1152-T1156 HydrophobicContact CE2-CG2 4.22Å; F1152-T1156 HydrophobicContact CG-CG2 4.47Å; F1152-T1156 HydrophobicContact CZ-CG2 4.13Å; F1152-T1156 WeakPolarHBondContact O-CB 3.44Å; F1152-T1156 WeakPolarHBondContact O-CG2 3.43Å; F1152-T1156 PolarHBondContact O-N 3.09Å; F1152-T1156 PolarHBondContact O-OG1 3.08Å; D1153-T1156 PolarHBondContact O-N 3.28Å; T1156-E1158 PolarHBondContact O-N 3.36Å; T1156-E1158 PolarHBondContact OG1-N 3.37Å; T1156-L1240 HydrophobicContact CG2-CD1 4.18Å; T1156-L1240 HydrophobicContact CG2-CD2 3.94Å; T1156-L1240 HydrophobicContact CG2-CG 4.26Å; T1156-F1279 HydrophobicContact CG2-CD1 4.1Å; T1156-F1279 HydrophobicContact CG2-CE1 4.26Å
1157	K	88.7	Confident	87.5	Confident	102 Å²	102	51 Å²	51	44%	0.443	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.6	29.9	-170.2	-54.3	-58.9	-173.8	-169.9	0	112.6	A856 N891 D1153 M1154	A856-K1157 VanDerWaalsContact O-CE 3.3Å; A856-K1157 WeakPolarHBondContact O-CE 3.29Å; A856-K1157 PolarHBondContact O-NZ 2.78Å; N891-K1157 PolarHBondContact OD1-NZ 2.85Å; D1153-K1157 WeakPolarHBondContact O-CA 3.32Å; D1153-K1157 PolarHBondContact O-N 3.18Å; M1154-K1157 WeakPolarHBondContact O-CD 3.25Å; M1154-K1157 WeakPolarHBondContact O-CE 3.41Å; M1154-K1157 PolarHBondContact O-NZ 3.47Å; M1154-K1157 VanDerWaalsContact O-NZ 3.13Å
1158	E	86.1	Confident	87.3	Confident	39 Å²	39	50.1 Å²	50.1	18%	0.182	27%	0.267	C	S	.	.			trans	-103.7	166.3	173.4	-66.2	-84.2	-156	0	0	110.2	D1153 T1156 S1162 F1163 N1238	D1153-E1158 WeakPolarHBondContact CA-O 3.37Å; D1153-E1158 WeakPolarHBondContact CB-O 3.42Å; T1156-E1158 PolarHBondContact O-N 3.36Å; T1156-E1158 PolarHBondContact OG1-N 3.37Å; E1158-S1162 VanDerWaalsContact OE2-CB 3.28Å; E1158-S1162 WeakPolarHBondContact OE2-CB 3.5Å; E1158-S1162 PolarHBondContact OE2-OG 3.09Å; E1158-F1163 HydrophobicContact CB-CB 3.77Å; E1158-F1163 HydrophobicContact CB-CG 4.44Å; E1158-F1163 HydrophobicContact CG-CB 3.96Å; E1158-F1163 HydrophobicContact CG-CD2 4.43Å; E1158-F1163 HydrophobicContact CG-CG 4.24Å; E1158-F1163 WeakPolarHBondContact OE1-CD2 3.33Å; E1158-N1238 HydrophobicContact CG-CB 4.42Å; E1158-N1238 PolarHBondContact OE1-ND2 2.85Å
1159	T	82.5	Confident	87.2	Confident	70 Å²	70	49.1 Å²	49.1	43%	0.429	26%	0.256	S	S	.	.			trans	-128.6	163.9	173.7	61.5	0	0	0	0	109.8	D1161 S1162 F1163	T1159-D1161 PolarHBondContact O-N 3.26Å; T1159-D1161 VanDerWaalsContact O-N 3.13Å; T1159-S1162 PolarHBondContact N-OG 2.82Å; T1159-S1162 PolarHBondContact O-N 3.46Å; T1159-S1162 PolarHBondContact O-OG 3.48Å; T1159-S1162 PolarHBondContact OG1-N 2.77Å; T1159-S1162 PolarHBondContact OG1-OG 3.47Å; T1159-F1163 PolarHBondContact O-N 2.81Å
1160	P	79.7	Confident	87.3	Confident	61 Å²	61	46.2 Å²	46.2	40%	0.396	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.8	-28.5	174.3	-28.7	37.2	0	0	0	114.2
1161	D	74.8	Confident	87.5	Confident	107 Å²	107	41 Å²	41	57%	0.572	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.3	-34.3	175.8	-64	-47.5	0	0	0	112.6	T1159 Y1164	T1159-D1161 PolarHBondContact O-N 3.26Å; T1159-D1161 VanDerWaalsContact O-N 3.13Å; D1161-Y1164 WeakPolarHBondContact O-CD1 3.33Å; D1161-Y1164 WeakPolarHBondContact O-CE1 3.48Å
1162	S	80.3	Confident	87.7	Confident	33 Å²	33	42.3 Å²	42.3	23%	0.231	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83	-26	178	70.1	0	0	0	0	113.4	E1158 T1159 K1167	E1158-S1162 VanDerWaalsContact OE2-CB 3.28Å; E1158-S1162 WeakPolarHBondContact OE2-CB 3.5Å; E1158-S1162 PolarHBondContact OE2-OG 3.09Å; T1159-S1162 PolarHBondContact N-OG 2.82Å; T1159-S1162 PolarHBondContact O-N 3.46Å; T1159-S1162 PolarHBondContact O-OG 3.48Å; T1159-S1162 PolarHBondContact OG1-N 2.77Å; T1159-S1162 PolarHBondContact OG1-OG 3.47Å; S1162-K1167 WeakPolarHBondContact O-CD 3.37Å; S1162-K1167 WeakPolarHBondContact O-CE 3.44Å; S1162-K1167 PolarHBondContact O-NZ 3.4Å
1163	F	86.3	Confident	87.8	Confident	12 Å²	12	42 Å²	42	5%	0.053	23%	0.225	C	C	.	.	S	Bend	trans	-139.6	77.4	-173	-160.1	-98.2	0	0	0	114.1	F1152 E1158 T1159 L1236 N1238 L1240 I1271 I1274 V1281	F1152-F1163 HydrophobicContact CE1-CD1 4.13Å; F1152-F1163 HydrophobicContact CZ-CD1 4.18Å; F1152-F1163 HydrophobicContact CZ-CE1 4.13Å; E1158-F1163 HydrophobicContact CB-CB 3.77Å; E1158-F1163 HydrophobicContact CB-CG 4.44Å; E1158-F1163 HydrophobicContact CG-CB 3.96Å; E1158-F1163 HydrophobicContact CG-CD2 4.43Å; E1158-F1163 HydrophobicContact CG-CG 4.24Å; E1158-F1163 WeakPolarHBondContact OE1-CD2 3.33Å; T1159-F1163 PolarHBondContact O-N 2.81Å; F1163-L1236 HydrophobicContact CE2-CD1 4.4Å; F1163-L1236 HydrophobicContact CZ-CD1 4.02Å; F1163-N1238 WeakPolarHBondContact CD2-ND2 3.47Å; F1163-N1238 WeakPolarHBondContact CE2-ND2 3.43Å; F1163-L1240 HydrophobicContact CE1-CD1 3.82Å; F1163-L1240 HydrophobicContact CE2-CD1 4.48Å; F1163-L1240 HydrophobicContact CZ-CD1 3.79Å; F1163-I1271 HydrophobicContact CD2-CD1 4.17Å; F1163-I1271 HydrophobicContact CE1-CD1 4.13Å; F1163-I1271 HydrophobicContact CE2-CD1 3.55Å; F1163-I1271 HydrophobicContact CZ-CD1 3.51Å; F1163-I1274 HydrophobicContact CD1-CD1 3.65Å; F1163-I1274 HydrophobicContact CD1-CG1 4.39Å; F1163-I1274 HydrophobicContact CE1-CD1 3.69Å; F1163-I1274 HydrophobicContact CE1-CG1 3.92Å; F1163-I1274 HydrophobicContact CE1-CG2 4.43Å; F1163-I1274 WeakPolarHBondContact O-CD1 3.44Å; F1163-V1281 HydrophobicContact CE1-CG2 4.21Å; F1163-V1281 HydrophobicContact CZ-CG2 3.99Å
1164	Y	87.1	Confident	88	Confident	64 Å²	64	42.4 Å²	42.4	25%	0.251	23%	0.23	S	C	.	.			trans	-110.6	158.6	-178.8	56.8	-91	0	0	0	114.7	D1161 G1166 K1167	D1161-Y1164 WeakPolarHBondContact O-CD1 3.33Å; D1161-Y1164 WeakPolarHBondContact O-CE1 3.48Å; Y1164-G1166 PolarHBondContact O-N 2.82Å; Y1164-K1167 HydrophobicContact CD1-CB 4.35Å; Y1164-K1167 HydrophobicContact CD1-CD 4.46Å; Y1164-K1167 HydrophobicContact CD2-CB 4.03Å; Y1164-K1167 HydrophobicContact CE1-CB 4.1Å; Y1164-K1167 HydrophobicContact CE1-CD 4.02Å; Y1164-K1167 HydrophobicContact CE1-CG 4.21Å; Y1164-K1167 HydrophobicContact CE2-CB 3.76Å; Y1164-K1167 HydrophobicContact CE2-CG 4.48Å; Y1164-K1167 HydrophobicContact CG-CB 4.31Å; Y1164-K1167 WeakPolarHBondContact O-CB 3.38Å; Y1164-K1167 PolarHBondContact O-N 2.93Å; Y1164-K1167 VanDerWaalsContact O-N 3.13Å
1165	V	89.9	Confident	88	Confident	75 Å²	75	41 Å²	41	46%	0.455	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.5	118	169.6	170.9	0	0	0	0	109.8	I1271 I1272 I1274	V1165-I1271 HydrophobicContact CG2-CG2 4.48Å; V1165-I1272 WeakPolarHBondContact CG1-O 3.42Å; V1165-I1274 HydrophobicContact CG2-CB 4.44Å; V1165-I1274 HydrophobicContact CG2-CD1 4.09Å; V1165-I1274 HydrophobicContact CG2-CG1 3.96Å
1166	G	86.6	Confident	88	Confident	1 Å²	1	42 Å²	42	1%	0.01	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	109.8	-13.2	-175.9	0	0	0	0	0	114.7	Y1164 R1270 I1271	Y1164-G1166 PolarHBondContact O-N 2.82Å; G1166-R1270 VanDerWaalsContact O-CD 3.3Å; G1166-R1270 WeakPolarHBondContact O-CD 3.38Å; G1166-R1270 WeakPolarHBondContact O-CG 3.49Å; G1166-R1270 PolarHBondContact O-NH1 2.83Å; G1166-I1271 VanDerWaalsContact CA-O 3.31Å; G1166-I1271 WeakPolarHBondContact CA-O 3.43Å; G1166-I1271 PolarHBondContact N-O 3.16Å
1167	K	86.5	Confident	87.9	Confident	46 Å²	46	42.6 Å²	42.6	20%	0.2	23%	0.233	C	C	.	.			trans	-63.4	140	176.2	-167.8	171.9	174.2	170.8	0	111.2	N636 S1162 Y1164 V1169 R1270 I1271	N636-K1167 WeakPolarHBondContact OD1-CE 3.37Å; S1162-K1167 WeakPolarHBondContact O-CD 3.37Å; S1162-K1167 WeakPolarHBondContact O-CE 3.44Å; S1162-K1167 PolarHBondContact O-NZ 3.4Å; Y1164-K1167 HydrophobicContact CD1-CB 4.35Å; Y1164-K1167 HydrophobicContact CD1-CD 4.46Å; Y1164-K1167 HydrophobicContact CD2-CB 4.03Å; Y1164-K1167 HydrophobicContact CE1-CB 4.1Å; Y1164-K1167 HydrophobicContact CE1-CD 4.02Å; Y1164-K1167 HydrophobicContact CE1-CG 4.21Å; Y1164-K1167 HydrophobicContact CE2-CB 3.76Å; Y1164-K1167 HydrophobicContact CE2-CG 4.48Å; Y1164-K1167 HydrophobicContact CG-CB 4.31Å; Y1164-K1167 WeakPolarHBondContact O-CB 3.38Å; Y1164-K1167 PolarHBondContact O-N 2.93Å; Y1164-K1167 VanDerWaalsContact O-N 3.13Å; K1167-V1169 HydrophobicContact CB-CG1 4.47Å; K1167-V1169 HydrophobicContact CD-CG1 4.11Å; K1167-V1169 HydrophobicContact CG-CG1 3.96Å; K1167-R1270 WeakPolarHBondContact O-CA 3.43Å; K1167-I1271 HydrophobicContact CB-CD1 4.46Å; K1167-I1271 PolarHBondContact O-N 2.94Å
1168	C	88	Confident	87.7	Confident	27 Å²	27	41.6 Å²	41.6	18%	0.182	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	125.7	169.9	-171.8	0	0	0	0	109.2
1169	V	89.1	Confident	87.4	Confident	25 Å²	25	48.4 Å²	48.4	15%	0.152	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	157.4	-172.4	-69.2	0	0	0	0	110.9	K1167 L1236 V1269 I1271	K1167-V1169 HydrophobicContact CB-CG1 4.47Å; K1167-V1169 HydrophobicContact CD-CG1 4.11Å; K1167-V1169 HydrophobicContact CG-CG1 3.96Å; V1169-L1236 HydrophobicContact CB-CD2 4.18Å; V1169-L1236 HydrophobicContact CG2-CD2 3.39Å; V1169-V1269 HydrophobicContact CG2-CG2 3.76Å; V1169-V1269 PolarHBondContact N-O 3.13Å; V1169-V1269 PolarHBondContact O-N 2.83Å; V1169-I1271 HydrophobicContact CG1-CD1 4.42Å; V1169-I1271 HydrophobicContact CG2-CD1 4.1Å; V1169-I1271 HydrophobicContact CG2-CG1 3.92Å
1170	T	92.5	Very high	87.1	Confident	41 Å²	41	53.6 Å²	53.6	25%	0.252	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	142.4	172.1	24.8	0	0	0	0	110.9	E1237 M1266	T1170-E1237 WeakPolarHBondContact CB-OE1 3.36Å; T1170-E1237 PolarHBondContact OG1-OE1 2.86Å; T1170-E1237 PolarHBondContact OG1-OE2 3.04Å; T1170-M1266 HydrophobicContact CG2-CE 4.5Å
1171	A	93.7	Very high	86.6	Confident	0 Å²	0	51.8 Å²	51.8	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.5	137.9	177	0	0	0	0	0	112.2	V1234 R1235 L1236 I1267 V1269	A1171-V1234 HydrophobicContact CB-CB 3.92Å; A1171-V1234 HydrophobicContact CB-CG2 3.84Å; A1171-R1235 CarbonylContact C-O 3.51Å; A1171-R1235 VanDerWaalsContact CA-O 3.29Å; A1171-R1235 WeakPolarHBondContact CA-O 3.48Å; A1171-L1236 HydrophobicContact CB-CD2 4.23Å; A1171-I1267 PolarHBondContact N-O 3.33Å; A1171-I1267 WeakPolarHBondContact O-CG1 3.46Å; A1171-I1267 PolarHBondContact O-N 3.3Å; A1171-V1269 HydrophobicContact CB-CG1 4.14Å; A1171-V1269 HydrophobicContact CB-CG2 3.88Å
1172	M	95.6	Very high	86.6	Confident	64 Å²	64	53.2 Å²	53.2	32%	0.315	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	129.6	175.2	-176.2	174.1	52	0	0	110.7	T1174 V1234 R1235 M1266	M1172-T1174 PolarHBondContact O-N 3.35Å; M1172-V1234 CarbonylContact O-C 3.46Å; M1172-V1234 WeakPolarHBondContact O-CA 3.24Å; M1172-V1234 WeakPolarHBondContact O-CB 3.45Å; M1172-R1235 PolarHBondContact N-O 2.88Å; M1172-R1235 PolarHBondContact O-N 2.96Å; M1172-M1266 HydrophobicContact CB-SD 3.62Å; M1172-M1266 HydrophobicContact CG-SD 4.28Å
1173	V	94.5	Very high	86.1	Confident	0 Å²	0	53.7 Å²	53.7	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	116.7	172.9	175.8	0	0	0	0	110.8	V1232 V1234 V1261 R1262 S1264 Q1265 I1267	V1173-V1232 HydrophobicContact CB-CG1 4.41Å; V1173-V1232 HydrophobicContact CG1-CG1 3.54Å; V1173-V1232 HydrophobicContact CG2-CG1 4.14Å; V1173-V1234 HydrophobicContact CG2-CG1 4.28Å; V1173-V1261 HydrophobicContact CG1-CG2 4.46Å; V1173-V1261 HydrophobicContact CG2-CB 4.18Å; V1173-V1261 HydrophobicContact CG2-CG2 4.13Å; V1173-R1262 VanDerWaalsContact CB-O 3.28Å; V1173-R1262 WeakPolarHBondContact CB-O 3.19Å; V1173-R1262 WeakPolarHBondContact CG1-O 3.28Å; V1173-S1264 PolarHBondContact O-N 3.43Å; V1173-Q1265 PolarHBondContact N-O 2.83Å; V1173-I1267 HydrophobicContact CG2-CD1 3.73Å; V1173-I1267 HydrophobicContact CG2-CG1 4.06Å; V1173-I1267 HydrophobicContact CG2-CG2 4.47Å
1174	T	93.2	Very high	85.5	Confident	58 Å²	58	59.3 Å²	59.3	36%	0.356	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	-17.5	-179.1	55.4	0	0	0	0	113.7	M1172 R1233 R1235	M1172-T1174 PolarHBondContact O-N 3.35Å; T1174-R1233 PolarHBondContact N-O 2.88Å; T1174-R1233 WeakPolarHBondContact OG1-CB 3.4Å; T1174-R1233 PolarHBondContact OG1-O 2.62Å; T1174-R1235 HydrophobicContact CG2-CB 3.67Å
1175	G	91.3	Very high	84.8	Confident	7 Å²	7	60.8 Å²	60.8	7%	0.072	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	151.2	166.7	169.1	0	0	0	0	0	114.8	R1233	G1175-R1233 PolarHBondContact N-O 2.93Å; G1175-R1233 WeakPolarHBondContact O-CB 3.14Å; G1175-R1233 PolarHBondContact O-N 3.31Å
1176	F	90.9	Very high	83.9	Confident	28 Å²	28	59.7 Å²	59.7	12%	0.123	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	167.7	-174.9	-52.5	-67.7	0	0	0	112.9	Y1178 V1232 R1233 P1257 E1258 V1261 V1263	F1176-Y1178 HydrophobicContact CB-CD2 4.48Å; F1176-Y1178 HydrophobicContact CB-CE2 3.71Å; F1176-V1232 HydrophobicContact CD1-CG1 4.3Å; F1176-V1232 HydrophobicContact CD1-CG2 4.09Å; F1176-V1232 HydrophobicContact CE1-CG1 4.21Å; F1176-V1232 HydrophobicContact CE1-CG2 4.2Å; F1176-R1233 PolarHBondContact O-NH2 3.27Å; F1176-R1233 VanDerWaalsContact O-NH2 3.15Å; F1176-P1257 HydrophobicContact CD1-CB 3.78Å; F1176-P1257 HydrophobicContact CD1-CG 3.61Å; F1176-P1257 HydrophobicContact CE1-CB 3.89Å; F1176-P1257 HydrophobicContact CE1-CG 4.13Å; F1176-P1257 HydrophobicContact CG-CG 4.24Å; F1176-E1258 HydrophobicContact CD2-CG 3.77Å; F1176-E1258 HydrophobicContact CE1-CG 4.26Å; F1176-E1258 HydrophobicContact CE2-CG 3.42Å; F1176-E1258 VanDerWaalsContact CE2-CG 3.42Å; F1176-E1258 HydrophobicContact CG-CG 4.35Å; F1176-E1258 HydrophobicContact CZ-CG 3.7Å; F1176-V1261 HydrophobicContact CE1-CG2 3.93Å; F1176-V1261 HydrophobicContact CZ-CG2 4.42Å; F1176-V1261 WeakPolarHBondContact CZ-O 3.44Å; F1176-V1263 HydrophobicContact CD2-CG2 4.34Å; F1176-V1263 HydrophobicContact CE2-CG2 3.68Å; F1176-V1263 HydrophobicContact CZ-CG2 4.27Å
1177	T	88.2	Confident	83.1	Confident	34 Å²	34	66.6 Å²	66.6	21%	0.209	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	136.9	173.3	60.5	0	0	0	0	110	S1230 G1231 R1233 F1243	T1177-S1230 PolarHBondContact O-N 3.04Å; T1177-G1231 PolarHBondContact N-O 3.24Å; T1177-G1231 PolarHBondContact OG1-N 3.19Å; T1177-G1231 PolarHBondContact OG1-O 3.24Å; T1177-R1233 HydrophobicContact CG2-CG 3.82Å; T1177-F1243 HydrophobicContact CG2-CE2 4.05Å; T1177-F1243 WeakPolarHBondContact OG1-CE2 3.44Å
1178	Y	85.2	Confident	82.5	Confident	82 Å²	82	69 Å²	69	32%	0.322	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	141.7	-176.6	-60.9	-93	0	0	0	110.3	F1176 P1226 P1229 E1258	F1176-Y1178 HydrophobicContact CB-CD2 4.48Å; F1176-Y1178 HydrophobicContact CB-CE2 3.71Å; Y1178-P1226 VanDerWaalsContact CB-O 3.25Å; Y1178-P1226 WeakPolarHBondContact CB-O 3.3Å; Y1178-P1226 HydrophobicContact CD1-CB 4.05Å; Y1178-P1226 HydrophobicContact CD1-CG 4.27Å; Y1178-P1226 HydrophobicContact CD2-CB 4.23Å; Y1178-P1226 HydrophobicContact CG-CB 3.87Å; Y1178-P1229 HydrophobicContact CD1-CB 3.8Å; Y1178-P1229 HydrophobicContact CE1-CB 3.75Å; Y1178-P1229 HydrophobicContact CE1-CG 4.42Å; Y1178-E1258 PolarHBondContact OH-OE1 3.08Å
1179	R	80.5	Confident	81.7	Confident	181 Å²	181	68.2 Å²	68.2	68%	0.683	35%	0.35	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.6	105	176.9	-118.1	-175.1	-171.7	-155.7	3.8	108.3	G1227 Q1228	R1179-G1227 CarbonylContact O-C 3.5Å; R1179-G1227 VanDerWaalsContact O-CA 3.27Å; R1179-G1227 WeakPolarHBondContact O-CA 3.39Å; R1179-Q1228 PolarHBondContact N-O 2.81Å; R1179-Q1228 PolarHBondContact O-N 3Å
1180	R	75.2	Confident	81.3	Confident	179 Å²	179	73.4 Å²	73.4	68%	0.675	38%	0.377	S	S	*	.	P	Polyproline II helix	trans	-58.6	139	173.8	-70.4	-176.8	175.6	-179.5	-2.6	110.4
1181	P	69	Low	80.7	Confident	24 Å²	24	72 Å²	72	16%	0.156	37%	0.368	C	S	.	.	P	Polyproline II helix	trans	-63.4	151.7	173.2	29.1	-35.7	0	0	0	110.9	Q1185 L1186 F1204	P1181-Q1185 HydrophobicContact CB-CB 4.35Å; P1181-L1186 HydrophobicContact CB-CD2 4.16Å; P1181-L1186 HydrophobicContact CB-CG 4.25Å; P1181-L1186 HydrophobicContact CG-CD2 3.68Å; P1181-L1186 HydrophobicContact CG-CG 4.16Å; P1181-F1204 HydrophobicContact CB-CD1 3.82Å; P1181-F1204 HydrophobicContact CB-CD2 4.15Å; P1181-F1204 HydrophobicContact CB-CE1 3.85Å; P1181-F1204 HydrophobicContact CB-CE2 4.19Å; P1181-F1204 HydrophobicContact CB-CG 3.98Å; P1181-F1204 HydrophobicContact CB-CZ 4.04Å; P1181-F1204 HydrophobicContact CG-CD1 4.38Å; P1181-F1204 HydrophobicContact CG-CD2 3.91Å; P1181-F1204 HydrophobicContact CG-CE2 4.21Å; P1181-F1204 HydrophobicContact CG-CG 4.01Å
1182	Q	74.5	Confident	80.1	Confident	136 Å²	136	75.9 Å²	75.9	64%	0.636	39%	0.392	S	S	*	.	P	Polyproline II helix	trans	-91	162.7	173.8	-66.1	-179.7	-22.2	0	0	110.8	D1184 Q1185 L1186	Q1182-D1184 PolarHBondContact O-N 2.88Å; Q1182-Q1185 HydrophobicContact CB-CG 4.4Å; Q1182-Q1185 WeakPolarHBondContact O-CA 3.04Å; Q1182-Q1185 VanDerWaalsContact O-CB 3.29Å; Q1182-Q1185 WeakPolarHBondContact O-CB 3.25Å; Q1182-Q1185 PolarHBondContact O-N 3.03Å; Q1182-L1186 PolarHBondContact O-N 3.26Å; Q1182-L1186 VanDerWaalsContact O-N 3.11Å
1183	G	70.1	Confident	79.4	Confident	43 Å²	43	78.5 Å²	78.5	44%	0.443	40%	0.399	S	S	.	.	H	α-helix	trans	-49.2	-54.9	-176.4	0	0	0	0	0	113.4	Q1185 L1186 D1187	G1183-Q1185 PolarHBondContact O-N 2.94Å; G1183-L1186 WeakPolarHBondContact O-CA 3.42Å; G1183-L1186 WeakPolarHBondContact O-CB 3.25Å; G1183-L1186 PolarHBondContact O-N 3.35Å; G1183-D1187 PolarHBondContact O-N 3.18Å; G1183-D1187 VanDerWaalsContact O-N 3.08Å
1184	D	74.7	Confident	78.6	Confident	131 Å²	131	80.5 Å²	80.5	70%	0.701	41%	0.409	S	S	*	.	H	α-helix	trans	-54.5	-26.5	178.2	-45.2	12.6	0	0	0	113.4	Q1182 S1188	Q1182-D1184 PolarHBondContact O-N 2.88Å; D1184-S1188 WeakPolarHBondContact O-CB 3.18Å; D1184-S1188 PolarHBondContact O-OG 3.47Å
1185	Q	71.4	Confident	77.7	Confident	94 Å²	94	85.7 Å²	85.7	44%	0.439	44%	0.435	S	S	.	.	H	α-helix	trans	-84.1	-35.2	178.2	-56.9	177.9	-26.5	0	0	111.7	P1181 Q1182 G1183 S1188 A1189 F1204	P1181-Q1185 HydrophobicContact CB-CB 4.35Å; Q1182-Q1185 HydrophobicContact CB-CG 4.4Å; Q1182-Q1185 WeakPolarHBondContact O-CA 3.04Å; Q1182-Q1185 VanDerWaalsContact O-CB 3.29Å; Q1182-Q1185 WeakPolarHBondContact O-CB 3.25Å; Q1182-Q1185 PolarHBondContact O-N 3.03Å; G1183-Q1185 PolarHBondContact O-N 2.94Å; Q1185-S1188 CarbonylContact O-C 3.59Å; Q1185-S1188 PolarHBondContact O-N 3.32Å; Q1185-A1189 PolarHBondContact O-N 2.76Å; Q1185-A1189 VanDerWaalsContact O-N 3.09Å; Q1185-F1204 HydrophobicContact CB-CE1 4.22Å; Q1185-F1204 HydrophobicContact CB-CZ 4.49Å; Q1185-F1204 WeakPolarHBondContact O-CZ 3.22Å
1186	L	70.5	Confident	76.8	Confident	53 Å²	53	90.5 Å²	90.5	28%	0.277	47%	0.467	S	S	.	.	H	α-helix	trans	-65	-44.1	174.4	-67.5	165.6	0	0	0	110.9	P1181 Q1182 G1183 S1188 A1189 F1204 F1220	P1181-L1186 HydrophobicContact CB-CD2 4.16Å; P1181-L1186 HydrophobicContact CB-CG 4.25Å; P1181-L1186 HydrophobicContact CG-CD2 3.68Å; P1181-L1186 HydrophobicContact CG-CG 4.16Å; Q1182-L1186 PolarHBondContact O-N 3.26Å; Q1182-L1186 VanDerWaalsContact O-N 3.11Å; G1183-L1186 WeakPolarHBondContact O-CA 3.42Å; G1183-L1186 WeakPolarHBondContact O-CB 3.25Å; G1183-L1186 PolarHBondContact O-N 3.35Å; L1186-S1188 PolarHBondContact O-N 2.75Å; L1186-A1189 WeakPolarHBondContact O-CB 3.48Å; L1186-A1189 PolarHBondContact O-N 3.14Å; L1186-F1204 HydrophobicContact CD2-CD2 4.48Å; L1186-F1204 HydrophobicContact CD2-CE2 3.82Å; L1186-F1204 HydrophobicContact CD2-CZ 4.36Å; L1186-F1220 HydrophobicContact CD2-CB 4.01Å; L1186-F1220 HydrophobicContact CD2-CD1 4.3Å; L1186-F1220 HydrophobicContact CD2-CG 4.08Å
1187	D	71.1	Confident	76.2	Confident	145 Å²	145	92.8 Å²	92.8	78%	0.775	48%	0.481	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.3	-24.8	173.3	-67.7	-22.2	0	0	0	112.6	G1183	G1183-D1187 PolarHBondContact O-N 3.18Å; G1183-D1187 VanDerWaalsContact O-N 3.08Å
1188	S	72.8	Confident	75.6	Confident	98 Å²	98	97.5 Å²	97.5	69%	0.685	50%	0.5	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.3	5.3	177	-57.1	0	0	0	0	113.3	D1184 Q1185 L1186 N1190	D1184-S1188 WeakPolarHBondContact O-CB 3.18Å; D1184-S1188 PolarHBondContact O-OG 3.47Å; Q1185-S1188 CarbonylContact O-C 3.59Å; Q1185-S1188 PolarHBondContact O-N 3.32Å; L1186-S1188 PolarHBondContact O-N 2.75Å; S1188-N1190 PolarHBondContact O-N 2.9Å
1189	A	71.1	Confident	75.5	Confident	10 Å²	10	94.1 Å²	94.1	8%	0.083	49%	0.489	C	S	.	.			trans	-70.3	125.8	-175.4	0	0	0	0	0	111.2	Q1185 L1186 P1203 F1204 W1217 F1220	Q1185-A1189 PolarHBondContact O-N 2.76Å; Q1185-A1189 VanDerWaalsContact O-N 3.09Å; L1186-A1189 WeakPolarHBondContact O-CB 3.48Å; L1186-A1189 PolarHBondContact O-N 3.14Å; A1189-P1203 HydrophobicContact CB-CG 4.22Å; A1189-F1204 HydrophobicContact CB-CE2 3.8Å; A1189-F1204 HydrophobicContact CB-CZ 3.73Å; A1189-W1217 HydrophobicContact CB-CH2 4.17Å; A1189-W1217 HydrophobicContact CB-CZ3 4.41Å; A1189-W1217 WeakPolarHBondContact O-CH2 3.11Å; A1189-F1220 HydrophobicContact CB-CD2 4.44Å; A1189-F1220 HydrophobicContact CB-CE2 3.59Å; A1189-F1220 HydrophobicContact CB-CZ 3.74Å
1190	N	81.2	Confident	75.7	Confident	134 Å²	134	88.3 Å²	88.3	72%	0.717	47%	0.467	S	S	*	.			trans	-122.8	91.1	176.7	-136.7	-13.3	0	0	0	108.6	S1188 V1192	S1188-N1190 PolarHBondContact O-N 2.9Å; N1190-V1192 PolarHBondContact O-N 3.35Å
1191	P	80.1	Confident	76.1	Confident	11 Å²	11	81.4 Å²	81.4	7%	0.071	44%	0.442	C	S	.	.	P	Polyproline II helix	trans	-55.6	135.4	175.9	-28	37.6	0	0	0	111.7	W1200 L1213 V1216 W1217 F1220	P1191-W1200 HydrophobicContact CB-CE3 3.99Å; P1191-L1213 HydrophobicContact CB-CD1 3.64Å; P1191-L1213 HydrophobicContact CG-CD1 3.72Å; P1191-V1216 HydrophobicContact CB-CB 4.27Å; P1191-V1216 HydrophobicContact CB-CG1 3.98Å; P1191-V1216 HydrophobicContact CB-CG2 4.36Å; P1191-V1216 HydrophobicContact CG-CB 4.15Å; P1191-V1216 HydrophobicContact CG-CG1 3.78Å; P1191-W1217 HydrophobicContact CG-CZ2 4.23Å; P1191-F1220 HydrophobicContact CG-CE2 4.38Å; P1191-F1220 HydrophobicContact CG-CZ 4.29Å
1192	V	80.2	Confident	76.8	Confident	82 Å²	82	80.3 Å²	80.3	50%	0.497	44%	0.435	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	126.9	-177.8	179.9	0	0	0	0	108.9	N1190 Q1201	N1190-V1192 PolarHBondContact O-N 3.35Å; V1192-Q1201 PolarHBondContact N-O 3.24Å; V1192-Q1201 PolarHBondContact O-N 3.21Å
1193	R	82	Confident	76.9	Confident	119 Å²	119	75.8 Å²	75.8	45%	0.449	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	137.1	171.1	-157.1	177.8	-173.1	-151	-7.3	109.8	E1198 S1199 W1200	R1193-E1198 VanDerWaalsContact CZ-O 3.23Å; R1193-E1198 IonicContact CZ-OE2 2.69Å; R1193-E1198 PolarHBondContact NE-O 2.94Å; R1193-E1198 IonicContact NH1-OE2 2.89Å; R1193-E1198 PolarHBondContact NH2-O 2.82Å; R1193-E1198 IonicContact NH2-OE2 2.58Å; R1193-E1198 PolarHBondContact NH2-OE2 2.73Å; R1193-S1199 WeakPolarHBondContact CA-O 3.38Å; R1193-S1199 VanDerWaalsContact CG-O 3.32Å; R1193-S1199 WeakPolarHBondContact CG-O 3.12Å; R1193-W1200 HydrophobicContact CB-CD2 3.99Å; R1193-W1200 HydrophobicContact CB-CE3 3.88Å; R1193-W1200 HydrophobicContact CB-CH2 4.2Å; R1193-W1200 HydrophobicContact CB-CZ2 4.27Å; R1193-W1200 HydrophobicContact CB-CZ3 4Å; R1193-W1200 HydrophobicContact CG-CD2 4.07Å; R1193-W1200 HydrophobicContact CG-CE3 4.48Å; R1193-W1200 HydrophobicContact CG-CG 4.42Å; R1193-W1200 HydrophobicContact CG-CZ2 4.3Å
1194	L	76.8	Confident	77.4	Confident	41 Å²	41	75.1 Å²	75.1	22%	0.215	40%	0.402	C	S	.	.	P	Polyproline II helix	trans	-100.3	120.8	-179	-71.6	168.1	0	0	0	110.8	S1196 N1197 E1198 S1199 Q1201 D1208	L1194-S1196 PolarHBondContact O-N 3.3Å; L1194-S1196 VanDerWaalsContact O-N 3.13Å; L1194-N1197 WeakPolarHBondContact CB-OD1 3.46Å; L1194-N1197 PolarHBondContact O-N 3.08Å; L1194-E1198 WeakPolarHBondContact O-CA 3.26Å; L1194-E1198 PolarHBondContact O-N 2.87Å; L1194-S1199 PolarHBondContact N-O 2.68Å; L1194-Q1201 HydrophobicContact CD1-CB 4Å; L1194-Q1201 HydrophobicContact CG-CB 4.29Å; L1194-D1208 HydrophobicContact CD1-CB 3.56Å
1195	D	73.7	Confident	77.5	Confident	168 Å²	168	69.9 Å²	69.9	90%	0.898	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.4	-16.8	-178.7	-61.2	-40.4	0	0	0	113.6
1196	S	73.9	Confident	77.6	Confident	108 Å²	108	67.8 Å²	67.8	76%	0.755	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79	-26.6	-176	41.3	0	0	0	0	115.2	L1194	L1194-S1196 PolarHBondContact O-N 3.3Å; L1194-S1196 VanDerWaalsContact O-N 3.13Å
1197	N	77	Confident	77.9	Confident	76 Å²	76	69.4 Å²	69.4	41%	0.406	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	-145.6	5	-167.9	49.2	-23.8	0	0	0	112.8	L1194 S1199	L1194-N1197 WeakPolarHBondContact CB-OD1 3.46Å; L1194-N1197 PolarHBondContact O-N 3.08Å; N1197-S1199 PolarHBondContact ND2-OG 3.03Å; N1197-S1199 VanDerWaalsContact ND2-OG 3.08Å; N1197-S1199 PolarHBondContact O-N 2.9Å
1198	E	76.2	Confident	78.3	Confident	133 Å²	133	66.1 Å²	66.1	62%	0.621	35%	0.353	S	S	*	.	S	Bend	trans	60	-1.5	-179.8	-78.6	-153.2	-142.4	0	0	116.4	R1193 L1194	R1193-E1198 VanDerWaalsContact CZ-O 3.23Å; R1193-E1198 IonicContact CZ-OE2 2.69Å; R1193-E1198 PolarHBondContact NE-O 2.94Å; R1193-E1198 IonicContact NH1-OE2 2.89Å; R1193-E1198 PolarHBondContact NH2-O 2.82Å; R1193-E1198 IonicContact NH2-OE2 2.58Å; R1193-E1198 PolarHBondContact NH2-OE2 2.73Å; L1194-E1198 WeakPolarHBondContact O-CA 3.26Å; L1194-E1198 PolarHBondContact O-N 2.87Å
1199	S	83.3	Confident	78.6	Confident	11 Å²	11	65.8 Å²	65.8	8%	0.077	34%	0.343	C	S	.	.			trans	-81.3	170.7	177.5	65.4	0	0	0	0	112.7	R1193 L1194 N1197 D1208 F1210	R1193-S1199 WeakPolarHBondContact CA-O 3.38Å; R1193-S1199 VanDerWaalsContact CG-O 3.32Å; R1193-S1199 WeakPolarHBondContact CG-O 3.12Å; L1194-S1199 PolarHBondContact N-O 2.68Å; N1197-S1199 PolarHBondContact ND2-OG 3.03Å; N1197-S1199 VanDerWaalsContact ND2-OG 3.08Å; N1197-S1199 PolarHBondContact O-N 2.9Å; S1199-D1208 VanDerWaalsContact CB-O 3.3Å; S1199-D1208 WeakPolarHBondContact CB-O 3.43Å; S1199-D1208 PolarHBondContact OG-O 2.93Å; S1199-F1210 WeakPolarHBondContact CA-O 3.27Å; S1199-F1210 WeakPolarHBondContact CB-O 3.41Å
1200	W	85.1	Confident	79.2	Confident	59 Å²	59	66.2 Å²	66.2	22%	0.223	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	144.9	174	-63	82.3	0	0	0	110.7	P1191 R1193 F1210 L1213 V1216	P1191-W1200 HydrophobicContact CB-CE3 3.99Å; R1193-W1200 HydrophobicContact CB-CD2 3.99Å; R1193-W1200 HydrophobicContact CB-CE3 3.88Å; R1193-W1200 HydrophobicContact CB-CH2 4.2Å; R1193-W1200 HydrophobicContact CB-CZ2 4.27Å; R1193-W1200 HydrophobicContact CB-CZ3 4Å; R1193-W1200 HydrophobicContact CG-CD2 4.07Å; R1193-W1200 HydrophobicContact CG-CE3 4.48Å; R1193-W1200 HydrophobicContact CG-CG 4.42Å; R1193-W1200 HydrophobicContact CG-CZ2 4.3Å; W1200-F1210 HydrophobicContact CB-CB 4.36Å; W1200-F1210 PolarHBondContact N-O 2.89Å; W1200-F1210 WeakPolarHBondContact O-CD2 3.42Å; W1200-L1213 VanDerWaalsContact CD1-N 3.33Å; W1200-L1213 HydrophobicContact CD2-CB 4.02Å; W1200-L1213 HydrophobicContact CD2-CD1 4.13Å; W1200-L1213 HydrophobicContact CE3-CB 4.49Å; W1200-L1213 HydrophobicContact CE3-CD1 3.8Å; W1200-L1213 HydrophobicContact CG-CB 4.43Å; W1200-L1213 HydrophobicContact CH2-CB 4.42Å; W1200-L1213 HydrophobicContact CH2-CD1 4.35Å; W1200-L1213 HydrophobicContact CH2-CD2 4.12Å; W1200-L1213 HydrophobicContact CZ2-CB 3.96Å; W1200-L1213 HydrophobicContact CZ2-CD2 4.36Å; W1200-L1213 HydrophobicContact CZ3-CD1 3.92Å; W1200-L1213 HydrophobicContact CZ3-CD2 4.45Å; W1200-V1216 HydrophobicContact CB-CG2 3.54Å; W1200-V1216 HydrophobicContact CG-CG2 4.46Å
1201	Q	83.6	Confident	79.2	Confident	34 Å²	34	64 Å²	64	16%	0.159	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	131.6	176.2	-178.6	166.8	75.7	0	0	111	V1192 L1194 H1206 K1207 D1208	V1192-Q1201 PolarHBondContact N-O 3.24Å; V1192-Q1201 PolarHBondContact O-N 3.21Å; L1194-Q1201 HydrophobicContact CD1-CB 4Å; L1194-Q1201 HydrophobicContact CG-CB 4.29Å; Q1201-H1206 PolarHBondContact NE2-O 2.76Å; Q1201-K1207 CarbonylContact C-O 3.46Å; Q1201-K1207 VanDerWaalsContact CA-O 3.3Å; Q1201-K1207 WeakPolarHBondContact CA-O 3.36Å; Q1201-D1208 HydrophobicContact CB-CB 4.47Å
1202	C	82.3	Confident	79.3	Confident	0 Å²	0	68.8 Å²	68.8	0%	0	36%	0.358	C	S	.	.			trans	-66.4	124.2	169.8	173	0	0	0	0	110.2	F1204 C1205 H1206 K1207 F1210 V1216	C1202-F1204 PolarHBondContact O-N 2.76Å; C1202-C1205 PolarHBondContact SG-SG 2.73Å; C1202-H1206 VanDerWaalsContact O-CA 3.27Å; C1202-H1206 WeakPolarHBondContact O-CA 3.48Å; C1202-H1206 PolarHBondContact O-N 2.77Å; C1202-K1207 PolarHBondContact N-O 3.48Å; C1202-F1210 HydrophobicContact CB-CE2 3.76Å; C1202-F1210 HydrophobicContact CB-CZ 4.48Å; C1202-V1216 HydrophobicContact CB-CG1 4.21Å
1203	P	78.4	Confident	79.3	Confident	41 Å²	41	67.9 Å²	67.9	27%	0.266	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69	-17.3	-176.4	27.7	-34.5	0	0	0	113.7	A1189 H1206 F1220	A1189-P1203 HydrophobicContact CB-CG 4.22Å; P1203-H1206 PolarHBondContact O-CE1 3.11Å; P1203-F1220 HydrophobicContact CG-CE1 4.41Å; P1203-F1220 HydrophobicContact CG-CZ 3.99Å
1204	F	79.5	Confident	79.4	Confident	30 Å²	30	65 Å²	65	13%	0.132	35%	0.348	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.8	-52.2	-176.6	-52.2	-62.9	0	0	0	113.6	P1181 Q1185 L1186 A1189 C1202 F1220 Q1228	P1181-F1204 HydrophobicContact CB-CD1 3.82Å; P1181-F1204 HydrophobicContact CB-CD2 4.15Å; P1181-F1204 HydrophobicContact CB-CE1 3.85Å; P1181-F1204 HydrophobicContact CB-CE2 4.19Å; P1181-F1204 HydrophobicContact CB-CG 3.98Å; P1181-F1204 HydrophobicContact CB-CZ 4.04Å; P1181-F1204 HydrophobicContact CG-CD1 4.38Å; P1181-F1204 HydrophobicContact CG-CD2 3.91Å; P1181-F1204 HydrophobicContact CG-CE2 4.21Å; P1181-F1204 HydrophobicContact CG-CG 4.01Å; Q1185-F1204 HydrophobicContact CB-CE1 4.22Å; Q1185-F1204 HydrophobicContact CB-CZ 4.49Å; Q1185-F1204 WeakPolarHBondContact O-CZ 3.22Å; L1186-F1204 HydrophobicContact CD2-CD2 4.48Å; L1186-F1204 HydrophobicContact CD2-CE2 3.82Å; L1186-F1204 HydrophobicContact CD2-CZ 4.36Å; A1189-F1204 HydrophobicContact CB-CE2 3.8Å; A1189-F1204 HydrophobicContact CB-CZ 3.73Å; C1202-F1204 PolarHBondContact O-N 2.76Å; F1204-F1220 HydrophobicContact CD2-CD1 4.03Å; F1204-F1220 AromaticContact CD2-CE1 3.56Å; F1204-F1220 HydrophobicContact CD2-CE1 3.56Å; F1204-F1220 HydrophobicContact CD2-CZ 4.27Å; F1204-F1220 HydrophobicContact CE2-CD1 4.03Å; F1204-F1220 AromaticContact CE2-CE1 3.57Å; F1204-F1220 HydrophobicContact CE2-CE1 3.57Å; F1204-F1220 AromaticContact CE2-CZ 3.9Å; F1204-F1220 HydrophobicContact CE2-CZ 3.9Å; F1204-Q1228 WeakPolarHBondContact O-CA 3.46Å; F1204-Q1228 PolarHBondContact O-N 2.99Å
1205	C	77.7	Confident	79.7	Confident	20 Å²	20	66.6 Å²	66.6	14%	0.135	35%	0.354	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.7	-3.1	-177.2	70.7	0	0	0	0	113.8	C1202 K1207 H1219 P1226 G1227	C1202-C1205 PolarHBondContact SG-SG 2.73Å; C1205-K1207 PolarHBondContact O-N 3.26Å; C1205-H1219 PolarHBondContact SG-NE2 3.13Å; C1205-P1226 HydrophobicContact CB-CG 3.86Å; C1205-G1227 WeakPolarHBondContact CA-O 3.37Å; C1205-G1227 WeakPolarHBondContact CB-O 3.37Å
1206	H	74	Confident	80	Confident	50 Å²	50	58.6 Å²	58.6	23%	0.231	31%	0.311	C	S	.	.			trans	60.3	6.9	179.8	-57.9	-44.1	0	0	0	117	Q1201 C1202 P1203 D1208	Q1201-H1206 PolarHBondContact NE2-O 2.76Å; C1202-H1206 VanDerWaalsContact O-CA 3.27Å; C1202-H1206 WeakPolarHBondContact O-CA 3.48Å; C1202-H1206 PolarHBondContact O-N 2.77Å; P1203-H1206 PolarHBondContact O-CE1 3.11Å; H1206-D1208 PolarHBondContact O-N 3.27Å
1207	K	76.7	Confident	80.3	Confident	87 Å²	87	57.9 Å²	57.9	38%	0.378	29%	0.292	S	S	.	.			trans	-50.8	130.2	163.5	-90.7	177.9	148.2	-84.5	0	111.5	Q1201 C1202 C1205 D1209 F1210	Q1201-K1207 CarbonylContact C-O 3.46Å; Q1201-K1207 VanDerWaalsContact CA-O 3.3Å; Q1201-K1207 WeakPolarHBondContact CA-O 3.36Å; C1202-K1207 PolarHBondContact N-O 3.48Å; C1205-K1207 PolarHBondContact O-N 3.26Å; K1207-D1209 VanDerWaalsContact CB-OD1 3.31Å; K1207-D1209 WeakPolarHBondContact CB-OD1 3.45Å; K1207-D1209 WeakPolarHBondContact CG-OD1 3.45Å; K1207-D1209 VanDerWaalsContact NZ-CG 3.29Å; K1207-D1209 IonicContact NZ-OD1 2.71Å; K1207-D1209 PolarHBondContact NZ-OD1 2.78Å; K1207-D1209 VanDerWaalsContact NZ-OD1 3.12Å; K1207-D1209 IonicContact NZ-OD2 3.41Å; K1207-D1209 PolarHBondContact NZ-OD2 2.74Å; K1207-F1210 HydrophobicContact CB-CE2 3.63Å; K1207-F1210 HydrophobicContact CB-CZ 4.09Å; K1207-F1210 HydrophobicContact CD-CZ 4.41Å; K1207-F1210 WeakPolarHBondContact O-CE2 3.35Å
1208	D	78.9	Confident	80.5	Confident	76 Å²	76	59 Å²	59	41%	0.406	30%	0.298	S	S	.	.			trans	-118.7	16.1	-175.6	59.8	-24.5	0	0	0	112.9	L1194 S1199 Q1201 H1206 F1210	L1194-D1208 HydrophobicContact CD1-CB 3.56Å; S1199-D1208 VanDerWaalsContact CB-O 3.3Å; S1199-D1208 WeakPolarHBondContact CB-O 3.43Å; S1199-D1208 PolarHBondContact OG-O 2.93Å; Q1201-D1208 HydrophobicContact CB-CB 4.47Å; H1206-D1208 PolarHBondContact O-N 3.27Å; D1208-F1210 PolarHBondContact O-N 3.14Å
1209	D	79.4	Confident	80.8	Confident	91 Å²	91	53.3 Å²	53.3	49%	0.487	27%	0.272	S	S	.	.			trans	-89.9	15.3	-175.2	55.6	-30.1	0	0	0	114.8	K1207 P1211	K1207-D1209 VanDerWaalsContact CB-OD1 3.31Å; K1207-D1209 WeakPolarHBondContact CB-OD1 3.45Å; K1207-D1209 WeakPolarHBondContact CG-OD1 3.45Å; K1207-D1209 VanDerWaalsContact NZ-CG 3.29Å; K1207-D1209 IonicContact NZ-OD1 2.71Å; K1207-D1209 PolarHBondContact NZ-OD1 2.78Å; K1207-D1209 VanDerWaalsContact NZ-OD1 3.12Å; K1207-D1209 IonicContact NZ-OD2 3.41Å; K1207-D1209 PolarHBondContact NZ-OD2 2.74Å; D1209-P1211 WeakPolarHBondContact O-CD 3.48Å
1210	F	82.9	Confident	80.4	Confident	19 Å²	19	53.3 Å²	53.3	8%	0.083	27%	0.27	C	S	.	.	B	Isolated β-bridge	trans	-100.8	98.9	-176	-52.8	-76	0	0	0	112.7	S1199 W1200 C1202 K1207 D1208 E1212 E1215 V1216 H1219	S1199-F1210 WeakPolarHBondContact CA-O 3.27Å; S1199-F1210 WeakPolarHBondContact CB-O 3.41Å; W1200-F1210 HydrophobicContact CB-CB 4.36Å; W1200-F1210 PolarHBondContact N-O 2.89Å; W1200-F1210 WeakPolarHBondContact O-CD2 3.42Å; C1202-F1210 HydrophobicContact CB-CE2 3.76Å; C1202-F1210 HydrophobicContact CB-CZ 4.48Å; K1207-F1210 HydrophobicContact CB-CE2 3.63Å; K1207-F1210 HydrophobicContact CB-CZ 4.09Å; K1207-F1210 HydrophobicContact CD-CZ 4.41Å; K1207-F1210 WeakPolarHBondContact O-CE2 3.35Å; D1208-F1210 PolarHBondContact O-N 3.14Å; F1210-E1212 VanDerWaalsContact C-N 3.29Å; F1210-E1212 PolarHBondContact O-N 3.13Å; F1210-E1215 HydrophobicContact CB-CB 4.31Å; F1210-E1215 HydrophobicContact CD1-CB 3.91Å; F1210-V1216 HydrophobicContact CB-CG2 3.7Å; F1210-V1216 HydrophobicContact CD2-CG2 3.89Å; F1210-V1216 HydrophobicContact CG-CG2 3.79Å; F1210-H1219 HydrophobicContact CE1-CB 3.66Å; F1210-H1219 AromaticContact CE1-CG 3.77Å; F1210-H1219 HydrophobicContact CZ-CB 3.79Å; F1210-H1219 AromaticContact CZ-CD2 3.6Å; F1210-H1219 AromaticContact CZ-CE1 3.94Å; F1210-H1219 AromaticContact CZ-CG 3.43Å; F1210-H1219 VanDerWaalsContact CZ-CG 3.43Å; F1210-H1219 AromaticContact CZ-ND1 3.67Å; F1210-H1219 AromaticContact CZ-NE2 3.93Å
1211	P	81.9	Confident	79.9	Confident	88 Å²	88	56.4 Å²	56.4	57%	0.571	29%	0.291	S	S	*	.	S	Bend	trans	-59.1	-33.2	173.8	19.8	-32.1	0	0	0	114.2	D1209 E1215	D1209-P1211 WeakPolarHBondContact O-CD 3.48Å; P1211-E1215 WeakPolarHBondContact CD-OE2 3.47Å; P1211-E1215 VanDerWaalsContact CG-OE2 3.23Å; P1211-E1215 WeakPolarHBondContact CG-OE2 3.28Å
1212	E	81.9	Confident	79.5	Confident	112 Å²	112	58.4 Å²	58.4	52%	0.523	31%	0.313	S	S	.	.	S	Bend	trans	-111	145.5	177	-72.9	-163.9	-169.5	0	0	114.2	F1210 S1214 E1215	F1210-E1212 VanDerWaalsContact C-N 3.29Å; F1210-E1212 PolarHBondContact O-N 3.13Å; E1212-S1214 PolarHBondContact O-N 3.01Å; E1212-S1214 WeakPolarHBondContact OE2-CB 3.45Å; E1212-S1214 PolarHBondContact OE2-OG 3.45Å; E1212-E1215 HydrophobicContact CB-CG 4.16Å; E1212-E1215 PolarHBondContact N-OE2 3.21Å; E1212-E1215 WeakPolarHBondContact O-CB 3.42Å; E1212-E1215 PolarHBondContact O-N 2.84Å
1213	L	81.2	Confident	78.9	Confident	63 Å²	63	64.2 Å²	64.2	33%	0.33	34%	0.344	S	S	.	.	H	α-helix	trans	-55.3	-38	168.5	178.5	57.7	0	0	0	111.2	P1191 W1200 E1215 V1216 W1217	P1191-L1213 HydrophobicContact CB-CD1 3.64Å; P1191-L1213 HydrophobicContact CG-CD1 3.72Å; W1200-L1213 VanDerWaalsContact CD1-N 3.33Å; W1200-L1213 HydrophobicContact CD2-CB 4.02Å; W1200-L1213 HydrophobicContact CD2-CD1 4.13Å; W1200-L1213 HydrophobicContact CE3-CB 4.49Å; W1200-L1213 HydrophobicContact CE3-CD1 3.8Å; W1200-L1213 HydrophobicContact CG-CB 4.43Å; W1200-L1213 HydrophobicContact CH2-CB 4.42Å; W1200-L1213 HydrophobicContact CH2-CD1 4.35Å; W1200-L1213 HydrophobicContact CH2-CD2 4.12Å; W1200-L1213 HydrophobicContact CZ2-CB 3.96Å; W1200-L1213 HydrophobicContact CZ2-CD2 4.36Å; W1200-L1213 HydrophobicContact CZ3-CD1 3.92Å; W1200-L1213 HydrophobicContact CZ3-CD2 4.45Å; L1213-E1215 PolarHBondContact O-N 3.32Å; L1213-V1216 PolarHBondContact O-N 3.36Å; L1213-V1216 VanDerWaalsContact O-N 3.12Å; L1213-W1217 PolarHBondContact O-N 3.39Å
1214	S	82.1	Confident	78.8	Confident	58 Å²	58	65 Å²	65	41%	0.406	36%	0.355	S	S	.	.	H	α-helix	trans	-46.9	-41	173	-39.3	0	0	0	0	112.6	E1212 N1218	E1212-S1214 PolarHBondContact O-N 3.01Å; E1212-S1214 WeakPolarHBondContact OE2-CB 3.45Å; E1212-S1214 PolarHBondContact OE2-OG 3.45Å; S1214-N1218 VanDerWaalsContact O-CG 3.31Å; S1214-N1218 PolarHBondContact O-N 3.5Å; S1214-N1218 PolarHBondContact O-ND2 3.19Å
1215	E	83.2	Confident	78.7	Confident	74 Å²	74	64 Å²	64	35%	0.346	35%	0.352	S	S	.	.	H	α-helix	trans	-78.9	-27.9	-174.9	-63.3	170.7	156	0	0	112.3	F1210 P1211 E1212 L1213 N1218 H1219	F1210-E1215 HydrophobicContact CB-CB 4.31Å; F1210-E1215 HydrophobicContact CD1-CB 3.91Å; P1211-E1215 WeakPolarHBondContact CD-OE2 3.47Å; P1211-E1215 VanDerWaalsContact CG-OE2 3.23Å; P1211-E1215 WeakPolarHBondContact CG-OE2 3.28Å; E1212-E1215 HydrophobicContact CB-CG 4.16Å; E1212-E1215 PolarHBondContact N-OE2 3.21Å; E1212-E1215 WeakPolarHBondContact O-CB 3.42Å; E1212-E1215 PolarHBondContact O-N 2.84Å; L1213-E1215 PolarHBondContact O-N 3.32Å; E1215-N1218 PolarHBondContact O-N 3.02Å; E1215-H1219 VanDerWaalsContact O-CB 3.24Å; E1215-H1219 WeakPolarHBondContact O-CB 3.26Å; E1215-H1219 PolarHBondContact O-N 2.88Å
1216	V	80.1	Confident	78.5	Confident	0 Å²	0	65.4 Å²	65.4	0%	0	36%	0.36	C	S	.	.	H	α-helix	trans	-67.9	-39.5	172.6	-166.4	0	0	0	0	110.8	P1191 W1200 C1202 F1210 L1213 H1219 F1220	P1191-V1216 HydrophobicContact CB-CB 4.27Å; P1191-V1216 HydrophobicContact CB-CG1 3.98Å; P1191-V1216 HydrophobicContact CB-CG2 4.36Å; P1191-V1216 HydrophobicContact CG-CB 4.15Å; P1191-V1216 HydrophobicContact CG-CG1 3.78Å; W1200-V1216 HydrophobicContact CB-CG2 3.54Å; W1200-V1216 HydrophobicContact CG-CG2 4.46Å; C1202-V1216 HydrophobicContact CB-CG1 4.21Å; F1210-V1216 HydrophobicContact CB-CG2 3.7Å; F1210-V1216 HydrophobicContact CD2-CG2 3.89Å; F1210-V1216 HydrophobicContact CG-CG2 3.79Å; L1213-V1216 PolarHBondContact O-N 3.36Å; L1213-V1216 VanDerWaalsContact O-N 3.12Å; V1216-H1219 WeakPolarHBondContact O-CB 2.94Å; V1216-H1219 PolarHBondContact O-N 2.9Å; V1216-F1220 HydrophobicContact CG1-CE1 3.99Å; V1216-F1220 HydrophobicContact CG1-CE2 4.29Å; V1216-F1220 HydrophobicContact CG1-CZ 3.69Å; V1216-F1220 WeakPolarHBondContact O-CG 3.33Å; V1216-F1220 PolarHBondContact O-N 2.81Å; V1216-F1220 VanDerWaalsContact O-N 3.16Å
1217	W	80.4	Confident	78.7	Confident	93 Å²	93	63 Å²	63	35%	0.352	35%	0.349	S	S	.	.	H	α-helix	trans	-67.2	-44.9	173.2	-66.1	102.7	0	0	0	111.5	A1189 P1191 L1213 H1219 F1220 D1221	A1189-W1217 HydrophobicContact CB-CH2 4.17Å; A1189-W1217 HydrophobicContact CB-CZ3 4.41Å; A1189-W1217 WeakPolarHBondContact O-CH2 3.11Å; P1191-W1217 HydrophobicContact CG-CZ2 4.23Å; L1213-W1217 PolarHBondContact O-N 3.39Å; W1217-H1219 PolarHBondContact O-N 3.33Å; W1217-F1220 HydrophobicContact CD2-CD2 4.1Å; W1217-F1220 HydrophobicContact CD2-CE2 4.04Å; W1217-F1220 AromaticContact CE3-CD2 3.49Å; W1217-F1220 HydrophobicContact CE3-CD2 3.49Å; W1217-F1220 VanDerWaalsContact CE3-CD2 3.49Å; W1217-F1220 AromaticContact CE3-CE2 3.68Å; W1217-F1220 HydrophobicContact CE3-CE2 3.68Å; W1217-F1220 HydrophobicContact CH2-CE2 4.19Å; W1217-F1220 AromaticContact CZ3-CD2 3.82Å; W1217-F1220 HydrophobicContact CZ3-CD2 3.82Å; W1217-F1220 AromaticContact CZ3-CE2 3.76Å; W1217-F1220 HydrophobicContact CZ3-CE2 3.76Å; W1217-F1220 WeakPolarHBondContact O-CA 3.47Å; W1217-F1220 WeakPolarHBondContact O-CB 3.22Å; W1217-F1220 PolarHBondContact O-N 3.18Å; W1217-D1221 PolarHBondContact O-N 2.9Å
1218	N	82.7	Confident	79	Confident	99 Å²	99	64.4 Å²	64.4	53%	0.529	36%	0.357	S	S	.	.	H	α-helix	trans	-57.4	-34.7	171.4	-71	-33.9	0	0	0	112.6	S1214 E1215 F1220 D1221 A1222	S1214-N1218 VanDerWaalsContact O-CG 3.31Å; S1214-N1218 PolarHBondContact O-N 3.5Å; S1214-N1218 PolarHBondContact O-ND2 3.19Å; E1215-N1218 PolarHBondContact O-N 3.02Å; N1218-F1220 VanDerWaalsContact C-N 3.32Å; N1218-D1221 PolarHBondContact O-N 3.28Å; N1218-A1222 WeakPolarHBondContact O-CB 3.29Å; N1218-A1222 PolarHBondContact O-N 3.35Å
1219	H	81.5	Confident	79.1	Confident	15 Å²	15	61.1 Å²	61.1	7%	0.069	34%	0.34	C	S	.	.	H	α-helix	trans	-68.5	-29.2	176.9	177.3	74.1	0	0	0	113.1	C1205 F1210 E1215 V1216 W1217 A1224 C1225	C1205-H1219 PolarHBondContact SG-NE2 3.13Å; F1210-H1219 HydrophobicContact CE1-CB 3.66Å; F1210-H1219 AromaticContact CE1-CG 3.77Å; F1210-H1219 HydrophobicContact CZ-CB 3.79Å; F1210-H1219 AromaticContact CZ-CD2 3.6Å; F1210-H1219 AromaticContact CZ-CE1 3.94Å; F1210-H1219 AromaticContact CZ-CG 3.43Å; F1210-H1219 VanDerWaalsContact CZ-CG 3.43Å; F1210-H1219 AromaticContact CZ-ND1 3.67Å; F1210-H1219 AromaticContact CZ-NE2 3.93Å; E1215-H1219 VanDerWaalsContact O-CB 3.24Å; E1215-H1219 WeakPolarHBondContact O-CB 3.26Å; E1215-H1219 PolarHBondContact O-N 2.88Å; V1216-H1219 WeakPolarHBondContact O-CB 2.94Å; V1216-H1219 PolarHBondContact O-N 2.9Å; W1217-H1219 PolarHBondContact O-N 3.33Å; H1219-A1224 VanDerWaalsContact CE1-C 3.5Å; H1219-A1224 PolarHBondContact CE1-O 2.8Å; H1219-A1224 VanDerWaalsContact CE1-O 3.26Å; H1219-A1224 PolarHBondContact O-N 3.15Å; H1219-C1225 VanDerWaalsContact CE1-CA 3.45Å; H1219-C1225 WeakPolarHBondContact CE1-CA 3.22Å; H1219-C1225 VanDerWaalsContact NE2-CA 3.35Å; H1219-C1225 WeakPolarHBondContact NE2-CA 3.43Å; H1219-C1225 WeakPolarHBondContact NE2-CB 3.28Å; H1219-C1225 PolarHBondContact O-N 3.26Å
1220	F	74	Confident	79.5	Confident	11 Å²	11	58.1 Å²	58.1	5%	0.048	33%	0.326	C	S	.	.	H	α-helix	trans	-71.9	-59.6	166.5	-53.2	-30.2	0	0	0	110.8	L1186 A1189 P1191 P1203 F1204 V1216 W1217 N1218 A1222 N1223	L1186-F1220 HydrophobicContact CD2-CB 4.01Å; L1186-F1220 HydrophobicContact CD2-CD1 4.3Å; L1186-F1220 HydrophobicContact CD2-CG 4.08Å; A1189-F1220 HydrophobicContact CB-CD2 4.44Å; A1189-F1220 HydrophobicContact CB-CE2 3.59Å; A1189-F1220 HydrophobicContact CB-CZ 3.74Å; P1191-F1220 HydrophobicContact CG-CE2 4.38Å; P1191-F1220 HydrophobicContact CG-CZ 4.29Å; P1203-F1220 HydrophobicContact CG-CE1 4.41Å; P1203-F1220 HydrophobicContact CG-CZ 3.99Å; F1204-F1220 HydrophobicContact CD2-CD1 4.03Å; F1204-F1220 AromaticContact CD2-CE1 3.56Å; F1204-F1220 HydrophobicContact CD2-CE1 3.56Å; F1204-F1220 HydrophobicContact CD2-CZ 4.27Å; F1204-F1220 HydrophobicContact CE2-CD1 4.03Å; F1204-F1220 AromaticContact CE2-CE1 3.57Å; F1204-F1220 HydrophobicContact CE2-CE1 3.57Å; F1204-F1220 AromaticContact CE2-CZ 3.9Å; F1204-F1220 HydrophobicContact CE2-CZ 3.9Å; V1216-F1220 HydrophobicContact CG1-CE1 3.99Å; V1216-F1220 HydrophobicContact CG1-CE2 4.29Å; V1216-F1220 HydrophobicContact CG1-CZ 3.69Å; V1216-F1220 WeakPolarHBondContact O-CG 3.33Å; V1216-F1220 PolarHBondContact O-N 2.81Å; V1216-F1220 VanDerWaalsContact O-N 3.16Å; W1217-F1220 HydrophobicContact CD2-CD2 4.1Å; W1217-F1220 HydrophobicContact CD2-CE2 4.04Å; W1217-F1220 AromaticContact CE3-CD2 3.49Å; W1217-F1220 HydrophobicContact CE3-CD2 3.49Å; W1217-F1220 VanDerWaalsContact CE3-CD2 3.49Å; W1217-F1220 AromaticContact CE3-CE2 3.68Å; W1217-F1220 HydrophobicContact CE3-CE2 3.68Å; W1217-F1220 HydrophobicContact CH2-CE2 4.19Å; W1217-F1220 AromaticContact CZ3-CD2 3.82Å; W1217-F1220 HydrophobicContact CZ3-CD2 3.82Å; W1217-F1220 AromaticContact CZ3-CE2 3.76Å; W1217-F1220 HydrophobicContact CZ3-CE2 3.76Å; W1217-F1220 WeakPolarHBondContact O-CA 3.47Å; W1217-F1220 WeakPolarHBondContact O-CB 3.22Å; W1217-F1220 PolarHBondContact O-N 3.18Å; N1218-F1220 VanDerWaalsContact C-N 3.32Å; F1220-A1222 VanDerWaalsContact C-N 3.33Å; F1220-A1222 PolarHBondContact O-N 3.33Å; F1220-N1223 WeakPolarHBondContact O-CA 3.49Å; F1220-N1223 PolarHBondContact O-N 3.08Å
1221	D	75	Confident	79.8	Confident	123 Å²	123	57.2 Å²	57.2	66%	0.658	32%	0.322	S	S	*	.	H	α-helix	trans	-65.2	-32.8	-167.5	-67.6	-16	0	0	0	113.1	W1217 N1218 N1223	W1217-D1221 PolarHBondContact O-N 2.9Å; N1218-D1221 PolarHBondContact O-N 3.28Å; D1221-N1223 PolarHBondContact O-N 3.49Å
1222	A	76	Confident	80.4	Confident	76 Å²	76	53 Å²	53	63%	0.628	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.3	4.6	175.4	0	0	0	0	0	113.9	N1218 F1220 A1224	N1218-A1222 WeakPolarHBondContact O-CB 3.29Å; N1218-A1222 PolarHBondContact O-N 3.35Å; F1220-A1222 VanDerWaalsContact C-N 3.33Å; F1220-A1222 PolarHBondContact O-N 3.33Å; A1222-A1224 HydrophobicContact CB-CB 4.35Å; A1222-A1224 PolarHBondContact O-N 3.41Å; A1222-A1224 VanDerWaalsContact O-N 3.13Å
1223	N	69.7	Low	81	Confident	122 Å²	122	53.7 Å²	53.7	65%	0.652	29%	0.292	S	S	*	.	S	Bend	trans	54.3	21.9	-168.3	-71.2	-66.2	0	0	0	113.9	F1220 D1221 C1225	F1220-N1223 WeakPolarHBondContact O-CA 3.49Å; F1220-N1223 PolarHBondContact O-N 3.08Å; D1221-N1223 PolarHBondContact O-N 3.49Å; N1223-C1225 VanDerWaalsContact C-N 3.25Å; N1223-C1225 PolarHBondContact O-N 2.81Å
1224	A	76.2	Confident	81.7	Confident	59 Å²	59	50.8 Å²	50.8	49%	0.488	28%	0.277	S	S	.	.			trans	-75.5	-15.6	-178.4	0	0	0	0	0	112.8	H1219 A1222 P1226	H1219-A1224 VanDerWaalsContact CE1-C 3.5Å; H1219-A1224 PolarHBondContact CE1-O 2.8Å; H1219-A1224 VanDerWaalsContact CE1-O 3.26Å; H1219-A1224 PolarHBondContact O-N 3.15Å; A1222-A1224 HydrophobicContact CB-CB 4.35Å; A1222-A1224 PolarHBondContact O-N 3.41Å; A1222-A1224 VanDerWaalsContact O-N 3.13Å; A1224-P1226 WeakPolarHBondContact O-CD 3.49Å
1225	C	76.7	Confident	82.2	Confident	9 Å²	9	54.5 Å²	54.5	6%	0.061	28%	0.282	C	S	.	.			trans	-73.7	116.5	173.8	-174.6	0	0	0	0	111.7	H1219 N1223 G1227	H1219-C1225 VanDerWaalsContact CE1-CA 3.45Å; H1219-C1225 WeakPolarHBondContact CE1-CA 3.22Å; H1219-C1225 VanDerWaalsContact NE2-CA 3.35Å; H1219-C1225 WeakPolarHBondContact NE2-CA 3.43Å; H1219-C1225 WeakPolarHBondContact NE2-CB 3.28Å; H1219-C1225 PolarHBondContact O-N 3.26Å; N1223-C1225 VanDerWaalsContact C-N 3.25Å; N1223-C1225 PolarHBondContact O-N 2.81Å; C1225-G1227 PolarHBondContact O-N 3.29Å; C1225-G1227 PolarHBondContact SG-N 3.08Å
1226	P	73.2	Confident	82.7	Confident	48 Å²	48	51.2 Å²	51.2	31%	0.312	27%	0.267	S	S	.	.			trans	-66.2	-23.3	171.8	29.5	-35.1	0	0	0	111.6	Y1178 C1205 A1224	Y1178-P1226 VanDerWaalsContact CB-O 3.25Å; Y1178-P1226 WeakPolarHBondContact CB-O 3.3Å; Y1178-P1226 HydrophobicContact CD1-CB 4.05Å; Y1178-P1226 HydrophobicContact CD1-CG 4.27Å; Y1178-P1226 HydrophobicContact CD2-CB 4.23Å; Y1178-P1226 HydrophobicContact CG-CB 3.87Å; C1205-P1226 HydrophobicContact CB-CG 3.86Å; A1224-P1226 WeakPolarHBondContact O-CD 3.49Å
1227	G	79.6	Confident	82.9	Confident	0 Å²	0	57.8 Å²	57.8	0%	0	30%	0.298	C	S	.	.			trans	92.4	-164.5	-175.9	0	0	0	0	0	112.8	R1179 C1205 C1225	R1179-G1227 CarbonylContact O-C 3.5Å; R1179-G1227 VanDerWaalsContact O-CA 3.27Å; R1179-G1227 WeakPolarHBondContact O-CA 3.39Å; C1205-G1227 WeakPolarHBondContact CA-O 3.37Å; C1205-G1227 WeakPolarHBondContact CB-O 3.37Å; C1225-G1227 PolarHBondContact O-N 3.29Å; C1225-G1227 PolarHBondContact SG-N 3.08Å
1228	Q	81.8	Confident	83.1	Confident	116 Å²	116	55.6 Å²	55.6	54%	0.542	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	127	-175.7	-169.3	178.1	35.6	0	0	110.7	R1179 F1204 S1230	R1179-Q1228 PolarHBondContact N-O 2.81Å; R1179-Q1228 PolarHBondContact O-N 3Å; F1204-Q1228 WeakPolarHBondContact O-CA 3.46Å; F1204-Q1228 PolarHBondContact O-N 2.99Å; Q1228-S1230 PolarHBondContact O-N 2.92Å
1229	P	82.6	Confident	83.2	Confident	8 Å²	8	52.8 Å²	52.8	5%	0.052	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.7	128	177.4	23.5	-31.8	0	0	0	110.8	Y1178 I1246 R1255 P1257	Y1178-P1229 HydrophobicContact CD1-CB 3.8Å; Y1178-P1229 HydrophobicContact CE1-CB 3.75Å; Y1178-P1229 HydrophobicContact CE1-CG 4.42Å; P1229-I1246 HydrophobicContact CB-CD1 4.03Å; P1229-I1246 HydrophobicContact CG-CD1 3.89Å; P1229-I1246 WeakPolarHBondContact O-CD1 3.34Å; P1229-R1255 WeakPolarHBondContact CG-O 3.16Å; P1229-P1257 HydrophobicContact CB-CG 4.03Å
1230	S	86.4	Confident	83.6	Confident	28 Å²	28	52.4 Å²	52.4	20%	0.196	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	-25.1	-173.8	-165.7	0	0	0	0	113	T1177 Q1228 I1246	T1177-S1230 PolarHBondContact O-N 3.04Å; Q1228-S1230 PolarHBondContact O-N 2.92Å; S1230-I1246 PolarHBondContact O-N 3.43Å
1231	G	90.5	Very high	84.5	Confident	0 Å²	0	54.8 Å²	54.8	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	162.7	179.1	-177.1	0	0	0	0	0	113.8	T1177 I1244	T1177-G1231 PolarHBondContact N-O 3.24Å; T1177-G1231 PolarHBondContact OG1-N 3.19Å; T1177-G1231 PolarHBondContact OG1-O 3.24Å; G1231-I1244 CarbonylContact C-O 3.58Å; G1231-I1244 WeakPolarHBondContact CA-O 3.3Å
1232	V	93.3	Very high	85.3	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	129.6	-176.7	-171	0	0	0	0	108.7	V1173 F1176 V1234 I1244 L1249 P1257 V1261	V1173-V1232 HydrophobicContact CB-CG1 4.41Å; V1173-V1232 HydrophobicContact CG1-CG1 3.54Å; V1173-V1232 HydrophobicContact CG2-CG1 4.14Å; F1176-V1232 HydrophobicContact CD1-CG1 4.3Å; F1176-V1232 HydrophobicContact CD1-CG2 4.09Å; F1176-V1232 HydrophobicContact CE1-CG1 4.21Å; F1176-V1232 HydrophobicContact CE1-CG2 4.2Å; V1232-V1234 HydrophobicContact CG1-CG1 4.35Å; V1232-I1244 HydrophobicContact CB-CB 4.37Å; V1232-I1244 PolarHBondContact N-O 3.33Å; V1232-I1244 PolarHBondContact O-N 2.95Å; V1232-L1249 HydrophobicContact CG2-CD1 3.97Å; V1232-L1249 HydrophobicContact CG2-CD2 3.9Å; V1232-P1257 HydrophobicContact CG2-CB 3.85Å; V1232-V1261 HydrophobicContact CG1-CG2 4.22Å; V1232-V1261 HydrophobicContact CG2-CG2 4.22Å
1233	R	95.2	Very high	86.3	Confident	125 Å²	125	48.4 Å²	48.4	47%	0.472	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	138.9	166.3	-69.8	172.9	-70.2	166.7	-2.9	109.2	T1174 G1175 F1176 T1177 F1243	T1174-R1233 PolarHBondContact N-O 2.88Å; T1174-R1233 WeakPolarHBondContact OG1-CB 3.4Å; T1174-R1233 PolarHBondContact OG1-O 2.62Å; G1175-R1233 PolarHBondContact N-O 2.93Å; G1175-R1233 WeakPolarHBondContact O-CB 3.14Å; G1175-R1233 PolarHBondContact O-N 3.31Å; F1176-R1233 PolarHBondContact O-NH2 3.27Å; F1176-R1233 VanDerWaalsContact O-NH2 3.15Å; T1177-R1233 HydrophobicContact CG2-CG 3.82Å; R1233-F1243 HydrophobicContact CG-CD2 4.16Å
1234	V	94.9	Very high	87.5	Confident	2 Å²	2	42.6 Å²	42.6	1%	0.012	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	168.3	175.1	-55.4	0	0	0	0	110.2	A1171 M1172 V1173 V1232 G1242 I1244 I1267	A1171-V1234 HydrophobicContact CB-CB 3.92Å; A1171-V1234 HydrophobicContact CB-CG2 3.84Å; M1172-V1234 CarbonylContact O-C 3.46Å; M1172-V1234 WeakPolarHBondContact O-CA 3.24Å; M1172-V1234 WeakPolarHBondContact O-CB 3.45Å; V1173-V1234 HydrophobicContact CG2-CG1 4.28Å; V1232-V1234 HydrophobicContact CG1-CG1 4.35Å; V1234-G1242 PolarHBondContact N-O 2.96Å; V1234-G1242 PolarHBondContact O-N 2.81Å; V1234-I1244 HydrophobicContact CG1-CD1 3.76Å; V1234-I1244 HydrophobicContact CG1-CG1 4.22Å; V1234-I1267 HydrophobicContact CG1-CD1 4.22Å
1235	R	94.3	Very high	88.2	Confident	136 Å²	136	43.1 Å²	43.1	51%	0.513	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	131.1	167.5	173.5	178.5	-68.4	163.2	-1.1	108.1	A1171 M1172 T1174 L1240	A1171-R1235 CarbonylContact C-O 3.51Å; A1171-R1235 VanDerWaalsContact CA-O 3.29Å; A1171-R1235 WeakPolarHBondContact CA-O 3.48Å; M1172-R1235 PolarHBondContact N-O 2.88Å; M1172-R1235 PolarHBondContact O-N 2.96Å; T1174-R1235 HydrophobicContact CG2-CB 3.67Å; R1235-L1240 WeakPolarHBondContact CA-O 3.37Å
1236	L	91.8	Very high	88.8	Confident	5 Å²	5	44.2 Å²	44.2	3%	0.026	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	163.1	174.1	-68.6	152.7	0	0	0	110.2	F1163 V1169 A1171 N1238 G1239 L1240 V1269 V1281	F1163-L1236 HydrophobicContact CE2-CD1 4.4Å; F1163-L1236 HydrophobicContact CZ-CD1 4.02Å; V1169-L1236 HydrophobicContact CB-CD2 4.18Å; V1169-L1236 HydrophobicContact CG2-CD2 3.39Å; A1171-L1236 HydrophobicContact CB-CD2 4.23Å; L1236-N1238 VanDerWaalsContact C-N 3.33Å; L1236-N1238 WeakPolarHBondContact CB-OD1 3.45Å; L1236-N1238 PolarHBondContact O-N 2.9Å; L1236-G1239 WeakPolarHBondContact O-CA 3.37Å; L1236-G1239 PolarHBondContact O-N 3.21Å; L1236-L1240 HydrophobicContact CB-CB 4.34Å; L1236-L1240 HydrophobicContact CD1-CB 3.85Å; L1236-L1240 PolarHBondContact N-O 2.71Å; L1236-V1269 HydrophobicContact CD2-CG2 4.42Å; L1236-V1281 HydrophobicContact CD1-CB 3.93Å; L1236-V1281 HydrophobicContact CD1-CG1 4.31Å; L1236-V1281 HydrophobicContact CD1-CG2 3.61Å
1237	E	86.1	Confident	89.6	Confident	139 Å²	139	49.2 Å²	49.2	65%	0.65	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.9	-36.3	-176.5	-70.7	173.3	178.5	0	0	112.4	T1170 G1239	T1170-E1237 WeakPolarHBondContact CB-OE1 3.36Å; T1170-E1237 PolarHBondContact OG1-OE1 2.86Å; T1170-E1237 PolarHBondContact OG1-OE2 3.04Å; E1237-G1239 PolarHBondContact O-N 2.62Å
1238	N	83.9	Confident	90.2	Very high	46 Å²	46	50.8 Å²	50.8	25%	0.246	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.5	16.4	167.4	66.1	16.7	0	0	0	114.7	E1158 F1163 L1236 L1240	E1158-N1238 HydrophobicContact CG-CB 4.42Å; E1158-N1238 PolarHBondContact OE1-ND2 2.85Å; F1163-N1238 WeakPolarHBondContact CD2-ND2 3.47Å; F1163-N1238 WeakPolarHBondContact CE2-ND2 3.43Å; L1236-N1238 VanDerWaalsContact C-N 3.33Å; L1236-N1238 WeakPolarHBondContact CB-OD1 3.45Å; L1236-N1238 PolarHBondContact O-N 2.9Å; N1238-L1240 PolarHBondContact O-N 2.76Å; N1238-L1240 VanDerWaalsContact O-N 3.13Å; N1238-L1240 WeakPolarHBondContact OD1-CB 3.1Å; N1238-L1240 WeakPolarHBondContact OD1-CG 3.3Å; N1238-L1240 PolarHBondContact OD1-N 2.81Å
1239	G	83.6	Confident	90.6	Very high	41 Å²	41	45.3 Å²	45.3	42%	0.423	22%	0.222	S	C	.	.	S	Bend	trans	76.4	-11	177.5	0	0	0	0	0	115.9	L1236 E1237	L1236-G1239 WeakPolarHBondContact O-CA 3.37Å; L1236-G1239 PolarHBondContact O-N 3.21Å; E1237-G1239 PolarHBondContact O-N 2.62Å
1240	L	90	Very high	90.9	Very high	7 Å²	7	46 Å²	46	4%	0.037	23%	0.227	C	C	.	.	P	Polyproline II helix	trans	-63.2	136.6	-173.8	-71.5	171.5	0	0	0	112.5	F1152 T1156 F1163 R1235 L1236 N1238 G1242 F1279 V1281	F1152-L1240 HydrophobicContact CE2-CD1 4.22Å; F1152-L1240 HydrophobicContact CE2-CD2 4.3Å; F1152-L1240 HydrophobicContact CZ-CD1 3.73Å; T1156-L1240 HydrophobicContact CG2-CD1 4.18Å; T1156-L1240 HydrophobicContact CG2-CD2 3.94Å; T1156-L1240 HydrophobicContact CG2-CG 4.26Å; F1163-L1240 HydrophobicContact CE1-CD1 3.82Å; F1163-L1240 HydrophobicContact CE2-CD1 4.48Å; F1163-L1240 HydrophobicContact CZ-CD1 3.79Å; R1235-L1240 WeakPolarHBondContact CA-O 3.37Å; L1236-L1240 HydrophobicContact CB-CB 4.34Å; L1236-L1240 HydrophobicContact CD1-CB 3.85Å; L1236-L1240 PolarHBondContact N-O 2.71Å; N1238-L1240 PolarHBondContact O-N 2.76Å; N1238-L1240 VanDerWaalsContact O-N 3.13Å; N1238-L1240 WeakPolarHBondContact OD1-CB 3.1Å; N1238-L1240 WeakPolarHBondContact OD1-CG 3.3Å; N1238-L1240 PolarHBondContact OD1-N 2.81Å; L1240-G1242 PolarHBondContact O-N 3.31Å; L1240-F1279 HydrophobicContact CD2-CB 4.02Å; L1240-F1279 HydrophobicContact CD2-CD1 4.4Å; L1240-V1281 HydrophobicContact CB-CG2 4.26Å; L1240-V1281 HydrophobicContact CD1-CG2 4.19Å
1241	P	93.2	Very high	90.8	Very high	60 Å²	60	48.8 Å²	48.8	39%	0.39	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	118.5	174	29.8	-33.3	0	0	0	110.9	F1279 S1280 V1281	P1241-F1279 VanDerWaalsContact CD-O 3.25Å; P1241-F1279 WeakPolarHBondContact CD-O 3.4Å; P1241-F1279 VanDerWaalsContact CG-O 3.3Å; P1241-F1279 WeakPolarHBondContact CG-O 3.17Å; P1241-S1280 WeakPolarHBondContact O-CA 3.31Å; P1241-V1281 PolarHBondContact O-N 2.95Å
1242	G	93.4	Very high	90.5	Very high	5 Å²	5	58.8 Å²	58.8	5%	0.052	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	156.2	175.2	0	0	0	0	0	113	V1234 L1240 V1281	V1234-G1242 PolarHBondContact N-O 2.96Å; V1234-G1242 PolarHBondContact O-N 2.81Å; L1240-G1242 PolarHBondContact O-N 3.31Å; G1242-V1281 CarbonylContact C-O 3.59Å; G1242-V1281 VanDerWaalsContact CA-O 3.25Å; G1242-V1281 WeakPolarHBondContact CA-O 3.01Å
1243	F	95.3	Very high	89.9	Confident	61 Å²	61	67.3 Å²	67.3	27%	0.268	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	127.1	174.7	-174	-105.7	0	0	0	112.1	T1177 R1233 H1245 V1281 E1282 C1283	T1177-F1243 HydrophobicContact CG2-CE2 4.05Å; T1177-F1243 WeakPolarHBondContact OG1-CE2 3.44Å; R1233-F1243 HydrophobicContact CG-CD2 4.16Å; F1243-H1245 HydrophobicContact CE1-CB 4.06Å; F1243-V1281 PolarHBondContact N-O 2.79Å; F1243-E1282 WeakPolarHBondContact O-CA 3.13Å; F1243-C1283 PolarHBondContact O-N 2.78Å
1244	I	94.9	Very high	89.2	Confident	0 Å²	0	62.4 Å²	62.4	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	105.5	172.8	-53.3	172.3	0	0	0	107.7	G1231 V1232 V1234 N1248 L1249 I1267 V1269 C1283	G1231-I1244 CarbonylContact C-O 3.58Å; G1231-I1244 WeakPolarHBondContact CA-O 3.3Å; V1232-I1244 HydrophobicContact CB-CB 4.37Å; V1232-I1244 PolarHBondContact N-O 3.33Å; V1232-I1244 PolarHBondContact O-N 2.95Å; V1234-I1244 HydrophobicContact CG1-CD1 3.76Å; V1234-I1244 HydrophobicContact CG1-CG1 4.22Å; I1244-N1248 HydrophobicContact CG2-CB 4.12Å; I1244-L1249 HydrophobicContact CG2-CB 4.36Å; I1244-L1249 HydrophobicContact CG2-CD1 4.35Å; I1244-I1267 HydrophobicContact CD1-CD1 3.62Å; I1244-V1269 HydrophobicContact CD1-CG1 3.75Å; I1244-C1283 HydrophobicContact CG1-CB 4.21Å
1245	H	92.2	Very high	88.4	Confident	69 Å²	69	68.8 Å²	68.8	32%	0.319	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.2	142.8	172	-175.2	-90.5	0	0	0	110.3	F1243 K1247 N1248	F1243-H1245 HydrophobicContact CE1-CB 4.06Å; H1245-K1247 PolarHBondContact ND1-N 3.45Å; H1245-K1247 PolarHBondContact O-N 2.91Å; H1245-N1248 WeakPolarHBondContact O-CA 3.38Å; H1245-N1248 WeakPolarHBondContact O-CB 3.29Å; H1245-N1248 PolarHBondContact O-N 2.96Å
1246	I	89.5	Confident	87.6	Confident	33 Å²	33	64.6 Å²	64.6	17%	0.169	31%	0.313	C	S	.	.	G	3₁₀ helix	trans	-54.7	-35.3	-171.1	-172.5	167.2	0	0	0	114	P1229 S1230 N1248 L1249	P1229-I1246 HydrophobicContact CB-CD1 4.03Å; P1229-I1246 HydrophobicContact CG-CD1 3.89Å; P1229-I1246 WeakPolarHBondContact O-CD1 3.34Å; S1230-I1246 PolarHBondContact O-N 3.43Å; I1246-N1248 PolarHBondContact O-N 3.34Å; I1246-N1248 VanDerWaalsContact O-N 3.15Å; I1246-L1249 WeakPolarHBondContact O-CB 3.2Å; I1246-L1249 PolarHBondContact O-N 3.16Å
1247	K	89.9	Confident	87.3	Confident	153 Å²	153	64.3 Å²	64.3	67%	0.665	31%	0.312	S	S	*	.	G	3₁₀ helix	trans	-60.9	-18.4	174	-64.3	175.8	-178.2	177	0	114.5	H1245 R1286	H1245-K1247 PolarHBondContact ND1-N 3.45Å; H1245-K1247 PolarHBondContact O-N 2.91Å; K1247-R1286 VanDerWaalsContact O-CZ 3.3Å; K1247-R1286 PolarHBondContact O-NE 3.21Å; K1247-R1286 PolarHBondContact O-NH2 3.21Å
1248	N	91.4	Very high	87.2	Confident	33 Å²	33	62.2 Å²	62.2	18%	0.176	30%	0.302	C	S	.	.	G	3₁₀ helix	trans	-107.1	6.1	-175	-61.9	10.1	0	0	0	111.9	I1244 H1245 I1246 S1284 S1285 R1286	I1244-N1248 HydrophobicContact CG2-CB 4.12Å; H1245-N1248 WeakPolarHBondContact O-CA 3.38Å; H1245-N1248 WeakPolarHBondContact O-CB 3.29Å; H1245-N1248 PolarHBondContact O-N 2.96Å; I1246-N1248 PolarHBondContact O-N 3.34Å; I1246-N1248 VanDerWaalsContact O-N 3.15Å; N1248-S1284 PolarHBondContact O-OG 2.94Å; N1248-S1284 VanDerWaalsContact O-OG 3.08Å; N1248-S1285 PolarHBondContact O-N 3.07Å; N1248-R1286 PolarHBondContact O-N 3.27Å; N1248-R1286 PolarHBondContact OD1-NH2 3.43Å
1249	L	90.5	Very high	87.2	Confident	0 Å²	0	66.8 Å²	66.8	0%	0	32%	0.322	C	S	.	.	S	Bend	trans	-82.2	-26.6	-178.8	-173.2	61.2	0	0	0	113.2	V1232 I1244 I1246 V1254 P1257 R1260 V1261	V1232-L1249 HydrophobicContact CG2-CD1 3.97Å; V1232-L1249 HydrophobicContact CG2-CD2 3.9Å; I1244-L1249 HydrophobicContact CG2-CB 4.36Å; I1244-L1249 HydrophobicContact CG2-CD1 4.35Å; I1246-L1249 WeakPolarHBondContact O-CB 3.2Å; I1246-L1249 PolarHBondContact O-N 3.16Å; L1249-V1254 HydrophobicContact CD2-CG1 4.29Å; L1249-P1257 HydrophobicContact CD2-CB 3.64Å; L1249-R1260 HydrophobicContact CD2-CB 4.38Å; L1249-R1260 HydrophobicContact CG-CG 4.25Å; L1249-V1261 HydrophobicContact CD1-CG1 4.11Å; L1249-V1261 HydrophobicContact CD1-CG2 4.28Å
1250	S	88.5	Confident	87.3	Confident	22 Å²	22	69.4 Å²	69.4	15%	0.154	32%	0.319	C	S	.	.			trans	-162.7	161.5	176.1	-164.4	0	0	0	0	111.3
1251	D	84.7	Confident	87.4	Confident	87 Å²	87	69.1 Å²	69.1	47%	0.465	32%	0.317	S	S	.	.	S	Bend	trans	-69.5	-26.2	172.7	-49.2	-8.1	0	0	0	111.4	R1286 T1287 A1288	D1251-R1286 WeakPolarHBondContact OD1-CA 3.09Å; D1251-R1286 VanDerWaalsContact OD1-CB 3.23Å; D1251-R1286 WeakPolarHBondContact OD1-CB 3.34Å; D1251-T1287 PolarHBondContact OD1-N 2.98Å; D1251-T1287 WeakPolarHBondContact OD2-CB 3.46Å; D1251-A1288 PolarHBondContact OD1-N 3.25Å; D1251-A1288 PolarHBondContact OD2-N 2.86Å
1252	R	84.6	Confident	87.3	Confident	211 Å²	211	75.3 Å²	75.3	80%	0.796	33%	0.333	S	S	*	.	S	Bend	trans	-85.9	144.9	171.7	-64.9	-176.5	179.8	179.1	0.6	109.6	V1254	R1252-V1254 PolarHBondContact O-N 3.17Å
1253	Q	80.1	Confident	87.2	Confident	178 Å²	178	78.6 Å²	78.6	83%	0.832	35%	0.352	S	S	*	.			trans	-67.5	97.9	176.9	-174	-179.3	10	0	0	111.1
1254	V	81.4	Confident	87	Confident	23 Å²	23	80 Å²	80	14%	0.139	37%	0.369	C	S	.	.			trans	-76.2	130.6	171.8	179.7	0	0	0	0	109.5	L1249 R1252 N1256 R1260	L1249-V1254 HydrophobicContact CD2-CG1 4.29Å; R1252-V1254 PolarHBondContact O-N 3.17Å; V1254-N1256 WeakPolarHBondContact CG1-O 3.22Å; V1254-R1260 HydrophobicContact CG2-CB 4.33Å
1255	R	76.3	Confident	86.9	Confident	136 Å²	136	83.4 Å²	83.4	51%	0.513	39%	0.385	S	S	.	.	S	Bend	trans	-94.2	-49.3	173.1	-70.2	-170	-176.5	-172.3	2.7	112	P1229	P1229-R1255 WeakPolarHBondContact CG-O 3.16Å
1256	N	78.9	Confident	86.9	Confident	47 Å²	47	84.7 Å²	84.7	25%	0.251	39%	0.393	S	S	.	.	S	Bend	trans	-107.4	120.2	170.2	-179.3	1.4	0	0	0	110.2	V1254 E1258 E1259	V1254-N1256 WeakPolarHBondContact CG1-O 3.22Å; N1256-E1258 PolarHBondContact ND2-OE2 3.27Å; N1256-E1258 PolarHBondContact O-N 3.24Å; N1256-E1258 WeakPolarHBondContact OD1-CB 3.46Å; N1256-E1258 PolarHBondContact OD1-N 3.39Å; N1256-E1259 HydrophobicContact CB-CG 4.13Å; N1256-E1259 WeakPolarHBondContact CB-OE1 3.44Å; N1256-E1259 WeakPolarHBondContact O-CB 3.46Å; N1256-E1259 PolarHBondContact O-N 3.29Å
1257	P	84.7	Confident	87.1	Confident	0 Å²	0	83.6 Å²	83.6	0%	0	39%	0.387	C	S	.	.	G	3₁₀ helix	trans	-59.6	-25.6	178.7	25.7	-36.2	0	0	0	114.1	F1176 P1229 V1232 L1249 E1259 R1260 V1261	F1176-P1257 HydrophobicContact CD1-CB 3.78Å; F1176-P1257 HydrophobicContact CD1-CG 3.61Å; F1176-P1257 HydrophobicContact CE1-CB 3.89Å; F1176-P1257 HydrophobicContact CE1-CG 4.13Å; F1176-P1257 HydrophobicContact CG-CG 4.24Å; P1229-P1257 HydrophobicContact CB-CG 4.03Å; V1232-P1257 HydrophobicContact CG2-CB 3.85Å; L1249-P1257 HydrophobicContact CD2-CB 3.64Å; P1257-E1259 PolarHBondContact O-N 2.84Å; P1257-R1260 PolarHBondContact O-N 3.13Å; P1257-V1261 PolarHBondContact O-N 2.71Å
1258	E	85	Confident	87.2	Confident	94 Å²	94	82 Å²	82	44%	0.439	38%	0.381	S	S	.	.	G	3₁₀ helix	trans	-65.8	-21.1	179.2	-65.1	168.1	177.9	0	0	113.2	F1176 Y1178 N1256 R1260	F1176-E1258 HydrophobicContact CD2-CG 3.77Å; F1176-E1258 HydrophobicContact CE1-CG 4.26Å; F1176-E1258 HydrophobicContact CE2-CG 3.42Å; F1176-E1258 VanDerWaalsContact CE2-CG 3.42Å; F1176-E1258 HydrophobicContact CG-CG 4.35Å; F1176-E1258 HydrophobicContact CZ-CG 3.7Å; Y1178-E1258 PolarHBondContact OH-OE1 3.08Å; N1256-E1258 PolarHBondContact ND2-OE2 3.27Å; N1256-E1258 PolarHBondContact O-N 3.24Å; N1256-E1258 WeakPolarHBondContact OD1-CB 3.46Å; N1256-E1258 PolarHBondContact OD1-N 3.39Å; E1258-R1260 PolarHBondContact O-N 2.83Å
1259	E	83.4	Confident	87.3	Confident	142 Å²	142	80.4 Å²	80.4	66%	0.664	37%	0.373	S	S	*	.	G	3₁₀ helix	trans	-66.5	-26.8	171.9	-65.3	165.9	-154.2	0	0	112.3	N1256 P1257	N1256-E1259 HydrophobicContact CB-CG 4.13Å; N1256-E1259 WeakPolarHBondContact CB-OE1 3.44Å; N1256-E1259 WeakPolarHBondContact O-CB 3.46Å; N1256-E1259 PolarHBondContact O-N 3.29Å; P1257-E1259 PolarHBondContact O-N 2.84Å
1260	R	85.9	Confident	87.4	Confident	97 Å²	97	80.5 Å²	80.5	37%	0.366	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111.6	-30.9	-169.4	179.3	56.1	-171.2	86.3	1.6	113.8	L1249 V1254 P1257 E1258	L1249-R1260 HydrophobicContact CD2-CB 4.38Å; L1249-R1260 HydrophobicContact CG-CG 4.25Å; V1254-R1260 HydrophobicContact CG2-CB 4.33Å; P1257-R1260 PolarHBondContact O-N 3.13Å; E1258-R1260 PolarHBondContact O-N 2.83Å
1261	V	90.7	Very high	87.6	Confident	1 Å²	1	79.5 Å²	79.5	1%	0.006	37%	0.366	C	S	.	.			trans	-142.5	151.1	177.2	-58.7	0	0	0	0	111.6	V1173 F1176 V1232 L1249 P1257 Q1265 I1267	V1173-V1261 HydrophobicContact CG1-CG2 4.46Å; V1173-V1261 HydrophobicContact CG2-CB 4.18Å; V1173-V1261 HydrophobicContact CG2-CG2 4.13Å; F1176-V1261 HydrophobicContact CE1-CG2 3.93Å; F1176-V1261 HydrophobicContact CZ-CG2 4.42Å; F1176-V1261 WeakPolarHBondContact CZ-O 3.44Å; V1232-V1261 HydrophobicContact CG1-CG2 4.22Å; V1232-V1261 HydrophobicContact CG2-CG2 4.22Å; L1249-V1261 HydrophobicContact CD1-CG1 4.11Å; L1249-V1261 HydrophobicContact CD1-CG2 4.28Å; P1257-V1261 PolarHBondContact O-N 2.71Å; V1261-Q1265 VanDerWaalsContact CA-OE1 3.32Å; V1261-I1267 HydrophobicContact CG1-CD1 4.4Å; V1261-I1267 HydrophobicContact CG1-CG2 3.97Å
1262	R	91.5	Very high	87.9	Confident	189 Å²	189	78 Å²	78	71%	0.713	36%	0.358	S	S	*	.			trans	-108.6	158.5	174.6	-64.3	179.4	-178.3	-101.2	-4	111.1	V1173 Q1265	V1173-R1262 VanDerWaalsContact CB-O 3.28Å; V1173-R1262 WeakPolarHBondContact CB-O 3.19Å; V1173-R1262 WeakPolarHBondContact CG1-O 3.28Å; R1262-Q1265 HydrophobicContact CB-CB 4.44Å; R1262-Q1265 WeakPolarHBondContact O-CB 3.44Å; R1262-Q1265 PolarHBondContact O-N 2.97Å
1263	V	91.9	Very high	88.3	Confident	75 Å²	75	71.7 Å²	71.7	46%	0.455	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.4	144.9	169.2	-171.5	0	0	0	0	109.6	F1176 Q1265	F1176-V1263 HydrophobicContact CD2-CG2 4.34Å; F1176-V1263 HydrophobicContact CE2-CG2 3.68Å; F1176-V1263 HydrophobicContact CZ-CG2 4.27Å; V1263-Q1265 PolarHBondContact O-N 2.98Å
1264	S	91.2	Very high	88.9	Confident	90 Å²	90	64.8 Å²	64.8	63%	0.629	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	63	9.9	-171.3	-50.4	0	0	0	0	115.4	V1173	V1173-S1264 PolarHBondContact O-N 3.43Å
1265	Q	92.3	Very high	89.4	Confident	71 Å²	71	65.2 Å²	65.2	33%	0.332	31%	0.306	S	S	.	.			trans	-78.6	130.2	170.7	-173.5	175.7	-1.2	0	0	110.6	V1173 V1261 R1262 V1263 I1267	V1173-Q1265 PolarHBondContact N-O 2.83Å; V1261-Q1265 VanDerWaalsContact CA-OE1 3.32Å; R1262-Q1265 HydrophobicContact CB-CB 4.44Å; R1262-Q1265 WeakPolarHBondContact O-CB 3.44Å; R1262-Q1265 PolarHBondContact O-N 2.97Å; V1263-Q1265 PolarHBondContact O-N 2.98Å; Q1265-I1267 HydrophobicContact CG-CG2 4.09Å
1266	M	93	Very high	90.1	Very high	97 Å²	97	61.1 Å²	61.1	48%	0.478	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74	130.2	165.1	-67.1	-62.2	-80.4	0	0	110	T1170 M1172	T1170-M1266 HydrophobicContact CG2-CE 4.5Å; M1172-M1266 HydrophobicContact CB-SD 3.62Å; M1172-M1266 HydrophobicContact CG-SD 4.28Å
1267	I	93	Very high	90.5	Very high	10 Å²	10	65.3 Å²	65.3	5%	0.051	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	150.7	176.3	57.5	170.6	0	0	0	110.4	A1171 V1173 V1234 I1244 V1261 Q1265 V1269	A1171-I1267 PolarHBondContact N-O 3.33Å; A1171-I1267 WeakPolarHBondContact O-CG1 3.46Å; A1171-I1267 PolarHBondContact O-N 3.3Å; V1173-I1267 HydrophobicContact CG2-CD1 3.73Å; V1173-I1267 HydrophobicContact CG2-CG1 4.06Å; V1173-I1267 HydrophobicContact CG2-CG2 4.47Å; V1234-I1267 HydrophobicContact CG1-CD1 4.22Å; I1244-I1267 HydrophobicContact CD1-CD1 3.62Å; V1261-I1267 HydrophobicContact CG1-CD1 4.4Å; V1261-I1267 HydrophobicContact CG1-CG2 3.97Å; Q1265-I1267 HydrophobicContact CG-CG2 4.09Å; I1267-V1269 HydrophobicContact CD1-CG1 3.99Å; I1267-V1269 HydrophobicContact CG1-CG1 3.97Å
1268	H	92.9	Very high	90.7	Very high	118 Å²	118	73.7 Å²	73.7	55%	0.546	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	135.7	170.2	-68.1	71.3	0	0	0	109	S1285 L1290	H1268-S1285 PolarHBondContact O-OG 2.86Å; H1268-L1290 HydrophobicContact CB-CD1 4.37Å; H1268-L1290 HydrophobicContact CB-CD2 4.05Å
1269	V	93	Very high	91	Very high	0 Å²	0	69.5 Å²	69.5	0%	0	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	143.3	177.9	-52	0	0	0	0	110.4	V1169 A1171 L1236 I1244 I1267 C1283 S1284	V1169-V1269 HydrophobicContact CG2-CG2 3.76Å; V1169-V1269 PolarHBondContact N-O 3.13Å; V1169-V1269 PolarHBondContact O-N 2.83Å; A1171-V1269 HydrophobicContact CB-CG1 4.14Å; A1171-V1269 HydrophobicContact CB-CG2 3.88Å; L1236-V1269 HydrophobicContact CD2-CG2 4.42Å; I1244-V1269 HydrophobicContact CD1-CG1 3.75Å; I1267-V1269 HydrophobicContact CD1-CG1 3.99Å; I1267-V1269 HydrophobicContact CG1-CG1 3.97Å; V1269-C1283 HydrophobicContact CB-CB 3.88Å; V1269-C1283 HydrophobicContact CG2-CB 3.89Å; V1269-S1284 CarbonylContact C-O 3.41Å; V1269-S1284 WeakPolarHBondContact CA-O 3.12Å
1270	R	92	Very high	91.4	Very high	3 Å²	3	64.2 Å²	64.2	1%	0.011	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	134.2	166.9	-163.6	174.7	-67	-78.8	-0.5	109.7	E635 G1166 K1167 C1283 S1284 D1289 L1290	E635-R1270 IonicContact OE1-CZ 2.73Å; E635-R1270 IonicContact OE1-NH1 3.23Å; E635-R1270 PolarHBondContact OE1-NH1 3.36Å; E635-R1270 IonicContact OE1-NH2 3.46Å; E635-R1270 PolarHBondContact OE1-NH2 3.22Å; E635-R1270 IonicContact OE2-NH2 2.63Å; G1166-R1270 VanDerWaalsContact O-CD 3.3Å; G1166-R1270 WeakPolarHBondContact O-CD 3.38Å; G1166-R1270 WeakPolarHBondContact O-CG 3.49Å; G1166-R1270 PolarHBondContact O-NH1 2.83Å; K1167-R1270 WeakPolarHBondContact O-CA 3.43Å; R1270-C1283 CarbonylContact O-C 3.34Å; R1270-C1283 VanDerWaalsContact O-CA 3.28Å; R1270-C1283 WeakPolarHBondContact O-CA 3.35Å; R1270-S1284 PolarHBondContact N-O 2.79Å; R1270-S1284 PolarHBondContact O-N 2.77Å; R1270-D1289 WeakPolarHBondContact CD-O 3.06Å; R1270-D1289 PolarHBondContact NE-O 3.23Å; R1270-L1290 HydrophobicContact CB-CD2 4.45Å; R1270-L1290 PolarHBondContact NH2-O 3.03Å
1271	I	92.2	Very high	91.8	Very high	0 Å²	0	59.8 Å²	59.8	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	127.1	176.4	-62	174.5	0	0	0	109	F1163 V1165 G1166 K1167 V1169 I1274 V1281	F1163-I1271 HydrophobicContact CD2-CD1 4.17Å; F1163-I1271 HydrophobicContact CE1-CD1 4.13Å; F1163-I1271 HydrophobicContact CE2-CD1 3.55Å; F1163-I1271 HydrophobicContact CZ-CD1 3.51Å; V1165-I1271 HydrophobicContact CG2-CG2 4.48Å; G1166-I1271 VanDerWaalsContact CA-O 3.31Å; G1166-I1271 WeakPolarHBondContact CA-O 3.43Å; G1166-I1271 PolarHBondContact N-O 3.16Å; K1167-I1271 HydrophobicContact CB-CD1 4.46Å; K1167-I1271 PolarHBondContact O-N 2.94Å; V1169-I1271 HydrophobicContact CG1-CD1 4.42Å; V1169-I1271 HydrophobicContact CG2-CD1 4.1Å; V1169-I1271 HydrophobicContact CG2-CG1 3.92Å; I1271-I1274 HydrophobicContact CG2-CD1 4.41Å; I1271-I1274 HydrophobicContact CG2-CG1 3.82Å; I1271-V1281 HydrophobicContact CB-CG1 4.39Å; I1271-V1281 HydrophobicContact CD1-CG1 4.5Å; I1271-V1281 HydrophobicContact CG1-CG1 4.1Å; I1271-V1281 HydrophobicContact CG2-CG1 3.68Å
1272	I	92.3	Very high	92	Very high	56 Å²	56	63.9 Å²	63.9	29%	0.287	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	-34.3	176.5	-70.4	178.4	0	0	0	111.6	V1165 E1282 W1297	V1165-I1272 WeakPolarHBondContact CG1-O 3.42Å; I1272-E1282 PolarHBondContact N-O 3.42Å; I1272-W1297 HydrophobicContact CG1-CZ2 4.23Å
1273	K	92.9	Very high	92.1	Very high	79 Å²	79	55 Å²	55	34%	0.343	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.9	138.6	177.4	165.9	176.9	162.9	-109.7	0	110	D1275 V1281 E1282	K1273-D1275 IonicContact NZ-OD2 2.86Å; K1273-D1275 PolarHBondContact NZ-OD2 3.13Å; K1273-V1281 WeakPolarHBondContact O-CG1 3.47Å; K1273-E1282 HydrophobicContact CB-CB 4.24Å; K1273-E1282 WeakPolarHBondContact CD-OE1 3.42Å; K1273-E1282 PolarHBondContact N-O 3.29Å; K1273-E1282 IonicContact NZ-OE1 2.67Å; K1273-E1282 PolarHBondContact NZ-OE1 2.69Å; K1273-E1282 PolarHBondContact O-N 3.42Å
1274	I	91.8	Very high	92.2	Very high	32 Å²	32	51.4 Å²	51.4	16%	0.164	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	134.6	167.9	-58.2	167.5	0	0	0	107	F1152 F1163 V1165 I1271 I1276 V1281	F1152-I1274 HydrophobicContact CE2-CG2 4.16Å; F1152-I1274 HydrophobicContact CZ-CG2 3.86Å; F1163-I1274 HydrophobicContact CD1-CD1 3.65Å; F1163-I1274 HydrophobicContact CD1-CG1 4.39Å; F1163-I1274 HydrophobicContact CE1-CD1 3.69Å; F1163-I1274 HydrophobicContact CE1-CG1 3.92Å; F1163-I1274 HydrophobicContact CE1-CG2 4.43Å; F1163-I1274 WeakPolarHBondContact O-CD1 3.44Å; V1165-I1274 HydrophobicContact CG2-CB 4.44Å; V1165-I1274 HydrophobicContact CG2-CD1 4.09Å; V1165-I1274 HydrophobicContact CG2-CG1 3.96Å; I1271-I1274 HydrophobicContact CG2-CD1 4.41Å; I1271-I1274 HydrophobicContact CG2-CG1 3.82Å; I1274-I1276 HydrophobicContact CG2-CG1 4.06Å; I1274-V1281 HydrophobicContact CG1-CG1 4.48Å
1275	D	92.4	Very high	92.3	Very high	33 Å²	33	47.2 Å²	47.2	18%	0.176	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	88.9	177.8	-159.8	-60.6	0	0	0	107.3	K1273 R1278 F1279 S1280	K1273-D1275 IonicContact NZ-OD2 2.86Å; K1273-D1275 PolarHBondContact NZ-OD2 3.13Å; D1275-R1278 HydrophobicContact CB-CB 4.43Å; D1275-R1278 PolarHBondContact O-N 3.08Å; D1275-R1278 WeakPolarHBondContact OD1-CB 3.43Å; D1275-R1278 WeakPolarHBondContact OD1-CD 3.17Å; D1275-R1278 WeakPolarHBondContact OD1-CG 3.48Å; D1275-R1278 IonicContact OD1-NE 2.72Å; D1275-F1279 PolarHBondContact O-N 2.9Å; D1275-S1280 WeakPolarHBondContact CB-O 2.85Å; D1275-S1280 PolarHBondContact N-O 3.49Å; D1275-S1280 PolarHBondContact O-N 3.48Å
1276	I	90.7	Very high	92.2	Very high	50 Å²	50	46.9 Å²	46.9	26%	0.256	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-53.8	-165.8	-57.5	-178.4	0	0	0	110.2	A1148 E1149 F1152 I1274 R1278 F1279	A1148-I1276 HydrophobicContact CB-CG2 4.44Å; A1148-I1276 VanDerWaalsContact O-CG2 3.29Å; A1148-I1276 WeakPolarHBondContact O-CG2 3.35Å; E1149-I1276 HydrophobicContact CG-CD1 4.08Å; F1152-I1276 HydrophobicContact CB-CG2 3.67Å; F1152-I1276 HydrophobicContact CD2-CG2 4.06Å; F1152-I1276 HydrophobicContact CG-CG2 4.02Å; I1274-I1276 HydrophobicContact CG2-CG1 4.06Å; I1276-R1278 PolarHBondContact O-N 3.42Å; I1276-F1279 WeakPolarHBondContact O-CD2 3.35Å; I1276-F1279 PolarHBondContact O-N 3.25Å
1277	D	88.4	Confident	92	Very high	135 Å²	135	45 Å²	45	72%	0.722	22%	0.215	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53	-33	178.1	-61.3	-41.5	0	0	0	113.5
1278	R	88.9	Confident	91.8	Very high	175 Å²	175	46.1 Å²	46.1	66%	0.66	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	-92.5	-13.5	-178.1	-66	-179.9	-174.5	-116.5	-9.7	113.5	R859 D1275 I1276 S1280	R859-R1278 PolarHBondContact NH2-O 2.81Å; D1275-R1278 HydrophobicContact CB-CB 4.43Å; D1275-R1278 PolarHBondContact O-N 3.08Å; D1275-R1278 WeakPolarHBondContact OD1-CB 3.43Å; D1275-R1278 WeakPolarHBondContact OD1-CD 3.17Å; D1275-R1278 WeakPolarHBondContact OD1-CG 3.48Å; D1275-R1278 IonicContact OD1-NE 2.72Å; I1276-R1278 PolarHBondContact O-N 3.42Å; R1278-S1280 WeakPolarHBondContact CB-OG 3.46Å
1279	F	91.1	Very high	91.5	Very high	7 Å²	7	41.3 Å²	41.3	3%	0.031	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	49.3	61.9	-166.7	-71.6	-113.9	0	0	0	109.5	R859 Q862 F1152 L1155 T1156 L1240 P1241 D1275 I1276	R859-F1279 VanDerWaalsContact NH1-CB 3.32Å; R859-F1279 PolarHBondContact NH1-O 3.41Å; R859-F1279 VanDerWaalsContact NH1-O 3.1Å; Q862-F1279 VanDerWaalsContact NE2-CZ 3.28Å; F1152-F1279 HydrophobicContact CB-CE1 4.19Å; F1152-F1279 HydrophobicContact CB-CZ 4.09Å; F1152-F1279 AromaticContact CD2-CD1 3.74Å; F1152-F1279 HydrophobicContact CD2-CD1 3.74Å; F1152-F1279 HydrophobicContact CD2-CD2 4.45Å; F1152-F1279 AromaticContact CD2-CE1 3.83Å; F1152-F1279 HydrophobicContact CD2-CE1 3.83Å; F1152-F1279 HydrophobicContact CD2-CE2 4.5Å; F1152-F1279 HydrophobicContact CD2-CG 4.06Å; F1152-F1279 HydrophobicContact CD2-CZ 4.21Å; F1152-F1279 HydrophobicContact CE2-CD1 4.18Å; F1152-F1279 HydrophobicContact CE2-CG 4.44Å; F1152-F1279 HydrophobicContact CG-CE1 4.26Å; L1155-F1279 HydrophobicContact CB-CE1 4Å; L1155-F1279 HydrophobicContact CD1-CE1 4.33Å; L1155-F1279 HydrophobicContact CD1-CZ 4.14Å; T1156-F1279 HydrophobicContact CG2-CD1 4.1Å; T1156-F1279 HydrophobicContact CG2-CE1 4.26Å; L1240-F1279 HydrophobicContact CD2-CB 4.02Å; L1240-F1279 HydrophobicContact CD2-CD1 4.4Å; P1241-F1279 VanDerWaalsContact CD-O 3.25Å; P1241-F1279 WeakPolarHBondContact CD-O 3.4Å; P1241-F1279 VanDerWaalsContact CG-O 3.3Å; P1241-F1279 WeakPolarHBondContact CG-O 3.17Å; D1275-F1279 PolarHBondContact O-N 2.9Å; I1276-F1279 WeakPolarHBondContact O-CD2 3.35Å; I1276-F1279 PolarHBondContact O-N 3.25Å
1280	S	92.3	Very high	91.2	Very high	31 Å²	31	43 Å²	43	22%	0.217	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.2	161	-178.2	66.8	0	0	0	0	112.4	P1241 D1275 R1278	P1241-S1280 WeakPolarHBondContact O-CA 3.31Å; D1275-S1280 WeakPolarHBondContact CB-O 2.85Å; D1275-S1280 PolarHBondContact N-O 3.49Å; D1275-S1280 PolarHBondContact O-N 3.48Å; R1278-S1280 WeakPolarHBondContact CB-OG 3.46Å
1281	V	93.6	Very high	90.8	Very high	4 Å²	4	49.3 Å²	49.3	2%	0.024	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	138.9	-166.6	-166.1	0	0	0	0	111.4	F1163 L1236 L1240 P1241 G1242 F1243 I1271 K1273 I1274	F1163-V1281 HydrophobicContact CE1-CG2 4.21Å; F1163-V1281 HydrophobicContact CZ-CG2 3.99Å; L1236-V1281 HydrophobicContact CD1-CB 3.93Å; L1236-V1281 HydrophobicContact CD1-CG1 4.31Å; L1236-V1281 HydrophobicContact CD1-CG2 3.61Å; L1240-V1281 HydrophobicContact CB-CG2 4.26Å; L1240-V1281 HydrophobicContact CD1-CG2 4.19Å; P1241-V1281 PolarHBondContact O-N 2.95Å; G1242-V1281 CarbonylContact C-O 3.59Å; G1242-V1281 VanDerWaalsContact CA-O 3.25Å; G1242-V1281 WeakPolarHBondContact CA-O 3.01Å; F1243-V1281 PolarHBondContact N-O 2.79Å; I1271-V1281 HydrophobicContact CB-CG1 4.39Å; I1271-V1281 HydrophobicContact CD1-CG1 4.5Å; I1271-V1281 HydrophobicContact CG1-CG1 4.1Å; I1271-V1281 HydrophobicContact CG2-CG1 3.68Å; K1273-V1281 WeakPolarHBondContact O-CG1 3.47Å; I1274-V1281 HydrophobicContact CG1-CG1 4.48Å
1282	E	94.7	Very high	90.3	Very high	87 Å²	87	49.4 Å²	49.4	41%	0.407	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	126.5	170.8	-63.8	178.1	-129.3	0	0	109.7	F1243 I1272 K1273	F1243-E1282 WeakPolarHBondContact O-CA 3.13Å; I1272-E1282 PolarHBondContact N-O 3.42Å; K1273-E1282 HydrophobicContact CB-CB 4.24Å; K1273-E1282 WeakPolarHBondContact CD-OE1 3.42Å; K1273-E1282 PolarHBondContact N-O 3.29Å; K1273-E1282 IonicContact NZ-OE1 2.67Å; K1273-E1282 PolarHBondContact NZ-OE1 2.69Å; K1273-E1282 PolarHBondContact O-N 3.42Å
1283	C	94	Very high	89.5	Confident	1 Å²	1	51.2 Å²	51.2	1%	0.007	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	167.8	-171.3	-45.7	0	0	0	0	112.9	F1243 I1244 V1269 R1270	F1243-C1283 PolarHBondContact O-N 2.78Å; I1244-C1283 HydrophobicContact CG1-CB 4.21Å; V1269-C1283 HydrophobicContact CB-CB 3.88Å; V1269-C1283 HydrophobicContact CG2-CB 3.89Å; R1270-C1283 CarbonylContact O-C 3.34Å; R1270-C1283 VanDerWaalsContact O-CA 3.28Å; R1270-C1283 WeakPolarHBondContact O-CA 3.35Å
1284	S	93.7	Very high	88.7	Confident	0 Å²	0	52.9 Å²	52.9	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	144.6	171.6	-177.9	0	0	0	0	112.3	N1248 V1269 R1270 R1286 D1289	N1248-S1284 PolarHBondContact O-OG 2.94Å; N1248-S1284 VanDerWaalsContact O-OG 3.08Å; V1269-S1284 CarbonylContact C-O 3.41Å; V1269-S1284 WeakPolarHBondContact CA-O 3.12Å; R1270-S1284 PolarHBondContact N-O 2.79Å; R1270-S1284 PolarHBondContact O-N 2.77Å; S1284-R1286 PolarHBondContact OG-N 3.47Å; S1284-D1289 WeakPolarHBondContact CB-OD2 3.46Å; S1284-D1289 PolarHBondContact OG-OD2 2.71Å
1285	S	93.3	Very high	87.8	Confident	2 Å²	2	57 Å²	57	1%	0.014	29%	0.289	C	S	.	.			trans	-118.5	17.3	172.2	-175.7	0	0	0	0	111.8	N1248 H1268	N1248-S1285 PolarHBondContact O-N 3.07Å; H1268-S1285 PolarHBondContact O-OG 2.86Å
1286	R	91	Very high	87	Confident	65 Å²	65	60.6 Å²	60.6	25%	0.245	31%	0.305	C	S	.	.			trans	-56.8	142.5	167.5	-72.7	-153.7	-161.6	103	1.6	110.8	K1247 N1248 D1251 S1284 A1288 D1289 L1290	K1247-R1286 VanDerWaalsContact O-CZ 3.3Å; K1247-R1286 PolarHBondContact O-NE 3.21Å; K1247-R1286 PolarHBondContact O-NH2 3.21Å; N1248-R1286 PolarHBondContact O-N 3.27Å; N1248-R1286 PolarHBondContact OD1-NH2 3.43Å; D1251-R1286 WeakPolarHBondContact OD1-CA 3.09Å; D1251-R1286 VanDerWaalsContact OD1-CB 3.23Å; D1251-R1286 WeakPolarHBondContact OD1-CB 3.34Å; S1284-R1286 PolarHBondContact OG-N 3.47Å; R1286-A1288 VanDerWaalsContact C-N 3.29Å; R1286-D1289 HydrophobicContact CB-CB 3.91Å; R1286-D1289 VanDerWaalsContact CB-CG 3.48Å; R1286-D1289 WeakPolarHBondContact CD-OD1 3.48Å; R1286-D1289 IonicContact CZ-OD2 3.42Å; R1286-D1289 IonicContact NH1-OD1 2.98Å; R1286-D1289 PolarHBondContact NH1-OD1 3.26Å; R1286-D1289 IonicContact NH1-OD2 2.66Å; R1286-D1289 PolarHBondContact NH1-OD2 3.42Å; R1286-D1289 PolarHBondContact O-N 3Å; R1286-L1290 WeakPolarHBondContact O-CB 3.34Å; R1286-L1290 WeakPolarHBondContact O-CG 3.41Å; R1286-L1290 PolarHBondContact O-N 2.83Å
1287	T	88.9	Confident	86.3	Confident	58 Å²	58	60.6 Å²	60.6	36%	0.356	30%	0.302	S	S	.	.	H	α-helix	trans	-74.3	-25.4	175.9	-49.2	0	0	0	0	111	D1251 K1291	D1251-T1287 PolarHBondContact OD1-N 2.98Å; D1251-T1287 WeakPolarHBondContact OD2-CB 3.46Å; T1287-K1291 HydrophobicContact CG2-CD 4.25Å; T1287-K1291 WeakPolarHBondContact O-CB 3.13Å; T1287-K1291 VanDerWaalsContact O-CG 3.3Å; T1287-K1291 WeakPolarHBondContact O-CG 3.06Å; T1287-K1291 PolarHBondContact O-N 3.05Å
1288	A	86.9	Confident	85.6	Confident	33 Å²	33	57 Å²	57	27%	0.273	28%	0.278	S	S	.	.	H	α-helix	trans	-64.8	-53.4	167.8	0	0	0	0	0	111.9	D1251 R1286 K1291 D1292 V1293	D1251-A1288 PolarHBondContact OD1-N 3.25Å; D1251-A1288 PolarHBondContact OD2-N 2.86Å; R1286-A1288 VanDerWaalsContact C-N 3.29Å; A1288-K1291 PolarHBondContact O-N 3.5Å; A1288-D1292 PolarHBondContact O-N 3.32Å; A1288-V1293 HydrophobicContact CB-CG2 4.44Å; A1288-V1293 PolarHBondContact O-N 3.12Å; A1288-V1293 VanDerWaalsContact O-N 3.16Å
1289	D	88.1	Confident	84.9	Confident	17 Å²	17	51.1 Å²	51.1	9%	0.091	26%	0.263	C	S	.	.	H	α-helix	trans	-68.3	-40.6	-177.1	-48.9	1.6	0	0	0	111.3	R1270 S1284 R1286 K1291 D1292 W1297	R1270-D1289 WeakPolarHBondContact CD-O 3.06Å; R1270-D1289 PolarHBondContact NE-O 3.23Å; S1284-D1289 WeakPolarHBondContact CB-OD2 3.46Å; S1284-D1289 PolarHBondContact OG-OD2 2.71Å; R1286-D1289 HydrophobicContact CB-CB 3.91Å; R1286-D1289 VanDerWaalsContact CB-CG 3.48Å; R1286-D1289 WeakPolarHBondContact CD-OD1 3.48Å; R1286-D1289 IonicContact CZ-OD2 3.42Å; R1286-D1289 IonicContact NH1-OD1 2.98Å; R1286-D1289 PolarHBondContact NH1-OD1 3.26Å; R1286-D1289 IonicContact NH1-OD2 2.66Å; R1286-D1289 PolarHBondContact NH1-OD2 3.42Å; R1286-D1289 PolarHBondContact O-N 3Å; D1289-K1291 VanDerWaalsContact C-N 3.32Å; D1289-K1291 PolarHBondContact O-N 2.97Å; D1289-D1292 PolarHBondContact O-N 2.89Å; D1289-W1297 HydrophobicContact CB-CH2 4.07Å; D1289-W1297 HydrophobicContact CB-CZ3 4.03Å
1290	L	86.3	Confident	84.4	Confident	36 Å²	36	58 Å²	58	19%	0.188	29%	0.288	C	S	.	.	H	α-helix	trans	-62.9	-34.8	176	-75.4	171.5	0	0	0	112.9	H1268 R1270 R1286 D1292	H1268-L1290 HydrophobicContact CB-CD1 4.37Å; H1268-L1290 HydrophobicContact CB-CD2 4.05Å; R1270-L1290 HydrophobicContact CB-CD2 4.45Å; R1270-L1290 PolarHBondContact NH2-O 3.03Å; R1286-L1290 WeakPolarHBondContact O-CB 3.34Å; R1286-L1290 WeakPolarHBondContact O-CG 3.41Å; R1286-L1290 PolarHBondContact O-N 2.83Å; L1290-D1292 VanDerWaalsContact C-N 3.3Å
1291	K	82.5	Confident	84.1	Confident	134 Å²	134	59.4 Å²	59.4	58%	0.583	29%	0.289	S	S	*	.	H	α-helix	trans	-80.1	-14.4	173.4	-72.2	179.6	177.5	-173.8	0	113.3	T1287 A1288 D1289 V1293 R1298	T1287-K1291 HydrophobicContact CG2-CD 4.25Å; T1287-K1291 WeakPolarHBondContact O-CB 3.13Å; T1287-K1291 VanDerWaalsContact O-CG 3.3Å; T1287-K1291 WeakPolarHBondContact O-CG 3.06Å; T1287-K1291 PolarHBondContact O-N 3.05Å; A1288-K1291 PolarHBondContact O-N 3.5Å; D1289-K1291 VanDerWaalsContact C-N 3.32Å; D1289-K1291 PolarHBondContact O-N 2.97Å; K1291-V1293 HydrophobicContact CB-CG2 3.98Å; K1291-R1298 PolarHBondContact O-NE 3.29Å; K1291-R1298 PolarHBondContact O-NH2 3.08Å
1292	D	81.7	Confident	83.8	Confident	2 Å²	2	60.6 Å²	60.6	1%	0.011	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	49.3	60.9	-165	-169.3	11.8	0	0	0	112.4	A1288 D1289 L1290 N1294 N1295 E1296 W1297 R1298	A1288-D1292 PolarHBondContact O-N 3.32Å; D1289-D1292 PolarHBondContact O-N 2.89Å; L1290-D1292 VanDerWaalsContact C-N 3.3Å; D1292-N1294 PolarHBondContact O-N 2.97Å; D1292-N1294 VanDerWaalsContact O-N 3.15Å; D1292-N1295 PolarHBondContact O-N 3.42Å; D1292-N1295 WeakPolarHBondContact OD1-CA 3.48Å; D1292-N1295 PolarHBondContact OD1-N 3.45Å; D1292-N1295 WeakPolarHBondContact OD2-CA 3.48Å; D1292-E1296 PolarHBondContact OD1-N 2.84Å; D1292-E1296 PolarHBondContact OD2-N 3.36Å; D1292-E1296 VanDerWaalsContact OD2-N 3.13Å; D1292-W1297 HydrophobicContact CB-CE3 4.09Å; D1292-W1297 WeakPolarHBondContact OD2-CA 3.18Å; D1292-W1297 PolarHBondContact OD2-N 2.88Å; D1292-R1298 HydrophobicContact CB-CG 4.06Å; D1292-R1298 WeakPolarHBondContact OD2-CG 3.37Å; D1292-R1298 PolarHBondContact OD2-N 2.99Å
1293	V	76.7	Confident	83.5	Confident	95 Å²	95	63.8 Å²	63.8	58%	0.576	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-20.8	-179.7	176.1	0	0	0	0	112.7	A1288 K1291	A1288-V1293 HydrophobicContact CB-CG2 4.44Å; A1288-V1293 PolarHBondContact O-N 3.12Å; A1288-V1293 VanDerWaalsContact O-N 3.16Å; K1291-V1293 HydrophobicContact CB-CG2 3.98Å
1294	N	76	Confident	83.4	Confident	113 Å²	113	67.7 Å²	67.7	60%	0.604	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.7	-9	-178.8	-65.4	-4.7	0	0	0	113.5	D1292 E1296	D1292-N1294 PolarHBondContact O-N 2.97Å; D1292-N1294 VanDerWaalsContact O-N 3.15Å; N1294-E1296 VanDerWaalsContact C-N 3.33Å; N1294-E1296 HydrophobicContact CB-CG 3.8Å; N1294-E1296 VanDerWaalsContact CB-OE1 3.28Å; N1294-E1296 WeakPolarHBondContact CB-OE1 3.49Å; N1294-E1296 PolarHBondContact ND2-OE1 3.36Å
1295	N	72.6	Confident	83.2	Confident	119 Å²	119	68.3 Å²	68.3	64%	0.636	33%	0.333	S	S	*	.			trans	53.5	45.6	-167.8	-60.8	-56.4	0	0	0	112.9	D1292	D1292-N1295 PolarHBondContact O-N 3.42Å; D1292-N1295 WeakPolarHBondContact OD1-CA 3.48Å; D1292-N1295 PolarHBondContact OD1-N 3.45Å; D1292-N1295 WeakPolarHBondContact OD2-CA 3.48Å
1296	E	76.1	Confident	83.2	Confident	108 Å²	108	69.9 Å²	69.9	51%	0.505	34%	0.341	S	S	.	.	S	Bend	trans	-83.8	-27.2	177.8	-78	178.6	-131.6	0	0	113.4	D1292 N1294	D1292-E1296 PolarHBondContact OD1-N 2.84Å; D1292-E1296 PolarHBondContact OD2-N 3.36Å; D1292-E1296 VanDerWaalsContact OD2-N 3.13Å; N1294-E1296 VanDerWaalsContact C-N 3.33Å; N1294-E1296 HydrophobicContact CB-CG 3.8Å; N1294-E1296 VanDerWaalsContact CB-OE1 3.28Å; N1294-E1296 WeakPolarHBondContact CB-OE1 3.49Å; N1294-E1296 PolarHBondContact ND2-OE1 3.36Å
1297	W	75.6	Confident	83.1	Confident	50 Å²	50	73 Å²	73	19%	0.189	35%	0.353	C	S	.	.	S	Bend	trans	-125.7	-26.4	-169	-59.9	-68.8	0	0	0	115	I1272 D1289 D1292	I1272-W1297 HydrophobicContact CG1-CZ2 4.23Å; D1289-W1297 HydrophobicContact CB-CH2 4.07Å; D1289-W1297 HydrophobicContact CB-CZ3 4.03Å; D1292-W1297 HydrophobicContact CB-CE3 4.09Å; D1292-W1297 WeakPolarHBondContact OD2-CA 3.18Å; D1292-W1297 PolarHBondContact OD2-N 2.88Å
1298	R	73.8	Confident	83.2	Confident	60 Å²	60	74.7 Å²	74.7	23%	0.226	36%	0.364	C	S	.	.	S	Bend	trans	-54.2	139	179.5	-77.7	-179.9	-177.6	-59.4	-25.3	111.5	E635 Y640 K1291 D1292 R1300	E635-R1298 IonicContact OE2-CZ 3.45Å; E635-R1298 IonicContact OE2-NH1 2.67Å; E635-R1298 PolarHBondContact OE2-NH1 2.97Å; E635-R1298 IonicContact OE2-NH2 2.79Å; E635-R1298 PolarHBondContact OE2-NH2 3.01Å; Y640-R1298 PolarHBondContact OH-NH1 2.93Å; Y640-R1298 VanDerWaalsContact OH-NH1 3.08Å; K1291-R1298 PolarHBondContact O-NE 3.29Å; K1291-R1298 PolarHBondContact O-NH2 3.08Å; D1292-R1298 HydrophobicContact CB-CG 4.06Å; D1292-R1298 WeakPolarHBondContact OD2-CG 3.37Å; D1292-R1298 PolarHBondContact OD2-N 2.99Å; R1298-R1300 PolarHBondContact O-N 3.29Å
1299	P	73.7	Confident	83.3	Confident	51 Å²	51	73.7 Å²	73.7	33%	0.331	35%	0.354	S	S	.	.	P	Polyproline II helix	trans	-50.5	135.4	169.9	-27.2	34.8	0	0	0	110.8	Y640 R1301	Y640-P1299 HydrophobicContact CD1-CB 4.45Å; Y640-P1299 HydrophobicContact CD1-CG 4.42Å; P1299-R1301 PolarHBondContact O-N 3.41Å
1300	R	81.1	Confident	83.4	Confident	152 Å²	152	74.6 Å²	74.6	57%	0.574	36%	0.358	S	S	*	.	P	Polyproline II helix	trans	-63.5	124.2	177.6	-73.7	-179.8	168.1	-113.5	-12.9	108.9	S641 R1298	S641-R1300 WeakPolarHBondContact CB-O 3.38Å; R1298-R1300 PolarHBondContact O-N 3.29Å
1301	R	85.3	Confident	83.5	Confident	61 Å²	61	78.9 Å²	78.9	23%	0.23	38%	0.377	C	S	.	.	P	Polyproline II helix	trans	-58.1	148.5	168.7	-70.6	175.7	172.3	-156.7	-11.6	109.9	P1299 Y1305 E1310	P1299-R1301 PolarHBondContact O-N 3.41Å; R1301-Y1305 HydrophobicContact CB-CD2 3.69Å; R1301-Y1305 HydrophobicContact CB-CE2 4.23Å; R1301-Y1305 HydrophobicContact CB-CG 3.89Å; R1301-Y1305 HydrophobicContact CG-CD2 3.79Å; R1301-Y1305 HydrophobicContact CG-CE2 3.8Å; R1301-Y1305 HydrophobicContact CG-CG 4.13Å; R1301-Y1305 PolarHBondContact NH2-OH 3.44Å; R1301-E1310 IonicContact CZ-OE1 2.99Å; R1301-E1310 IonicContact CZ-OE2 3.32Å; R1301-E1310 VanDerWaalsContact CZ-OE2 3.29Å; R1301-E1310 IonicContact NH1-OE1 2.88Å; R1301-E1310 IonicContact NH1-OE2 2.64Å; R1301-E1310 PolarHBondContact NH1-OE2 3.27Å; R1301-E1310 VanDerWaalsContact NH2-CD 3.29Å; R1301-E1310 IonicContact NH2-OE1 3.18Å; R1301-E1310 PolarHBondContact NH2-OE1 2.67Å; R1301-E1310 IonicContact NH2-OE2 3.14Å; R1301-E1310 PolarHBondContact NH2-OE2 3.39Å; R1301-E1310 VanDerWaalsContact NH2-OE2 3.07Å
1302	D	88.2	Confident	83.9	Confident	28 Å²	28	76.3 Å²	76.3	15%	0.15	37%	0.367	C	S	.	.	P	Polyproline II helix	trans	-56.1	153.4	175.6	-169	-71.9	0	0	0	111	S641 M642 V645 K648 Y1304 Y1305	S641-D1302 WeakPolarHBondContact O-CB 3.5Å; S641-D1302 PolarHBondContact O-N 3.28Å; M642-D1302 HydrophobicContact CG-CB 4.41Å; V645-D1302 HydrophobicContact CG2-CB 4.03Å; K648-D1302 IonicContact NZ-OD2 3.2Å; K648-D1302 PolarHBondContact NZ-OD2 2.79Å; D1302-Y1304 PolarHBondContact O-N 2.84Å; D1302-Y1304 WeakPolarHBondContact OD1-CD2 3.4Å; D1302-Y1304 PolarHBondContact OD1-N 3.3Å; D1302-Y1305 WeakPolarHBondContact O-CB 3.49Å; D1302-Y1305 PolarHBondContact O-N 2.97Å
1303	N	88.5	Confident	84.2	Confident	154 Å²	154	77.6 Å²	77.6	82%	0.824	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.4	-25.9	178.3	-65.1	-37.1	0	0	0	112.4
1304	Y	91	Very high	84.6	Confident	84 Å²	84	77.2 Å²	77.2	33%	0.329	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.9	23.1	-177.8	-60.6	-82.5	0	0	0	113.3	V645 A646 K648 P649 D652 D1302	V645-Y1304 WeakPolarHBondContact CA-O 3.49Å; A646-Y1304 PolarHBondContact N-O 3.08Å; K648-Y1304 HydrophobicContact CB-CD2 3.86Å; K648-Y1304 HydrophobicContact CB-CG 3.83Å; K648-Y1304 HydrophobicContact CD-CD2 4.18Å; K648-Y1304 HydrophobicContact CG-CD2 3.72Å; K648-Y1304 HydrophobicContact CG-CE2 4.28Å; K648-Y1304 HydrophobicContact CG-CG 4.23Å; P649-Y1304 HydrophobicContact CG-CE1 4.37Å; D652-Y1304 HydrophobicContact CB-CE2 4.28Å; D652-Y1304 VanDerWaalsContact OD2-CE2 3.3Å; D652-Y1304 WeakPolarHBondContact OD2-CE2 3.43Å; D652-Y1304 PolarHBondContact OD2-OH 3.04Å; D1302-Y1304 PolarHBondContact O-N 2.84Å; D1302-Y1304 WeakPolarHBondContact OD1-CD2 3.4Å; D1302-Y1304 PolarHBondContact OD1-N 3.3Å
1305	Y	90.8	Very high	85.2	Confident	13 Å²	13	77.5 Å²	77.5	5%	0.051	36%	0.361	C	S	.	.	B	Isolated β-bridge	trans	-70.4	129	-175.8	-160.7	-82.5	0	0	0	113.3	S641 K643 Y644 R1301 D1302 Y1307 E1310	S641-Y1305 VanDerWaalsContact O-CD2 3.27Å; S641-Y1305 WeakPolarHBondContact O-CD2 3.47Å; K643-Y1305 HydrophobicContact CB-CE2 4.5Å; Y644-Y1305 HydrophobicContact CD2-CE1 4.3Å; Y644-Y1305 CarbonylContact O-C 3.39Å; Y644-Y1305 WeakPolarHBondContact O-CA 3.47Å; Y644-Y1305 VanDerWaalsContact O-CD2 3.3Å; Y644-Y1305 WeakPolarHBondContact O-CD2 3.42Å; Y644-Y1305 VanDerWaalsContact O-CG 3.27Å; R1301-Y1305 HydrophobicContact CB-CD2 3.69Å; R1301-Y1305 HydrophobicContact CB-CE2 4.23Å; R1301-Y1305 HydrophobicContact CB-CG 3.89Å; R1301-Y1305 HydrophobicContact CG-CD2 3.79Å; R1301-Y1305 HydrophobicContact CG-CE2 3.8Å; R1301-Y1305 HydrophobicContact CG-CG 4.13Å; R1301-Y1305 PolarHBondContact NH2-OH 3.44Å; D1302-Y1305 WeakPolarHBondContact O-CB 3.49Å; D1302-Y1305 PolarHBondContact O-N 2.97Å; Y1305-Y1307 HydrophobicContact CD1-CD1 4.26Å; Y1305-Y1307 HydrophobicContact CD1-CD2 4.15Å; Y1305-Y1307 HydrophobicContact CD1-CE1 4.22Å; Y1305-Y1307 HydrophobicContact CD1-CE2 4.08Å; Y1305-Y1307 HydrophobicContact CD1-CG 4.22Å; Y1305-Y1307 HydrophobicContact CG-CE2 4.41Å; Y1305-Y1307 WeakPolarHBondContact O-CD2 3.17Å; Y1305-Y1307 WeakPolarHBondContact O-CE2 3.43Å; Y1305-Y1307 PolarHBondContact O-N 2.99Å; Y1305-E1310 PolarHBondContact OH-OE1 2.96Å
1306	D	91.5	Very high	85.9	Confident	34 Å²	34	77.9 Å²	77.9	18%	0.182	36%	0.357	C	S	.	.			trans	-92.5	84.8	-179.3	-172.7	-1.7	0	0	0	112.7	Y644 A646 V1308 T1309 E1310	Y644-D1306 PolarHBondContact O-N 3.35Å; A646-D1306 HydrophobicContact CB-CB 3.89Å; D1306-V1308 PolarHBondContact O-N 2.92Å; D1306-V1308 WeakPolarHBondContact OD1-CA 3.37Å; D1306-V1308 WeakPolarHBondContact OD1-CB 3.3Å; D1306-V1308 PolarHBondContact OD1-N 3.45Å; D1306-T1309 PolarHBondContact OD1-N 3.18Å; D1306-T1309 WeakPolarHBondContact OD2-CB 3.27Å; D1306-T1309 PolarHBondContact OD2-OG1 3.27Å; D1306-E1310 PolarHBondContact O-N 2.85Å; D1306-E1310 VanDerWaalsContact O-N 3.14Å
1307	Y	90.1	Very high	86.3	Confident	131 Å²	131	75 Å²	75	51%	0.514	35%	0.347	S	S	.	.	H	α-helix	trans	-60.1	-23.2	171.9	-58.6	-94.5	0	0	0	113.5	Y1305 E1311	Y1305-Y1307 HydrophobicContact CD1-CD1 4.26Å; Y1305-Y1307 HydrophobicContact CD1-CD2 4.15Å; Y1305-Y1307 HydrophobicContact CD1-CE1 4.22Å; Y1305-Y1307 HydrophobicContact CD1-CE2 4.08Å; Y1305-Y1307 HydrophobicContact CD1-CG 4.22Å; Y1305-Y1307 HydrophobicContact CG-CE2 4.41Å; Y1305-Y1307 WeakPolarHBondContact O-CD2 3.17Å; Y1305-Y1307 WeakPolarHBondContact O-CE2 3.43Å; Y1305-Y1307 PolarHBondContact O-N 2.99Å; Y1307-E1311 PolarHBondContact O-N 2.88Å
1308	V	90.2	Very high	86.6	Confident	94 Å²	94	76.1 Å²	76.1	57%	0.57	36%	0.362	S	S	*	.	H	α-helix	trans	-84.7	-39.3	-174	178.5	0	0	0	0	111.2	D1306 Q1312	D1306-V1308 PolarHBondContact O-N 2.92Å; D1306-V1308 WeakPolarHBondContact OD1-CA 3.37Å; D1306-V1308 WeakPolarHBondContact OD1-CB 3.3Å; D1306-V1308 PolarHBondContact OD1-N 3.45Å; V1308-Q1312 VanDerWaalsContact O-CG 3.28Å; V1308-Q1312 WeakPolarHBondContact O-CG 3.2Å; V1308-Q1312 PolarHBondContact O-N 3.3Å; V1308-Q1312 PolarHBondContact O-NE2 3.23Å
1309	T	89.9	Confident	87.1	Confident	11 Å²	11	77 Å²	77	7%	0.067	37%	0.372	C	S	.	.	H	α-helix	trans	-64.9	-44.7	166.5	-66	0	0	0	0	110	R624 Y644 D1306 E1311 Q1312 D1313	R624-T1309 PolarHBondContact NH2-OG1 3.26Å; Y644-T1309 HydrophobicContact CD1-CG2 3.84Å; Y644-T1309 HydrophobicContact CE1-CG2 3.94Å; D1306-T1309 PolarHBondContact OD1-N 3.18Å; D1306-T1309 WeakPolarHBondContact OD2-CB 3.27Å; D1306-T1309 PolarHBondContact OD2-OG1 3.27Å; T1309-E1311 PolarHBondContact O-N 2.94Å; T1309-Q1312 WeakPolarHBondContact O-CB 3.42Å; T1309-Q1312 PolarHBondContact O-N 3.35Å; T1309-Q1312 VanDerWaalsContact O-N 3.11Å; T1309-D1313 VanDerWaalsContact CG2-OD2 3.26Å; T1309-D1313 WeakPolarHBondContact CG2-OD2 3.28Å; T1309-D1313 PolarHBondContact O-N 3.29Å
1310	E	90.7	Very high	87.5	Confident	36 Å²	36	77.2 Å²	77.2	17%	0.168	38%	0.377	C	S	.	.	H	α-helix	trans	-56.3	-46	177.9	178.9	-178	-138	0	0	112.6	Y644 R1301 Y1305 D1306 Q1312 N1314	Y644-E1310 HydrophobicContact CD1-CB 4.32Å; Y644-E1310 HydrophobicContact CD2-CB 3.74Å; Y644-E1310 HydrophobicContact CD2-CG 3.97Å; Y644-E1310 HydrophobicContact CE1-CB 4.32Å; Y644-E1310 HydrophobicContact CE2-CB 3.74Å; Y644-E1310 HydrophobicContact CE2-CG 3.63Å; Y644-E1310 HydrophobicContact CG-CB 4.03Å; R1301-E1310 IonicContact CZ-OE1 2.99Å; R1301-E1310 IonicContact CZ-OE2 3.32Å; R1301-E1310 VanDerWaalsContact CZ-OE2 3.29Å; R1301-E1310 IonicContact NH1-OE1 2.88Å; R1301-E1310 IonicContact NH1-OE2 2.64Å; R1301-E1310 PolarHBondContact NH1-OE2 3.27Å; R1301-E1310 VanDerWaalsContact NH2-CD 3.29Å; R1301-E1310 IonicContact NH2-OE1 3.18Å; R1301-E1310 PolarHBondContact NH2-OE1 2.67Å; R1301-E1310 IonicContact NH2-OE2 3.14Å; R1301-E1310 PolarHBondContact NH2-OE2 3.39Å; R1301-E1310 VanDerWaalsContact NH2-OE2 3.07Å; Y1305-E1310 PolarHBondContact OH-OE1 2.96Å; D1306-E1310 PolarHBondContact O-N 2.85Å; D1306-E1310 VanDerWaalsContact O-N 3.14Å; E1310-Q1312 VanDerWaalsContact C-N 3.33Å; E1310-Q1312 PolarHBondContact O-N 3.2Å; E1310-N1314 WeakPolarHBondContact CG-ND2 3.41Å; E1310-N1314 VanDerWaalsContact O-CB 3.3Å; E1310-N1314 WeakPolarHBondContact O-CB 3.44Å; E1310-N1314 PolarHBondContact O-N 3.4Å; E1310-N1314 PolarHBondContact O-ND2 3.35Å
1311	E	88.1	Confident	87.4	Confident	126 Å²	126	77 Å²	77	59%	0.589	38%	0.38	S	S	*	.	H	α-helix	trans	-64.6	-39	178.2	-161.1	-153.4	129.3	0	0	111.6	Y1307 T1309 R1315	Y1307-E1311 PolarHBondContact O-N 2.88Å; T1309-E1311 PolarHBondContact O-N 2.94Å; E1311-R1315 VanDerWaalsContact O-CB 3.25Å; E1311-R1315 WeakPolarHBondContact O-CB 3.25Å; E1311-R1315 PolarHBondContact O-N 2.89Å; E1311-R1315 IonicContact OE1-NH1 3.65Å; E1311-R1315 PolarHBondContact OE1-NH1 3.17Å
1312	Q	89.4	Confident	87	Confident	81 Å²	81	76 Å²	76	38%	0.379	39%	0.386	S	S	.	.	H	α-helix	trans	-64.3	-46.7	178	-75.8	178.7	66.3	0	0	112.2	V1308 T1309 E1310 R1315 K1316	V1308-Q1312 VanDerWaalsContact O-CG 3.28Å; V1308-Q1312 WeakPolarHBondContact O-CG 3.2Å; V1308-Q1312 PolarHBondContact O-N 3.3Å; V1308-Q1312 PolarHBondContact O-NE2 3.23Å; T1309-Q1312 WeakPolarHBondContact O-CB 3.42Å; T1309-Q1312 PolarHBondContact O-N 3.35Å; T1309-Q1312 VanDerWaalsContact O-N 3.11Å; E1310-Q1312 VanDerWaalsContact C-N 3.33Å; E1310-Q1312 PolarHBondContact O-N 3.2Å; Q1312-R1315 WeakPolarHBondContact O-CB 3.48Å; Q1312-R1315 PolarHBondContact O-N 2.98Å; Q1312-K1316 WeakPolarHBondContact O-CG 3.36Å; Q1312-K1316 PolarHBondContact O-N 2.99Å
1313	D	88.5	Confident	86.5	Confident	28 Å²	28	83.4 Å²	83.4	15%	0.15	41%	0.411	C	S	.	.	H	α-helix	trans	-73.5	-37.9	-177.6	-69.7	-31.6	0	0	0	111.9	M630 Y644 T1309 R1315 K1316 V1317	M630-D1313 HydrophobicContact SD-CB 4.18Å; Y644-D1313 HydrophobicContact CE1-CB 4.49Å; T1309-D1313 VanDerWaalsContact CG2-OD2 3.26Å; T1309-D1313 WeakPolarHBondContact CG2-OD2 3.28Å; T1309-D1313 PolarHBondContact O-N 3.29Å; D1313-R1315 VanDerWaalsContact C-N 3.27Å; D1313-R1315 PolarHBondContact O-N 2.83Å; D1313-K1316 PolarHBondContact O-N 2.69Å; D1313-K1316 WeakPolarHBondContact OD1-CD 3.37Å; D1313-K1316 VanDerWaalsContact OD1-CE 3.29Å; D1313-K1316 WeakPolarHBondContact OD1-CE 3.35Å; D1313-K1316 IonicContact OD1-NZ 2.77Å; D1313-K1316 PolarHBondContact OD1-NZ 2.93Å; D1313-V1317 WeakPolarHBondContact O-CG2 3.16Å; D1313-V1317 PolarHBondContact O-N 3Å
1314	N	86.5	Confident	85.6	Confident	88 Å²	88	78.7 Å²	78.7	47%	0.471	39%	0.394	S	S	.	.	H	α-helix	trans	-59.4	-37.9	168.3	-80.3	-61.5	0	0	0	112.2	E1310 S1318	E1310-N1314 WeakPolarHBondContact CG-ND2 3.41Å; E1310-N1314 VanDerWaalsContact O-CB 3.3Å; E1310-N1314 WeakPolarHBondContact O-CB 3.44Å; E1310-N1314 PolarHBondContact O-N 3.4Å; E1310-N1314 PolarHBondContact O-ND2 3.35Å; N1314-S1318 WeakPolarHBondContact O-CB 3.27Å; N1314-S1318 PolarHBondContact O-N 3.36Å
1315	R	87.6	Confident	84.5	Confident	119 Å²	119	81.4 Å²	81.4	45%	0.449	41%	0.413	S	S	.	.	H	α-helix	trans	-67.2	-45	174.3	-174.7	168.3	63.8	-121.8	2.8	111.9	E1311 Q1312 D1313 V1317 S1318 D1319	E1311-R1315 VanDerWaalsContact O-CB 3.25Å; E1311-R1315 WeakPolarHBondContact O-CB 3.25Å; E1311-R1315 PolarHBondContact O-N 2.89Å; E1311-R1315 IonicContact OE1-NH1 3.65Å; E1311-R1315 PolarHBondContact OE1-NH1 3.17Å; Q1312-R1315 WeakPolarHBondContact O-CB 3.48Å; Q1312-R1315 PolarHBondContact O-N 2.98Å; D1313-R1315 VanDerWaalsContact C-N 3.27Å; D1313-R1315 PolarHBondContact O-N 2.83Å; R1315-V1317 VanDerWaalsContact C-N 3.33Å; R1315-V1317 PolarHBondContact O-N 2.94Å; R1315-S1318 PolarHBondContact O-N 2.73Å; R1315-D1319 WeakPolarHBondContact O-CB 3.5Å; R1315-D1319 PolarHBondContact O-N 3.13Å
1316	K	87.6	Confident	83.2	Confident	127 Å²	127	88.1 Å²	88.1	55%	0.552	44%	0.443	S	S	*	.	H	α-helix	trans	-55.3	-46.8	173.1	-68.6	171.7	-161.2	164.8	0	111.3	Q1312 D1313 D1319 A1320	Q1312-K1316 WeakPolarHBondContact O-CG 3.36Å; Q1312-K1316 PolarHBondContact O-N 2.99Å; D1313-K1316 PolarHBondContact O-N 2.69Å; D1313-K1316 WeakPolarHBondContact OD1-CD 3.37Å; D1313-K1316 VanDerWaalsContact OD1-CE 3.29Å; D1313-K1316 WeakPolarHBondContact OD1-CE 3.35Å; D1313-K1316 IonicContact OD1-NZ 2.77Å; D1313-K1316 PolarHBondContact OD1-NZ 2.93Å; K1316-D1319 PolarHBondContact O-N 3.05Å; K1316-A1320 VanDerWaalsContact O-CB 3.22Å; K1316-A1320 WeakPolarHBondContact O-CB 3.49Å; K1316-A1320 PolarHBondContact O-N 3.23Å
1317	V	83.9	Confident	81.7	Confident	47 Å²	47	96.8 Å²	96.8	29%	0.285	47%	0.473	S	S	.	.	H	α-helix	trans	-65.8	-39.5	178.5	171.1	0	0	0	0	111.9	M630 D1313 R1315 K1321	M630-V1317 HydrophobicContact CE-CG2 4.41Å; M630-V1317 HydrophobicContact SD-CG2 4.08Å; D1313-V1317 WeakPolarHBondContact O-CG2 3.16Å; D1313-V1317 PolarHBondContact O-N 3Å; R1315-V1317 VanDerWaalsContact C-N 3.33Å; R1315-V1317 PolarHBondContact O-N 2.94Å; V1317-K1321 HydrophobicContact CG1-CD 4.1Å; V1317-K1321 WeakPolarHBondContact O-CB 3.22Å; V1317-K1321 VanDerWaalsContact O-CG 3.31Å; V1317-K1321 WeakPolarHBondContact O-CG 3.27Å; V1317-K1321 PolarHBondContact O-N 2.76Å
1318	S	81.8	Confident	80	Confident	73 Å²	73	99.2 Å²	99.2	51%	0.51	49%	0.486	S	S	.	.	H	α-helix	trans	-64	-48.5	175	-171.9	0	0	0	0	111.8	N1314 R1315 A1320 K1321 A1322	N1314-S1318 WeakPolarHBondContact O-CB 3.27Å; N1314-S1318 PolarHBondContact O-N 3.36Å; R1315-S1318 PolarHBondContact O-N 2.73Å; S1318-A1320 PolarHBondContact O-N 3.38Å; S1318-K1321 PolarHBondContact O-N 3.17Å; S1318-A1322 WeakPolarHBondContact O-CB 3.42Å; S1318-A1322 PolarHBondContact O-N 3.31Å
1319	D	85.9	Confident	78.5	Confident	80 Å²	80	99.7 Å²	99.7	43%	0.428	48%	0.484	S	S	.	.	H	α-helix	trans	-65.4	-38.1	178	-76.3	-26.4	0	0	0	111.7	R1315 K1316 A1322 R1323	R1315-D1319 WeakPolarHBondContact O-CB 3.5Å; R1315-D1319 PolarHBondContact O-N 3.13Å; K1316-D1319 PolarHBondContact O-N 3.05Å; D1319-A1322 PolarHBondContact O-N 3.06Å; D1319-R1323 WeakPolarHBondContact O-CB 3.5Å; D1319-R1323 VanDerWaalsContact O-CG 3.23Å; D1319-R1323 WeakPolarHBondContact O-CG 3.3Å; D1319-R1323 PolarHBondContact O-N 2.89Å
1320	A	81.4	Confident	77.2	Confident	55 Å²	55	103.8 Å²	103.8	46%	0.455	50%	0.499	S	S	.	.	H	α-helix	trans	-62.8	-46.1	173.2	0	0	0	0	0	111.7	K1316 S1318 A1322 R1323 A1324	K1316-A1320 VanDerWaalsContact O-CB 3.22Å; K1316-A1320 WeakPolarHBondContact O-CB 3.49Å; K1316-A1320 PolarHBondContact O-N 3.23Å; S1318-A1320 PolarHBondContact O-N 3.38Å; A1320-A1322 VanDerWaalsContact C-N 3.32Å; A1320-A1322 PolarHBondContact O-N 2.78Å; A1320-R1323 PolarHBondContact O-N 3.17Å; A1320-A1324 WeakPolarHBondContact O-CB 3.17Å; A1320-A1324 PolarHBondContact O-N 3.08Å
1321	K	79.1	Confident	76	Confident	147 Å²	147	104.1 Å²	104.1	64%	0.639	51%	0.508	S	S	*	.	H	α-helix	trans	-60.9	-39.9	173.9	-74.9	171.6	-179.8	174.4	0	111.6	V1317 S1318 A1324 L1325	V1317-K1321 HydrophobicContact CG1-CD 4.1Å; V1317-K1321 WeakPolarHBondContact O-CB 3.22Å; V1317-K1321 VanDerWaalsContact O-CG 3.31Å; V1317-K1321 WeakPolarHBondContact O-CG 3.27Å; V1317-K1321 PolarHBondContact O-N 2.76Å; S1318-K1321 PolarHBondContact O-N 3.17Å; K1321-A1324 PolarHBondContact O-N 2.96Å; K1321-L1325 WeakPolarHBondContact O-CB 3.26Å; K1321-L1325 PolarHBondContact O-N 3.05Å
1322	A	77.6	Confident	75.4	Confident	41 Å²	41	107.9 Å²	107.9	34%	0.339	52%	0.517	S	S	.	.	H	α-helix	trans	-68.2	-35.9	175.4	0	0	0	0	0	113.2	S1318 D1319 A1320 K1326	S1318-A1322 WeakPolarHBondContact O-CB 3.42Å; S1318-A1322 PolarHBondContact O-N 3.31Å; D1319-A1322 PolarHBondContact O-N 3.06Å; A1320-A1322 VanDerWaalsContact C-N 3.32Å; A1320-A1322 PolarHBondContact O-N 2.78Å; A1322-K1326 WeakPolarHBondContact O-CB 3.32Å; A1322-K1326 VanDerWaalsContact O-CG 3.25Å; A1322-K1326 WeakPolarHBondContact O-CG 3.39Å; A1322-K1326 PolarHBondContact O-N 3.06Å
1323	R	76.3	Confident	75	Confident	183 Å²	183	104.3 Å²	104.3	69%	0.691	50%	0.5	S	S	*	.	H	α-helix	trans	-67.8	-44.4	172.6	-72.9	171.4	-169.6	-157.2	5.1	111.4	D1319 A1320 K1326 R1327	D1319-R1323 WeakPolarHBondContact O-CB 3.5Å; D1319-R1323 VanDerWaalsContact O-CG 3.23Å; D1319-R1323 WeakPolarHBondContact O-CG 3.3Å; D1319-R1323 PolarHBondContact O-N 2.89Å; A1320-R1323 PolarHBondContact O-N 3.17Å; R1323-K1326 CarbonylContact O-C 3.6Å; R1323-K1326 WeakPolarHBondContact O-CA 3.46Å; R1323-K1326 WeakPolarHBondContact O-CB 3.25Å; R1323-K1326 PolarHBondContact O-N 3.12Å; R1323-K1326 VanDerWaalsContact O-N 3.14Å; R1323-R1327 PolarHBondContact O-N 3.2Å
1324	A	70.4	Confident	74.6	Confident	55 Å²	55	108.8 Å²	108.8	46%	0.455	53%	0.528	S	S	.	.	H	α-helix	trans	-62.5	-44.2	177.3	0	0	0	0	0	111.9	A1320 K1321 K1326 R1327	A1320-A1324 WeakPolarHBondContact O-CB 3.17Å; A1320-A1324 PolarHBondContact O-N 3.08Å; K1321-A1324 PolarHBondContact O-N 2.96Å; A1324-K1326 PolarHBondContact O-N 2.86Å; A1324-R1327 PolarHBondContact O-N 3.4Å; A1324-R1327 VanDerWaalsContact O-N 3.11Å
1325	L	68	Low	74.6	Confident	140 Å²	140	105.6 Å²	105.6	73%	0.733	51%	0.511	S	S	*	.	H	α-helix	trans	-61.7	-33.1	174.4	-163	71.6	0	0	0	112	K1321	K1321-L1325 WeakPolarHBondContact O-CB 3.26Å; K1321-L1325 PolarHBondContact O-N 3.05Å
1326	K	63.8	Low	74.4	Confident	154 Å²	154	105.4 Å²	105.4	67%	0.67	54%	0.535	S	S	*	.	H	α-helix	trans	-77.9	-19.7	173.9	-74.3	172.1	-178.5	176.5	0	114.8	A1322 R1323 A1324 I1329	A1322-K1326 WeakPolarHBondContact O-CB 3.32Å; A1322-K1326 VanDerWaalsContact O-CG 3.25Å; A1322-K1326 WeakPolarHBondContact O-CG 3.39Å; A1322-K1326 PolarHBondContact O-N 3.06Å; R1323-K1326 CarbonylContact O-C 3.6Å; R1323-K1326 WeakPolarHBondContact O-CA 3.46Å; R1323-K1326 WeakPolarHBondContact O-CB 3.25Å; R1323-K1326 PolarHBondContact O-N 3.12Å; R1323-K1326 VanDerWaalsContact O-N 3.14Å; A1324-K1326 PolarHBondContact O-N 2.86Å; K1326-I1329 WeakPolarHBondContact O-CD1 3.46Å; K1326-I1329 WeakPolarHBondContact O-CG1 3.44Å
1327	R	58.8	Low	74.4	Confident	216 Å²	216	100.5 Å²	100.5	82%	0.815	51%	0.514	S	S	*	.	H	α-helix	trans	-75.9	-21.8	175	-81.2	-172.2	174.4	179.3	-0.5	112.5	R1323 A1324 I1329	R1323-R1327 PolarHBondContact O-N 3.2Å; A1324-R1327 PolarHBondContact O-N 3.4Å; A1324-R1327 VanDerWaalsContact O-N 3.11Å; R1327-I1329 PolarHBondContact O-N 2.86Å
1328	K	55.4	Low	74.6	Confident	183 Å²	183	103.7 Å²	103.7	80%	0.796	54%	0.536	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.9	50.6	178.7	-64.8	-166.5	174.4	-168.5	0	114.2
1329	I	57.8	Low	75	Confident	104 Å²	104	101.6 Å²	101.6	53%	0.533	52%	0.521	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.7	-29	-177.4	-75	170	0	0	0	113.3	K1326 R1327 A1331	K1326-I1329 WeakPolarHBondContact O-CD1 3.46Å; K1326-I1329 WeakPolarHBondContact O-CG1 3.44Å; R1327-I1329 PolarHBondContact O-N 2.86Å; I1329-A1331 PolarHBondContact O-N 3.21Å
1330	Y	63.1	Low	75.3	Confident	96 Å²	96	98.7 Å²	98.7	38%	0.376	50%	0.504	S	S	.	.			trans	-80.4	102.1	176.8	-66.9	-69.5	0	0	0	111.5	P1364	Y1330-P1364 HydrophobicContact CD1-CB 4.39Å
1331	A	66.2	Low	75.7	Confident	44 Å²	44	99 Å²	99	36%	0.364	50%	0.496	S	S	.	.			trans	-75.9	121.9	164.4	0	0	0	0	0	109.7	I1329 R1333	I1329-A1331 PolarHBondContact O-N 3.21Å; A1331-R1333 PolarHBondContact O-N 2.99Å
1332	R	74.2	Confident	76.1	Confident	204 Å²	204	95.3 Å²	95.3	77%	0.77	48%	0.483	S	S	*	.			trans	-59.7	131	166.7	-78.1	-174.7	166.2	178.2	-3	108.8	N1342 F1397	R1332-N1342 WeakPolarHBondContact CA-OD1 3.19Å; R1332-N1342 HydrophobicContact CG-CB 4.26Å; R1332-F1397 WeakPolarHBondContact O-CD1 3.39Å
1333	R	81.1	Confident	76.6	Confident	6 Å²	6	96.7 Å²	96.7	2%	0.023	48%	0.481	C	S	.	.			trans	-105.9	158.3	177.7	-59.8	-76.8	-158.5	87.5	21	110.3	A1331 I1335 F1340 N1342 P1364 K1369 H1371 E1390 K1393 D1396 F1397 S1398	A1331-R1333 PolarHBondContact O-N 2.99Å; R1333-I1335 HydrophobicContact CB-CD1 3.87Å; R1333-I1335 HydrophobicContact CB-CG1 4.06Å; R1333-I1335 HydrophobicContact CG-CD1 4.2Å; R1333-F1340 HydrophobicContact CB-CE1 4.16Å; R1333-F1340 HydrophobicContact CB-CZ 3.83Å; R1333-F1340 HydrophobicContact CG-CZ 4.22Å; R1333-N1342 PolarHBondContact N-OD1 3.25Å; R1333-N1342 PolarHBondContact O-ND2 3.23Å; R1333-N1342 PolarHBondContact O-OD1 3.1Å; R1333-P1364 HydrophobicContact CG-CG 4.16Å; R1333-K1369 PolarHBondContact NH2-O 3.43Å; R1333-H1371 PolarHBondContact NH2-O 2.92Å; R1333-E1390 IonicContact CZ-OE1 3.01Å; R1333-E1390 IonicContact CZ-OE2 3.76Å; R1333-E1390 IonicContact NH1-OE1 3.72Å; R1333-E1390 PolarHBondContact NH1-OE1 3.02Å; R1333-E1390 IonicContact NH1-OE2 3.1Å; R1333-E1390 PolarHBondContact NH1-OE2 2.85Å; R1333-E1390 IonicContact NH2-OE1 3.66Å; R1333-E1390 IonicContact NH2-OE2 2.72Å; R1333-E1390 PolarHBondContact NH2-OE2 3.36Å; R1333-K1393 VanDerWaalsContact CZ-NZ 3.33Å; R1333-D1396 WeakPolarHBondContact CD-O 3.44Å; R1333-F1397 WeakPolarHBondContact CB-O 3.36Å; R1333-S1398 PolarHBondContact NH1-O 2.88Å; R1333-S1398 VanDerWaalsContact NH1-O 3.15Å
1334	V	81.2	Confident	76.9	Confident	123 Å²	123	89.3 Å²	89.3	75%	0.745	46%	0.458	S	S	*	.			trans	-112.8	82.6	171.9	-173.6	0	0	0	0	108.1	F1397	V1334-F1397 PolarHBondContact N-O 3.43Å
1335	I	84.6	Confident	77.6	Confident	21 Å²	21	92.4 Å²	92.4	11%	0.108	46%	0.459	C	S	.	.			trans	-120.5	114.8	-178.8	-63.7	169.2	0	0	0	107.4	R1333 H1337 F1340 L1372 L1399 L1413	R1333-I1335 HydrophobicContact CB-CD1 3.87Å; R1333-I1335 HydrophobicContact CB-CG1 4.06Å; R1333-I1335 HydrophobicContact CG-CD1 4.2Å; I1335-H1337 HydrophobicContact CG2-CB 4.36Å; I1335-H1337 PolarHBondContact O-N 3.41Å; I1335-F1340 HydrophobicContact CB-CD1 3.8Å; I1335-F1340 HydrophobicContact CB-CD2 4.41Å; I1335-F1340 HydrophobicContact CB-CE1 3.96Å; I1335-F1340 HydrophobicContact CB-CG 4.05Å; I1335-F1340 HydrophobicContact CB-CZ 4.35Å; I1335-F1340 HydrophobicContact CD1-CD2 4.43Å; I1335-F1340 HydrophobicContact CD1-CE1 4.47Å; I1335-F1340 HydrophobicContact CD1-CE2 3.99Å; I1335-F1340 HydrophobicContact CD1-CZ 4.02Å; I1335-F1340 HydrophobicContact CG2-CB 4.38Å; I1335-F1340 HydrophobicContact CG2-CD1 4.29Å; I1335-F1340 HydrophobicContact CG2-CD2 4.35Å; I1335-F1340 HydrophobicContact CG2-CG 4.05Å; I1335-F1340 WeakPolarHBondContact O-CD1 3.38Å; I1335-L1372 HydrophobicContact CD1-CD1 4.26Å; I1335-L1372 HydrophobicContact CD1-CD2 4.34Å; I1335-L1399 HydrophobicContact CD1-CB 4.3Å; I1335-L1399 HydrophobicContact CD1-CD1 4.18Å; I1335-L1399 HydrophobicContact CG1-CB 4.26Å; I1335-L1413 HydrophobicContact CG2-CD1 3.85Å
1336	A	84.4	Confident	78.5	Confident	114 Å²	114	88.9 Å²	88.9	94%	0.942	45%	0.449	S	S	*	.			trans	-88.5	85.1	-178.3	0	0	0	0	0	110.5
1337	H	87.5	Confident	79.6	Confident	24 Å²	24	85.9 Å²	85.9	11%	0.111	44%	0.438	C	S	.	.			trans	-140.8	137	176.7	-179.5	-88.5	0	0	0	110.3	I1335 S1339 F1340 L1413 D1414 I1417	I1335-H1337 HydrophobicContact CG2-CB 4.36Å; I1335-H1337 PolarHBondContact O-N 3.41Å; H1337-S1339 WeakPolarHBondContact CE1-CB 3.45Å; H1337-S1339 PolarHBondContact CE1-N 3.4Å; H1337-S1339 PolarHBondContact CE1-OG 3.11Å; H1337-S1339 PolarHBondContact ND1-N 3.03Å; H1337-S1339 PolarHBondContact O-N 3.27Å; H1337-S1339 VanDerWaalsContact O-N 3.17Å; H1337-F1340 HydrophobicContact CB-CB 3.92Å; H1337-F1340 PolarHBondContact O-N 3.1Å; H1337-L1413 HydrophobicContact CB-CD1 3.8Å; H1337-D1414 IonicContact CD2-OD1 2.68Å; H1337-D1414 IonicContact CD2-OD2 3.42Å; H1337-D1414 IonicContact CE1-OD1 3.78Å; H1337-D1414 WeakPolarHBondContact NE2-CB 3.09Å; H1337-D1414 PolarHBondContact NE2-N 3.02Å; H1337-D1414 CovalentContact NE2-OD1 1.78Å; H1337-D1414 IonicContact NE2-OD1 2.67Å; H1337-D1414 PolarHBondContact NE2-OD1 3.47Å; H1337-D1414 IonicContact NE2-OD2 2.71Å; H1337-D1414 PolarHBondContact NE2-OD2 3.21Å; H1337-I1417 WeakPolarHBondContact CE1-CD1 3.47Å
1338	P	88.8	Confident	81.1	Confident	115 Å²	115	75.6 Å²	75.6	75%	0.747	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	-28.4	-172.8	-26.1	35.6	0	0	0	115.3
1339	S	89.6	Confident	82.7	Confident	29 Å²	29	68.5 Å²	68.5	20%	0.203	37%	0.371	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.4	6.8	178.6	-51.7	0	0	0	0	112.9	H1337 F1341 L1362	H1337-S1339 WeakPolarHBondContact CE1-CB 3.45Å; H1337-S1339 PolarHBondContact CE1-N 3.4Å; H1337-S1339 PolarHBondContact CE1-OG 3.11Å; H1337-S1339 PolarHBondContact ND1-N 3.03Å; H1337-S1339 PolarHBondContact O-N 3.27Å; H1337-S1339 VanDerWaalsContact O-N 3.17Å; S1339-F1341 VanDerWaalsContact C-CE2 3.46Å; S1339-F1341 VanDerWaalsContact O-CD2 3.22Å; S1339-F1341 WeakPolarHBondContact O-CD2 3.19Å; S1339-F1341 VanDerWaalsContact O-CE2 3.24Å; S1339-F1341 WeakPolarHBondContact O-CE2 3.42Å; S1339-L1362 WeakPolarHBondContact O-CB 3.24Å; S1339-L1362 PolarHBondContact O-N 2.89Å
1340	F	92.3	Very high	84.2	Confident	18 Å²	18	66.5 Å²	66.5	8%	0.079	37%	0.37	C	S	.	.	B	Isolated β-bridge	trans	-95.2	126.3	179.4	-178.6	-92.6	0	0	0	112.7	R1333 I1335 H1337 L1362 P1364 L1372	R1333-F1340 HydrophobicContact CB-CE1 4.16Å; R1333-F1340 HydrophobicContact CB-CZ 3.83Å; R1333-F1340 HydrophobicContact CG-CZ 4.22Å; I1335-F1340 HydrophobicContact CB-CD1 3.8Å; I1335-F1340 HydrophobicContact CB-CD2 4.41Å; I1335-F1340 HydrophobicContact CB-CE1 3.96Å; I1335-F1340 HydrophobicContact CB-CG 4.05Å; I1335-F1340 HydrophobicContact CB-CZ 4.35Å; I1335-F1340 HydrophobicContact CD1-CD2 4.43Å; I1335-F1340 HydrophobicContact CD1-CE1 4.47Å; I1335-F1340 HydrophobicContact CD1-CE2 3.99Å; I1335-F1340 HydrophobicContact CD1-CZ 4.02Å; I1335-F1340 HydrophobicContact CG2-CB 4.38Å; I1335-F1340 HydrophobicContact CG2-CD1 4.29Å; I1335-F1340 HydrophobicContact CG2-CD2 4.35Å; I1335-F1340 HydrophobicContact CG2-CG 4.05Å; I1335-F1340 WeakPolarHBondContact O-CD1 3.38Å; H1337-F1340 HydrophobicContact CB-CB 3.92Å; H1337-F1340 PolarHBondContact O-N 3.1Å; F1340-L1362 CarbonylContact C-O 3.48Å; F1340-L1362 WeakPolarHBondContact CA-O 3.41Å; F1340-L1362 HydrophobicContact CB-CB 4.45Å; F1340-L1362 HydrophobicContact CD2-CB 4.08Å; F1340-P1364 HydrophobicContact CE2-CG 4.5Å; F1340-P1364 HydrophobicContact CZ-CG 3.98Å; F1340-L1372 HydrophobicContact CE2-CD2 3.97Å
1341	F	89.9	Confident	85.4	Confident	62 Å²	62	64.4 Å²	64.4	27%	0.272	36%	0.364	S	S	.	.			trans	-129.8	131.7	-177.6	-55.1	-85.4	0	0	0	111.2	S1339 K1343 M1351 A1361 L1362 R1363 P1364	S1339-F1341 VanDerWaalsContact C-CE2 3.46Å; S1339-F1341 VanDerWaalsContact O-CD2 3.22Å; S1339-F1341 WeakPolarHBondContact O-CD2 3.19Å; S1339-F1341 VanDerWaalsContact O-CE2 3.24Å; S1339-F1341 WeakPolarHBondContact O-CE2 3.42Å; F1341-K1343 HydrophobicContact CB-CB 4.09Å; F1341-K1343 HydrophobicContact CB-CD 4.18Å; F1341-K1343 HydrophobicContact CB-CG 4.08Å; F1341-K1343 PolarHBondContact O-N 3.35Å; F1341-M1351 HydrophobicContact CD1-CE 4.41Å; F1341-M1351 HydrophobicContact CD1-SD 4.14Å; F1341-M1351 HydrophobicContact CD2-CE 3.72Å; F1341-M1351 HydrophobicContact CD2-SD 4.47Å; F1341-M1351 HydrophobicContact CE1-CE 4.27Å; F1341-M1351 HydrophobicContact CE1-SD 4.05Å; F1341-M1351 HydrophobicContact CE2-CE 3.54Å; F1341-M1351 HydrophobicContact CE2-SD 4.39Å; F1341-M1351 HydrophobicContact CG-CE 4.16Å; F1341-M1351 HydrophobicContact CG-SD 4.35Å; F1341-M1351 HydrophobicContact CZ-CE 3.84Å; F1341-M1351 HydrophobicContact CZ-SD 4.18Å; F1341-A1361 HydrophobicContact CD2-CB 3.92Å; F1341-A1361 HydrophobicContact CE2-CB 4.07Å; F1341-L1362 PolarHBondContact N-O 3.46Å; F1341-R1363 WeakPolarHBondContact O-CA 3.49Å; F1341-R1363 WeakPolarHBondContact O-CB 3.3Å; F1341-P1364 VanDerWaalsContact O-CD 3.31Å; F1341-P1364 WeakPolarHBondContact O-CD 3.21Å
1342	N	88.1	Confident	86.6	Confident	70 Å²	70	62.5 Å²	62.5	37%	0.374	35%	0.348	S	S	.	.			trans	-77.1	45.4	168.8	-79	-54.9	0	0	0	112.2	R1332 R1333	R1332-N1342 WeakPolarHBondContact CA-OD1 3.19Å; R1332-N1342 HydrophobicContact CG-CB 4.26Å; R1333-N1342 PolarHBondContact N-OD1 3.25Å; R1333-N1342 PolarHBondContact O-ND2 3.23Å; R1333-N1342 PolarHBondContact O-OD1 3.1Å
1343	K	87.3	Confident	87.2	Confident	70 Å²	70	54.8 Å²	54.8	30%	0.304	33%	0.328	S	S	.	.			trans	-106.6	147.2	-177.6	-77.6	-176.6	169.2	-172.8	0	110.5	F1341 E1347 V1348 M1351 R1363	F1341-K1343 HydrophobicContact CB-CB 4.09Å; F1341-K1343 HydrophobicContact CB-CD 4.18Å; F1341-K1343 HydrophobicContact CB-CG 4.08Å; F1341-K1343 PolarHBondContact O-N 3.35Å; K1343-E1347 HydrophobicContact CB-CB 3.82Å; K1343-E1347 HydrophobicContact CD-CB 4.05Å; K1343-E1347 HydrophobicContact CG-CB 4.03Å; K1343-V1348 HydrophobicContact CB-CG2 3.68Å; K1343-M1351 HydrophobicContact CD-SD 4Å; K1343-M1351 PolarHBondContact NZ-SD 3.31Å; K1343-R1363 WeakPolarHBondContact O-CB 3.49Å; K1343-R1363 WeakPolarHBondContact O-CD 3.24Å
1344	S	83.1	Confident	87.5	Confident	28 Å²	28	63.5 Å²	63.5	20%	0.196	37%	0.369	C	S	.	.			trans	-67.7	178.6	173.2	70.1	0	0	0	0	112.4	E1347 V1348	S1344-E1347 WeakPolarHBondContact CA-OE2 3.44Å; S1344-E1347 WeakPolarHBondContact CB-OE2 3.46Å; S1344-E1347 PolarHBondContact N-OE2 2.76Å; S1344-E1347 PolarHBondContact OG-N 3.03Å; S1344-E1347 PolarHBondContact OG-OE2 2.82Å; S1344-V1348 WeakPolarHBondContact O-CB 3.44Å; S1344-V1348 WeakPolarHBondContact O-CG2 3.3Å; S1344-V1348 PolarHBondContact O-N 3.29Å
1345	Y	85.3	Confident	87.9	Confident	120 Å²	120	58.1 Å²	58.1	47%	0.471	34%	0.337	S	S	.	.	H	α-helix	trans	-58.7	-46	173.2	164.7	-118.6	0	0	0	112.7	V1348 V1349 H1385	Y1345-V1348 PolarHBondContact O-N 3.37Å; Y1345-V1349 HydrophobicContact CD2-CG2 3.88Å; Y1345-V1349 HydrophobicContact CE2-CG2 3.39Å; Y1345-V1349 WeakPolarHBondContact O-CG2 3.41Å; Y1345-V1349 PolarHBondContact O-N 3.11Å; Y1345-H1385 AromaticContact CD2-CE1 3.93Å; Y1345-H1385 AromaticContact CE2-CE1 3.5Å; Y1345-H1385 VanDerWaalsContact CE2-CE1 3.5Å; Y1345-H1385 WeakPolarHBondContact CE2-CE1 3.41Å; Y1345-H1385 AromaticContact CE2-NE2 3.46Å; Y1345-H1385 WeakPolarHBondContact CE2-NE2 3.33Å
1346	A	85.7	Confident	88.2	Confident	65 Å²	65	63 Å²	63	54%	0.537	36%	0.364	S	S	.	.	H	α-helix	trans	-66.9	-47.2	-176.9	0	0	0	0	0	111.9	V1348 V1349 A1350	A1346-V1348 VanDerWaalsContact C-N 3.28Å; A1346-V1348 PolarHBondContact O-N 3.06Å; A1346-V1349 PolarHBondContact O-N 2.59Å; A1346-V1349 VanDerWaalsContact O-N 3.14Å; A1346-A1350 PolarHBondContact O-N 3.48Å
1347	E	87.8	Confident	88.6	Confident	92 Å²	92	58.8 Å²	58.8	43%	0.43	32%	0.324	S	S	.	.	H	α-helix	trans	-61.5	-34.1	177.5	-68.1	162.5	81.5	0	0	113	K1343 S1344 M1351	K1343-E1347 HydrophobicContact CB-CB 3.82Å; K1343-E1347 HydrophobicContact CD-CB 4.05Å; K1343-E1347 HydrophobicContact CG-CB 4.03Å; S1344-E1347 WeakPolarHBondContact CA-OE2 3.44Å; S1344-E1347 WeakPolarHBondContact CB-OE2 3.46Å; S1344-E1347 PolarHBondContact N-OE2 2.76Å; S1344-E1347 PolarHBondContact OG-N 3.03Å; S1344-E1347 PolarHBondContact OG-OE2 2.82Å; E1347-M1351 WeakPolarHBondContact O-CB 3.34Å; E1347-M1351 PolarHBondContact O-N 3.07Å
1348	V	89.4	Confident	88.8	Confident	0 Å²	0	58.3 Å²	58.3	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-74.1	-35.9	174.7	165.8	0	0	0	0	112	K1343 S1344 Y1345 A1346 L1352 A1361 R1363 T1375	K1343-V1348 HydrophobicContact CB-CG2 3.68Å; S1344-V1348 WeakPolarHBondContact O-CB 3.44Å; S1344-V1348 WeakPolarHBondContact O-CG2 3.3Å; S1344-V1348 PolarHBondContact O-N 3.29Å; Y1345-V1348 PolarHBondContact O-N 3.37Å; A1346-V1348 VanDerWaalsContact C-N 3.28Å; A1346-V1348 PolarHBondContact O-N 3.06Å; V1348-L1352 HydrophobicContact CG1-CD1 3.9Å; V1348-L1352 WeakPolarHBondContact O-CB 3.46Å; V1348-L1352 WeakPolarHBondContact O-CG 3.35Å; V1348-L1352 PolarHBondContact O-N 2.91Å; V1348-A1361 HydrophobicContact CG1-CB 3.67Å; V1348-A1361 HydrophobicContact CG2-CB 4.44Å; V1348-R1363 HydrophobicContact CG2-CB 4.2Å; V1348-R1363 HydrophobicContact CG2-CG 4.23Å; V1348-T1375 HydrophobicContact CG1-CG2 4Å
1349	V	88.9	Confident	89	Confident	34 Å²	34	57.4 Å²	57.4	21%	0.206	31%	0.312	C	S	.	.	H	α-helix	trans	-66.1	-45.4	173.8	164.3	0	0	0	0	111.1	Y1345 A1346 L1352 A1353 F1383	Y1345-V1349 HydrophobicContact CD2-CG2 3.88Å; Y1345-V1349 HydrophobicContact CE2-CG2 3.39Å; Y1345-V1349 WeakPolarHBondContact O-CG2 3.41Å; Y1345-V1349 PolarHBondContact O-N 3.11Å; A1346-V1349 PolarHBondContact O-N 2.59Å; A1346-V1349 VanDerWaalsContact O-N 3.14Å; V1349-L1352 CarbonylContact O-C 3.56Å; V1349-L1352 PolarHBondContact O-N 2.93Å; V1349-A1353 PolarHBondContact O-N 3.48Å; V1349-F1383 HydrophobicContact CG1-CD2 4.01Å; V1349-F1383 HydrophobicContact CG1-CE2 3.75Å; V1349-F1383 HydrophobicContact CG1-CZ 4.47Å; V1349-F1383 HydrophobicContact CG2-CD2 4.15Å
1350	A	88.8	Confident	89.2	Confident	62 Å²	62	57 Å²	57	51%	0.512	31%	0.308	S	S	.	.	H	α-helix	trans	-59.8	-47.6	175.3	0	0	0	0	0	111.6	A1346 L1352 A1353	A1346-A1350 PolarHBondContact O-N 3.48Å; A1350-L1352 VanDerWaalsContact C-N 3.28Å; A1350-L1352 PolarHBondContact O-N 3.14Å; A1350-A1353 WeakPolarHBondContact O-CB 3.49Å; A1350-A1353 PolarHBondContact O-N 2.82Å; A1350-A1353 VanDerWaalsContact O-N 3.12Å
1351	M	88.7	Confident	89.3	Confident	52 Å²	52	56.1 Å²	56.1	26%	0.256	30%	0.304	S	S	.	.	H	α-helix	trans	-63	-31.1	177.7	-171	-173.1	82.8	0	0	113.4	F1341 K1343 E1347 A1361	F1341-M1351 HydrophobicContact CD1-CE 4.41Å; F1341-M1351 HydrophobicContact CD1-SD 4.14Å; F1341-M1351 HydrophobicContact CD2-CE 3.72Å; F1341-M1351 HydrophobicContact CD2-SD 4.47Å; F1341-M1351 HydrophobicContact CE1-CE 4.27Å; F1341-M1351 HydrophobicContact CE1-SD 4.05Å; F1341-M1351 HydrophobicContact CE2-CE 3.54Å; F1341-M1351 HydrophobicContact CE2-SD 4.39Å; F1341-M1351 HydrophobicContact CG-CE 4.16Å; F1341-M1351 HydrophobicContact CG-SD 4.35Å; F1341-M1351 HydrophobicContact CZ-CE 3.84Å; F1341-M1351 HydrophobicContact CZ-SD 4.18Å; K1343-M1351 HydrophobicContact CD-SD 4Å; K1343-M1351 PolarHBondContact NZ-SD 3.31Å; E1347-M1351 WeakPolarHBondContact O-CB 3.34Å; E1347-M1351 PolarHBondContact O-N 3.07Å; M1351-A1361 HydrophobicContact CE-CB 3.55Å
1352	L	91	Very high	89.4	Confident	3 Å²	3	53.1 Å²	53.1	2%	0.016	29%	0.291	C	S	.	.	H	α-helix	trans	-89.1	-6.6	176	-71.6	173.3	0	0	0	113.7	V1348 V1349 A1350 A1355 E1359 A1361 T1375 K1377 F1383	V1348-L1352 HydrophobicContact CG1-CD1 3.9Å; V1348-L1352 WeakPolarHBondContact O-CB 3.46Å; V1348-L1352 WeakPolarHBondContact O-CG 3.35Å; V1348-L1352 PolarHBondContact O-N 2.91Å; V1349-L1352 CarbonylContact O-C 3.56Å; V1349-L1352 PolarHBondContact O-N 2.93Å; A1350-L1352 VanDerWaalsContact C-N 3.28Å; A1350-L1352 PolarHBondContact O-N 3.14Å; L1352-A1355 HydrophobicContact CB-CB 4.49Å; L1352-A1355 HydrophobicContact CD2-CB 3.93Å; L1352-A1355 PolarHBondContact O-N 3.03Å; L1352-E1359 HydrophobicContact CD2-CB 4.06Å; L1352-A1361 HydrophobicContact CD1-CB 3.93Å; L1352-A1361 HydrophobicContact CD2-CB 4.37Å; L1352-A1361 HydrophobicContact CG-CB 4.21Å; L1352-T1375 HydrophobicContact CD1-CG2 3.56Å; L1352-K1377 WeakPolarHBondContact O-CD 3.48Å; L1352-F1383 HydrophobicContact CB-CD1 3.89Å; L1352-F1383 HydrophobicContact CB-CE1 3.61Å; L1352-F1383 HydrophobicContact CD1-CD1 4.44Å; L1352-F1383 WeakPolarHBondContact O-CE1 3.38Å
1353	A	88.3	Confident	89.6	Confident	42 Å²	42	50.4 Å²	50.4	35%	0.347	28%	0.276	S	S	.	.	H	α-helix	trans	-65.7	-47.3	176.4	0	0	0	0	0	111	V1349 A1350 A1355 K1377 F1383	V1349-A1353 PolarHBondContact O-N 3.48Å; A1350-A1353 WeakPolarHBondContact O-CB 3.49Å; A1350-A1353 PolarHBondContact O-N 2.82Å; A1350-A1353 VanDerWaalsContact O-N 3.12Å; A1353-A1355 VanDerWaalsContact C-N 3.28Å; A1353-A1355 PolarHBondContact O-N 2.8Å; A1353-K1377 PolarHBondContact O-NZ 3.44Å; A1353-F1383 HydrophobicContact CB-CZ 4.5Å
1354	E	87.1	Confident	89.7	Confident	189 Å²	189	47.4 Å²	47.4	88%	0.883	26%	0.263	S	S	*	.	S	Bend	trans	-74	-17.4	177.5	-58.2	-175.7	161.3	0	0	113.4
1355	A	89.1	Confident	89.9	Confident	11 Å²	11	46.4 Å²	46.4	9%	0.091	26%	0.256	C	S	.	.	S	Bend	trans	-71.8	158.7	-175.1	0	0	0	0	0	113.9	L1352 A1353 E1359 K1377	L1352-A1355 HydrophobicContact CB-CB 4.49Å; L1352-A1355 HydrophobicContact CD2-CB 3.93Å; L1352-A1355 PolarHBondContact O-N 3.03Å; A1353-A1355 VanDerWaalsContact C-N 3.28Å; A1353-A1355 PolarHBondContact O-N 2.8Å; A1355-E1359 HydrophobicContact CB-CB 3.95Å; A1355-E1359 HydrophobicContact CB-CG 4.28Å; A1355-K1377 WeakPolarHBondContact O-CD 3.35Å; A1355-K1377 WeakPolarHBondContact O-CE 3.49Å; A1355-K1377 PolarHBondContact O-NZ 2.87Å
1356	D	92.1	Very high	89.7	Confident	124 Å²	124	43.6 Å²	43.6	66%	0.663	26%	0.255	S	S	*	.	P	Polyproline II helix	trans	-72.4	154	177.5	-126.5	-18.4	0	0	0	111.8	G1358 E1359	D1356-G1358 PolarHBondContact O-N 2.73Å; D1356-E1359 HydrophobicContact CB-CG 4.28Å; D1356-E1359 WeakPolarHBondContact CB-OE1 3.14Å; D1356-E1359 PolarHBondContact N-OE1 2.81Å; D1356-E1359 WeakPolarHBondContact O-CB 3.13Å; D1356-E1359 PolarHBondContact O-N 3.3Å; D1356-E1359 VanDerWaalsContact O-N 3.11Å
1357	Q	92.5	Very high	89.6	Confident	24 Å²	24	47.1 Å²	47.1	11%	0.112	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.2	122.6	179.8	-176.9	-84.7	-25.7	0	0	110.4	V1378 A1425 R1429 I1432	Q1357-V1378 VanDerWaalsContact CG-O 3.31Å; Q1357-V1378 WeakPolarHBondContact CG-O 3.14Å; Q1357-V1378 PolarHBondContact NE2-O 3.5Å; Q1357-A1425 PolarHBondContact NE2-O 3.04Å; Q1357-R1429 PolarHBondContact O-NH2 2.88Å; Q1357-I1432 HydrophobicContact CG-CD1 4.07Å
1358	G	90.9	Very high	89.3	Confident	15 Å²	15	45 Å²	45	16%	0.155	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	100.2	-5.5	-175.6	0	0	0	0	0	115.9	D1356 K1377	D1356-G1358 PolarHBondContact O-N 2.73Å; G1358-K1377 PolarHBondContact N-O 2.92Å
1359	E	93.3	Very high	88.9	Confident	96 Å²	96	50.3 Å²	50.3	45%	0.449	28%	0.276	S	S	.	.			trans	-65.3	153.2	172.3	-76.9	-166.8	-126	0	0	112.8	L1352 A1355 D1356 W1376 K1377	L1352-E1359 HydrophobicContact CD2-CB 4.06Å; A1355-E1359 HydrophobicContact CB-CB 3.95Å; A1355-E1359 HydrophobicContact CB-CG 4.28Å; D1356-E1359 HydrophobicContact CB-CG 4.28Å; D1356-E1359 WeakPolarHBondContact CB-OE1 3.14Å; D1356-E1359 PolarHBondContact N-OE1 2.81Å; D1356-E1359 WeakPolarHBondContact O-CB 3.13Å; D1356-E1359 PolarHBondContact O-N 3.3Å; D1356-E1359 VanDerWaalsContact O-N 3.11Å; E1359-W1376 WeakPolarHBondContact O-CA 3.13Å; E1359-W1376 WeakPolarHBondContact O-CB 3.39Å; E1359-K1377 PolarHBondContact O-N 2.61Å; E1359-K1377 VanDerWaalsContact O-N 3.1Å
1360	V	94.1	Very high	88.8	Confident	19 Å²	19	52.6 Å²	52.6	12%	0.115	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	133.7	-168.4	-168.1	0	0	0	0	111.6	T1375 W1376 I1417 I1421	V1360-T1375 CarbonylContact C-O 3.29Å; V1360-T1375 WeakPolarHBondContact CA-O 3.32Å; V1360-W1376 HydrophobicContact CG1-CB 4.46Å; V1360-W1376 HydrophobicContact CG2-CB 4.04Å; V1360-I1417 HydrophobicContact CB-CG1 4.49Å; V1360-I1417 HydrophobicContact CG1-CG1 4.2Å; V1360-I1417 HydrophobicContact CG2-CG2 4.42Å; V1360-I1421 HydrophobicContact CG1-CD1 3.73Å; V1360-I1421 HydrophobicContact CG2-CB 4.37Å; V1360-I1421 HydrophobicContact CG2-CD1 4.4Å; V1360-I1421 HydrophobicContact CG2-CG2 3.63Å
1361	A	93.7	Very high	88.9	Confident	0 Å²	0	51 Å²	51	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	115.6	170.7	0	0	0	0	0	110.6	F1341 V1348 M1351 L1352 T1375	F1341-A1361 HydrophobicContact CD2-CB 3.92Å; F1341-A1361 HydrophobicContact CE2-CB 4.07Å; V1348-A1361 HydrophobicContact CG1-CB 3.67Å; V1348-A1361 HydrophobicContact CG2-CB 4.44Å; M1351-A1361 HydrophobicContact CE-CB 3.55Å; L1352-A1361 HydrophobicContact CD1-CB 3.93Å; L1352-A1361 HydrophobicContact CD2-CB 4.37Å; L1352-A1361 HydrophobicContact CG-CB 4.21Å; A1361-T1375 PolarHBondContact N-O 3.24Å; A1361-T1375 PolarHBondContact O-N 3.08Å
1362	L	93.1	Very high	89	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	136.1	171.1	-71	151.8	0	0	0	109.2	S1339 F1340 F1341 T1373 A1374 L1413 I1417	S1339-L1362 WeakPolarHBondContact O-CB 3.24Å; S1339-L1362 PolarHBondContact O-N 2.89Å; F1340-L1362 CarbonylContact C-O 3.48Å; F1340-L1362 WeakPolarHBondContact CA-O 3.41Å; F1340-L1362 HydrophobicContact CB-CB 4.45Å; F1340-L1362 HydrophobicContact CD2-CB 4.08Å; F1341-L1362 PolarHBondContact N-O 3.46Å; L1362-T1373 WeakPolarHBondContact CA-O 3.3Å; L1362-A1374 HydrophobicContact CD2-CB 3.55Å; L1362-A1374 HydrophobicContact CG-CB 4.39Å; L1362-L1413 HydrophobicContact CD1-CB 3.89Å; L1362-L1413 HydrophobicContact CD1-CD1 4.23Å; L1362-L1413 HydrophobicContact CD1-CD2 3.94Å; L1362-L1413 HydrophobicContact CD1-CG 4.23Å; L1362-L1413 HydrophobicContact CD2-CD2 4.02Å; L1362-I1417 HydrophobicContact CD1-CD1 4.14Å
1363	R	91.6	Very high	89.2	Confident	12 Å²	12	48.9 Å²	48.9	5%	0.045	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	164	177.3	56.7	157.7	177.3	73	3.8	112.3	F1341 K1343 V1348 S1365 L1372 T1373	F1341-R1363 WeakPolarHBondContact O-CA 3.49Å; F1341-R1363 WeakPolarHBondContact O-CB 3.3Å; K1343-R1363 WeakPolarHBondContact O-CB 3.49Å; K1343-R1363 WeakPolarHBondContact O-CD 3.24Å; V1348-R1363 HydrophobicContact CG2-CB 4.2Å; V1348-R1363 HydrophobicContact CG2-CG 4.23Å; R1363-S1365 PolarHBondContact O-N 3.02Å; R1363-L1372 WeakPolarHBondContact O-CA 3.27Å; R1363-T1373 PolarHBondContact N-O 3.28Å; R1363-T1373 VanDerWaalsContact NH1-CB 3.3Å; R1363-T1373 PolarHBondContact NH1-OG1 3.29Å; R1363-T1373 PolarHBondContact O-N 2.91Å
1364	P	89.7	Confident	89.4	Confident	7 Å²	7	46.9 Å²	46.9	5%	0.045	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-50.9	139	166.6	-26	35.2	0	0	0	111.9	Y1330 R1333 F1340 F1341	Y1330-P1364 HydrophobicContact CD1-CB 4.39Å; R1333-P1364 HydrophobicContact CG-CG 4.16Å; F1340-P1364 HydrophobicContact CE2-CG 4.5Å; F1340-P1364 HydrophobicContact CZ-CG 3.98Å; F1341-P1364 VanDerWaalsContact O-CD 3.31Å; F1341-P1364 WeakPolarHBondContact O-CD 3.21Å
1365	S	87	Confident	89.8	Confident	7 Å²	7	37.9 Å²	37.9	5%	0.049	20%	0.201	C	C	.	.			trans	-80.8	144	172.8	-168.8	0	0	0	0	110.5	R1363 K1367 H1371	R1363-S1365 PolarHBondContact O-N 3.02Å; S1365-K1367 PolarHBondContact O-N 2.98Å; S1365-K1367 PolarHBondContact OG-N 3.36Å; S1365-H1371 WeakPolarHBondContact CB-O 3.16Å; S1365-H1371 PolarHBondContact N-O 2.95Å; S1365-H1371 VanDerWaalsContact N-O 3.16Å
1366	S	81.4	Confident	90	Very high	62 Å²	62	37.4 Å²	37.4	43%	0.434	20%	0.196	S	C	.	.	S	Bend	trans	-79.3	-2.3	169.8	47.9	0	0	0	0	113.2
1367	K	82.7	Confident	90.1	Very high	138 Å²	138	32 Å²	32	60%	0.6	17%	0.167	S	C	*	.	S	Bend	trans	-76.7	-51.2	-179.5	-63.9	-171.7	-174.1	-172.5	0	113.2	S1365 D1387	S1365-K1367 PolarHBondContact O-N 2.98Å; S1365-K1367 PolarHBondContact OG-N 3.36Å; K1367-D1387 WeakPolarHBondContact CE-OD2 3.43Å; K1367-D1387 IonicContact NZ-OD1 3.7Å; K1367-D1387 IonicContact NZ-OD2 3.16Å; K1367-D1387 PolarHBondContact NZ-OD2 3.3Å
1368	S	80.9	Confident	90.2	Very high	47 Å²	47	30.9 Å²	30.9	33%	0.329	16%	0.162	S	C	.	.			trans	-164.1	176	177	80	0	0	0	0	110.9	D1370 H1371	S1368-D1370 PolarHBondContact O-N 2.92Å; S1368-D1370 PolarHBondContact OG-N 2.89Å; S1368-D1370 PolarHBondContact OG-OD2 2.98Å; S1368-H1371 PolarHBondContact OG-CD2 2.68Å
1369	K	82.3	Confident	90.2	Very high	113 Å²	113	30.5 Å²	30.5	49%	0.491	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-14.9	170.8	-60.1	-175.1	-178.4	-178.1	0	113.8	R1333 K1393 D1396	R1333-K1369 PolarHBondContact NH2-O 3.43Å; K1369-K1393 PolarHBondContact O-NZ 3.39Å; K1369-D1396 WeakPolarHBondContact CD-OD2 3.3Å; K1369-D1396 WeakPolarHBondContact CE-OD2 3.45Å; K1369-D1396 IonicContact NZ-OD2 2.8Å; K1369-D1396 PolarHBondContact NZ-OD2 3.38Å
1370	D	86.6	Confident	90	Very high	81 Å²	81	31.6 Å²	31.6	43%	0.433	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	-105.9	15.5	-169.8	-45.7	-61.2	0	0	0	112.6	S1368 E1390	S1368-D1370 PolarHBondContact O-N 2.92Å; S1368-D1370 PolarHBondContact OG-N 2.89Å; S1368-D1370 PolarHBondContact OG-OD2 2.98Å; D1370-E1390 PolarHBondContact O-N 3.23Å
1371	H	90.6	Very high	89.6	Confident	30 Å²	30	35.9 Å²	35.9	14%	0.139	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	146	-179.8	-77.2	-120.4	0	0	0	111.1	R1333 S1365 S1368 D1387 V1388 E1390	R1333-H1371 PolarHBondContact NH2-O 2.92Å; S1365-H1371 WeakPolarHBondContact CB-O 3.16Å; S1365-H1371 PolarHBondContact N-O 2.95Å; S1365-H1371 VanDerWaalsContact N-O 3.16Å; S1368-H1371 PolarHBondContact OG-CD2 2.68Å; H1371-D1387 IonicContact CE1-OD1 2.7Å; H1371-D1387 IonicContact CE1-OD2 2.76Å; H1371-D1387 PolarHBondContact CE1-OD2 3.03Å; H1371-D1387 VanDerWaalsContact CE1-OD2 3.27Å; H1371-D1387 IonicContact CG-OD1 2.81Å; H1371-D1387 VanDerWaalsContact ND1-CG 3.25Å; H1371-D1387 IonicContact ND1-OD1 3.84Å; H1371-D1387 PolarHBondContact ND1-OD1 3.45Å; H1371-D1387 IonicContact ND1-OD2 2.7Å; H1371-D1387 PolarHBondContact ND1-OD2 3.37Å; H1371-V1388 CarbonylContact C-O 3.44Å; H1371-V1388 WeakPolarHBondContact CA-O 3.46Å; H1371-E1390 PolarHBondContact N-OE2 2.61Å
1372	L	91.6	Very high	89.5	Confident	0 Å²	0	36.2 Å²	36.2	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	170.3	161.3	-60.6	-178.4	0	0	0	109.9	I1335 F1340 R1363 V1388 E1390 L1399 L1413	I1335-L1372 HydrophobicContact CD1-CD1 4.26Å; I1335-L1372 HydrophobicContact CD1-CD2 4.34Å; F1340-L1372 HydrophobicContact CE2-CD2 3.97Å; R1363-L1372 WeakPolarHBondContact O-CA 3.27Å; L1372-V1388 HydrophobicContact CB-CB 4.26Å; L1372-V1388 PolarHBondContact N-O 3.41Å; L1372-V1388 PolarHBondContact O-N 3.49Å; L1372-E1390 HydrophobicContact CG-CG 4.24Å; L1372-L1399 HydrophobicContact CD1-CD1 3.65Å; L1372-L1413 HydrophobicContact CD1-CD2 4.1Å
1373	T	93.8	Very high	89.4	Confident	10 Å²	10	37.1 Å²	37.1	6%	0.061	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	119	169.5	-47.7	0	0	0	0	109.7	L1362 R1363 H1385 I1386	L1362-T1373 WeakPolarHBondContact CA-O 3.3Å; R1363-T1373 PolarHBondContact N-O 3.28Å; R1363-T1373 VanDerWaalsContact NH1-CB 3.3Å; R1363-T1373 PolarHBondContact NH1-OG1 3.29Å; R1363-T1373 PolarHBondContact O-N 2.91Å; T1373-H1385 HydrophobicContact CG2-CB 3.82Å; T1373-I1386 CarbonylContact C-O 3.47Å; T1373-I1386 WeakPolarHBondContact CA-O 3.48Å
1374	A	93.5	Very high	89.5	Confident	0 Å²	0	38.4 Å²	38.4	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	114.3	167.9	0	0	0	0	0	108.7	L1362 I1386 V1388 I1421	L1362-A1374 HydrophobicContact CD2-CB 3.55Å; L1362-A1374 HydrophobicContact CG-CB 4.39Å; A1374-I1386 HydrophobicContact CB-CB 4.38Å; A1374-I1386 PolarHBondContact N-O 2.87Å; A1374-I1386 PolarHBondContact O-N 3.03Å; A1374-V1388 HydrophobicContact CB-CG2 4.17Å; A1374-I1421 HydrophobicContact CB-CD1 3.8Å
1375	T	94.4	Very high	89.7	Confident	0 Å²	0	41.6 Å²	41.6	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	135.2	174.3	-56.9	0	0	0	0	109.2	V1348 L1352 V1360 A1361 F1383 Q1384 H1385	V1348-T1375 HydrophobicContact CG1-CG2 4Å; L1352-T1375 HydrophobicContact CD1-CG2 3.56Å; V1360-T1375 CarbonylContact C-O 3.29Å; V1360-T1375 WeakPolarHBondContact CA-O 3.32Å; A1361-T1375 PolarHBondContact N-O 3.24Å; A1361-T1375 PolarHBondContact O-N 3.08Å; T1375-F1383 HydrophobicContact CG2-CB 4.06Å; T1375-Q1384 WeakPolarHBondContact CA-O 3.32Å; T1375-H1385 WeakPolarHBondContact CG2-CE1 3.5Å; T1375-H1385 WeakPolarHBondContact CG2-ND1 3.47Å; T1375-H1385 PolarHBondContact OG1-ND1 3.41Å
1376	W	94.7	Very high	89.9	Confident	0 Å²	0	42 Å²	42	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	149.8	175.6	75.3	-84.4	0	0	0	113.3	E1359 V1360 V1378 F1383 Q1384 I1421 M1424 A1425 A1428	E1359-W1376 WeakPolarHBondContact O-CA 3.13Å; E1359-W1376 WeakPolarHBondContact O-CB 3.39Å; V1360-W1376 HydrophobicContact CG1-CB 4.46Å; V1360-W1376 HydrophobicContact CG2-CB 4.04Å; W1376-V1378 HydrophobicContact CD2-CG2 4.32Å; W1376-V1378 HydrophobicContact CE3-CG2 4.39Å; W1376-V1378 HydrophobicContact CH2-CB 4.19Å; W1376-V1378 HydrophobicContact CH2-CG1 4Å; W1376-V1378 HydrophobicContact CH2-CG2 3.98Å; W1376-V1378 HydrophobicContact CZ2-CG1 4.48Å; W1376-V1378 HydrophobicContact CZ2-CG2 3.87Å; W1376-V1378 HydrophobicContact CZ3-CB 4.28Å; W1376-V1378 HydrophobicContact CZ3-CG1 4.46Å; W1376-V1378 HydrophobicContact CZ3-CG2 4.23Å; W1376-V1378 PolarHBondContact O-N 3.13Å; W1376-F1383 WeakPolarHBondContact O-CA 3.31Å; W1376-Q1384 PolarHBondContact N-O 2.9Å; W1376-Q1384 PolarHBondContact O-N 3.15Å; W1376-I1421 HydrophobicContact CB-CG2 3.74Å; W1376-I1421 HydrophobicContact CD2-CG2 3.86Å; W1376-I1421 HydrophobicContact CE3-CG2 4.45Å; W1376-I1421 HydrophobicContact CG-CG2 3.54Å; W1376-M1424 HydrophobicContact CH2-CB 4.21Å; W1376-M1424 HydrophobicContact CZ2-CB 3.89Å; W1376-M1424 HydrophobicContact CZ2-CE 4.12Å; W1376-A1425 HydrophobicContact CE3-CB 4.15Å; W1376-A1425 HydrophobicContact CH2-CB 4.45Å; W1376-A1425 HydrophobicContact CZ3-CB 3.77Å; W1376-A1428 HydrophobicContact CH2-CB 4Å; W1376-A1428 HydrophobicContact CZ3-CB 4.44Å
1377	K	94.4	Very high	90.5	Very high	10 Å²	10	41.3 Å²	41.3	4%	0.043	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	105.8	-178.4	-169.6	-179.1	-168.8	-180	0	110.9	L1352 A1353 A1355 G1358 E1359 A1379 D1380 F1383	L1352-K1377 WeakPolarHBondContact O-CD 3.48Å; A1353-K1377 PolarHBondContact O-NZ 3.44Å; A1355-K1377 WeakPolarHBondContact O-CD 3.35Å; A1355-K1377 WeakPolarHBondContact O-CE 3.49Å; A1355-K1377 PolarHBondContact O-NZ 2.87Å; G1358-K1377 PolarHBondContact N-O 2.92Å; E1359-K1377 PolarHBondContact O-N 2.61Å; E1359-K1377 VanDerWaalsContact O-N 3.1Å; K1377-A1379 WeakPolarHBondContact CG-O 3.25Å; K1377-D1380 WeakPolarHBondContact CE-OD1 3.27Å; K1377-D1380 IonicContact NZ-OD1 2.71Å; K1377-D1380 PolarHBondContact NZ-OD1 3.41Å; K1377-F1383 HydrophobicContact CB-CD1 4.16Å; K1377-F1383 HydrophobicContact CB-CE1 4.15Å; K1377-F1383 HydrophobicContact CD-CE1 4.37Å; K1377-F1383 HydrophobicContact CG-CD1 4.22Å; K1377-F1383 HydrophobicContact CG-CE1 3.85Å
1378	V	93.7	Very high	91	Very high	2 Å²	2	34.8 Å²	34.8	1%	0.012	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	-47.1	-179.8	-171.2	0	0	0	0	110.6	Q1357 W1376 I1382 Q1384 A1428 I1432 P1478 F1481	Q1357-V1378 VanDerWaalsContact CG-O 3.31Å; Q1357-V1378 WeakPolarHBondContact CG-O 3.14Å; Q1357-V1378 PolarHBondContact NE2-O 3.5Å; W1376-V1378 HydrophobicContact CD2-CG2 4.32Å; W1376-V1378 HydrophobicContact CE3-CG2 4.39Å; W1376-V1378 HydrophobicContact CH2-CB 4.19Å; W1376-V1378 HydrophobicContact CH2-CG1 4Å; W1376-V1378 HydrophobicContact CH2-CG2 3.98Å; W1376-V1378 HydrophobicContact CZ2-CG1 4.48Å; W1376-V1378 HydrophobicContact CZ2-CG2 3.87Å; W1376-V1378 HydrophobicContact CZ3-CB 4.28Å; W1376-V1378 HydrophobicContact CZ3-CG1 4.46Å; W1376-V1378 HydrophobicContact CZ3-CG2 4.23Å; W1376-V1378 PolarHBondContact O-N 3.13Å; V1378-I1382 WeakPolarHBondContact CA-O 3.23Å; V1378-I1382 HydrophobicContact CB-CG2 4.15Å; V1378-I1382 VanDerWaalsContact CB-O 3.29Å; V1378-I1382 WeakPolarHBondContact CB-O 3.24Å; V1378-I1382 PolarHBondContact N-O 3.02Å; V1378-Q1384 HydrophobicContact CG2-CB 3.54Å; V1378-A1428 HydrophobicContact CG1-CB 4.18Å; V1378-I1432 VanDerWaalsContact O-CD1 3.32Å; V1378-I1432 WeakPolarHBondContact O-CD1 3.46Å; V1378-P1478 HydrophobicContact CG2-CB 4.35Å; V1378-F1481 HydrophobicContact CG1-CE2 4.25Å; V1378-F1481 HydrophobicContact CG1-CZ 4.44Å
1379	A	90.6	Very high	91.6	Very high	6 Å²	6	38 Å²	38	5%	0.05	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.8	177.8	174.2	0	0	0	0	0	107.8	K1377 D1381 I1382 I1432 A1473	K1377-A1379 WeakPolarHBondContact CG-O 3.25Å; A1379-D1381 PolarHBondContact O-N 3.5Å; A1379-I1382 HydrophobicContact CB-CB 4.38Å; A1379-I1382 PolarHBondContact N-O 3.39Å; A1379-I1382 PolarHBondContact O-N 3.38Å; A1379-I1382 VanDerWaalsContact O-N 3.12Å; A1379-I1432 HydrophobicContact CB-CD1 3.92Å; A1379-A1473 HydrophobicContact CB-CB 3.9Å
1380	D	88.8	Confident	92	Very high	119 Å²	119	32.8 Å²	32.8	64%	0.636	16%	0.162	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.1	136.1	174.6	-53.5	-57.9	0	0	0	111.3	K1377 I1382	K1377-D1380 WeakPolarHBondContact CE-OD1 3.27Å; K1377-D1380 IonicContact NZ-OD1 2.71Å; K1377-D1380 PolarHBondContact NZ-OD1 3.41Å; D1380-I1382 PolarHBondContact O-N 2.91Å
1381	D	86.2	Confident	92	Very high	110 Å²	110	32.8 Å²	32.8	59%	0.588	16%	0.159	S	C	*	.	T	Hydrogen-bonded Turn	trans	50.9	17.4	-170.9	-59.3	-25.7	0	0	0	116.8	A1379	A1379-D1381 PolarHBondContact O-N 3.5Å
1382	I	91	Very high	91.7	Very high	7 Å²	7	33.7 Å²	33.7	4%	0.036	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	99.6	-179.1	-59.4	175	0	0	0	110.1	V1378 A1379 D1380 N1440 A1473 R1475 P1478	V1378-I1382 WeakPolarHBondContact CA-O 3.23Å; V1378-I1382 HydrophobicContact CB-CG2 4.15Å; V1378-I1382 VanDerWaalsContact CB-O 3.29Å; V1378-I1382 WeakPolarHBondContact CB-O 3.24Å; V1378-I1382 PolarHBondContact N-O 3.02Å; A1379-I1382 HydrophobicContact CB-CB 4.38Å; A1379-I1382 PolarHBondContact N-O 3.39Å; A1379-I1382 PolarHBondContact O-N 3.38Å; A1379-I1382 VanDerWaalsContact O-N 3.12Å; D1380-I1382 PolarHBondContact O-N 2.91Å; I1382-N1440 HydrophobicContact CD1-CB 4.43Å; I1382-A1473 HydrophobicContact CD1-CB 3.6Å; I1382-A1473 WeakPolarHBondContact CD1-O 3.46Å; I1382-R1475 HydrophobicContact CD1-CB 4.26Å; I1382-R1475 HydrophobicContact CG1-CB 4.3Å; I1382-R1475 HydrophobicContact CG1-CG 4.32Å; I1382-P1478 HydrophobicContact CG2-CB 3.95Å; I1382-P1478 HydrophobicContact CG2-CG 4.09Å
1383	F	92.7	Very high	91.2	Very high	18 Å²	18	36 Å²	36	8%	0.079	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	137	-179.8	-49.4	-78.1	0	0	0	110.9	V1349 L1352 A1353 T1375 W1376 K1377 P1478	V1349-F1383 HydrophobicContact CG1-CD2 4.01Å; V1349-F1383 HydrophobicContact CG1-CE2 3.75Å; V1349-F1383 HydrophobicContact CG1-CZ 4.47Å; V1349-F1383 HydrophobicContact CG2-CD2 4.15Å; L1352-F1383 HydrophobicContact CB-CD1 3.89Å; L1352-F1383 HydrophobicContact CB-CE1 3.61Å; L1352-F1383 HydrophobicContact CD1-CD1 4.44Å; L1352-F1383 WeakPolarHBondContact O-CE1 3.38Å; A1353-F1383 HydrophobicContact CB-CZ 4.5Å; T1375-F1383 HydrophobicContact CG2-CB 4.06Å; W1376-F1383 WeakPolarHBondContact O-CA 3.31Å; K1377-F1383 HydrophobicContact CB-CD1 4.16Å; K1377-F1383 HydrophobicContact CB-CE1 4.15Å; K1377-F1383 HydrophobicContact CD-CE1 4.37Å; K1377-F1383 HydrophobicContact CG-CD1 4.22Å; K1377-F1383 HydrophobicContact CG-CE1 3.85Å; F1383-P1478 WeakPolarHBondContact O-CB 3.49Å; F1383-P1478 WeakPolarHBondContact O-CG 3.27Å
1384	Q	93.8	Very high	90.5	Very high	40 Å²	40	42.4 Å²	42.4	19%	0.187	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	129.7	173.8	-178.9	177.8	3.3	0	0	110.2	T1375 W1376 V1378 I1386 P1478	T1375-Q1384 WeakPolarHBondContact CA-O 3.32Å; W1376-Q1384 PolarHBondContact N-O 2.9Å; W1376-Q1384 PolarHBondContact O-N 3.15Å; V1378-Q1384 HydrophobicContact CG2-CB 3.54Å; Q1384-I1386 HydrophobicContact CG-CG1 4.25Å; Q1384-P1478 HydrophobicContact CB-CB 3.84Å; Q1384-P1478 HydrophobicContact CG-CB 4.42Å
1385	H	92.8	Very high	89.8	Confident	73 Å²	73	45.7 Å²	45.7	34%	0.338	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	113.1	179.4	-49.6	-70	0	0	0	109.8	Y1345 T1373 T1375	Y1345-H1385 AromaticContact CD2-CE1 3.93Å; Y1345-H1385 AromaticContact CE2-CE1 3.5Å; Y1345-H1385 VanDerWaalsContact CE2-CE1 3.5Å; Y1345-H1385 WeakPolarHBondContact CE2-CE1 3.41Å; Y1345-H1385 AromaticContact CE2-NE2 3.46Å; Y1345-H1385 WeakPolarHBondContact CE2-NE2 3.33Å; T1373-H1385 HydrophobicContact CG2-CB 3.82Å; T1375-H1385 WeakPolarHBondContact CG2-CE1 3.5Å; T1375-H1385 WeakPolarHBondContact CG2-ND1 3.47Å; T1375-H1385 PolarHBondContact OG1-ND1 3.41Å
1386	I	92.6	Very high	89.1	Confident	15 Å²	15	49.3 Å²	49.3	8%	0.077	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	124	178.8	-54.7	179.3	0	0	0	107.9	T1373 A1374 Q1384 I1405 I1421	T1373-I1386 CarbonylContact C-O 3.47Å; T1373-I1386 WeakPolarHBondContact CA-O 3.48Å; A1374-I1386 HydrophobicContact CB-CB 4.38Å; A1374-I1386 PolarHBondContact N-O 2.87Å; A1374-I1386 PolarHBondContact O-N 3.03Å; Q1384-I1386 HydrophobicContact CG-CG1 4.25Å; I1386-I1405 HydrophobicContact CG2-CD1 4.09Å; I1386-I1405 HydrophobicContact CG2-CG1 4.29Å; I1386-I1405 HydrophobicContact CG2-CG2 3.62Å; I1386-I1421 HydrophobicContact CD1-CG1 4.23Å
1387	D	93.4	Very high	88.4	Confident	49 Å²	49	54.8 Å²	54.8	26%	0.262	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	120.5	178.6	-172.6	46.2	0	0	0	109.4	K1367 H1371	K1367-D1387 WeakPolarHBondContact CE-OD2 3.43Å; K1367-D1387 IonicContact NZ-OD1 3.7Å; K1367-D1387 IonicContact NZ-OD2 3.16Å; K1367-D1387 PolarHBondContact NZ-OD2 3.3Å; H1371-D1387 IonicContact CE1-OD1 2.7Å; H1371-D1387 IonicContact CE1-OD2 2.76Å; H1371-D1387 PolarHBondContact CE1-OD2 3.03Å; H1371-D1387 VanDerWaalsContact CE1-OD2 3.27Å; H1371-D1387 IonicContact CG-OD1 2.81Å; H1371-D1387 VanDerWaalsContact ND1-CG 3.25Å; H1371-D1387 IonicContact ND1-OD1 3.84Å; H1371-D1387 PolarHBondContact ND1-OD1 3.45Å; H1371-D1387 IonicContact ND1-OD2 2.7Å; H1371-D1387 PolarHBondContact ND1-OD2 3.37Å
1388	V	93.4	Very high	87.8	Confident	0 Å²	0	56.2 Å²	56.2	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	113.4	-178.8	-178.7	0	0	0	0	107.3	H1371 L1372 A1374 L1403 I1405 I1416	H1371-V1388 CarbonylContact C-O 3.44Å; H1371-V1388 WeakPolarHBondContact CA-O 3.46Å; L1372-V1388 HydrophobicContact CB-CB 4.26Å; L1372-V1388 PolarHBondContact N-O 3.41Å; L1372-V1388 PolarHBondContact O-N 3.49Å; A1374-V1388 HydrophobicContact CB-CG2 4.17Å; V1388-L1403 HydrophobicContact CG1-CB 4.05Å; V1388-I1405 HydrophobicContact CG2-CD1 4.12Å; V1388-I1405 HydrophobicContact CG2-CG1 4.06Å; V1388-I1416 HydrophobicContact CG1-CD1 3.64Å; V1388-I1416 HydrophobicContact CG2-CD1 4.23Å
1389	R	92.4	Very high	87.4	Confident	114 Å²	114	58.6 Å²	58.6	43%	0.43	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	131.5	-178.9	-179.8	169.3	175.6	-90.1	-14.1	110	E1391 W1404	R1389-E1391 IonicContact CZ-OE1 3.18Å; R1389-E1391 IonicContact NH1-OE1 2.71Å; R1389-E1391 PolarHBondContact NH1-OE1 3.11Å; R1389-E1391 IonicContact NH2-OE1 2.82Å; R1389-E1391 PolarHBondContact NH2-OE1 3.49Å; R1389-W1404 HydrophobicContact CB-CB 4.28Å; R1389-W1404 PolarHBondContact N-O 2.89Å; R1389-W1404 PolarHBondContact O-N 3.43Å
1390	E	90.4	Very high	87.2	Confident	5 Å²	5	58.6 Å²	58.6	2%	0.023	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	132.6	-175.7	-60.2	165.7	88.6	0	0	110.5	R1333 D1370 H1371 L1372 K1393 G1400 L1403	R1333-E1390 IonicContact CZ-OE1 3.01Å; R1333-E1390 IonicContact CZ-OE2 3.76Å; R1333-E1390 IonicContact NH1-OE1 3.72Å; R1333-E1390 PolarHBondContact NH1-OE1 3.02Å; R1333-E1390 IonicContact NH1-OE2 3.1Å; R1333-E1390 PolarHBondContact NH1-OE2 2.85Å; R1333-E1390 IonicContact NH2-OE1 3.66Å; R1333-E1390 IonicContact NH2-OE2 2.72Å; R1333-E1390 PolarHBondContact NH2-OE2 3.36Å; D1370-E1390 PolarHBondContact O-N 3.23Å; H1371-E1390 PolarHBondContact N-OE2 2.61Å; L1372-E1390 HydrophobicContact CG-CG 4.24Å; E1390-K1393 VanDerWaalsContact CB-CE 3.42Å; E1390-K1393 VanDerWaalsContact CD-CE 3.44Å; E1390-K1393 VanDerWaalsContact OE1-CE 3.32Å; E1390-K1393 WeakPolarHBondContact OE1-CE 3.35Å; E1390-K1393 IonicContact OE1-NZ 3.27Å; E1390-K1393 PolarHBondContact OE1-NZ 3.16Å; E1390-K1393 IonicContact OE2-NZ 2.68Å; E1390-K1393 PolarHBondContact OE2-NZ 3.35Å; E1390-G1400 PolarHBondContact OE1-N 2.9Å; E1390-L1403 HydrophobicContact CB-CD2 4.34Å; E1390-L1403 HydrophobicContact CG-CD2 3.78Å
1391	E	88.5	Confident	87	Confident	81 Å²	81	61.8 Å²	61.8	38%	0.379	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	159.4	169.2	-62.8	-164.7	173.7	0	0	112.1	R1389 G1400 R1401 S1402	R1389-E1391 IonicContact CZ-OE1 3.18Å; R1389-E1391 IonicContact NH1-OE1 2.71Å; R1389-E1391 PolarHBondContact NH1-OE1 3.11Å; R1389-E1391 IonicContact NH2-OE1 2.82Å; R1389-E1391 PolarHBondContact NH2-OE1 3.49Å; E1391-G1400 CarbonylContact O-C 3.53Å; E1391-G1400 WeakPolarHBondContact O-CA 3.37Å; E1391-R1401 PolarHBondContact O-N 3.04Å; E1391-S1402 PolarHBondContact N-O 3.2Å; E1391-S1402 PolarHBondContact O-N 3.37Å
1392	G	84	Confident	87.1	Confident	49 Å²	49	57.4 Å²	57.4	51%	0.505	28%	0.282	S	S	.	.	S	Bend	trans	73.9	40.1	172.9	0	0	0	0	0	115.9	R1401	G1392-R1401 WeakPolarHBondContact O-CD 3.44Å; G1392-R1401 VanDerWaalsContact O-CG 3.25Å; G1392-R1401 WeakPolarHBondContact O-CG 3.44Å
1393	K	79.8	Confident	87.1	Confident	49 Å²	49	57 Å²	57	21%	0.213	28%	0.28	C	S	.	.			trans	-76.1	151.7	179.3	-60.7	-174.8	-178.7	-157.1	0	113.5	R1333 K1369 E1390	R1333-K1393 VanDerWaalsContact CZ-NZ 3.33Å; K1369-K1393 PolarHBondContact O-NZ 3.39Å; E1390-K1393 VanDerWaalsContact CB-CE 3.42Å; E1390-K1393 VanDerWaalsContact CD-CE 3.44Å; E1390-K1393 VanDerWaalsContact OE1-CE 3.32Å; E1390-K1393 WeakPolarHBondContact OE1-CE 3.35Å; E1390-K1393 IonicContact OE1-NZ 3.27Å; E1390-K1393 PolarHBondContact OE1-NZ 3.16Å; E1390-K1393 IonicContact OE2-NZ 2.68Å; E1390-K1393 PolarHBondContact OE2-NZ 3.35Å
1394	E	78.6	Confident	87.1	Confident	144 Å²	144	59.6 Å²	59.6	67%	0.673	29%	0.29	S	S	*	.	S	Bend	trans	-93.5	-25.6	172.6	-61.4	-174.3	179	0	0	112.9	R1401	E1394-R1401 IonicContact OE1-CZ 3.04Å; E1394-R1401 IonicContact OE1-NE 3.03Å; E1394-R1401 PolarHBondContact OE1-NE 3.34Å; E1394-R1401 IonicContact OE1-NH2 3.89Å; E1394-R1401 PolarHBondContact OE1-NH2 3.35Å
1395	N	79.9	Confident	87	Confident	68 Å²	68	58.4 Å²	58.4	36%	0.364	28%	0.284	S	S	.	.	S	Bend	trans	-157.5	169.8	171.1	65.5	72.1	0	0	0	110.3	F1397 S1398	N1395-F1397 PolarHBondContact O-N 3.2Å; N1395-F1397 WeakPolarHBondContact OD1-CA 3.31Å; N1395-F1397 WeakPolarHBondContact OD1-CB 3.22Å; N1395-F1397 PolarHBondContact OD1-N 2.64Å; N1395-S1398 PolarHBondContact ND2-OG 3.15Å; N1395-S1398 PolarHBondContact OD1-N 2.67Å; N1395-S1398 PolarHBondContact OD1-OG 3.4Å
1396	D	79	Confident	86.6	Confident	76 Å²	76	58.7 Å²	58.7	41%	0.406	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-20.8	-178.3	-77.4	8.1	0	0	0	115.1	R1333 K1369	R1333-D1396 WeakPolarHBondContact CD-O 3.44Å; K1369-D1396 WeakPolarHBondContact CD-OD2 3.3Å; K1369-D1396 WeakPolarHBondContact CE-OD2 3.45Å; K1369-D1396 IonicContact NZ-OD2 2.8Å; K1369-D1396 PolarHBondContact NZ-OD2 3.38Å
1397	F	80.3	Confident	86.3	Confident	115 Å²	115	64.4 Å²	64.4	50%	0.504	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98	-22.6	-171.5	-54.2	-79.7	0	0	0	113.5	R1332 R1333 V1334 N1395	R1332-F1397 WeakPolarHBondContact O-CD1 3.39Å; R1333-F1397 WeakPolarHBondContact CB-O 3.36Å; V1334-F1397 PolarHBondContact N-O 3.43Å; N1395-F1397 PolarHBondContact O-N 3.2Å; N1395-F1397 WeakPolarHBondContact OD1-CA 3.31Å; N1395-F1397 WeakPolarHBondContact OD1-CB 3.22Å; N1395-F1397 PolarHBondContact OD1-N 2.64Å
1398	S	82.1	Confident	86	Confident	41 Å²	41	65.2 Å²	65.2	29%	0.287	35%	0.345	S	S	.	.	S	Bend	trans	-81.2	169.7	179.3	-63.6	0	0	0	0	113.2	R1333 N1395	R1333-S1398 PolarHBondContact NH1-O 2.88Å; R1333-S1398 VanDerWaalsContact NH1-O 3.15Å; N1395-S1398 PolarHBondContact ND2-OG 3.15Å; N1395-S1398 PolarHBondContact OD1-N 2.67Å; N1395-S1398 PolarHBondContact OD1-OG 3.4Å
1399	L	86.2	Confident	85.9	Confident	51 Å²	51	70.2 Å²	70.2	27%	0.267	37%	0.369	S	S	.	.	P	Polyproline II helix	trans	-75	153.1	169.2	-170.7	64.5	0	0	0	110.5	I1335 L1372 L1403 L1413	I1335-L1399 HydrophobicContact CD1-CB 4.3Å; I1335-L1399 HydrophobicContact CD1-CD1 4.18Å; I1335-L1399 HydrophobicContact CG1-CB 4.26Å; L1372-L1399 HydrophobicContact CD1-CD1 3.65Å; L1399-L1403 HydrophobicContact CD1-CD1 4.3Å; L1399-L1403 HydrophobicContact CD1-CD2 3.81Å; L1399-L1403 HydrophobicContact CD2-CD1 4.4Å; L1399-L1403 HydrophobicContact CG-CD2 4.18Å; L1399-L1413 HydrophobicContact CD1-CD1 4.17Å; L1399-L1413 HydrophobicContact CD1-CD2 4.16Å; L1399-L1413 HydrophobicContact CD1-CG 4.25Å; L1399-L1413 HydrophobicContact CD2-CD1 4.05Å; L1399-L1413 HydrophobicContact CD2-CG 4.02Å
1400	G	85.1	Confident	85.9	Confident	7 Å²	7	64.9 Å²	64.9	7%	0.072	35%	0.348	C	S	.	.	P	Polyproline II helix	trans	-69.5	158.6	169	0	0	0	0	0	113.4	E1390 E1391	E1390-G1400 PolarHBondContact OE1-N 2.9Å; E1391-G1400 CarbonylContact O-C 3.53Å; E1391-G1400 WeakPolarHBondContact O-CA 3.37Å
1401	R	85.9	Confident	85.6	Confident	185 Å²	185	72.7 Å²	72.7	70%	0.698	39%	0.385	S	S	*	.	S	Bend	trans	-81.1	-13	174.4	-75	177.4	177.4	-159.9	2.3	113.8	E1391 G1392 E1394	E1391-R1401 PolarHBondContact O-N 3.04Å; G1392-R1401 WeakPolarHBondContact O-CD 3.44Å; G1392-R1401 VanDerWaalsContact O-CG 3.25Å; G1392-R1401 WeakPolarHBondContact O-CG 3.44Å; E1394-R1401 IonicContact OE1-CZ 3.04Å; E1394-R1401 IonicContact OE1-NE 3.03Å; E1394-R1401 PolarHBondContact OE1-NE 3.34Å; E1394-R1401 IonicContact OE1-NH2 3.89Å; E1394-R1401 PolarHBondContact OE1-NH2 3.35Å
1402	S	86.7	Confident	85.7	Confident	18 Å²	18	72.2 Å²	72.2	13%	0.126	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	138.3	169.4	57.1	0	0	0	0	109.2	E1391 W1404 E1409	E1391-S1402 PolarHBondContact N-O 3.2Å; E1391-S1402 PolarHBondContact O-N 3.37Å; S1402-W1404 PolarHBondContact OG-NE1 3.13Å; S1402-E1409 VanDerWaalsContact CB-OE1 3.22Å; S1402-E1409 WeakPolarHBondContact CB-OE1 3.45Å
1403	L	91.7	Very high	86.1	Confident	0 Å²	0	70 Å²	70	0%	0	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	131.9	-177.3	-54.3	178.4	0	0	0	109.6	V1388 E1390 L1399 E1409 F1410 L1413 I1416	V1388-L1403 HydrophobicContact CG1-CB 4.05Å; E1390-L1403 HydrophobicContact CB-CD2 4.34Å; E1390-L1403 HydrophobicContact CG-CD2 3.78Å; L1399-L1403 HydrophobicContact CD1-CD1 4.3Å; L1399-L1403 HydrophobicContact CD1-CD2 3.81Å; L1399-L1403 HydrophobicContact CD2-CD1 4.4Å; L1399-L1403 HydrophobicContact CG-CD2 4.18Å; L1403-E1409 CarbonylContact O-C 3.49Å; L1403-E1409 WeakPolarHBondContact O-CA 3.48Å; L1403-F1410 HydrophobicContact CB-CB 4.34Å; L1403-F1410 PolarHBondContact N-O 3.08Å; L1403-F1410 VanDerWaalsContact N-O 3.12Å; L1403-F1410 PolarHBondContact O-N 3.25Å; L1403-L1413 HydrophobicContact CD1-CD2 3.79Å; L1403-L1413 HydrophobicContact CD1-CG 4.18Å; L1403-I1416 HydrophobicContact CB-CD1 3.92Å; L1403-I1416 HydrophobicContact CD1-CD1 3.9Å
1404	W	91.9	Very high	86.7	Confident	71 Å²	71	71.7 Å²	71.7	27%	0.269	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	126.3	-169.2	-66.1	82.6	0	0	0	111.9	R1389 S1402 E1408 E1409	R1389-W1404 HydrophobicContact CB-CB 4.28Å; R1389-W1404 PolarHBondContact N-O 2.89Å; R1389-W1404 PolarHBondContact O-N 3.43Å; S1402-W1404 PolarHBondContact OG-NE1 3.13Å; W1404-E1408 WeakPolarHBondContact CA-O 3.43Å; W1404-E1409 HydrophobicContact CD2-CB 4.26Å; W1404-E1409 HydrophobicContact CD2-CG 4.38Å; W1404-E1409 HydrophobicContact CE3-CB 4.07Å; W1404-E1409 HydrophobicContact CH2-CB 3.76Å; W1404-E1409 HydrophobicContact CH2-CG 4.04Å; W1404-E1409 HydrophobicContact CZ2-CB 3.94Å; W1404-E1409 HydrophobicContact CZ2-CG 3.71Å; W1404-E1409 WeakPolarHBondContact CZ2-OE1 3.27Å; W1404-E1409 HydrophobicContact CZ3-CB 3.83Å
1405	I	91.3	Very high	87.3	Confident	15 Å²	15	67.4 Å²	67.4	8%	0.077	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	105.7	169.4	-58.1	175.1	0	0	0	108	I1386 V1388 T1407 E1408 F1410 I1416	I1386-I1405 HydrophobicContact CG2-CD1 4.09Å; I1386-I1405 HydrophobicContact CG2-CG1 4.29Å; I1386-I1405 HydrophobicContact CG2-CG2 3.62Å; V1388-I1405 HydrophobicContact CG2-CD1 4.12Å; V1388-I1405 HydrophobicContact CG2-CG1 4.06Å; I1405-T1407 PolarHBondContact O-N 2.97Å; I1405-E1408 PolarHBondContact N-O 2.71Å; I1405-E1408 PolarHBondContact O-N 3.09Å; I1405-E1408 VanDerWaalsContact O-N 3.07Å; I1405-F1410 HydrophobicContact CB-CE2 3.82Å; I1405-F1410 HydrophobicContact CB-CZ 4.49Å; I1405-F1410 HydrophobicContact CD1-CD2 4.45Å; I1405-F1410 HydrophobicContact CD1-CE2 4Å; I1405-F1410 HydrophobicContact CD1-CZ 4.19Å; I1405-F1410 HydrophobicContact CG1-CD2 4.36Å; I1405-F1410 HydrophobicContact CG1-CE2 3.99Å; I1405-I1416 HydrophobicContact CD1-CB 4.35Å; I1405-I1416 HydrophobicContact CD1-CD1 4.13Å; I1405-I1416 HydrophobicContact CD1-CG1 3.92Å; I1405-I1416 HydrophobicContact CD1-CG2 3.65Å
1406	G	85.4	Confident	87.9	Confident	80 Å²	80	64.1 Å²	64.1	83%	0.825	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.3	-100.2	-176.3	0	0	0	0	0	112.3
1407	T	86.8	Confident	88.5	Confident	134 Å²	134	61.5 Å²	61.5	82%	0.822	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-120.2	5.8	177.3	54.6	0	0	0	0	113.1	I1405	I1405-T1407 PolarHBondContact O-N 2.97Å
1408	E	87.3	Confident	89.1	Confident	66 Å²	66	58.8 Å²	58.8	31%	0.308	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	131.7	177.8	-69.9	172.2	-142	0	0	110.1	W1404 I1405 F1410 R1419	W1404-E1408 WeakPolarHBondContact CA-O 3.43Å; I1405-E1408 PolarHBondContact N-O 2.71Å; I1405-E1408 PolarHBondContact O-N 3.09Å; I1405-E1408 VanDerWaalsContact O-N 3.07Å; E1408-F1410 HydrophobicContact CB-CD2 4.45Å; E1408-F1410 HydrophobicContact CB-CE2 3.61Å; E1408-F1410 HydrophobicContact CB-CZ 4.11Å; E1408-R1419 IonicContact OE2-CZ 2.76Å; E1408-R1419 IonicContact OE2-NH1 3.18Å; E1408-R1419 PolarHBondContact OE2-NH1 3.3Å
1409	E	91.5	Very high	89.6	Confident	105 Å²	105	61.4 Å²	61.4	49%	0.491	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	148.1	170.8	-168.4	168.3	-158.2	0	0	109.5	S1402 L1403 W1404 R1419	S1402-E1409 VanDerWaalsContact CB-OE1 3.22Å; S1402-E1409 WeakPolarHBondContact CB-OE1 3.45Å; L1403-E1409 CarbonylContact O-C 3.49Å; L1403-E1409 WeakPolarHBondContact O-CA 3.48Å; W1404-E1409 HydrophobicContact CD2-CB 4.26Å; W1404-E1409 HydrophobicContact CD2-CG 4.38Å; W1404-E1409 HydrophobicContact CE3-CB 4.07Å; W1404-E1409 HydrophobicContact CH2-CB 3.76Å; W1404-E1409 HydrophobicContact CH2-CG 4.04Å; W1404-E1409 HydrophobicContact CZ2-CB 3.94Å; W1404-E1409 HydrophobicContact CZ2-CG 3.71Å; W1404-E1409 WeakPolarHBondContact CZ2-OE1 3.27Å; W1404-E1409 HydrophobicContact CZ3-CB 3.83Å; E1409-R1419 PolarHBondContact O-NH2 3.3Å
1410	F	90.9	Very high	89.9	Confident	2 Å²	2	60 Å²	60	1%	0.009	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	141.2	178.1	-61	-106.2	0	0	0	108.8	L1403 I1405 E1408 E1415 I1416 R1419 H1420	L1403-F1410 HydrophobicContact CB-CB 4.34Å; L1403-F1410 PolarHBondContact N-O 3.08Å; L1403-F1410 VanDerWaalsContact N-O 3.12Å; L1403-F1410 PolarHBondContact O-N 3.25Å; I1405-F1410 HydrophobicContact CB-CE2 3.82Å; I1405-F1410 HydrophobicContact CB-CZ 4.49Å; I1405-F1410 HydrophobicContact CD1-CD2 4.45Å; I1405-F1410 HydrophobicContact CD1-CE2 4Å; I1405-F1410 HydrophobicContact CD1-CZ 4.19Å; I1405-F1410 HydrophobicContact CG1-CD2 4.36Å; I1405-F1410 HydrophobicContact CG1-CE2 3.99Å; E1408-F1410 HydrophobicContact CB-CD2 4.45Å; E1408-F1410 HydrophobicContact CB-CE2 3.61Å; E1408-F1410 HydrophobicContact CB-CZ 4.11Å; F1410-E1415 VanDerWaalsContact CA-OE2 3.24Å; F1410-E1415 WeakPolarHBondContact CA-OE2 3.25Å; F1410-E1415 HydrophobicContact CD1-CB 4.33Å; F1410-E1415 HydrophobicContact CD1-CG 4.18Å; F1410-I1416 HydrophobicContact CB-CD1 4.23Å; F1410-I1416 HydrophobicContact CB-CG1 3.67Å; F1410-I1416 HydrophobicContact CD1-CB 4.26Å; F1410-I1416 HydrophobicContact CD1-CG1 3.54Å; F1410-I1416 HydrophobicContact CD2-CG1 4.02Å; F1410-I1416 HydrophobicContact CE1-CG1 4.15Å; F1410-I1416 HydrophobicContact CG-CD1 4.34Å; F1410-I1416 HydrophobicContact CG-CG1 3.47Å; F1410-I1416 VanDerWaalsContact CG-CG1 3.47Å; F1410-R1419 HydrophobicContact CE1-CB 4.31Å; F1410-H1420 HydrophobicContact CE1-CB 4.01Å; F1410-H1420 HydrophobicContact CZ-CB 3.97Å
1411	E	85.6	Confident	90.3	Very high	170 Å²	170	59.8 Å²	59.8	79%	0.794	31%	0.313	S	S	*	.	S	Bend	trans	-74.6	-39.7	-178.6	-62.9	-172.5	175.2	0	0	111.7	E1415	E1411-E1415 PolarHBondContact N-OE2 3.11Å
1412	D	89.9	Confident	90.6	Very high	71 Å²	71	55.8 Å²	55.8	38%	0.38	30%	0.303	S	S	.	.	S	Bend	trans	-148.3	-175.4	179.8	71.3	36.7	0	0	0	114.3	D1414 E1415 I1416	D1412-D1414 WeakPolarHBondContact OD1-CA 3.43Å; D1412-D1414 PolarHBondContact OD1-N 2.98Å; D1412-E1415 PolarHBondContact OD1-N 3.49Å; D1412-I1416 PolarHBondContact O-N 3.47Å
1413	L	92.3	Very high	90.9	Very high	3 Å²	3	56.8 Å²	56.8	2%	0.016	31%	0.309	C	S	.	.	H	α-helix	trans	-76.4	-27	-177.7	-65.7	173.8	0	0	0	113.5	I1335 H1337 L1362 L1372 L1399 L1403 I1416 I1417	I1335-L1413 HydrophobicContact CG2-CD1 3.85Å; H1337-L1413 HydrophobicContact CB-CD1 3.8Å; L1362-L1413 HydrophobicContact CD1-CB 3.89Å; L1362-L1413 HydrophobicContact CD1-CD1 4.23Å; L1362-L1413 HydrophobicContact CD1-CD2 3.94Å; L1362-L1413 HydrophobicContact CD1-CG 4.23Å; L1362-L1413 HydrophobicContact CD2-CD2 4.02Å; L1372-L1413 HydrophobicContact CD1-CD2 4.1Å; L1399-L1413 HydrophobicContact CD1-CD1 4.17Å; L1399-L1413 HydrophobicContact CD1-CD2 4.16Å; L1399-L1413 HydrophobicContact CD1-CG 4.25Å; L1399-L1413 HydrophobicContact CD2-CD1 4.05Å; L1399-L1413 HydrophobicContact CD2-CG 4.02Å; L1403-L1413 HydrophobicContact CD1-CD2 3.79Å; L1403-L1413 HydrophobicContact CD1-CG 4.18Å; L1413-I1416 HydrophobicContact CD2-CD1 4.5Å; L1413-I1417 WeakPolarHBondContact O-CG1 3.4Å; L1413-I1417 PolarHBondContact O-N 3Å
1414	D	91.3	Very high	91	Very high	84 Å²	84	57 Å²	57	45%	0.449	31%	0.311	S	S	.	.	H	α-helix	trans	-77.1	-34.3	176.7	-73.9	-50.7	0	0	0	110.9	H1337 D1412 I1416 I1417 A1418	H1337-D1414 IonicContact CD2-OD1 2.68Å; H1337-D1414 IonicContact CD2-OD2 3.42Å; H1337-D1414 IonicContact CE1-OD1 3.78Å; H1337-D1414 WeakPolarHBondContact NE2-CB 3.09Å; H1337-D1414 PolarHBondContact NE2-N 3.02Å; H1337-D1414 CovalentContact NE2-OD1 1.78Å; H1337-D1414 IonicContact NE2-OD1 2.67Å; H1337-D1414 PolarHBondContact NE2-OD1 3.47Å; H1337-D1414 IonicContact NE2-OD2 2.71Å; H1337-D1414 PolarHBondContact NE2-OD2 3.21Å; D1412-D1414 WeakPolarHBondContact OD1-CA 3.43Å; D1412-D1414 PolarHBondContact OD1-N 2.98Å; D1414-I1416 VanDerWaalsContact C-N 3.34Å; D1414-I1416 PolarHBondContact O-N 2.94Å; D1414-I1417 PolarHBondContact O-N 3.4Å; D1414-A1418 VanDerWaalsContact O-CB 3.29Å; D1414-A1418 WeakPolarHBondContact O-CB 3.4Å; D1414-A1418 PolarHBondContact O-N 3.36Å
1415	E	91.8	Very high	91.1	Very high	53 Å²	53	54 Å²	54	25%	0.248	30%	0.3	C	S	.	.	H	α-helix	trans	-62.4	-40.7	171.5	-159.1	-150.4	146.4	0	0	111.6	F1410 E1411 D1412 I1417 A1418 R1419	F1410-E1415 VanDerWaalsContact CA-OE2 3.24Å; F1410-E1415 WeakPolarHBondContact CA-OE2 3.25Å; F1410-E1415 HydrophobicContact CD1-CB 4.33Å; F1410-E1415 HydrophobicContact CD1-CG 4.18Å; E1411-E1415 PolarHBondContact N-OE2 3.11Å; D1412-E1415 PolarHBondContact OD1-N 3.49Å; E1415-I1417 VanDerWaalsContact C-N 3.34Å; E1415-I1417 PolarHBondContact O-N 2.92Å; E1415-A1418 PolarHBondContact O-N 3.44Å; E1415-R1419 HydrophobicContact CG-CB 4.46Å; E1415-R1419 VanDerWaalsContact O-CB 3.26Å; E1415-R1419 WeakPolarHBondContact O-CB 3.49Å; E1415-R1419 PolarHBondContact O-N 2.83Å; E1415-R1419 IonicContact OE1-CZ 2.82Å; E1415-R1419 IonicContact OE1-NE 3.17Å; E1415-R1419 PolarHBondContact OE1-NE 3.29Å; E1415-R1419 IonicContact OE1-NH2 2.67Å; E1415-R1419 PolarHBondContact OE1-NH2 3.04Å
1416	I	92.5	Very high	91.2	Very high	0 Å²	0	58.3 Å²	58.3	0%	0	32%	0.323	C	S	.	.	I	π-helix	trans	-58.3	-47	173.4	-74.2	171.9	0	0	0	110.8	V1388 L1403 I1405 F1410 D1412 L1413 D1414 H1420 I1421	V1388-I1416 HydrophobicContact CG1-CD1 3.64Å; V1388-I1416 HydrophobicContact CG2-CD1 4.23Å; L1403-I1416 HydrophobicContact CB-CD1 3.92Å; L1403-I1416 HydrophobicContact CD1-CD1 3.9Å; I1405-I1416 HydrophobicContact CD1-CB 4.35Å; I1405-I1416 HydrophobicContact CD1-CD1 4.13Å; I1405-I1416 HydrophobicContact CD1-CG1 3.92Å; I1405-I1416 HydrophobicContact CD1-CG2 3.65Å; F1410-I1416 HydrophobicContact CB-CD1 4.23Å; F1410-I1416 HydrophobicContact CB-CG1 3.67Å; F1410-I1416 HydrophobicContact CD1-CB 4.26Å; F1410-I1416 HydrophobicContact CD1-CG1 3.54Å; F1410-I1416 HydrophobicContact CD2-CG1 4.02Å; F1410-I1416 HydrophobicContact CE1-CG1 4.15Å; F1410-I1416 HydrophobicContact CG-CD1 4.34Å; F1410-I1416 HydrophobicContact CG-CG1 3.47Å; F1410-I1416 VanDerWaalsContact CG-CG1 3.47Å; D1412-I1416 PolarHBondContact O-N 3.47Å; L1413-I1416 HydrophobicContact CD2-CD1 4.5Å; D1414-I1416 VanDerWaalsContact C-N 3.34Å; D1414-I1416 PolarHBondContact O-N 2.94Å; I1416-H1420 VanDerWaalsContact O-CB 3.29Å; I1416-H1420 WeakPolarHBondContact O-CB 3.16Å; I1416-H1420 PolarHBondContact O-N 3.16Å; I1416-H1420 VanDerWaalsContact O-N 3.12Å; I1416-I1421 HydrophobicContact CG2-CD1 3.96Å; I1416-I1421 HydrophobicContact CG2-CG1 4.42Å; I1416-I1421 PolarHBondContact O-N 3.4Å
1417	I	92.8	Very high	91.6	Very high	20 Å²	20	54.9 Å²	54.9	10%	0.103	29%	0.287	C	S	.	.	I	π-helix	trans	-64.2	-50.5	179.2	-67.7	166.7	0	0	0	110	H1337 V1360 L1362 L1413 D1414 E1415 I1421 M1422	H1337-I1417 WeakPolarHBondContact CE1-CD1 3.47Å; V1360-I1417 HydrophobicContact CB-CG1 4.49Å; V1360-I1417 HydrophobicContact CG1-CG1 4.2Å; V1360-I1417 HydrophobicContact CG2-CG2 4.42Å; L1362-I1417 HydrophobicContact CD1-CD1 4.14Å; L1413-I1417 WeakPolarHBondContact O-CG1 3.4Å; L1413-I1417 PolarHBondContact O-N 3Å; D1414-I1417 PolarHBondContact O-N 3.4Å; E1415-I1417 VanDerWaalsContact C-N 3.34Å; E1415-I1417 PolarHBondContact O-N 2.92Å; I1417-I1421 PolarHBondContact O-N 3.39Å; I1417-M1422 HydrophobicContact CG2-CG 4.04Å; I1417-M1422 HydrophobicContact CG2-SD 4.14Å; I1417-M1422 WeakPolarHBondContact O-CB 3.17Å; I1417-M1422 WeakPolarHBondContact O-CG 3.33Å; I1417-M1422 PolarHBondContact O-N 3.43Å
1418	A	92.2	Very high	91.9	Very high	58 Å²	58	48.5 Å²	48.5	48%	0.479	25%	0.248	S	C	.	.	I	π-helix	trans	-73.6	-39.8	-173	0	0	0	0	0	114.4	D1414 E1415 P1423	D1414-A1418 VanDerWaalsContact O-CB 3.29Å; D1414-A1418 WeakPolarHBondContact O-CB 3.4Å; D1414-A1418 PolarHBondContact O-N 3.36Å; E1415-A1418 PolarHBondContact O-N 3.44Å; A1418-P1423 WeakPolarHBondContact O-CD 3.35Å
1419	R	92.6	Very high	92.2	Very high	96 Å²	96	49.9 Å²	49.9	36%	0.362	25%	0.25	S	S	.	.	I	π-helix	trans	-92.6	-28.5	-175.1	-172.7	167.8	63	75.6	-6.8	113.8	E1408 E1409 F1410 E1415	E1408-R1419 IonicContact OE2-CZ 2.76Å; E1408-R1419 IonicContact OE2-NH1 3.18Å; E1408-R1419 PolarHBondContact OE2-NH1 3.3Å; E1409-R1419 PolarHBondContact O-NH2 3.3Å; F1410-R1419 HydrophobicContact CE1-CB 4.31Å; E1415-R1419 HydrophobicContact CG-CB 4.46Å; E1415-R1419 VanDerWaalsContact O-CB 3.26Å; E1415-R1419 WeakPolarHBondContact O-CB 3.49Å; E1415-R1419 PolarHBondContact O-N 2.83Å; E1415-R1419 IonicContact OE1-CZ 2.82Å; E1415-R1419 IonicContact OE1-NE 3.17Å; E1415-R1419 PolarHBondContact OE1-NE 3.29Å; E1415-R1419 IonicContact OE1-NH2 2.67Å; E1415-R1419 PolarHBondContact OE1-NH2 3.04Å
1420	H	92.1	Very high	92.3	Very high	23 Å²	23	47.8 Å²	47.8	11%	0.106	24%	0.241	C	C	.	.	I	π-helix	trans	-108.6	-53.6	-177.1	-159.1	88.8	0	0	0	112.5	F1410 I1416 M1424	F1410-H1420 HydrophobicContact CE1-CB 4.01Å; F1410-H1420 HydrophobicContact CZ-CB 3.97Å; I1416-H1420 VanDerWaalsContact O-CB 3.29Å; I1416-H1420 WeakPolarHBondContact O-CB 3.16Å; I1416-H1420 PolarHBondContact O-N 3.16Å; I1416-H1420 VanDerWaalsContact O-N 3.12Å; H1420-M1424 WeakPolarHBondContact O-CG 3.46Å
1421	I	93.2	Very high	92.3	Very high	1 Å²	1	47.7 Å²	47.7	1%	0.005	24%	0.24	C	C	.	.	I	π-helix	trans	-82.6	-46.2	-168.2	-54.7	174.9	0	0	0	112.5	V1360 A1374 W1376 I1386 I1416 I1417 M1424 A1425	V1360-I1421 HydrophobicContact CG1-CD1 3.73Å; V1360-I1421 HydrophobicContact CG2-CB 4.37Å; V1360-I1421 HydrophobicContact CG2-CD1 4.4Å; V1360-I1421 HydrophobicContact CG2-CG2 3.63Å; A1374-I1421 HydrophobicContact CB-CD1 3.8Å; W1376-I1421 HydrophobicContact CB-CG2 3.74Å; W1376-I1421 HydrophobicContact CD2-CG2 3.86Å; W1376-I1421 HydrophobicContact CE3-CG2 4.45Å; W1376-I1421 HydrophobicContact CG-CG2 3.54Å; I1386-I1421 HydrophobicContact CD1-CG1 4.23Å; I1416-I1421 HydrophobicContact CG2-CD1 3.96Å; I1416-I1421 HydrophobicContact CG2-CG1 4.42Å; I1416-I1421 PolarHBondContact O-N 3.4Å; I1417-I1421 PolarHBondContact O-N 3.39Å; I1421-M1424 CarbonylContact O-C 3.51Å; I1421-M1424 WeakPolarHBondContact O-CB 3.36Å; I1421-M1424 PolarHBondContact O-N 3.01Å; I1421-M1424 VanDerWaalsContact O-N 3.15Å; I1421-A1425 WeakPolarHBondContact O-CB 3.2Å; I1421-A1425 PolarHBondContact O-N 2.94Å
1422	M	93.2	Very high	92.7	Very high	101 Å²	101	41.9 Å²	41.9	50%	0.498	21%	0.214	S	C	.	.	H	α-helix	trans	-59.3	-42.3	-179.7	-74.7	178.6	70.6	0	0	113.5	I1417 M1424 A1425 L1426	I1417-M1422 HydrophobicContact CG2-CG 4.04Å; I1417-M1422 HydrophobicContact CG2-SD 4.14Å; I1417-M1422 WeakPolarHBondContact O-CB 3.17Å; I1417-M1422 WeakPolarHBondContact O-CG 3.33Å; I1417-M1422 PolarHBondContact O-N 3.43Å; M1422-M1424 PolarHBondContact O-N 3.42Å; M1422-A1425 PolarHBondContact O-N 3.09Å; M1422-L1426 WeakPolarHBondContact O-CG 3.36Å; M1422-L1426 PolarHBondContact O-N 3.33Å
1423	P	93	Very high	92.8	Very high	39 Å²	39	45.7 Å²	45.7	25%	0.253	23%	0.229	S	C	.	.	H	α-helix	trans	-62.8	-40.1	173.9	-24.7	36.7	0	0	0	112.7	A1418 L1426 A1427 P1500	A1418-P1423 WeakPolarHBondContact O-CD 3.35Å; P1423-L1426 PolarHBondContact O-N 2.97Å; P1423-A1427 WeakPolarHBondContact O-CB 3.46Å; P1423-A1427 PolarHBondContact O-N 2.97Å; P1423-P1500 HydrophobicContact CB-CB 4.4Å; P1423-P1500 WeakPolarHBondContact CB-O 3.35Å
1424	M	94.1	Very high	92.8	Very high	6 Å²	6	47.3 Å²	47.3	3%	0.03	24%	0.236	C	C	.	.	H	α-helix	trans	-64.8	-39.4	173.9	-70.4	176.7	62.7	0	0	112.1	W1376 H1420 I1421 M1422 A1427 A1428 V1498 M1499 P1500	W1376-M1424 HydrophobicContact CH2-CB 4.21Å; W1376-M1424 HydrophobicContact CZ2-CB 3.89Å; W1376-M1424 HydrophobicContact CZ2-CE 4.12Å; H1420-M1424 WeakPolarHBondContact O-CG 3.46Å; I1421-M1424 CarbonylContact O-C 3.51Å; I1421-M1424 WeakPolarHBondContact O-CB 3.36Å; I1421-M1424 PolarHBondContact O-N 3.01Å; I1421-M1424 VanDerWaalsContact O-N 3.15Å; M1422-M1424 PolarHBondContact O-N 3.42Å; M1424-A1427 PolarHBondContact O-N 2.99Å; M1424-A1428 WeakPolarHBondContact O-CB 3.26Å; M1424-A1428 PolarHBondContact O-N 3.24Å; M1424-V1498 HydrophobicContact CB-CG1 4.03Å; M1424-V1498 HydrophobicContact CG-CG1 4.27Å; M1424-V1498 WeakPolarHBondContact O-CG1 3.43Å; M1424-M1499 VanDerWaalsContact CG-C 3.46Å; M1424-P1500 HydrophobicContact CG-CG 4.04Å; M1424-P1500 HydrophobicContact SD-CG 4.01Å
1425	A	93.6	Very high	92.8	Very high	6 Å²	6	51 Å²	51	5%	0.05	25%	0.248	C	C	.	.	H	α-helix	trans	-64	-44.7	176.5	0	0	0	0	0	112.2	Q1357 W1376 I1421 M1422 A1428 R1429	Q1357-A1425 PolarHBondContact NE2-O 3.04Å; W1376-A1425 HydrophobicContact CE3-CB 4.15Å; W1376-A1425 HydrophobicContact CH2-CB 4.45Å; W1376-A1425 HydrophobicContact CZ3-CB 3.77Å; I1421-A1425 WeakPolarHBondContact O-CB 3.2Å; I1421-A1425 PolarHBondContact O-N 2.94Å; M1422-A1425 PolarHBondContact O-N 3.09Å; A1425-A1428 PolarHBondContact O-N 3.49Å; A1425-R1429 WeakPolarHBondContact O-CB 3.35Å; A1425-R1429 PolarHBondContact O-N 2.5Å
1426	L	93.8	Very high	92.8	Very high	106 Å²	106	51.4 Å²	51.4	56%	0.555	25%	0.247	S	C	*	.	H	α-helix	trans	-62.3	-40.7	174.8	-70.4	170.9	0	0	0	112.1	M1422 P1423 R1429 E1430	M1422-L1426 WeakPolarHBondContact O-CG 3.36Å; M1422-L1426 PolarHBondContact O-N 3.33Å; P1423-L1426 PolarHBondContact O-N 2.97Å; L1426-R1429 WeakPolarHBondContact O-CB 3.38Å; L1426-R1429 PolarHBondContact O-N 2.78Å; L1426-E1430 PolarHBondContact O-N 3.09Å
1427	A	93	Very high	92.9	Very high	9 Å²	9	53.3 Å²	53.3	7%	0.074	26%	0.255	C	S	.	.	H	α-helix	trans	-68.9	-43.2	177.6	0	0	0	0	0	112.4	P1423 M1424 R1429 E1430 L1431 V1498 Y1503	P1423-A1427 WeakPolarHBondContact O-CB 3.46Å; P1423-A1427 PolarHBondContact O-N 2.97Å; M1424-A1427 PolarHBondContact O-N 2.99Å; A1427-R1429 PolarHBondContact O-N 3.36Å; A1427-E1430 PolarHBondContact O-N 2.92Å; A1427-L1431 PolarHBondContact O-N 2.79Å; A1427-V1498 HydrophobicContact CB-CG1 3.66Å; A1427-Y1503 WeakPolarHBondContact CA-OH 3.41Å; A1427-Y1503 HydrophobicContact CB-CE1 3.74Å; A1427-Y1503 WeakPolarHBondContact O-CE1 3.39Å; A1427-Y1503 PolarHBondContact O-OH 3.14Å
1428	A	93.3	Very high	92.8	Very high	0 Å²	0	55.4 Å²	55.4	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-58.2	-38.2	170.4	0	0	0	0	0	111.5	W1376 V1378 M1424 A1425 L1431 I1432 F1481	W1376-A1428 HydrophobicContact CH2-CB 4Å; W1376-A1428 HydrophobicContact CZ3-CB 4.44Å; V1378-A1428 HydrophobicContact CG1-CB 4.18Å; M1424-A1428 WeakPolarHBondContact O-CB 3.26Å; M1424-A1428 PolarHBondContact O-N 3.24Å; A1425-A1428 PolarHBondContact O-N 3.49Å; A1428-L1431 PolarHBondContact O-N 2.8Å; A1428-I1432 VanDerWaalsContact O-CG1 3.27Å; A1428-I1432 WeakPolarHBondContact O-CG1 3.07Å; A1428-I1432 PolarHBondContact O-N 3.1Å; A1428-F1481 HydrophobicContact CB-CE2 3.95Å; A1428-F1481 HydrophobicContact CB-CZ 3.98Å
1429	R	93.6	Very high	92.5	Very high	95 Å²	95	56.7 Å²	56.7	36%	0.358	27%	0.267	S	S	.	.	H	α-helix	trans	-64.7	-42.1	177.2	-161.5	177.7	-69.1	-177.4	-4.3	113.1	Q1357 A1425 L1426 A1427 L1431 I1432 Q1433	Q1357-R1429 PolarHBondContact O-NH2 2.88Å; A1425-R1429 WeakPolarHBondContact O-CB 3.35Å; A1425-R1429 PolarHBondContact O-N 2.5Å; L1426-R1429 WeakPolarHBondContact O-CB 3.38Å; L1426-R1429 PolarHBondContact O-N 2.78Å; A1427-R1429 PolarHBondContact O-N 3.36Å; R1429-L1431 VanDerWaalsContact C-N 3.28Å; R1429-L1431 PolarHBondContact O-N 2.86Å; R1429-I1432 PolarHBondContact O-N 3.43Å; R1429-Q1433 HydrophobicContact CG-CG 4.4Å; R1429-Q1433 WeakPolarHBondContact O-CB 3.35Å; R1429-Q1433 VanDerWaalsContact O-CG 3.31Å; R1429-Q1433 WeakPolarHBondContact O-CG 3.22Å; R1429-Q1433 PolarHBondContact O-N 2.87Å
1430	E	93.1	Very high	92	Very high	61 Å²	61	54.1 Å²	54.1	29%	0.285	26%	0.26	S	S	.	.	H	α-helix	trans	-61.7	-36.7	175	-162.3	-164.4	170.2	0	0	111.3	L1426 A1427 Y1434 Y1503 V1513	L1426-E1430 PolarHBondContact O-N 3.09Å; A1427-E1430 PolarHBondContact O-N 2.92Å; E1430-Y1434 PolarHBondContact O-N 2.9Å; E1430-Y1503 VanDerWaalsContact CB-OH 3.28Å; E1430-Y1503 WeakPolarHBondContact CB-OH 3.45Å; E1430-Y1503 WeakPolarHBondContact OE2-CE2 3.4Å; E1430-Y1503 PolarHBondContact OE2-OH 3.26Å; E1430-V1513 HydrophobicContact CB-CG2 3.99Å; E1430-V1513 VanDerWaalsContact CD-CG2 3.45Å; E1430-V1513 VanDerWaalsContact CD-N 3.34Å; E1430-V1513 HydrophobicContact CG-CB 4.11Å; E1430-V1513 HydrophobicContact CG-CG2 3.74Å; E1430-V1513 WeakPolarHBondContact OE1-CB 3.49Å; E1430-V1513 PolarHBondContact OE1-N 2.74Å; E1430-V1513 WeakPolarHBondContact OE2-CG2 3.42Å; E1430-V1513 PolarHBondContact OE2-N 2.79Å; E1430-V1513 VanDerWaalsContact OE2-N 3.07Å
1431	L	92.3	Very high	91.1	Very high	0 Å²	0	59.6 Å²	59.6	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-70.6	-43	175.4	-79.8	172.5	0	0	0	112.9	A1427 A1428 R1429 Y1434 F1471 F1481 V1496 V1498 Y1503 V1513	A1427-L1431 PolarHBondContact O-N 2.79Å; A1428-L1431 PolarHBondContact O-N 2.8Å; R1429-L1431 VanDerWaalsContact C-N 3.28Å; R1429-L1431 PolarHBondContact O-N 2.86Å; L1431-Y1434 VanDerWaalsContact O-CB 3.28Å; L1431-Y1434 WeakPolarHBondContact O-CB 3.46Å; L1431-Y1434 PolarHBondContact O-N 2.89Å; L1431-F1471 HydrophobicContact CD2-CD1 4.12Å; L1431-F1471 HydrophobicContact CD2-CD2 4.32Å; L1431-F1471 HydrophobicContact CD2-CE1 3.99Å; L1431-F1471 HydrophobicContact CD2-CE2 4.19Å; L1431-F1471 HydrophobicContact CD2-CG 4.28Å; L1431-F1471 HydrophobicContact CD2-CZ 4.01Å; L1431-F1481 HydrophobicContact CB-CD1 4.05Å; L1431-F1481 HydrophobicContact CB-CE1 3.96Å; L1431-F1481 HydrophobicContact CB-CE2 4.5Å; L1431-F1481 HydrophobicContact CB-CG 4.35Å; L1431-F1481 HydrophobicContact CB-CZ 4.2Å; L1431-F1481 HydrophobicContact CD1-CB 4.06Å; L1431-F1481 HydrophobicContact CD1-CD1 4.25Å; L1431-F1481 HydrophobicContact CD1-CD2 3.59Å; L1431-F1481 HydrophobicContact CD1-CE2 4.07Å; L1431-F1481 HydrophobicContact CD1-CG 3.7Å; L1431-V1496 HydrophobicContact CD1-CG1 4.3Å; L1431-V1498 HydrophobicContact CD1-CG2 4.07Å; L1431-Y1503 HydrophobicContact CD1-CD1 3.65Å; L1431-Y1503 HydrophobicContact CD1-CE1 3.57Å; L1431-Y1503 HydrophobicContact CG-CD1 4.13Å; L1431-Y1503 HydrophobicContact CG-CE1 3.69Å; L1431-V1513 HydrophobicContact CD2-CG1 4.15Å; L1431-V1513 HydrophobicContact CD2-CG2 3.56Å; L1431-V1513 HydrophobicContact CG-CG2 3.72Å
1432	I	92.4	Very high	90.1	Very high	47 Å²	47	60.7 Å²	60.7	24%	0.241	29%	0.294	C	S	.	.	H	α-helix	trans	-65.8	-41.3	178	-68.5	163.8	0	0	0	111	Q1357 V1378 A1379 A1428 R1429 Y1434 Y1437 F1481	Q1357-I1432 HydrophobicContact CG-CD1 4.07Å; V1378-I1432 VanDerWaalsContact O-CD1 3.32Å; V1378-I1432 WeakPolarHBondContact O-CD1 3.46Å; A1379-I1432 HydrophobicContact CB-CD1 3.92Å; A1428-I1432 VanDerWaalsContact O-CG1 3.27Å; A1428-I1432 WeakPolarHBondContact O-CG1 3.07Å; A1428-I1432 PolarHBondContact O-N 3.1Å; R1429-I1432 PolarHBondContact O-N 3.43Å; I1432-Y1434 PolarHBondContact O-N 2.96Å; I1432-Y1437 HydrophobicContact CB-CE1 4.41Å; I1432-Y1437 HydrophobicContact CG1-CE1 4.37Å; I1432-Y1437 HydrophobicContact CG1-CE2 4.16Å; I1432-Y1437 HydrophobicContact CG2-CD1 4.24Å; I1432-Y1437 HydrophobicContact CG2-CE1 3.98Å; I1432-Y1437 WeakPolarHBondContact O-CB 3.38Å; I1432-Y1437 WeakPolarHBondContact O-CD1 3.5Å; I1432-F1481 HydrophobicContact CD1-CE1 4.45Å; I1432-F1481 HydrophobicContact CD1-CZ 4.17Å; I1432-F1481 HydrophobicContact CG1-CE1 3.74Å; I1432-F1481 HydrophobicContact CG1-CZ 3.9Å
1433	Q	91.9	Very high	88.8	Confident	151 Å²	151	61.3 Å²	61.3	71%	0.706	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.7	-4.9	176.3	-66.6	-179.3	-3.5	0	0	113.2	R1429	R1429-Q1433 HydrophobicContact CG-CG 4.4Å; R1429-Q1433 WeakPolarHBondContact O-CB 3.35Å; R1429-Q1433 VanDerWaalsContact O-CG 3.31Å; R1429-Q1433 WeakPolarHBondContact O-CG 3.22Å; R1429-Q1433 PolarHBondContact O-N 2.87Å
1434	Y	92.8	Very high	87.5	Confident	38 Å²	38	62.4 Å²	62.4	15%	0.149	32%	0.322	C	S	.	.	S	Bend	trans	-70.6	134.7	-179.8	-167	-107.7	0	0	0	111.6	E1430 L1431 I1432 Y1436 Y1437 Y1469 F1471 V1513 L1517	E1430-Y1434 PolarHBondContact O-N 2.9Å; L1431-Y1434 VanDerWaalsContact O-CB 3.28Å; L1431-Y1434 WeakPolarHBondContact O-CB 3.46Å; L1431-Y1434 PolarHBondContact O-N 2.89Å; I1432-Y1434 PolarHBondContact O-N 2.96Å; Y1434-Y1436 AromaticContact CE1-CD2 3.78Å; Y1434-Y1436 HydrophobicContact CE1-CD2 3.78Å; Y1434-Y1436 HydrophobicContact CE1-CG 4.26Å; Y1434-Y1436 PolarHBondContact O-N 2.98Å; Y1434-Y1437 WeakPolarHBondContact O-CB 3.48Å; Y1434-Y1437 PolarHBondContact O-N 3.4Å; Y1434-Y1469 HydrophobicContact CE1-CE2 4.43Å; Y1434-F1471 AromaticContact CD1-CD2 3.99Å; Y1434-F1471 HydrophobicContact CD1-CD2 3.99Å; Y1434-F1471 AromaticContact CD1-CE2 3.88Å; Y1434-F1471 HydrophobicContact CD1-CE2 3.88Å; Y1434-F1471 HydrophobicContact CE1-CE2 4.29Å; Y1434-V1513 HydrophobicContact CD2-CG1 3.84Å; Y1434-V1513 HydrophobicContact CE2-CG1 4.26Å; Y1434-V1513 HydrophobicContact CG-CG1 4.07Å; Y1434-L1517 HydrophobicContact CD1-CD1 4.09Å; Y1434-L1517 HydrophobicContact CD2-CD1 4.34Å; Y1434-L1517 HydrophobicContact CE1-CD1 3.38Å; Y1434-L1517 HydrophobicContact CE2-CD1 3.7Å; Y1434-L1517 VanDerWaalsContact OH-CD1 3.3Å; Y1434-L1517 WeakPolarHBondContact OH-CD1 3.37Å
1435	K	91.8	Very high	86.2	Confident	160 Å²	160	70.7 Å²	70.7	70%	0.696	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.5	-5.7	-175.1	71	-179.1	-177.7	-177.3	0	117.5
1436	Y	92.3	Very high	85.2	Confident	63 Å²	63	76 Å²	76	25%	0.247	39%	0.39	C	S	.	.	T	Hydrogen-bonded Turn	trans	-119.2	18.1	172.3	-65.5	-51.5	0	0	0	112	Y1434 Y1469 F1470 F1471	Y1434-Y1436 AromaticContact CE1-CD2 3.78Å; Y1434-Y1436 HydrophobicContact CE1-CD2 3.78Å; Y1434-Y1436 HydrophobicContact CE1-CG 4.26Å; Y1434-Y1436 PolarHBondContact O-N 2.98Å; Y1436-Y1469 HydrophobicContact CD2-CE1 4.07Å; Y1436-Y1469 AromaticContact CD2-CE2 3.77Å; Y1436-Y1469 HydrophobicContact CD2-CE2 3.77Å; Y1436-Y1469 AromaticContact CD2-CZ 3.47Å; Y1436-Y1469 VanDerWaalsContact CD2-CZ 3.47Å; Y1436-Y1469 WeakPolarHBondContact CD2-OH 3.39Å; Y1436-Y1469 HydrophobicContact CE2-CE1 4.04Å; Y1436-Y1469 HydrophobicContact CE2-CE2 4.48Å; Y1436-Y1469 AromaticContact CE2-CZ 3.73Å; Y1436-Y1469 WeakPolarHBondContact CE2-OH 3.38Å; Y1436-Y1469 HydrophobicContact CG-CE2 4.48Å; Y1436-F1470 HydrophobicContact CD1-CD1 4.3Å; Y1436-F1470 HydrophobicContact CD1-CE1 4.05Å; Y1436-F1470 CarbonylContact O-C 3.37Å; Y1436-F1470 WeakPolarHBondContact O-CA 3.41Å; Y1436-F1471 PolarHBondContact O-N 2.79Å
1437	Y	93.1	Very high	84.5	Confident	39 Å²	39	74.3 Å²	74.3	15%	0.153	38%	0.382	C	S	.	.	B	Isolated β-bridge	trans	-68.3	147.7	161	-173.7	-109.8	0	0	0	110.2	I1432 Y1434 P1439 F1471 A1473 F1481	I1432-Y1437 HydrophobicContact CB-CE1 4.41Å; I1432-Y1437 HydrophobicContact CG1-CE1 4.37Å; I1432-Y1437 HydrophobicContact CG1-CE2 4.16Å; I1432-Y1437 HydrophobicContact CG2-CD1 4.24Å; I1432-Y1437 HydrophobicContact CG2-CE1 3.98Å; I1432-Y1437 WeakPolarHBondContact O-CB 3.38Å; I1432-Y1437 WeakPolarHBondContact O-CD1 3.5Å; Y1434-Y1437 WeakPolarHBondContact O-CB 3.48Å; Y1434-Y1437 PolarHBondContact O-N 3.4Å; Y1437-P1439 HydrophobicContact CE1-CG 4.44Å; Y1437-F1471 CarbonylContact C-O 3.5Å; Y1437-F1471 WeakPolarHBondContact CA-O 3.17Å; Y1437-F1471 HydrophobicContact CD2-CB 4.14Å; Y1437-A1473 HydrophobicContact CE2-CB 4.38Å; Y1437-A1473 WeakPolarHBondContact OH-CB 3.29Å; Y1437-F1481 HydrophobicContact CD2-CD1 4.41Å; Y1437-F1481 HydrophobicContact CD2-CE1 4.37Å; Y1437-F1481 AromaticContact CE2-CD1 3.94Å; Y1437-F1481 HydrophobicContact CE2-CD1 3.94Å; Y1437-F1481 AromaticContact CE2-CE1 3.72Å; Y1437-F1481 HydrophobicContact CE2-CE1 3.72Å
1438	K	91.1	Very high	84.1	Confident	64 Å²	64	74.5 Å²	74.5	28%	0.278	38%	0.381	S	S	.	.			trans	-129.6	126.4	168.9	-67.4	-67.7	-173.9	171.8	0	106.5	M1452 L1455 F1470 F1471 T1472	K1438-M1452 HydrophobicContact CB-SD 4.1Å; K1438-M1452 HydrophobicContact CG-SD 4.45Å; K1438-L1455 HydrophobicContact CG-CD1 4.39Å; K1438-F1470 HydrophobicContact CD-CD1 4.5Å; K1438-F1470 HydrophobicContact CG-CB 4Å; K1438-F1470 HydrophobicContact CG-CD1 4.01Å; K1438-F1470 HydrophobicContact CG-CD2 4.43Å; K1438-F1470 HydrophobicContact CG-CG 3.91Å; K1438-F1471 PolarHBondContact N-O 2.66Å; K1438-T1472 WeakPolarHBondContact O-CA 3.46Å; K1438-T1472 WeakPolarHBondContact O-CB 3.47Å; K1438-T1472 PolarHBondContact O-OG1 2.91Å
1439	P	86.9	Confident	83.9	Confident	85 Å²	85	79.4 Å²	79.4	55%	0.552	40%	0.4	S	S	*	.			trans	-51.1	148.6	169.7	-26.5	35.5	0	0	0	110.9	Y1437 M1441	Y1437-P1439 HydrophobicContact CE1-CG 4.44Å; P1439-M1441 HydrophobicContact CB-CG 4.42Å; P1439-M1441 WeakPolarHBondContact O-CG 3.37Å; P1439-M1441 PolarHBondContact O-N 3.2Å
1440	N	80.6	Confident	83.6	Confident	42 Å²	42	79.6 Å²	79.6	23%	0.225	41%	0.408	C	S	.	.			trans	-77.4	112.2	175.2	-166.9	-25.4	0	0	0	107.9	I1382 V1442 T1472 A1473	I1382-N1440 HydrophobicContact CD1-CB 4.43Å; N1440-V1442 WeakPolarHBondContact OD1-CB 3.29Å; N1440-V1442 VanDerWaalsContact OD1-CG2 3.27Å; N1440-V1442 WeakPolarHBondContact OD1-CG2 3.42Å; N1440-V1442 PolarHBondContact OD1-N 3.09Å; N1440-T1472 WeakPolarHBondContact CA-OG1 3.06Å; N1440-T1472 PolarHBondContact N-OG1 3.3Å; N1440-A1473 PolarHBondContact ND2-O 2.9Å
1441	M	73.7	Confident	83.3	Confident	139 Å²	139	78.1 Å²	78.1	69%	0.685	40%	0.403	S	S	*	.			trans	-107.8	26.3	-174.1	-51	-169.9	85.9	0	0	112.3	P1439 T1443	P1439-M1441 HydrophobicContact CB-CG 4.42Å; P1439-M1441 WeakPolarHBondContact O-CG 3.37Å; P1439-M1441 PolarHBondContact O-N 3.2Å; M1441-T1443 PolarHBondContact O-N 3.01Å
1442	V	73.3	Confident	83.2	Confident	24 Å²	24	78.3 Å²	78.3	15%	0.145	40%	0.404	C	S	.	.			trans	-70.9	115.5	177.3	164.1	0	0	0	0	110.6	N1440 E1446 E1448 V1451	N1440-V1442 WeakPolarHBondContact OD1-CB 3.29Å; N1440-V1442 VanDerWaalsContact OD1-CG2 3.27Å; N1440-V1442 WeakPolarHBondContact OD1-CG2 3.42Å; N1440-V1442 PolarHBondContact OD1-N 3.09Å; V1442-E1446 HydrophobicContact CG1-CB 4.35Å; V1442-E1446 WeakPolarHBondContact CG1-O 3.48Å; V1442-E1448 HydrophobicContact CG2-CB 4.28Å; V1442-V1451 HydrophobicContact CG2-CG2 4.14Å
1443	T	65.5	Low	83.1	Confident	113 Å²	113	78.1 Å²	78.1	69%	0.693	40%	0.402	S	S	*	.			trans	-111	127.8	169.6	53.5	0	0	0	0	109.9	M1441	M1441-T1443 PolarHBondContact O-N 3.01Å
1444	G	66	Low	82.9	Confident	63 Å²	63	77.2 Å²	77.2	65%	0.649	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.7	-146.6	-173.6	0	0	0	0	0	113	E1446	G1444-E1446 VanDerWaalsContact C-N 3.29Å; G1444-E1446 PolarHBondContact O-N 3.15Å
1445	D	66.7	Low	82.8	Confident	179 Å²	179	77.6 Å²	77.6	96%	0.957	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.6	7.9	-174.6	-79.6	-26.1	0	0	0	115.2
1446	E	71.3	Confident	82.8	Confident	117 Å²	117	70 Å²	70	55%	0.547	37%	0.367	S	S	.	.			trans	-61.8	142.7	179.3	-70.7	-157.7	152.5	0	0	112.7	V1442 G1444	V1442-E1446 HydrophobicContact CG1-CB 4.35Å; V1442-E1446 WeakPolarHBondContact CG1-O 3.48Å; G1444-E1446 VanDerWaalsContact C-N 3.29Å; G1444-E1446 PolarHBondContact O-N 3.15Å
1447	N	80.7	Confident	82.7	Confident	72 Å²	72	73.8 Å²	73.8	39%	0.385	38%	0.381	S	S	.	.			trans	-82.5	133.2	177.3	-156.1	-66.3	0	0	0	111.3	R1449 D1450 V1451	N1447-R1449 PolarHBondContact O-N 3.44Å; N1447-R1449 WeakPolarHBondContact OD1-CB 3.47Å; N1447-R1449 WeakPolarHBondContact OD1-CG 3.39Å; N1447-R1449 PolarHBondContact OD1-N 3.02Å; N1447-D1450 HydrophobicContact CB-CB 4.35Å; N1447-D1450 VanDerWaalsContact CB-OD2 3.23Å; N1447-D1450 WeakPolarHBondContact CB-OD2 3.32Å; N1447-D1450 PolarHBondContact O-N 3.25Å; N1447-V1451 PolarHBondContact O-N 3.46Å
1448	E	84.4	Confident	82.5	Confident	12 Å²	12	76.4 Å²	76.4	6%	0.056	40%	0.395	C	S	.	.	H	α-helix	trans	-50.9	-24.6	171.2	56.6	177.4	-137.3	0	0	113.5	V1442 M1452 S1474 R1475 L1482 Y1495	V1442-E1448 HydrophobicContact CG2-CB 4.28Å; E1448-M1452 WeakPolarHBondContact O-CG 3.39Å; E1448-S1474 VanDerWaalsContact CD-OG 3.24Å; E1448-S1474 PolarHBondContact OE1-OG 3.47Å; E1448-S1474 WeakPolarHBondContact OE2-CA 3.5Å; E1448-S1474 PolarHBondContact OE2-OG 3.38Å; E1448-R1475 PolarHBondContact OE2-N 3.05Å; E1448-L1482 HydrophobicContact CB-CD2 4.39Å; E1448-L1482 HydrophobicContact CG-CD2 4.17Å; E1448-Y1495 PolarHBondContact OE1-OH 3.23Å
1449	R	88.7	Confident	82.5	Confident	103 Å²	103	76.1 Å²	76.1	39%	0.389	39%	0.394	S	S	.	.	H	α-helix	trans	-77.1	-37.8	174.8	-63.8	177.3	-170.9	165.7	9.9	113.4	N1447 M1452 E1453 L1482 H1493 Y1495	N1447-R1449 PolarHBondContact O-N 3.44Å; N1447-R1449 WeakPolarHBondContact OD1-CB 3.47Å; N1447-R1449 WeakPolarHBondContact OD1-CG 3.39Å; N1447-R1449 PolarHBondContact OD1-N 3.02Å; R1449-M1452 CarbonylContact O-C 3.49Å; R1449-M1452 PolarHBondContact O-N 2.89Å; R1449-E1453 WeakPolarHBondContact O-CB 3.41Å; R1449-E1453 PolarHBondContact O-N 2.82Å; R1449-L1482 HydrophobicContact CG-CD1 4.3Å; R1449-L1482 HydrophobicContact CG-CD2 3.94Å; R1449-H1493 PolarHBondContact O-CE1 3.17Å; R1449-Y1495 PolarHBondContact NE-OH 3.31Å; R1449-Y1495 PolarHBondContact NH2-OH 2.75Å
1450	D	87.3	Confident	82.6	Confident	100 Å²	100	73.7 Å²	73.7	54%	0.535	38%	0.375	S	S	.	.	H	α-helix	trans	-75.3	-40.1	-171.3	-61.4	-28.3	0	0	0	110.7	N1447 M1452 E1453 K1454	N1447-D1450 HydrophobicContact CB-CB 4.35Å; N1447-D1450 VanDerWaalsContact CB-OD2 3.23Å; N1447-D1450 WeakPolarHBondContact CB-OD2 3.32Å; N1447-D1450 PolarHBondContact O-N 3.25Å; D1450-M1452 VanDerWaalsContact C-N 3.29Å; D1450-M1452 PolarHBondContact O-N 3.44Å; D1450-E1453 PolarHBondContact O-N 3.06Å; D1450-K1454 WeakPolarHBondContact O-CB 3.49Å; D1450-K1454 PolarHBondContact O-N 3.37Å
1451	V	87	Confident	82.9	Confident	29 Å²	29	75.2 Å²	75.2	18%	0.176	39%	0.393	C	S	.	.	H	α-helix	trans	-57	-43.9	169	-177.2	0	0	0	0	110.8	V1442 N1447 K1454 L1455	V1442-V1451 HydrophobicContact CG2-CG2 4.14Å; N1447-V1451 PolarHBondContact O-N 3.46Å; V1451-K1454 PolarHBondContact O-N 3.39Å; V1451-L1455 HydrophobicContact CG1-CD1 4.33Å; V1451-L1455 WeakPolarHBondContact O-CG 3.36Å; V1451-L1455 PolarHBondContact O-N 3.19Å
1452	M	89.3	Confident	83.7	Confident	4 Å²	4	75 Å²	75	2%	0.02	40%	0.395	C	S	.	.	H	α-helix	trans	-73	-33.8	179.5	-68.7	-72.2	-86.7	0	0	112.8	K1438 E1448 R1449 D1450 L1455 L1456 F1470 T1472 L1482	K1438-M1452 HydrophobicContact CB-SD 4.1Å; K1438-M1452 HydrophobicContact CG-SD 4.45Å; E1448-M1452 WeakPolarHBondContact O-CG 3.39Å; R1449-M1452 CarbonylContact O-C 3.49Å; R1449-M1452 PolarHBondContact O-N 2.89Å; D1450-M1452 VanDerWaalsContact C-N 3.29Å; D1450-M1452 PolarHBondContact O-N 3.44Å; M1452-L1455 HydrophobicContact SD-CD1 4.3Å; M1452-L1456 WeakPolarHBondContact O-CB 3.45Å; M1452-L1456 WeakPolarHBondContact O-CD1 3.49Å; M1452-L1456 WeakPolarHBondContact O-CG 3.45Å; M1452-L1456 PolarHBondContact O-N 3.35Å; M1452-F1470 HydrophobicContact CE-CB 3.49Å; M1452-F1470 VanDerWaalsContact CE-CB 3.49Å; M1452-F1470 HydrophobicContact SD-CB 4.41Å; M1452-T1472 HydrophobicContact CE-CG2 3.83Å; M1452-T1472 HydrophobicContact CG-CG2 3.88Å; M1452-T1472 HydrophobicContact SD-CG2 4.01Å; M1452-L1482 HydrophobicContact CG-CD2 4.35Å
1453	E	90.3	Very high	84.4	Confident	43 Å²	43	76.7 Å²	76.7	20%	0.201	40%	0.403	C	S	.	.	H	α-helix	trans	-65.3	-43.4	170.9	165.4	135.4	-133.2	0	0	110.8	R1449 D1450 L1456 R1457 V1491	R1449-E1453 WeakPolarHBondContact O-CB 3.41Å; R1449-E1453 PolarHBondContact O-N 2.82Å; D1450-E1453 PolarHBondContact O-N 3.06Å; E1453-L1456 PolarHBondContact O-N 3.27Å; E1453-R1457 HydrophobicContact CG-CG 4.41Å; E1453-R1457 WeakPolarHBondContact O-CB 3.37Å; E1453-R1457 VanDerWaalsContact O-CG 3.26Å; E1453-R1457 WeakPolarHBondContact O-CG 3.45Å; E1453-R1457 PolarHBondContact O-N 2.91Å; E1453-R1457 IonicContact OE1-CZ 3.73Å; E1453-R1457 IonicContact OE1-NE 3.73Å; E1453-R1457 PolarHBondContact OE1-NE 2.83Å; E1453-R1457 IonicContact OE1-NH2 3.28Å; E1453-R1457 PolarHBondContact OE1-NH2 2.76Å; E1453-R1457 IonicContact OE2-NH2 2.77Å; E1453-V1491 HydrophobicContact CB-CB 4.37Å; E1453-V1491 HydrophobicContact CB-CG1 4.32Å; E1453-V1491 HydrophobicContact CB-CG2 4.11Å; E1453-V1491 HydrophobicContact CG-CB 4.3Å; E1453-V1491 HydrophobicContact CG-CG2 3.79Å; E1453-V1491 WeakPolarHBondContact OE1-CG2 3.32Å
1454	K	88.5	Confident	85.4	Confident	132 Å²	132	75.4 Å²	75.4	57%	0.574	40%	0.397	S	S	*	.	H	α-helix	trans	-57.1	-55.3	174.3	-179.9	-179.6	175.2	-174	0	111.6	D1450 V1451 L1456 R1457 E1458	D1450-K1454 WeakPolarHBondContact O-CB 3.49Å; D1450-K1454 PolarHBondContact O-N 3.37Å; V1451-K1454 PolarHBondContact O-N 3.39Å; K1454-L1456 VanDerWaalsContact C-N 3.3Å; K1454-L1456 PolarHBondContact O-N 2.93Å; K1454-R1457 PolarHBondContact O-N 2.97Å; K1454-R1457 VanDerWaalsContact O-N 3.09Å; K1454-E1458 WeakPolarHBondContact CE-OE1 3.34Å; K1454-E1458 VanDerWaalsContact CG-OE1 3.3Å; K1454-E1458 WeakPolarHBondContact CG-OE1 3.26Å; K1454-E1458 WeakPolarHBondContact O-CG 3.44Å; K1454-E1458 PolarHBondContact O-N 2.99Å
1455	L	89.8	Confident	86.5	Confident	47 Å²	47	82 Å²	82	25%	0.246	41%	0.408	C	S	.	.	H	α-helix	trans	-56	-41.2	177.7	-75.1	170.1	0	0	0	112.8	K1438 V1451 M1452 E1459	K1438-L1455 HydrophobicContact CG-CD1 4.39Å; V1451-L1455 HydrophobicContact CG1-CD1 4.33Å; V1451-L1455 WeakPolarHBondContact O-CG 3.36Å; V1451-L1455 PolarHBondContact O-N 3.19Å; M1452-L1455 HydrophobicContact SD-CD1 4.3Å; L1455-E1459 WeakPolarHBondContact O-CB 3.49Å; L1455-E1459 PolarHBondContact O-N 3.19Å
1456	L	91.7	Very high	87.5	Confident	0 Å²	0	76.5 Å²	76.5	0%	0	38%	0.375	C	S	.	.	H	α-helix	trans	-68.1	-38.2	177.6	-76.3	168.5	0	0	0	112.7	M1452 E1453 K1454 K1460 H1468 F1470 L1486 V1491	M1452-L1456 WeakPolarHBondContact O-CB 3.45Å; M1452-L1456 WeakPolarHBondContact O-CD1 3.49Å; M1452-L1456 WeakPolarHBondContact O-CG 3.45Å; M1452-L1456 PolarHBondContact O-N 3.35Å; E1453-L1456 PolarHBondContact O-N 3.27Å; K1454-L1456 VanDerWaalsContact C-N 3.3Å; K1454-L1456 PolarHBondContact O-N 2.93Å; L1456-K1460 WeakPolarHBondContact O-CB 3.46Å; L1456-K1460 PolarHBondContact O-N 3.09Å; L1456-H1468 HydrophobicContact CD2-CB 3.75Å; L1456-H1468 WeakPolarHBondContact CD2-O 3.38Å; L1456-F1470 HydrophobicContact CD2-CD2 3.57Å; L1456-F1470 HydrophobicContact CD2-CE2 3.84Å; L1456-F1470 HydrophobicContact CD2-CG 4.48Å; L1456-F1470 HydrophobicContact CG-CD2 3.96Å; L1456-F1470 HydrophobicContact CG-CE2 4.36Å; L1456-L1486 HydrophobicContact CB-CB 4.07Å; L1456-L1486 HydrophobicContact CB-CD2 4.29Å; L1456-L1486 HydrophobicContact CD2-CB 4.48Å; L1456-V1491 HydrophobicContact CB-CG2 4.36Å; L1456-V1491 HydrophobicContact CD1-CG1 3.67Å; L1456-V1491 HydrophobicContact CD1-CG2 4.45Å
1457	R	90.5	Very high	88.3	Confident	143 Å²	143	73.6 Å²	73.6	54%	0.54	36%	0.363	S	S	.	.	H	α-helix	trans	-67.7	-41.5	177	-73.4	172.1	177	-154.5	10.4	111.6	E1453 K1454 K1460 A1461 L1486	E1453-R1457 HydrophobicContact CG-CG 4.41Å; E1453-R1457 WeakPolarHBondContact O-CB 3.37Å; E1453-R1457 VanDerWaalsContact O-CG 3.26Å; E1453-R1457 WeakPolarHBondContact O-CG 3.45Å; E1453-R1457 PolarHBondContact O-N 2.91Å; E1453-R1457 IonicContact OE1-CZ 3.73Å; E1453-R1457 IonicContact OE1-NE 3.73Å; E1453-R1457 PolarHBondContact OE1-NE 2.83Å; E1453-R1457 IonicContact OE1-NH2 3.28Å; E1453-R1457 PolarHBondContact OE1-NH2 2.76Å; E1453-R1457 IonicContact OE2-NH2 2.77Å; K1454-R1457 PolarHBondContact O-N 2.97Å; K1454-R1457 VanDerWaalsContact O-N 3.09Å; R1457-K1460 PolarHBondContact O-N 3.25Å; R1457-A1461 PolarHBondContact O-N 3.07Å; R1457-L1486 HydrophobicContact CG-CD2 4.13Å
1458	E	90.1	Very high	88.8	Confident	94 Å²	94	70.6 Å²	70.6	44%	0.439	35%	0.347	S	S	.	.	H	α-helix	trans	-62.4	-51.5	176	-71	168.5	-179.2	0	0	111.5	K1454 K1460 A1461 N1462	K1454-E1458 WeakPolarHBondContact CE-OE1 3.34Å; K1454-E1458 VanDerWaalsContact CG-OE1 3.3Å; K1454-E1458 WeakPolarHBondContact CG-OE1 3.26Å; K1454-E1458 WeakPolarHBondContact O-CG 3.44Å; K1454-E1458 PolarHBondContact O-N 2.99Å; E1458-K1460 VanDerWaalsContact C-N 3.29Å; E1458-K1460 PolarHBondContact O-N 2.87Å; E1458-A1461 WeakPolarHBondContact O-CB 3.35Å; E1458-A1461 PolarHBondContact O-N 3.12Å; E1458-A1461 VanDerWaalsContact O-N 3.1Å; E1458-N1462 PolarHBondContact O-N 2.74Å; E1458-N1462 VanDerWaalsContact O-N 3.15Å
1459	E	89.6	Confident	89.2	Confident	58 Å²	58	71.2 Å²	71.2	27%	0.271	35%	0.349	S	S	.	.	H	α-helix	trans	-60.9	-36.9	174.9	-82.8	-94.8	167.4	0	0	112.5	L1455 A1461 N1462 D1463 K1466 H1468 F1470	L1455-E1459 WeakPolarHBondContact O-CB 3.49Å; L1455-E1459 PolarHBondContact O-N 3.19Å; E1459-A1461 VanDerWaalsContact C-N 3.3Å; E1459-A1461 PolarHBondContact O-N 3.39Å; E1459-N1462 PolarHBondContact O-N 3.14Å; E1459-D1463 PolarHBondContact O-N 3.42Å; E1459-K1466 IonicContact OE2-NZ 2.89Å; E1459-K1466 PolarHBondContact OE2-NZ 2.67Å; E1459-H1468 HydrophobicContact CB-CB 4.38Å; E1459-H1468 PolarHBondContact O-CE1 2.91Å; E1459-H1468 PolarHBondContact O-NE2 2.83Å; E1459-H1468 IonicContact OE2-CE1 3.7Å; E1459-H1468 PolarHBondContact OE2-CE1 2.74Å; E1459-H1468 IonicContact OE2-ND1 2.73Å; E1459-H1468 PolarHBondContact OE2-ND1 3.07Å; E1459-H1468 VanDerWaalsContact OE2-ND1 3.17Å; E1459-F1470 HydrophobicContact CG-CE2 4.13Å; E1459-F1470 HydrophobicContact CG-CZ 3.85Å
1460	K	89.1	Confident	89.5	Confident	33 Å²	33	66.7 Å²	66.7	14%	0.143	33%	0.332	C	S	.	.	H	α-helix	trans	-69.7	-24.1	176.2	-171.7	65	176.1	176.9	0	113.3	L1456 R1457 E1458 D1463 P1464 K1466 H1468 L1486	L1456-K1460 WeakPolarHBondContact O-CB 3.46Å; L1456-K1460 PolarHBondContact O-N 3.09Å; R1457-K1460 PolarHBondContact O-N 3.25Å; E1458-K1460 VanDerWaalsContact C-N 3.29Å; E1458-K1460 PolarHBondContact O-N 2.87Å; K1460-D1463 CarbonylContact O-C 3.42Å; K1460-P1464 WeakPolarHBondContact CE-O 3.26Å; K1460-P1464 PolarHBondContact NZ-O 3.16Å; K1460-P1464 VanDerWaalsContact O-CA 3.26Å; K1460-P1464 WeakPolarHBondContact O-CA 3.47Å; K1460-P1464 WeakPolarHBondContact O-CG 3.19Å; K1460-K1466 PolarHBondContact NZ-O 3.41Å; K1460-H1468 WeakPolarHBondContact CA-NE2 3.41Å; K1460-H1468 PolarHBondContact N-NE2 2.87Å; K1460-L1486 HydrophobicContact CB-CD2 3.67Å; K1460-L1486 HydrophobicContact CB-CG 4.35Å; K1460-L1486 HydrophobicContact CG-CD2 3.82Å; K1460-L1486 HydrophobicContact CG-CG 4.12Å
1461	A	88.3	Confident	89.8	Confident	74 Å²	74	61.9 Å²	61.9	61%	0.612	31%	0.306	S	S	*	.	H	α-helix	trans	-73.1	-38.9	168.8	0	0	0	0	0	111.5	R1457 E1458 E1459	R1457-A1461 PolarHBondContact O-N 3.07Å; E1458-A1461 WeakPolarHBondContact O-CB 3.35Å; E1458-A1461 PolarHBondContact O-N 3.12Å; E1458-A1461 VanDerWaalsContact O-N 3.1Å; E1459-A1461 VanDerWaalsContact C-N 3.3Å; E1459-A1461 PolarHBondContact O-N 3.39Å
1462	N	89.7	Confident	90.1	Very high	135 Å²	135	60.6 Å²	60.6	72%	0.722	30%	0.298	S	S	*	.	H	α-helix	trans	-69.1	-41.5	178.3	-67.3	-26.3	0	0	0	113.1	E1458 E1459	E1458-N1462 PolarHBondContact O-N 2.74Å; E1458-N1462 VanDerWaalsContact O-N 3.15Å; E1459-N1462 PolarHBondContact O-N 3.14Å
1463	D	88.5	Confident	90.3	Very high	59 Å²	59	60.5 Å²	60.5	32%	0.316	30%	0.298	S	S	.	.			trans	-131.9	93.2	169.3	-174.8	-10.7	0	0	0	111.3	E1459 K1460 K1465 K1466 H1468	E1459-D1463 PolarHBondContact O-N 3.42Å; K1460-D1463 CarbonylContact O-C 3.42Å; D1463-K1465 PolarHBondContact O-N 3.38Å; D1463-K1465 WeakPolarHBondContact OD1-CA 3.48Å; D1463-K1465 WeakPolarHBondContact OD1-CB 3.38Å; D1463-K1465 PolarHBondContact OD1-N 3.14Å; D1463-K1466 HydrophobicContact CB-CB 4.02Å; D1463-K1466 VanDerWaalsContact CG-CB 3.42Å; D1463-K1466 PolarHBondContact O-N 3.46Å; D1463-K1466 PolarHBondContact OD1-N 3.32Å; D1463-K1466 VanDerWaalsContact OD2-CB 3.23Å; D1463-K1466 WeakPolarHBondContact OD2-CB 3.23Å; D1463-H1468 WeakPolarHBondContact CA-NE2 3.45Å; D1463-H1468 WeakPolarHBondContact CB-NE2 3.35Å; D1463-H1468 PolarHBondContact N-NE2 3.27Å; D1463-H1468 PolarHBondContact O-NE2 2.94Å
1464	P	86.7	Confident	90.3	Very high	86 Å²	86	58.5 Å²	58.5	56%	0.558	29%	0.289	S	S	*	.	S	Bend	trans	-66.1	-17.8	176.6	-24.6	35.4	0	0	0	114.8	K1460	K1460-P1464 WeakPolarHBondContact CE-O 3.26Å; K1460-P1464 PolarHBondContact NZ-O 3.16Å; K1460-P1464 VanDerWaalsContact O-CA 3.26Å; K1460-P1464 WeakPolarHBondContact O-CA 3.47Å; K1460-P1464 WeakPolarHBondContact O-CG 3.19Å
1465	K	87.5	Confident	90.2	Very high	201 Å²	201	58.8 Å²	58.8	87%	0.874	29%	0.286	S	S	*	.	S	Bend	trans	-83.1	-33.8	-179.3	-61.6	176.7	-178	172.2	0	111.6	D1463	D1463-K1465 PolarHBondContact O-N 3.38Å; D1463-K1465 WeakPolarHBondContact OD1-CA 3.48Å; D1463-K1465 WeakPolarHBondContact OD1-CB 3.38Å; D1463-K1465 PolarHBondContact OD1-N 3.14Å
1466	K	87.7	Confident	89.9	Confident	64 Å²	64	60.4 Å²	60.4	28%	0.278	31%	0.307	S	S	.	.	S	Bend	trans	-72.6	144.8	177.6	179.8	173.4	166.1	-136	0	111.7	E1459 K1460 D1463 H1468	E1459-K1466 IonicContact OE2-NZ 2.89Å; E1459-K1466 PolarHBondContact OE2-NZ 2.67Å; K1460-K1466 PolarHBondContact NZ-O 3.41Å; D1463-K1466 HydrophobicContact CB-CB 4.02Å; D1463-K1466 VanDerWaalsContact CG-CB 3.42Å; D1463-K1466 PolarHBondContact O-N 3.46Å; D1463-K1466 PolarHBondContact OD1-N 3.32Å; D1463-K1466 VanDerWaalsContact OD2-CB 3.23Å; D1463-K1466 WeakPolarHBondContact OD2-CB 3.23Å; K1466-H1468 WeakPolarHBondContact CD-CE1 3.32Å; K1466-H1468 VanDerWaalsContact CE-CE1 3.47Å; K1466-H1468 WeakPolarHBondContact CE-CE1 3.34Å; K1466-H1468 WeakPolarHBondContact CE-ND1 3.46Å; K1466-H1468 PolarHBondContact NZ-CE1 2.82Å; K1466-H1468 PolarHBondContact NZ-ND1 2.66Å
1467	I	88.6	Confident	89.8	Confident	57 Å²	57	63.1 Å²	63.1	29%	0.292	32%	0.32	S	S	.	.			trans	-95.6	110.8	164.2	-64.8	178.7	0	0	0	105.9	P1487 W1524	I1467-P1487 HydrophobicContact CD1-CB 4.37Å; I1467-W1524 HydrophobicContact CD1-CH2 3.52Å; I1467-W1524 HydrophobicContact CD1-CZ2 3.41Å; I1467-W1524 VanDerWaalsContact CD1-CZ2 3.41Å; I1467-W1524 HydrophobicContact CD1-CZ3 4.17Å
1468	H	91.7	Very high	89.7	Confident	8 Å²	8	58.4 Å²	58.4	4%	0.037	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	143.3	177.4	-56.9	-88.4	0	0	0	109.7	L1456 E1459 K1460 D1463 K1466 Y1485 L1486	L1456-H1468 HydrophobicContact CD2-CB 3.75Å; L1456-H1468 WeakPolarHBondContact CD2-O 3.38Å; E1459-H1468 HydrophobicContact CB-CB 4.38Å; E1459-H1468 PolarHBondContact O-CE1 2.91Å; E1459-H1468 PolarHBondContact O-NE2 2.83Å; E1459-H1468 IonicContact OE2-CE1 3.7Å; E1459-H1468 PolarHBondContact OE2-CE1 2.74Å; E1459-H1468 IonicContact OE2-ND1 2.73Å; E1459-H1468 PolarHBondContact OE2-ND1 3.07Å; E1459-H1468 VanDerWaalsContact OE2-ND1 3.17Å; K1460-H1468 WeakPolarHBondContact CA-NE2 3.41Å; K1460-H1468 PolarHBondContact N-NE2 2.87Å; D1463-H1468 WeakPolarHBondContact CA-NE2 3.45Å; D1463-H1468 WeakPolarHBondContact CB-NE2 3.35Å; D1463-H1468 PolarHBondContact N-NE2 3.27Å; D1463-H1468 PolarHBondContact O-NE2 2.94Å; K1466-H1468 WeakPolarHBondContact CD-CE1 3.32Å; K1466-H1468 VanDerWaalsContact CE-CE1 3.47Å; K1466-H1468 WeakPolarHBondContact CE-CE1 3.34Å; K1466-H1468 WeakPolarHBondContact CE-ND1 3.46Å; K1466-H1468 PolarHBondContact NZ-CE1 2.82Å; K1466-H1468 PolarHBondContact NZ-ND1 2.66Å; H1468-Y1485 WeakPolarHBondContact O-CA 3.29Å; H1468-L1486 PolarHBondContact O-N 3.21Å
1469	Y	93.4	Very high	89.6	Confident	26 Å²	26	54 Å²	54	10%	0.102	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	142.7	175.2	64.2	-78.3	0	0	0	108.3	Y1434 Y1436 L1483 S1484 L1517 F1520 K1521	Y1434-Y1469 HydrophobicContact CE1-CE2 4.43Å; Y1436-Y1469 HydrophobicContact CD2-CE1 4.07Å; Y1436-Y1469 AromaticContact CD2-CE2 3.77Å; Y1436-Y1469 HydrophobicContact CD2-CE2 3.77Å; Y1436-Y1469 AromaticContact CD2-CZ 3.47Å; Y1436-Y1469 VanDerWaalsContact CD2-CZ 3.47Å; Y1436-Y1469 WeakPolarHBondContact CD2-OH 3.39Å; Y1436-Y1469 HydrophobicContact CE2-CE1 4.04Å; Y1436-Y1469 HydrophobicContact CE2-CE2 4.48Å; Y1436-Y1469 AromaticContact CE2-CZ 3.73Å; Y1436-Y1469 WeakPolarHBondContact CE2-OH 3.38Å; Y1436-Y1469 HydrophobicContact CG-CE2 4.48Å; Y1469-L1483 HydrophobicContact CD2-CD1 4.13Å; Y1469-S1484 CarbonylContact C-O 3.55Å; Y1469-S1484 WeakPolarHBondContact CA-O 3.45Å; Y1469-L1517 HydrophobicContact CD2-CD2 4.34Å; Y1469-L1517 HydrophobicContact CE2-CD2 3.73Å; Y1469-F1520 HydrophobicContact CD1-CE1 4.49Å; Y1469-F1520 AromaticContact CD2-CE1 3.99Å; Y1469-F1520 HydrophobicContact CD2-CE1 3.99Å; Y1469-F1520 AromaticContact CG-CE1 3.96Å; Y1469-F1520 HydrophobicContact CG-CE1 3.96Å; Y1469-K1521 WeakPolarHBondContact OH-CE 3.45Å; Y1469-K1521 PolarHBondContact OH-NZ 3.35Å
1470	F	94.7	Very high	89.8	Confident	7 Å²	7	54.4 Å²	54.4	3%	0.031	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	150.9	178.7	-61.4	-58.8	0	0	0	110.7	Y1436 K1438 M1452 L1456 E1459 S1484	Y1436-F1470 HydrophobicContact CD1-CD1 4.3Å; Y1436-F1470 HydrophobicContact CD1-CE1 4.05Å; Y1436-F1470 CarbonylContact O-C 3.37Å; Y1436-F1470 WeakPolarHBondContact O-CA 3.41Å; K1438-F1470 HydrophobicContact CD-CD1 4.5Å; K1438-F1470 HydrophobicContact CG-CB 4Å; K1438-F1470 HydrophobicContact CG-CD1 4.01Å; K1438-F1470 HydrophobicContact CG-CD2 4.43Å; K1438-F1470 HydrophobicContact CG-CG 3.91Å; M1452-F1470 HydrophobicContact CE-CB 3.49Å; M1452-F1470 VanDerWaalsContact CE-CB 3.49Å; M1452-F1470 HydrophobicContact SD-CB 4.41Å; L1456-F1470 HydrophobicContact CD2-CD2 3.57Å; L1456-F1470 HydrophobicContact CD2-CE2 3.84Å; L1456-F1470 HydrophobicContact CD2-CG 4.48Å; L1456-F1470 HydrophobicContact CG-CD2 3.96Å; L1456-F1470 HydrophobicContact CG-CE2 4.36Å; E1459-F1470 HydrophobicContact CG-CE2 4.13Å; E1459-F1470 HydrophobicContact CG-CZ 3.85Å; F1470-S1484 PolarHBondContact N-O 3.11Å; F1470-S1484 PolarHBondContact O-N 3.22Å
1471	F	93.6	Very high	90.1	Very high	0 Å²	0	52.8 Å²	52.8	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	148.1	165.4	-63.5	-78.7	0	0	0	109.8	L1431 Y1434 Y1436 Y1437 K1438 L1482 L1483 V1496 L1516 L1517	L1431-F1471 HydrophobicContact CD2-CD1 4.12Å; L1431-F1471 HydrophobicContact CD2-CD2 4.32Å; L1431-F1471 HydrophobicContact CD2-CE1 3.99Å; L1431-F1471 HydrophobicContact CD2-CE2 4.19Å; L1431-F1471 HydrophobicContact CD2-CG 4.28Å; L1431-F1471 HydrophobicContact CD2-CZ 4.01Å; Y1434-F1471 AromaticContact CD1-CD2 3.99Å; Y1434-F1471 HydrophobicContact CD1-CD2 3.99Å; Y1434-F1471 AromaticContact CD1-CE2 3.88Å; Y1434-F1471 HydrophobicContact CD1-CE2 3.88Å; Y1434-F1471 HydrophobicContact CE1-CE2 4.29Å; Y1436-F1471 PolarHBondContact O-N 2.79Å; Y1437-F1471 CarbonylContact C-O 3.5Å; Y1437-F1471 WeakPolarHBondContact CA-O 3.17Å; Y1437-F1471 HydrophobicContact CD2-CB 4.14Å; K1438-F1471 PolarHBondContact N-O 2.66Å; F1471-L1482 WeakPolarHBondContact CA-O 3.28Å; F1471-L1483 HydrophobicContact CD1-CB 3.92Å; F1471-L1483 HydrophobicContact CD1-CD1 4.06Å; F1471-L1483 HydrophobicContact CD1-CG 4.46Å; F1471-L1483 HydrophobicContact CE1-CB 3.82Å; F1471-L1483 HydrophobicContact CE1-CD1 3.79Å; F1471-L1483 HydrophobicContact CE1-CD2 4.01Å; F1471-L1483 HydrophobicContact CE1-CG 4.07Å; F1471-L1483 HydrophobicContact CZ-CD1 4.09Å; F1471-L1483 HydrophobicContact CZ-CD2 4.4Å; F1471-V1496 HydrophobicContact CE1-CG2 3.99Å; F1471-L1516 HydrophobicContact CZ-CD2 4.39Å; F1471-L1517 HydrophobicContact CE2-CD1 4.16Å; F1471-L1517 HydrophobicContact CE2-CD2 3.95Å; F1471-L1517 HydrophobicContact CE2-CG 4.36Å; F1471-L1517 HydrophobicContact CZ-CD2 3.72Å; F1471-L1517 HydrophobicContact CZ-CG 4.23Å
1472	T	93.5	Very high	90.3	Very high	2 Å²	2	49.3 Å²	49.3	1%	0.012	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	155.6	159.4	-166.3	0	0	0	0	109.7	K1438 N1440 M1452 F1481 L1482	K1438-T1472 WeakPolarHBondContact O-CA 3.46Å; K1438-T1472 WeakPolarHBondContact O-CB 3.47Å; K1438-T1472 PolarHBondContact O-OG1 2.91Å; N1440-T1472 WeakPolarHBondContact CA-OG1 3.06Å; N1440-T1472 PolarHBondContact N-OG1 3.3Å; M1452-T1472 HydrophobicContact CE-CG2 3.83Å; M1452-T1472 HydrophobicContact CG-CG2 3.88Å; M1452-T1472 HydrophobicContact SD-CG2 4.01Å; T1472-F1481 CarbonylContact O-C 3.58Å; T1472-F1481 VanDerWaalsContact O-CA 3.26Å; T1472-F1481 WeakPolarHBondContact O-CA 3.46Å; T1472-L1482 HydrophobicContact CG2-CB 3.99Å; T1472-L1482 HydrophobicContact CG2-CD2 4.11Å; T1472-L1482 PolarHBondContact N-O 3.04Å; T1472-L1482 VanDerWaalsContact N-O 3.16Å; T1472-L1482 PolarHBondContact O-N 3.06Å
1473	A	92.3	Very high	90.5	Very high	1 Å²	1	42.9 Å²	42.9	1%	0.008	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	130.7	176.7	0	0	0	0	0	109.8	A1379 I1382 Y1437 N1440 R1475 F1481	A1379-A1473 HydrophobicContact CB-CB 3.9Å; I1382-A1473 HydrophobicContact CD1-CB 3.6Å; I1382-A1473 WeakPolarHBondContact CD1-O 3.46Å; Y1437-A1473 HydrophobicContact CE2-CB 4.38Å; Y1437-A1473 WeakPolarHBondContact OH-CB 3.29Å; N1440-A1473 PolarHBondContact ND2-O 2.9Å; A1473-R1475 PolarHBondContact O-N 3.4Å; A1473-F1481 HydrophobicContact CB-CD1 4.13Å; A1473-F1481 HydrophobicContact CB-CE1 3.79Å; A1473-F1481 HydrophobicContact CB-CZ 4.23Å
1474	S	90.4	Very high	90.7	Very high	1 Å²	1	40 Å²	40	1%	0.007	20%	0.204	C	C	.	.			trans	-80.5	118.6	-176.2	-175.4	0	0	0	0	110.8	E1448 A1476 M1477 K1480	E1448-S1474 VanDerWaalsContact CD-OG 3.24Å; E1448-S1474 PolarHBondContact OE1-OG 3.47Å; E1448-S1474 WeakPolarHBondContact OE2-CA 3.5Å; E1448-S1474 PolarHBondContact OE2-OG 3.38Å; S1474-A1476 VanDerWaalsContact C-N 3.34Å; S1474-M1477 CarbonylContact O-C 3.54Å; S1474-M1477 VanDerWaalsContact O-C 3.29Å; S1474-M1477 PolarHBondContact OG-N 2.58Å; S1474-M1477 VanDerWaalsContact OG-N 3.16Å; S1474-K1480 VanDerWaalsContact CB-O 3.27Å; S1474-K1480 WeakPolarHBondContact CB-O 2.9Å; S1474-K1480 PolarHBondContact N-O 2.94Å
1475	R	86.2	Confident	91	Very high	138 Å²	138	36 Å²	36	52%	0.521	18%	0.177	S	C	.	.	S	Bend	trans	-73.4	-33.3	175.3	-165.7	-179.9	-169.2	-160.3	3.5	110.5	I1382 E1448 A1473 M1477	I1382-R1475 HydrophobicContact CD1-CB 4.26Å; I1382-R1475 HydrophobicContact CG1-CB 4.3Å; I1382-R1475 HydrophobicContact CG1-CG 4.32Å; E1448-R1475 PolarHBondContact OE2-N 3.05Å; A1473-R1475 PolarHBondContact O-N 3.4Å; R1475-M1477 VanDerWaalsContact C-N 3.34Å
1476	A	85	Confident	91.1	Very high	82 Å²	82	26.6 Å²	26.6	68%	0.678	14%	0.137	S	C	*	.	S	Bend	trans	-74.5	-20.4	176.6	0	0	0	0	0	113.8	S1474	S1474-A1476 VanDerWaalsContact C-N 3.34Å
1477	M	88.4	Confident	90.9	Very high	56 Å²	56	24.4 Å²	24.4	28%	0.276	13%	0.129	S	C	.	.	S	Bend	trans	-142	81	175.2	-68.6	-173.4	-70.8	0	0	111.5	S1474 R1475 K1480 Y1495	S1474-M1477 CarbonylContact O-C 3.54Å; S1474-M1477 VanDerWaalsContact O-C 3.29Å; S1474-M1477 PolarHBondContact OG-N 2.58Å; S1474-M1477 VanDerWaalsContact OG-N 3.16Å; R1475-M1477 VanDerWaalsContact C-N 3.34Å; M1477-K1480 HydrophobicContact CB-CB 4.19Å; M1477-K1480 HydrophobicContact CB-CD 3.88Å; M1477-K1480 HydrophobicContact CB-CG 4.17Å; M1477-K1480 HydrophobicContact CE-CD 4.06Å; M1477-K1480 HydrophobicContact CG-CD 4.44Å; M1477-K1480 WeakPolarHBondContact O-CB 3.3Å; M1477-K1480 PolarHBondContact O-N 3.29Å; M1477-K1480 HydrophobicContact SD-CD 3.79Å; M1477-K1480 PolarHBondContact SD-NZ 3.17Å; M1477-Y1495 HydrophobicContact CE-CD1 3.63Å; M1477-Y1495 HydrophobicContact CE-CD2 3.77Å; M1477-Y1495 HydrophobicContact CE-CE1 3.38Å; M1477-Y1495 HydrophobicContact CE-CE2 3.55Å; M1477-Y1495 HydrophobicContact CE-CG 3.81Å
1478	P	89.1	Confident	90.6	Very high	44 Å²	44	29.6 Å²	29.6	29%	0.286	15%	0.149	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51	140.8	173	-27.2	35.4	0	0	0	112.4	V1378 I1382 F1383 Q1384 K1480	V1378-P1478 HydrophobicContact CG2-CB 4.35Å; I1382-P1478 HydrophobicContact CG2-CB 3.95Å; I1382-P1478 HydrophobicContact CG2-CG 4.09Å; F1383-P1478 WeakPolarHBondContact O-CB 3.49Å; F1383-P1478 WeakPolarHBondContact O-CG 3.27Å; Q1384-P1478 HydrophobicContact CB-CB 3.84Å; Q1384-P1478 HydrophobicContact CG-CB 4.42Å; P1478-K1480 VanDerWaalsContact C-N 3.3Å
1479	G	88.4	Confident	90.2	Very high	3 Å²	3	35.2 Å²	35.2	3%	0.031	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	81.3	2	-169.1	0	0	0	0	0	114.4	V1498	G1479-V1498 PolarHBondContact O-N 3.5Å
1480	K	93.5	Very high	89.9	Confident	65 Å²	65	41.9 Å²	41.9	28%	0.283	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	145.8	172.2	-54.1	-173.6	-170.4	161.3	0	112.2	S1474 M1477 P1478 Y1495 V1496 T1497	S1474-K1480 VanDerWaalsContact CB-O 3.27Å; S1474-K1480 WeakPolarHBondContact CB-O 2.9Å; S1474-K1480 PolarHBondContact N-O 2.94Å; M1477-K1480 HydrophobicContact CB-CB 4.19Å; M1477-K1480 HydrophobicContact CB-CD 3.88Å; M1477-K1480 HydrophobicContact CB-CG 4.17Å; M1477-K1480 HydrophobicContact CE-CD 4.06Å; M1477-K1480 HydrophobicContact CG-CD 4.44Å; M1477-K1480 WeakPolarHBondContact O-CB 3.3Å; M1477-K1480 PolarHBondContact O-N 3.29Å; M1477-K1480 HydrophobicContact SD-CD 3.79Å; M1477-K1480 PolarHBondContact SD-NZ 3.17Å; P1478-K1480 VanDerWaalsContact C-N 3.3Å; K1480-Y1495 HydrophobicContact CB-CD1 4.17Å; K1480-V1496 CarbonylContact C-O 3.5Å; K1480-V1496 VanDerWaalsContact CA-O 3.27Å; K1480-V1496 WeakPolarHBondContact CA-O 3.47Å; K1480-T1497 HydrophobicContact CG-CG2 4.08Å
1481	F	94.3	Very high	89.7	Confident	0 Å²	0	41.9 Å²	41.9	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	132.3	176.2	-72.5	-105.1	0	0	0	109.9	V1378 A1428 L1431 I1432 Y1437 T1472 A1473 L1483 Y1495 V1496 V1498	V1378-F1481 HydrophobicContact CG1-CE2 4.25Å; V1378-F1481 HydrophobicContact CG1-CZ 4.44Å; A1428-F1481 HydrophobicContact CB-CE2 3.95Å; A1428-F1481 HydrophobicContact CB-CZ 3.98Å; L1431-F1481 HydrophobicContact CB-CD1 4.05Å; L1431-F1481 HydrophobicContact CB-CE1 3.96Å; L1431-F1481 HydrophobicContact CB-CE2 4.5Å; L1431-F1481 HydrophobicContact CB-CG 4.35Å; L1431-F1481 HydrophobicContact CB-CZ 4.2Å; L1431-F1481 HydrophobicContact CD1-CB 4.06Å; L1431-F1481 HydrophobicContact CD1-CD1 4.25Å; L1431-F1481 HydrophobicContact CD1-CD2 3.59Å; L1431-F1481 HydrophobicContact CD1-CE2 4.07Å; L1431-F1481 HydrophobicContact CD1-CG 3.7Å; I1432-F1481 HydrophobicContact CD1-CE1 4.45Å; I1432-F1481 HydrophobicContact CD1-CZ 4.17Å; I1432-F1481 HydrophobicContact CG1-CE1 3.74Å; I1432-F1481 HydrophobicContact CG1-CZ 3.9Å; Y1437-F1481 HydrophobicContact CD2-CD1 4.41Å; Y1437-F1481 HydrophobicContact CD2-CE1 4.37Å; Y1437-F1481 AromaticContact CE2-CD1 3.94Å; Y1437-F1481 HydrophobicContact CE2-CD1 3.94Å; Y1437-F1481 AromaticContact CE2-CE1 3.72Å; Y1437-F1481 HydrophobicContact CE2-CE1 3.72Å; T1472-F1481 CarbonylContact O-C 3.58Å; T1472-F1481 VanDerWaalsContact O-CA 3.26Å; T1472-F1481 WeakPolarHBondContact O-CA 3.46Å; A1473-F1481 HydrophobicContact CB-CD1 4.13Å; A1473-F1481 HydrophobicContact CB-CE1 3.79Å; A1473-F1481 HydrophobicContact CB-CZ 4.23Å; F1481-L1483 PolarHBondContact O-N 3.17Å; F1481-Y1495 WeakPolarHBondContact O-CA 3.49Å; F1481-V1496 PolarHBondContact N-O 3.21Å; F1481-V1496 PolarHBondContact O-N 3.23Å; F1481-V1498 HydrophobicContact CD2-CG2 3.75Å; F1481-V1498 HydrophobicContact CE2-CG2 3.73Å
1482	L	93.2	Very high	89.5	Confident	0 Å²	0	45.6 Å²	45.6	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	102.2	-179.5	-177.7	73.5	0	0	0	109.7	E1448 R1449 M1452 F1471 T1472 S1484 H1493 Y1495	E1448-L1482 HydrophobicContact CB-CD2 4.39Å; E1448-L1482 HydrophobicContact CG-CD2 4.17Å; R1449-L1482 HydrophobicContact CG-CD1 4.3Å; R1449-L1482 HydrophobicContact CG-CD2 3.94Å; M1452-L1482 HydrophobicContact CG-CD2 4.35Å; F1471-L1482 WeakPolarHBondContact CA-O 3.28Å; T1472-L1482 HydrophobicContact CG2-CB 3.99Å; T1472-L1482 HydrophobicContact CG2-CD2 4.11Å; T1472-L1482 PolarHBondContact N-O 3.04Å; T1472-L1482 VanDerWaalsContact N-O 3.16Å; T1472-L1482 PolarHBondContact O-N 3.06Å; L1482-S1484 PolarHBondContact O-N 2.9Å; L1482-H1493 HydrophobicContact CD1-CB 3.98Å; L1482-Y1495 HydrophobicContact CB-CD1 4.45Å; L1482-Y1495 HydrophobicContact CB-CE1 4.16Å; L1482-Y1495 HydrophobicContact CD1-CD1 4.12Å; L1482-Y1495 HydrophobicContact CD1-CE1 3.58Å; L1482-Y1495 HydrophobicContact CD1-CE2 4.06Å; L1482-Y1495 HydrophobicContact CG-CE1 4.48Å
1483	L	93.4	Very high	89.4	Confident	0 Å²	0	48 Å²	48	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	103.3	169.9	176.1	52.3	0	0	0	109.3	Y1469 F1471 F1481 E1494 V1496 F1505 F1520	Y1469-L1483 HydrophobicContact CD2-CD1 4.13Å; F1471-L1483 HydrophobicContact CD1-CB 3.92Å; F1471-L1483 HydrophobicContact CD1-CD1 4.06Å; F1471-L1483 HydrophobicContact CD1-CG 4.46Å; F1471-L1483 HydrophobicContact CE1-CB 3.82Å; F1471-L1483 HydrophobicContact CE1-CD1 3.79Å; F1471-L1483 HydrophobicContact CE1-CD2 4.01Å; F1471-L1483 HydrophobicContact CE1-CG 4.07Å; F1471-L1483 HydrophobicContact CZ-CD1 4.09Å; F1471-L1483 HydrophobicContact CZ-CD2 4.4Å; F1481-L1483 PolarHBondContact O-N 3.17Å; L1483-E1494 WeakPolarHBondContact CA-O 3.37Å; L1483-E1494 PolarHBondContact N-O 2.69Å; L1483-E1494 PolarHBondContact O-N 3Å; L1483-V1496 HydrophobicContact CB-CG2 4.36Å; L1483-F1505 HydrophobicContact CD2-CE2 4.01Å; L1483-F1505 HydrophobicContact CD2-CZ 3.88Å; L1483-F1520 HydrophobicContact CD1-CE1 4.36Å; L1483-F1520 HydrophobicContact CD1-CZ 4.32Å; L1483-F1520 HydrophobicContact CD2-CD1 4.26Å; L1483-F1520 HydrophobicContact CD2-CD2 3.83Å; L1483-F1520 HydrophobicContact CD2-CE1 4.29Å; L1483-F1520 HydrophobicContact CD2-CE2 3.86Å; L1483-F1520 HydrophobicContact CD2-CG 4.03Å; L1483-F1520 HydrophobicContact CD2-CZ 4.1Å; L1483-F1520 HydrophobicContact CG-CE2 4.41Å; L1483-F1520 HydrophobicContact CG-CZ 4.37Å
1484	S	92.8	Very high	89.4	Confident	0 Å²	0	49 Å²	49	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	136.2	177.6	-55.3	0	0	0	0	110.1	Y1469 F1470 L1482 R1492 H1493	Y1469-S1484 CarbonylContact C-O 3.55Å; Y1469-S1484 WeakPolarHBondContact CA-O 3.45Å; F1470-S1484 PolarHBondContact N-O 3.11Å; F1470-S1484 PolarHBondContact O-N 3.22Å; L1482-S1484 PolarHBondContact O-N 2.9Å; S1484-R1492 CarbonylContact C-O 3.54Å; S1484-R1492 WeakPolarHBondContact CA-O 3.31Å; S1484-H1493 WeakPolarHBondContact CB-ND1 3.21Å; S1484-H1493 PolarHBondContact OG-ND1 3.39Å
1485	Y	93.1	Very high	89.5	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150	148.3	-178.1	65	-76.4	0	0	0	114	H1468 P1487 R1492 E1494 R1506 F1520 W1524	H1468-Y1485 WeakPolarHBondContact O-CA 3.29Å; Y1485-P1487 HydrophobicContact CD2-CG 3.73Å; Y1485-P1487 HydrophobicContact CE2-CG 3.9Å; Y1485-P1487 WeakPolarHBondContact O-CD 3.46Å; Y1485-R1492 HydrophobicContact CD1-CB 3.97Å; Y1485-R1492 HydrophobicContact CD2-CB 4.44Å; Y1485-R1492 HydrophobicContact CE1-CB 3.55Å; Y1485-R1492 HydrophobicContact CE2-CB 4.08Å; Y1485-R1492 HydrophobicContact CE2-CG 4.4Å; Y1485-R1492 HydrophobicContact CG-CB 4.39Å; Y1485-R1492 VanDerWaalsContact CZ-CD 3.4Å; Y1485-R1492 PolarHBondContact N-O 2.97Å; Y1485-R1492 PolarHBondContact O-N 3.44Å; Y1485-R1492 WeakPolarHBondContact OH-CD 3.32Å; Y1485-R1492 PolarHBondContact OH-NH1 3.34Å; Y1485-R1492 VanDerWaalsContact OH-NH1 3.1Å; Y1485-E1494 HydrophobicContact CE1-CG 4.27Å; Y1485-E1494 VanDerWaalsContact CE1-OE1 3.24Å; Y1485-E1494 WeakPolarHBondContact CE1-OE1 3.46Å; Y1485-E1494 VanDerWaalsContact CZ-OE1 3.3Å; Y1485-E1494 PolarHBondContact OH-OE1 3.32Å; Y1485-R1506 PolarHBondContact OH-NH2 3.22Å; Y1485-F1520 AromaticContact CD1-CE2 3.9Å; Y1485-F1520 HydrophobicContact CD1-CE2 3.9Å; Y1485-F1520 AromaticContact CD1-CZ 3.88Å; Y1485-F1520 HydrophobicContact CD1-CZ 3.88Å; Y1485-F1520 HydrophobicContact CD2-CE2 4.2Å; Y1485-F1520 AromaticContact CD2-CZ 3.95Å; Y1485-F1520 HydrophobicContact CD2-CZ 3.95Å; Y1485-F1520 AromaticContact CE1-CE2 3.83Å; Y1485-F1520 HydrophobicContact CE1-CE2 3.83Å; Y1485-F1520 HydrophobicContact CE1-CZ 4.28Å; Y1485-F1520 HydrophobicContact CE2-CE2 4.13Å; Y1485-F1520 HydrophobicContact CE2-CZ 4.34Å; Y1485-F1520 HydrophobicContact CG-CE2 4.1Å; Y1485-F1520 AromaticContact CG-CZ 3.71Å; Y1485-F1520 HydrophobicContact CG-CZ 3.71Å; Y1485-F1520 AromaticContact CZ-CE2 3.95Å; Y1485-W1524 HydrophobicContact CE2-CB 4.06Å
1486	L	90.6	Very high	89.9	Confident	5 Å²	5	44.9 Å²	44.9	3%	0.026	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	90.3	-175.9	-179.6	48	0	0	0	112.7	L1456 R1457 K1460 H1468 K1490 V1491	L1456-L1486 HydrophobicContact CB-CB 4.07Å; L1456-L1486 HydrophobicContact CB-CD2 4.29Å; L1456-L1486 HydrophobicContact CD2-CB 4.48Å; R1457-L1486 HydrophobicContact CG-CD2 4.13Å; K1460-L1486 HydrophobicContact CB-CD2 3.67Å; K1460-L1486 HydrophobicContact CB-CG 4.35Å; K1460-L1486 HydrophobicContact CG-CD2 3.82Å; K1460-L1486 HydrophobicContact CG-CG 4.12Å; H1468-L1486 PolarHBondContact O-N 3.21Å; L1486-K1490 WeakPolarHBondContact CD1-O 3.38Å; L1486-V1491 HydrophobicContact CB-CG2 4.16Å; L1486-V1491 HydrophobicContact CD1-CG2 3.94Å; L1486-V1491 HydrophobicContact CD2-CG2 4.05Å; L1486-V1491 HydrophobicContact CG-CG2 4.27Å
1487	P	83.7	Confident	90.3	Very high	17 Å²	17	42.7 Å²	42.7	11%	0.11	21%	0.207	C	C	.	.	S	Bend	trans	-68.5	-43.2	178.9	-25.8	36.4	0	0	0	115.5	I1467 Y1485 W1524	I1467-P1487 HydrophobicContact CD1-CB 4.37Å; Y1485-P1487 HydrophobicContact CD2-CG 3.73Å; Y1485-P1487 HydrophobicContact CE2-CG 3.9Å; Y1485-P1487 WeakPolarHBondContact O-CD 3.46Å; P1487-W1524 HydrophobicContact CB-CE3 4Å; P1487-W1524 HydrophobicContact CB-CH2 4.1Å; P1487-W1524 HydrophobicContact CB-CZ3 3.41Å; P1487-W1524 VanDerWaalsContact CB-CZ3 3.41Å; P1487-W1524 HydrophobicContact CG-CE3 3.77Å; P1487-W1524 HydrophobicContact CG-CZ3 3.72Å
1488	K	81.9	Confident	90.6	Very high	166 Å²	166	40.2 Å²	40.2	72%	0.722	20%	0.195	S	C	*	.	S	Bend	trans	-135.9	-94.6	-173	-66.2	-174.4	179.9	-178.7	0	110.2
1489	T	82.5	Confident	90.7	Very high	127 Å²	127	40 Å²	40	78%	0.779	19%	0.191	S	C	*	.	S	Bend	trans	-118.5	-26.5	-177.3	49.8	0	0	0	0	113.6
1490	K	87.7	Confident	90.8	Very high	165 Å²	165	41.3 Å²	41.3	72%	0.717	20%	0.198	S	C	*	.	S	Bend	trans	-100.9	125.4	177.1	177.2	164.3	-175.9	172.5	0	110	L1486	L1486-K1490 WeakPolarHBondContact CD1-O 3.38Å
1491	V	89.6	Confident	90.6	Very high	7 Å²	7	42.5 Å²	42.5	4%	0.042	21%	0.205	C	C	.	.			trans	-68.8	145.4	168.6	179.8	0	0	0	0	109.3	E1453 L1456 L1486 H1493	E1453-V1491 HydrophobicContact CB-CB 4.37Å; E1453-V1491 HydrophobicContact CB-CG1 4.32Å; E1453-V1491 HydrophobicContact CB-CG2 4.11Å; E1453-V1491 HydrophobicContact CG-CB 4.3Å; E1453-V1491 HydrophobicContact CG-CG2 3.79Å; E1453-V1491 WeakPolarHBondContact OE1-CG2 3.32Å; L1456-V1491 HydrophobicContact CB-CG2 4.36Å; L1456-V1491 HydrophobicContact CD1-CG1 3.67Å; L1456-V1491 HydrophobicContact CD1-CG2 4.45Å; L1486-V1491 HydrophobicContact CB-CG2 4.16Å; L1486-V1491 HydrophobicContact CD1-CG2 3.94Å; L1486-V1491 HydrophobicContact CD2-CG2 4.05Å; L1486-V1491 HydrophobicContact CG-CG2 4.27Å; V1491-H1493 VanDerWaalsContact CG1-CE1 3.5Å; V1491-H1493 WeakPolarHBondContact CG1-CE1 3.29Å; V1491-H1493 WeakPolarHBondContact CG1-NE2 3.09Å
1492	R	90	Very high	90.5	Very high	78 Å²	78	42.9 Å²	42.9	29%	0.294	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	140.6	170	-69.4	-176.7	175.5	-172.9	0.1	108.6	S1484 Y1485 W1524 D1526	S1484-R1492 CarbonylContact C-O 3.54Å; S1484-R1492 WeakPolarHBondContact CA-O 3.31Å; Y1485-R1492 HydrophobicContact CD1-CB 3.97Å; Y1485-R1492 HydrophobicContact CD2-CB 4.44Å; Y1485-R1492 HydrophobicContact CE1-CB 3.55Å; Y1485-R1492 HydrophobicContact CE2-CB 4.08Å; Y1485-R1492 HydrophobicContact CE2-CG 4.4Å; Y1485-R1492 HydrophobicContact CG-CB 4.39Å; Y1485-R1492 VanDerWaalsContact CZ-CD 3.4Å; Y1485-R1492 PolarHBondContact N-O 2.97Å; Y1485-R1492 PolarHBondContact O-N 3.44Å; Y1485-R1492 WeakPolarHBondContact OH-CD 3.32Å; Y1485-R1492 PolarHBondContact OH-NH1 3.34Å; Y1485-R1492 VanDerWaalsContact OH-NH1 3.1Å; R1492-W1524 PolarHBondContact NH1-O 3.15Å; R1492-D1526 PolarHBondContact NH1-O 3.22Å
1493	H	91.3	Very high	90.5	Very high	52 Å²	52	43 Å²	43	24%	0.241	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	129.7	176.7	-54.5	-87	0	0	0	108.8	R1449 L1482 S1484 V1491	R1449-H1493 PolarHBondContact O-CE1 3.17Å; L1482-H1493 HydrophobicContact CD1-CB 3.98Å; S1484-H1493 WeakPolarHBondContact CB-ND1 3.21Å; S1484-H1493 PolarHBondContact OG-ND1 3.39Å; V1491-H1493 VanDerWaalsContact CG1-CE1 3.5Å; V1491-H1493 WeakPolarHBondContact CG1-CE1 3.29Å; V1491-H1493 WeakPolarHBondContact CG1-NE2 3.09Å
1494	E	91.9	Very high	90.5	Very high	22 Å²	22	47.7 Å²	47.7	10%	0.103	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	151.6	179.1	-62.9	-177.7	-130.8	0	0	109.5	L1483 Y1485 F1505 R1506 T1528	L1483-E1494 WeakPolarHBondContact CA-O 3.37Å; L1483-E1494 PolarHBondContact N-O 2.69Å; L1483-E1494 PolarHBondContact O-N 3Å; Y1485-E1494 HydrophobicContact CE1-CG 4.27Å; Y1485-E1494 VanDerWaalsContact CE1-OE1 3.24Å; Y1485-E1494 WeakPolarHBondContact CE1-OE1 3.46Å; Y1485-E1494 VanDerWaalsContact CZ-OE1 3.3Å; Y1485-E1494 PolarHBondContact OH-OE1 3.32Å; E1494-F1505 HydrophobicContact CB-CE2 3.67Å; E1494-F1505 HydrophobicContact CB-CZ 4.17Å; E1494-F1505 WeakPolarHBondContact OE2-CZ 3.4Å; E1494-R1506 IonicContact OE1-CZ 3.3Å; E1494-R1506 IonicContact OE1-NE 2.78Å; E1494-R1506 IonicContact OE1-NH2 3.67Å; E1494-R1506 PolarHBondContact OE1-NH2 3.35Å; E1494-R1506 IonicContact OE2-CZ 3.74Å; E1494-R1506 IonicContact OE2-NE 3.36Å; E1494-R1506 PolarHBondContact OE2-NE 3.16Å; E1494-R1506 IonicContact OE2-NH2 3.48Å; E1494-R1506 PolarHBondContact OE2-NH2 3.41Å; E1494-T1528 HydrophobicContact CG-CG2 4.08Å; E1494-T1528 WeakPolarHBondContact OE1-CG2 3.38Å; E1494-T1528 WeakPolarHBondContact OE2-CG2 3.33Å
1495	Y	92.9	Very high	90.5	Very high	53 Å²	53	47.8 Å²	47.8	21%	0.208	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	127.8	-178.4	-69.6	-83.8	0	0	0	111.7	E1448 R1449 M1477 K1480 F1481 L1482	E1448-Y1495 PolarHBondContact OE1-OH 3.23Å; R1449-Y1495 PolarHBondContact NE-OH 3.31Å; R1449-Y1495 PolarHBondContact NH2-OH 2.75Å; M1477-Y1495 HydrophobicContact CE-CD1 3.63Å; M1477-Y1495 HydrophobicContact CE-CD2 3.77Å; M1477-Y1495 HydrophobicContact CE-CE1 3.38Å; M1477-Y1495 HydrophobicContact CE-CE2 3.55Å; M1477-Y1495 HydrophobicContact CE-CG 3.81Å; K1480-Y1495 HydrophobicContact CB-CD1 4.17Å; F1481-Y1495 WeakPolarHBondContact O-CA 3.49Å; L1482-Y1495 HydrophobicContact CB-CD1 4.45Å; L1482-Y1495 HydrophobicContact CB-CE1 4.16Å; L1482-Y1495 HydrophobicContact CD1-CD1 4.12Å; L1482-Y1495 HydrophobicContact CD1-CE1 3.58Å; L1482-Y1495 HydrophobicContact CD1-CE2 4.06Å; L1482-Y1495 HydrophobicContact CG-CE1 4.48Å
1496	V	94.3	Very high	90.3	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	125.8	160.8	-179.7	0	0	0	0	107.3	L1431 F1471 K1480 F1481 L1483 Y1503 F1505 L1516	L1431-V1496 HydrophobicContact CD1-CG1 4.3Å; F1471-V1496 HydrophobicContact CE1-CG2 3.99Å; K1480-V1496 CarbonylContact C-O 3.5Å; K1480-V1496 VanDerWaalsContact CA-O 3.27Å; K1480-V1496 WeakPolarHBondContact CA-O 3.47Å; F1481-V1496 PolarHBondContact N-O 3.21Å; F1481-V1496 PolarHBondContact O-N 3.23Å; L1483-V1496 HydrophobicContact CB-CG2 4.36Å; V1496-Y1503 HydrophobicContact CG1-CD1 4.12Å; V1496-Y1503 HydrophobicContact CG1-CG 4.37Å; V1496-F1505 HydrophobicContact CG2-CB 4.29Å; V1496-F1505 HydrophobicContact CG2-CD2 3.62Å; V1496-F1505 HydrophobicContact CG2-CE2 4.25Å; V1496-F1505 HydrophobicContact CG2-CG 4.18Å; V1496-L1516 HydrophobicContact CG1-CD2 4.02Å; V1496-L1516 HydrophobicContact CG2-CD1 4.4Å; V1496-L1516 HydrophobicContact CG2-CD2 4.09Å
1497	T	94.5	Very high	90.1	Very high	36 Å²	36	54 Å²	54	22%	0.221	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	129.3	173.4	-54.9	0	0	0	0	109	K1480 M1499 R1504	K1480-T1497 HydrophobicContact CG-CG2 4.08Å; T1497-M1499 HydrophobicContact CG2-SD 4.1Å; T1497-R1504 PolarHBondContact N-O 3.23Å; T1497-R1504 PolarHBondContact O-N 3.26Å
1498	V	94.4	Very high	90.4	Very high	4 Å²	4	57.5 Å²	57.5	2%	0.024	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	134.8	172.9	-178.8	0	0	0	0	108.9	M1424 A1427 L1431 G1479 F1481	M1424-V1498 HydrophobicContact CB-CG1 4.03Å; M1424-V1498 HydrophobicContact CG-CG1 4.27Å; M1424-V1498 WeakPolarHBondContact O-CG1 3.43Å; A1427-V1498 HydrophobicContact CB-CG1 3.66Å; L1431-V1498 HydrophobicContact CD1-CG2 4.07Å; G1479-V1498 PolarHBondContact O-N 3.5Å; F1481-V1498 HydrophobicContact CD2-CG2 3.75Å; F1481-V1498 HydrophobicContact CE2-CG2 3.73Å
1499	M	91.5	Very high	90.8	Very high	41 Å²	41	53.6 Å²	53.6	20%	0.202	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	163.6	-179	-58.3	-68.6	-37.3	0	0	108.8	M1424 T1497 E1501 G1502 R1504	M1424-M1499 VanDerWaalsContact CG-C 3.46Å; T1497-M1499 HydrophobicContact CG2-SD 4.1Å; M1499-E1501 VanDerWaalsContact CB-OE2 3.3Å; M1499-E1501 WeakPolarHBondContact CB-OE2 3.32Å; M1499-E1501 PolarHBondContact O-N 3.01Å; M1499-G1502 PolarHBondContact N-O 3.21Å; M1499-G1502 PolarHBondContact O-N 3.46Å; M1499-R1504 HydrophobicContact CG-CB 3.86Å; M1499-R1504 HydrophobicContact SD-CB 4.49Å; M1499-R1504 PolarHBondContact SD-NE 3Å
1500	P	90.5	Very high	91.3	Very high	29 Å²	29	48.3 Å²	48.3	19%	0.188	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-28.1	170.8	-23.6	34.8	0	0	0	113.1	P1423 M1424 G1502	P1423-P1500 HydrophobicContact CB-CB 4.4Å; P1423-P1500 WeakPolarHBondContact CB-O 3.35Å; M1424-P1500 HydrophobicContact CG-CG 4.04Å; M1424-P1500 HydrophobicContact SD-CG 4.01Å; P1500-G1502 VanDerWaalsContact C-N 3.33Å
1501	E	88.8	Confident	91.4	Very high	91 Å²	91	46.2 Å²	46.2	43%	0.425	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.3	8.8	177.1	-36.8	78.4	-143	0	0	114.4	M1499 I1509	M1499-E1501 VanDerWaalsContact CB-OE2 3.3Å; M1499-E1501 WeakPolarHBondContact CB-OE2 3.32Å; M1499-E1501 PolarHBondContact O-N 3.01Å; E1501-I1509 HydrophobicContact CB-CG2 4.16Å
1502	G	91.1	Very high	91.5	Very high	7 Å²	7	48.2 Å²	48.2	7%	0.072	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	108.5	-125.1	-177.9	0	0	0	0	0	113.5	M1499 P1500	M1499-G1502 PolarHBondContact N-O 3.21Å; M1499-G1502 PolarHBondContact O-N 3.46Å; P1500-G1502 VanDerWaalsContact C-N 3.33Å
1503	Y	94.8	Very high	91.5	Very high	3 Å²	3	44.5 Å²	44.5	1%	0.012	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	116.8	-167	-47.8	-73.5	0	0	0	112.8	A1427 E1430 L1431 V1496 I1509 F1510 V1513 L1516	A1427-Y1503 WeakPolarHBondContact CA-OH 3.41Å; A1427-Y1503 HydrophobicContact CB-CE1 3.74Å; A1427-Y1503 WeakPolarHBondContact O-CE1 3.39Å; A1427-Y1503 PolarHBondContact O-OH 3.14Å; E1430-Y1503 VanDerWaalsContact CB-OH 3.28Å; E1430-Y1503 WeakPolarHBondContact CB-OH 3.45Å; E1430-Y1503 WeakPolarHBondContact OE2-CE2 3.4Å; E1430-Y1503 PolarHBondContact OE2-OH 3.26Å; L1431-Y1503 HydrophobicContact CD1-CD1 3.65Å; L1431-Y1503 HydrophobicContact CD1-CE1 3.57Å; L1431-Y1503 HydrophobicContact CG-CD1 4.13Å; L1431-Y1503 HydrophobicContact CG-CE1 3.69Å; V1496-Y1503 HydrophobicContact CG1-CD1 4.12Å; V1496-Y1503 HydrophobicContact CG1-CG 4.37Å; Y1503-I1509 CarbonylContact O-C 3.45Å; Y1503-I1509 WeakPolarHBondContact O-CA 3.43Å; Y1503-F1510 WeakPolarHBondContact CD2-O 3.49Å; Y1503-F1510 PolarHBondContact N-O 3.1Å; Y1503-F1510 PolarHBondContact O-N 2.85Å; Y1503-V1513 HydrophobicContact CD2-CG2 4.41Å; Y1503-V1513 HydrophobicContact CE1-CG2 4Å; Y1503-V1513 HydrophobicContact CE2-CG2 3.77Å; Y1503-V1513 VanDerWaalsContact CE2-N 3.28Å; Y1503-L1516 HydrophobicContact CG-CD2 4.14Å
1504	R	93.8	Very high	91.5	Very high	99 Å²	99	46.2 Å²	46.2	37%	0.374	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	114.6	171.8	-169.8	-176.6	-58.9	-119.9	-3.5	110.5	T1497 M1499 Q1508 I1509	T1497-R1504 PolarHBondContact N-O 3.23Å; T1497-R1504 PolarHBondContact O-N 3.26Å; M1499-R1504 HydrophobicContact CG-CB 3.86Å; M1499-R1504 HydrophobicContact SD-CB 4.49Å; M1499-R1504 PolarHBondContact SD-NE 3Å; R1504-Q1508 CarbonylContact C-O 3.54Å; R1504-Q1508 VanDerWaalsContact CA-O 3.29Å; R1504-Q1508 WeakPolarHBondContact CA-O 3.45Å; R1504-I1509 HydrophobicContact CG-CG1 4.43Å
1505	F	92.8	Very high	91.5	Very high	2 Å²	2	46.4 Å²	46.4	1%	0.009	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	132.2	179.4	-178.6	-111.7	0	0	0	111	L1483 E1494 V1496 G1507 Q1508 F1510 L1516 W1519 F1520	L1483-F1505 HydrophobicContact CD2-CE2 4.01Å; L1483-F1505 HydrophobicContact CD2-CZ 3.88Å; E1494-F1505 HydrophobicContact CB-CE2 3.67Å; E1494-F1505 HydrophobicContact CB-CZ 4.17Å; E1494-F1505 WeakPolarHBondContact OE2-CZ 3.4Å; V1496-F1505 HydrophobicContact CG2-CB 4.29Å; V1496-F1505 HydrophobicContact CG2-CD2 3.62Å; V1496-F1505 HydrophobicContact CG2-CE2 4.25Å; V1496-F1505 HydrophobicContact CG2-CG 4.18Å; F1505-G1507 PolarHBondContact O-N 2.96Å; F1505-Q1508 PolarHBondContact N-O 3Å; F1505-Q1508 PolarHBondContact O-N 3.27Å; F1505-F1510 HydrophobicContact CB-CD2 4.2Å; F1505-F1510 HydrophobicContact CB-CE2 3.99Å; F1505-F1510 HydrophobicContact CD1-CE2 4.49Å; F1505-L1516 HydrophobicContact CB-CD1 3.44Å; F1505-L1516 VanDerWaalsContact CB-CD1 3.44Å; F1505-L1516 HydrophobicContact CD1-CD1 3.77Å; F1505-L1516 HydrophobicContact CG-CD1 3.72Å; F1505-W1519 HydrophobicContact CD1-CE3 4.04Å; F1505-W1519 AromaticContact CD1-CZ3 3.77Å; F1505-W1519 HydrophobicContact CD1-CZ3 3.77Å; F1505-W1519 HydrophobicContact CE1-CE3 4.24Å; F1505-W1519 AromaticContact CE1-CZ3 3.84Å; F1505-W1519 HydrophobicContact CE1-CZ3 3.84Å; F1505-F1520 HydrophobicContact CE1-CB 4.48Å; F1505-F1520 HydrophobicContact CE1-CD2 4.16Å; F1505-F1520 HydrophobicContact CZ-CD2 4.21Å
1506	R	88.4	Confident	91.5	Very high	70 Å²	70	43.9 Å²	43.9	26%	0.264	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	45.9	29.9	-171.5	-64.6	-170.9	-178.8	170	1.7	114.8	Y1485 E1494 Q1508 W1519 H1523	Y1485-R1506 PolarHBondContact OH-NH2 3.22Å; E1494-R1506 IonicContact OE1-CZ 3.3Å; E1494-R1506 IonicContact OE1-NE 2.78Å; E1494-R1506 IonicContact OE1-NH2 3.67Å; E1494-R1506 PolarHBondContact OE1-NH2 3.35Å; E1494-R1506 IonicContact OE2-CZ 3.74Å; E1494-R1506 IonicContact OE2-NE 3.36Å; E1494-R1506 PolarHBondContact OE2-NE 3.16Å; E1494-R1506 IonicContact OE2-NH2 3.48Å; E1494-R1506 PolarHBondContact OE2-NH2 3.41Å; R1506-Q1508 VanDerWaalsContact C-N 3.32Å; R1506-Q1508 PolarHBondContact O-N 3.49Å; R1506-W1519 HydrophobicContact CB-CH2 4.07Å; R1506-W1519 HydrophobicContact CB-CZ3 4.18Å; R1506-W1519 HydrophobicContact CG-CH2 4.43Å; R1506-W1519 HydrophobicContact CG-CZ3 4.3Å; R1506-H1523 PolarHBondContact NH1-O 2.69Å
1507	G	85.4	Confident	91.4	Very high	66 Å²	66	44 Å²	44	68%	0.68	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	84.2	-8.3	-179	0	0	0	0	0	115.7	F1505	F1505-G1507 PolarHBondContact O-N 2.96Å
1508	Q	89.5	Confident	91.2	Very high	90 Å²	90	50.3 Å²	50.3	42%	0.421	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	155.1	168.7	-62.7	-174.4	13.5	0	0	110.3	R1504 F1505 R1506 F1510	R1504-Q1508 CarbonylContact C-O 3.54Å; R1504-Q1508 VanDerWaalsContact CA-O 3.29Å; R1504-Q1508 WeakPolarHBondContact CA-O 3.45Å; F1505-Q1508 PolarHBondContact N-O 3Å; F1505-Q1508 PolarHBondContact O-N 3.27Å; R1506-Q1508 VanDerWaalsContact C-N 3.32Å; R1506-Q1508 PolarHBondContact O-N 3.49Å; Q1508-F1510 HydrophobicContact CB-CE1 4.49Å; Q1508-F1510 HydrophobicContact CB-CE2 3.65Å; Q1508-F1510 HydrophobicContact CB-CZ 3.62Å
1509	I	90.7	Very high	91.1	Very high	83 Å²	83	52 Å²	52	43%	0.426	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	134.2	175.3	-58.6	175.8	0	0	0	108	E1501 Y1503 R1504	E1501-I1509 HydrophobicContact CB-CG2 4.16Å; Y1503-I1509 CarbonylContact O-C 3.45Å; Y1503-I1509 WeakPolarHBondContact O-CA 3.43Å; R1504-I1509 HydrophobicContact CG-CG1 4.43Å
1510	F	93.7	Very high	91.1	Very high	17 Å²	17	50.4 Å²	50.4	8%	0.075	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	129.7	-177	-61.1	-79.4	0	0	0	109.7	Y1503 F1505 Q1508 T1512 L1516 W1519	Y1503-F1510 WeakPolarHBondContact CD2-O 3.49Å; Y1503-F1510 PolarHBondContact N-O 3.1Å; Y1503-F1510 PolarHBondContact O-N 2.85Å; F1505-F1510 HydrophobicContact CB-CD2 4.2Å; F1505-F1510 HydrophobicContact CB-CE2 3.99Å; F1505-F1510 HydrophobicContact CD1-CE2 4.49Å; Q1508-F1510 HydrophobicContact CB-CE1 4.49Å; Q1508-F1510 HydrophobicContact CB-CE2 3.65Å; Q1508-F1510 HydrophobicContact CB-CZ 3.62Å; F1510-T1512 VanDerWaalsContact C-N 3.3Å; F1510-T1512 PolarHBondContact O-N 2.68Å; F1510-L1516 HydrophobicContact CB-CB 3.82Å; F1510-L1516 HydrophobicContact CD2-CB 4.24Å; F1510-L1516 HydrophobicContact CD2-CD1 3.68Å; F1510-L1516 HydrophobicContact CE2-CD1 4.05Å; F1510-L1516 HydrophobicContact CG-CB 3.95Å; F1510-L1516 HydrophobicContact CG-CD1 4.26Å; F1510-W1519 HydrophobicContact CD1-CB 4.39Å; F1510-W1519 HydrophobicContact CE1-CB 3.49Å; F1510-W1519 VanDerWaalsContact CE1-CB 3.49Å; F1510-W1519 HydrophobicContact CE1-CD2 4.07Å; F1510-W1519 HydrophobicContact CE1-CE3 4.47Å; F1510-W1519 AromaticContact CE1-CG 3.61Å; F1510-W1519 HydrophobicContact CE1-CG 3.61Å; F1510-W1519 HydrophobicContact CE2-CE3 4.24Å; F1510-W1519 HydrophobicContact CZ-CB 3.85Å; F1510-W1519 AromaticContact CZ-CD2 3.54Å; F1510-W1519 HydrophobicContact CZ-CD2 3.54Å; F1510-W1519 AromaticContact CZ-CE3 3.63Å; F1510-W1519 HydrophobicContact CZ-CE3 3.63Å; F1510-W1519 AromaticContact CZ-CG 3.62Å; F1510-W1519 HydrophobicContact CZ-CG 3.62Å; F1510-W1519 HydrophobicContact CZ-CZ3 4.41Å
1511	D	90.4	Very high	91.1	Very high	120 Å²	120	53.5 Å²	53.5	64%	0.642	27%	0.266	S	S	*	.	S	Bend	trans	-69.4	-21.6	-176.5	61.2	-1.3	0	0	0	114.8	S1515	D1511-S1515 PolarHBondContact N-OG 2.98Å; D1511-S1515 WeakPolarHBondContact OD1-CB 3.48Å; D1511-S1515 PolarHBondContact OD1-OG 3.45Å
1512	T	90.7	Very high	91	Very high	49 Å²	49	55.7 Å²	55.7	30%	0.301	28%	0.276	S	S	.	.	S	Bend	trans	-150.6	152.5	-170	54.1	0	0	0	0	109.9	F1510 N1514 S1515 L1516	F1510-T1512 VanDerWaalsContact C-N 3.3Å; F1510-T1512 PolarHBondContact O-N 2.68Å; T1512-N1514 PolarHBondContact O-N 2.6Å; T1512-N1514 VanDerWaalsContact O-N 3.12Å; T1512-S1515 PolarHBondContact N-OG 3.17Å; T1512-S1515 PolarHBondContact O-N 2.82Å; T1512-S1515 VanDerWaalsContact O-N 3.17Å; T1512-S1515 PolarHBondContact O-OG 2.84Å; T1512-S1515 VanDerWaalsContact O-OG 3.09Å; T1512-S1515 PolarHBondContact OG1-N 2.79Å; T1512-S1515 PolarHBondContact OG1-OG 3.49Å; T1512-L1516 WeakPolarHBondContact O-CB 3.37Å; T1512-L1516 PolarHBondContact O-N 3.45Å; T1512-L1516 VanDerWaalsContact O-N 3.13Å
1513	V	90.6	Very high	90.8	Very high	0 Å²	0	57.8 Å²	57.8	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-60	-25.8	171.6	175.2	0	0	0	0	110.3	E1430 L1431 Y1434 Y1503 L1517	E1430-V1513 HydrophobicContact CB-CG2 3.99Å; E1430-V1513 VanDerWaalsContact CD-CG2 3.45Å; E1430-V1513 VanDerWaalsContact CD-N 3.34Å; E1430-V1513 HydrophobicContact CG-CB 4.11Å; E1430-V1513 HydrophobicContact CG-CG2 3.74Å; E1430-V1513 WeakPolarHBondContact OE1-CB 3.49Å; E1430-V1513 PolarHBondContact OE1-N 2.74Å; E1430-V1513 WeakPolarHBondContact OE2-CG2 3.42Å; E1430-V1513 PolarHBondContact OE2-N 2.79Å; E1430-V1513 VanDerWaalsContact OE2-N 3.07Å; L1431-V1513 HydrophobicContact CD2-CG1 4.15Å; L1431-V1513 HydrophobicContact CD2-CG2 3.56Å; L1431-V1513 HydrophobicContact CG-CG2 3.72Å; Y1434-V1513 HydrophobicContact CD2-CG1 3.84Å; Y1434-V1513 HydrophobicContact CE2-CG1 4.26Å; Y1434-V1513 HydrophobicContact CG-CG1 4.07Å; Y1503-V1513 HydrophobicContact CD2-CG2 4.41Å; Y1503-V1513 HydrophobicContact CE1-CG2 4Å; Y1503-V1513 HydrophobicContact CE2-CG2 3.77Å; Y1503-V1513 VanDerWaalsContact CE2-N 3.28Å; V1513-L1517 HydrophobicContact CG1-CD1 3.62Å; V1513-L1517 HydrophobicContact CG1-CG 4.09Å; V1513-L1517 WeakPolarHBondContact O-CB 3.42Å; V1513-L1517 WeakPolarHBondContact O-CG 3.19Å; V1513-L1517 PolarHBondContact O-N 3.33Å
1514	N	90.9	Very high	90.3	Very high	88 Å²	88	60.4 Å²	60.4	47%	0.471	29%	0.294	S	S	.	.	H	α-helix	trans	-70.6	-40.6	175.7	-74	-75.7	0	0	0	114.3	T1512 R1518	T1512-N1514 PolarHBondContact O-N 2.6Å; T1512-N1514 VanDerWaalsContact O-N 3.12Å; N1514-R1518 VanDerWaalsContact O-CG 3.27Å; N1514-R1518 WeakPolarHBondContact O-CG 3.45Å; N1514-R1518 PolarHBondContact O-N 2.99Å
1515	S	92	Very high	89.5	Confident	26 Å²	26	60.8 Å²	60.8	18%	0.182	30%	0.303	C	S	.	.	H	α-helix	trans	-71.8	-44.5	175.5	62	0	0	0	0	111.2	D1511 T1512 L1517 R1518 W1519	D1511-S1515 PolarHBondContact N-OG 2.98Å; D1511-S1515 WeakPolarHBondContact OD1-CB 3.48Å; D1511-S1515 PolarHBondContact OD1-OG 3.45Å; T1512-S1515 PolarHBondContact N-OG 3.17Å; T1512-S1515 PolarHBondContact O-N 2.82Å; T1512-S1515 VanDerWaalsContact O-N 3.17Å; T1512-S1515 PolarHBondContact O-OG 2.84Å; T1512-S1515 VanDerWaalsContact O-OG 3.09Å; T1512-S1515 PolarHBondContact OG1-N 2.79Å; T1512-S1515 PolarHBondContact OG1-OG 3.49Å; S1515-L1517 VanDerWaalsContact C-N 3.31Å; S1515-L1517 PolarHBondContact O-N 3.47Å; S1515-R1518 PolarHBondContact O-N 2.97Å; S1515-W1519 PolarHBondContact O-N 3.33Å
1516	L	92.9	Very high	88.8	Confident	0 Å²	0	63.8 Å²	63.8	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-49.1	-50.2	169.6	170.9	65.3	0	0	0	111.8	F1471 V1496 Y1503 F1505 F1510 T1512 W1519 F1520	F1471-L1516 HydrophobicContact CZ-CD2 4.39Å; V1496-L1516 HydrophobicContact CG1-CD2 4.02Å; V1496-L1516 HydrophobicContact CG2-CD1 4.4Å; V1496-L1516 HydrophobicContact CG2-CD2 4.09Å; Y1503-L1516 HydrophobicContact CG-CD2 4.14Å; F1505-L1516 HydrophobicContact CB-CD1 3.44Å; F1505-L1516 VanDerWaalsContact CB-CD1 3.44Å; F1505-L1516 HydrophobicContact CD1-CD1 3.77Å; F1505-L1516 HydrophobicContact CG-CD1 3.72Å; F1510-L1516 HydrophobicContact CB-CB 3.82Å; F1510-L1516 HydrophobicContact CD2-CB 4.24Å; F1510-L1516 HydrophobicContact CD2-CD1 3.68Å; F1510-L1516 HydrophobicContact CE2-CD1 4.05Å; F1510-L1516 HydrophobicContact CG-CB 3.95Å; F1510-L1516 HydrophobicContact CG-CD1 4.26Å; T1512-L1516 WeakPolarHBondContact O-CB 3.37Å; T1512-L1516 PolarHBondContact O-N 3.45Å; T1512-L1516 VanDerWaalsContact O-N 3.13Å; L1516-W1519 PolarHBondContact O-N 3.03Å; L1516-F1520 VanDerWaalsContact O-CB 3.32Å; L1516-F1520 WeakPolarHBondContact O-CB 3.33Å; L1516-F1520 PolarHBondContact O-N 3.05Å
1517	L	91.6	Very high	87.5	Confident	2 Å²	2	66 Å²	66	1%	0.01	34%	0.343	C	S	.	.	H	α-helix	trans	-78.8	-23.7	-176.5	-76.2	177.2	0	0	0	114.7	Y1434 Y1469 F1471 V1513 S1515 F1520 K1521	Y1434-L1517 HydrophobicContact CD1-CD1 4.09Å; Y1434-L1517 HydrophobicContact CD2-CD1 4.34Å; Y1434-L1517 HydrophobicContact CE1-CD1 3.38Å; Y1434-L1517 HydrophobicContact CE2-CD1 3.7Å; Y1434-L1517 VanDerWaalsContact OH-CD1 3.3Å; Y1434-L1517 WeakPolarHBondContact OH-CD1 3.37Å; Y1469-L1517 HydrophobicContact CD2-CD2 4.34Å; Y1469-L1517 HydrophobicContact CE2-CD2 3.73Å; F1471-L1517 HydrophobicContact CE2-CD1 4.16Å; F1471-L1517 HydrophobicContact CE2-CD2 3.95Å; F1471-L1517 HydrophobicContact CE2-CG 4.36Å; F1471-L1517 HydrophobicContact CZ-CD2 3.72Å; F1471-L1517 HydrophobicContact CZ-CG 4.23Å; V1513-L1517 HydrophobicContact CG1-CD1 3.62Å; V1513-L1517 HydrophobicContact CG1-CG 4.09Å; V1513-L1517 WeakPolarHBondContact O-CB 3.42Å; V1513-L1517 WeakPolarHBondContact O-CG 3.19Å; V1513-L1517 PolarHBondContact O-N 3.33Å; S1515-L1517 VanDerWaalsContact C-N 3.31Å; S1515-L1517 PolarHBondContact O-N 3.47Å; L1517-F1520 HydrophobicContact CD2-CD1 3.97Å; L1517-K1521 WeakPolarHBondContact O-CB 3.46Å; L1517-K1521 WeakPolarHBondContact O-CD 3.5Å; L1517-K1521 WeakPolarHBondContact O-CG 3.49Å; L1517-K1521 PolarHBondContact O-N 2.81Å; L1517-K1521 VanDerWaalsContact O-N 3.13Å
1518	R	91.5	Very high	86	Confident	170 Å²	170	65.8 Å²	65.8	64%	0.642	33%	0.328	S	S	*	.	H	α-helix	trans	-65.2	-53.5	167.1	-76.8	169.4	-173.2	165.2	4.4	109.1	N1514 S1515 F1520 K1521 E1522	N1514-R1518 VanDerWaalsContact O-CG 3.27Å; N1514-R1518 WeakPolarHBondContact O-CG 3.45Å; N1514-R1518 PolarHBondContact O-N 2.99Å; S1515-R1518 PolarHBondContact O-N 2.97Å; R1518-F1520 PolarHBondContact O-N 2.66Å; R1518-K1521 PolarHBondContact O-N 3.02Å; R1518-E1522 PolarHBondContact O-N 3.38Å; R1518-E1522 VanDerWaalsContact O-N 3.1Å
1519	W	92.2	Very high	83.7	Confident	39 Å²	39	65.8 Å²	65.8	15%	0.148	34%	0.344	C	S	.	.	H	α-helix	trans	-58.5	-47.4	179.7	-170.1	82.2	0	0	0	111.9	F1505 R1506 F1510 S1515 L1516 K1521 E1522 H1523	F1505-W1519 HydrophobicContact CD1-CE3 4.04Å; F1505-W1519 AromaticContact CD1-CZ3 3.77Å; F1505-W1519 HydrophobicContact CD1-CZ3 3.77Å; F1505-W1519 HydrophobicContact CE1-CE3 4.24Å; F1505-W1519 AromaticContact CE1-CZ3 3.84Å; F1505-W1519 HydrophobicContact CE1-CZ3 3.84Å; R1506-W1519 HydrophobicContact CB-CH2 4.07Å; R1506-W1519 HydrophobicContact CB-CZ3 4.18Å; R1506-W1519 HydrophobicContact CG-CH2 4.43Å; R1506-W1519 HydrophobicContact CG-CZ3 4.3Å; F1510-W1519 HydrophobicContact CD1-CB 4.39Å; F1510-W1519 HydrophobicContact CE1-CB 3.49Å; F1510-W1519 VanDerWaalsContact CE1-CB 3.49Å; F1510-W1519 HydrophobicContact CE1-CD2 4.07Å; F1510-W1519 HydrophobicContact CE1-CE3 4.47Å; F1510-W1519 AromaticContact CE1-CG 3.61Å; F1510-W1519 HydrophobicContact CE1-CG 3.61Å; F1510-W1519 HydrophobicContact CE2-CE3 4.24Å; F1510-W1519 HydrophobicContact CZ-CB 3.85Å; F1510-W1519 AromaticContact CZ-CD2 3.54Å; F1510-W1519 HydrophobicContact CZ-CD2 3.54Å; F1510-W1519 AromaticContact CZ-CE3 3.63Å; F1510-W1519 HydrophobicContact CZ-CE3 3.63Å; F1510-W1519 AromaticContact CZ-CG 3.62Å; F1510-W1519 HydrophobicContact CZ-CG 3.62Å; F1510-W1519 HydrophobicContact CZ-CZ3 4.41Å; S1515-W1519 PolarHBondContact O-N 3.33Å; L1516-W1519 PolarHBondContact O-N 3.03Å; W1519-K1521 VanDerWaalsContact C-N 3.34Å; W1519-K1521 PolarHBondContact O-N 2.87Å; W1519-E1522 PolarHBondContact O-N 3.48Å; W1519-E1522 VanDerWaalsContact O-N 3.15Å; W1519-H1523 AromaticContact CD1-CE1 3.36Å; W1519-H1523 AromaticContact CD1-ND1 3.38Å; W1519-H1523 HydrophobicContact CD2-CB 4.23Å; W1519-H1523 AromaticContact CD2-ND1 3.79Å; W1519-H1523 AromaticContact CE2-CD2 3.87Å; W1519-H1523 AromaticContact CE2-CE1 3.93Å; W1519-H1523 AromaticContact CE2-CG 3.54Å; W1519-H1523 AromaticContact CE2-ND1 3.56Å; W1519-H1523 HydrophobicContact CE3-CB 4.36Å; W1519-H1523 AromaticContact CG-ND1 3.68Å; W1519-H1523 HydrophobicContact CH2-CB 4.1Å; W1519-H1523 HydrophobicContact CZ2-CB 3.92Å; W1519-H1523 AromaticContact CZ2-CD2 3.93Å; W1519-H1523 AromaticContact CZ2-CG 3.78Å; W1519-H1523 HydrophobicContact CZ3-CB 4.31Å; W1519-H1523 AromaticContact NE1-CD2 3.73Å; W1519-H1523 AromaticContact NE1-CE1 3.2Å; W1519-H1523 PolarHBondContact NE1-CE1 3.47Å; W1519-H1523 AromaticContact NE1-CG 3.63Å; W1519-H1523 AromaticContact NE1-ND1 3.27Å; W1519-H1523 PolarHBondContact NE1-ND1 2.87Å; W1519-H1523 AromaticContact NE1-NE2 3.46Å; W1519-H1523 PolarHBondContact NE1-NE2 3.2Å; W1519-H1523 WeakPolarHBondContact O-CB 3.48Å; W1519-H1523 PolarHBondContact O-N 3Å; W1519-H1523 PolarHBondContact O-ND1 3.34Å
1520	F	91.7	Very high	80.9	Confident	7 Å²	7	67.1 Å²	67.1	3%	0.031	36%	0.356	C	S	.	.	H	α-helix	trans	-57.9	-40.5	174	169.6	-110.1	0	0	0	113	Y1469 L1483 Y1485 F1505 L1516 L1517 R1518 E1522 H1523 W1524	Y1469-F1520 HydrophobicContact CD1-CE1 4.49Å; Y1469-F1520 AromaticContact CD2-CE1 3.99Å; Y1469-F1520 HydrophobicContact CD2-CE1 3.99Å; Y1469-F1520 AromaticContact CG-CE1 3.96Å; Y1469-F1520 HydrophobicContact CG-CE1 3.96Å; L1483-F1520 HydrophobicContact CD1-CE1 4.36Å; L1483-F1520 HydrophobicContact CD1-CZ 4.32Å; L1483-F1520 HydrophobicContact CD2-CD1 4.26Å; L1483-F1520 HydrophobicContact CD2-CD2 3.83Å; L1483-F1520 HydrophobicContact CD2-CE1 4.29Å; L1483-F1520 HydrophobicContact CD2-CE2 3.86Å; L1483-F1520 HydrophobicContact CD2-CG 4.03Å; L1483-F1520 HydrophobicContact CD2-CZ 4.1Å; L1483-F1520 HydrophobicContact CG-CE2 4.41Å; L1483-F1520 HydrophobicContact CG-CZ 4.37Å; Y1485-F1520 AromaticContact CD1-CE2 3.9Å; Y1485-F1520 HydrophobicContact CD1-CE2 3.9Å; Y1485-F1520 AromaticContact CD1-CZ 3.88Å; Y1485-F1520 HydrophobicContact CD1-CZ 3.88Å; Y1485-F1520 HydrophobicContact CD2-CE2 4.2Å; Y1485-F1520 AromaticContact CD2-CZ 3.95Å; Y1485-F1520 HydrophobicContact CD2-CZ 3.95Å; Y1485-F1520 AromaticContact CE1-CE2 3.83Å; Y1485-F1520 HydrophobicContact CE1-CE2 3.83Å; Y1485-F1520 HydrophobicContact CE1-CZ 4.28Å; Y1485-F1520 HydrophobicContact CE2-CE2 4.13Å; Y1485-F1520 HydrophobicContact CE2-CZ 4.34Å; Y1485-F1520 HydrophobicContact CG-CE2 4.1Å; Y1485-F1520 AromaticContact CG-CZ 3.71Å; Y1485-F1520 HydrophobicContact CG-CZ 3.71Å; Y1485-F1520 AromaticContact CZ-CE2 3.95Å; F1505-F1520 HydrophobicContact CE1-CB 4.48Å; F1505-F1520 HydrophobicContact CE1-CD2 4.16Å; F1505-F1520 HydrophobicContact CZ-CD2 4.21Å; L1516-F1520 VanDerWaalsContact O-CB 3.32Å; L1516-F1520 WeakPolarHBondContact O-CB 3.33Å; L1516-F1520 PolarHBondContact O-N 3.05Å; L1517-F1520 HydrophobicContact CD2-CD1 3.97Å; R1518-F1520 PolarHBondContact O-N 2.66Å; F1520-E1522 VanDerWaalsContact C-N 3.26Å; F1520-E1522 PolarHBondContact O-N 2.99Å; F1520-H1523 PolarHBondContact O-N 2.81Å; F1520-W1524 HydrophobicContact CD2-CB 4.17Å; F1520-W1524 HydrophobicContact CE2-CB 3.83Å; F1520-W1524 HydrophobicContact CZ-CB 4.21Å; F1520-W1524 WeakPolarHBondContact O-CA 3.34Å; F1520-W1524 VanDerWaalsContact O-CB 3.26Å; F1520-W1524 WeakPolarHBondContact O-CB 3.44Å; F1520-W1524 PolarHBondContact O-N 3.21Å
1521	K	89	Confident	78.1	Confident	95 Å²	95	72.8 Å²	72.8	41%	0.413	39%	0.394	S	S	.	.	H	α-helix	trans	-70.4	-21.7	179.1	-75.2	164	-166.2	156.4	0	113.7	Y1469 L1517 R1518 W1519 W1524	Y1469-K1521 WeakPolarHBondContact OH-CE 3.45Å; Y1469-K1521 PolarHBondContact OH-NZ 3.35Å; L1517-K1521 WeakPolarHBondContact O-CB 3.46Å; L1517-K1521 WeakPolarHBondContact O-CD 3.5Å; L1517-K1521 WeakPolarHBondContact O-CG 3.49Å; L1517-K1521 PolarHBondContact O-N 2.81Å; L1517-K1521 VanDerWaalsContact O-N 3.13Å; R1518-K1521 PolarHBondContact O-N 3.02Å; W1519-K1521 VanDerWaalsContact C-N 3.34Å; W1519-K1521 PolarHBondContact O-N 2.87Å; K1521-W1524 VanDerWaalsContact O-CD1 3.26Å
1522	E	87.9	Confident	75.2	Confident	136 Å²	136	70.7 Å²	70.7	64%	0.636	39%	0.394	S	S	*	.	H	α-helix	trans	-85.2	-39.2	172.1	-70.2	161.1	-171.8	0	0	111.4	R1518 W1519 F1520	R1518-E1522 PolarHBondContact O-N 3.38Å; R1518-E1522 VanDerWaalsContact O-N 3.1Å; W1519-E1522 PolarHBondContact O-N 3.48Å; W1519-E1522 VanDerWaalsContact O-N 3.15Å; F1520-E1522 VanDerWaalsContact C-N 3.26Å; F1520-E1522 PolarHBondContact O-N 2.99Å
1523	H	87.2	Confident	72.3	Confident	52 Å²	52	74.7 Å²	74.7	24%	0.241	42%	0.424	C	S	.	.	H	α-helix	trans	-110.5	9.8	-167.3	-55.9	77.4	0	0	0	114.5	R1506 W1519 F1520 L1525 D1526	R1506-H1523 PolarHBondContact NH1-O 2.69Å; W1519-H1523 AromaticContact CD1-CE1 3.36Å; W1519-H1523 AromaticContact CD1-ND1 3.38Å; W1519-H1523 HydrophobicContact CD2-CB 4.23Å; W1519-H1523 AromaticContact CD2-ND1 3.79Å; W1519-H1523 AromaticContact CE2-CD2 3.87Å; W1519-H1523 AromaticContact CE2-CE1 3.93Å; W1519-H1523 AromaticContact CE2-CG 3.54Å; W1519-H1523 AromaticContact CE2-ND1 3.56Å; W1519-H1523 HydrophobicContact CE3-CB 4.36Å; W1519-H1523 AromaticContact CG-ND1 3.68Å; W1519-H1523 HydrophobicContact CH2-CB 4.1Å; W1519-H1523 HydrophobicContact CZ2-CB 3.92Å; W1519-H1523 AromaticContact CZ2-CD2 3.93Å; W1519-H1523 AromaticContact CZ2-CG 3.78Å; W1519-H1523 HydrophobicContact CZ3-CB 4.31Å; W1519-H1523 AromaticContact NE1-CD2 3.73Å; W1519-H1523 AromaticContact NE1-CE1 3.2Å; W1519-H1523 PolarHBondContact NE1-CE1 3.47Å; W1519-H1523 AromaticContact NE1-CG 3.63Å; W1519-H1523 AromaticContact NE1-ND1 3.27Å; W1519-H1523 PolarHBondContact NE1-ND1 2.87Å; W1519-H1523 AromaticContact NE1-NE2 3.46Å; W1519-H1523 PolarHBondContact NE1-NE2 3.2Å; W1519-H1523 WeakPolarHBondContact O-CB 3.48Å; W1519-H1523 PolarHBondContact O-N 3Å; W1519-H1523 PolarHBondContact O-ND1 3.34Å; F1520-H1523 PolarHBondContact O-N 2.81Å; H1523-L1525 PolarHBondContact O-N 3.46Å; H1523-D1526 WeakPolarHBondContact CB-OD2 3.31Å; H1523-D1526 IonicContact CD2-OD2 2.68Å; H1523-D1526 PolarHBondContact CD2-OD2 3.3Å; H1523-D1526 VanDerWaalsContact CD2-OD2 3.3Å; H1523-D1526 IonicContact CG-OD2 3.49Å; H1523-D1526 WeakPolarHBondContact O-CB 3.48Å; H1523-D1526 PolarHBondContact O-N 3.09Å
1524	W	83.7	Confident	69.3	Low	57 Å²	57	78.4 Å²	78.4	22%	0.216	46%	0.455	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-27.9	178.9	67.5	-91.1	0	0	0	113.2	I1467 Y1485 P1487 R1492 F1520 K1521 D1526	I1467-W1524 HydrophobicContact CD1-CH2 3.52Å; I1467-W1524 HydrophobicContact CD1-CZ2 3.41Å; I1467-W1524 VanDerWaalsContact CD1-CZ2 3.41Å; I1467-W1524 HydrophobicContact CD1-CZ3 4.17Å; Y1485-W1524 HydrophobicContact CE2-CB 4.06Å; P1487-W1524 HydrophobicContact CB-CE3 4Å; P1487-W1524 HydrophobicContact CB-CH2 4.1Å; P1487-W1524 HydrophobicContact CB-CZ3 3.41Å; P1487-W1524 VanDerWaalsContact CB-CZ3 3.41Å; P1487-W1524 HydrophobicContact CG-CE3 3.77Å; P1487-W1524 HydrophobicContact CG-CZ3 3.72Å; R1492-W1524 PolarHBondContact NH1-O 3.15Å; F1520-W1524 HydrophobicContact CD2-CB 4.17Å; F1520-W1524 HydrophobicContact CE2-CB 3.83Å; F1520-W1524 HydrophobicContact CZ-CB 4.21Å; F1520-W1524 WeakPolarHBondContact O-CA 3.34Å; F1520-W1524 VanDerWaalsContact O-CB 3.26Å; F1520-W1524 WeakPolarHBondContact O-CB 3.44Å; F1520-W1524 PolarHBondContact O-N 3.21Å; K1521-W1524 VanDerWaalsContact O-CD1 3.26Å; W1524-D1526 VanDerWaalsContact C-N 3.33Å
1525	L	77.7	Confident	66.3	Low	107 Å²	107	79 Å²	79	56%	0.56	47%	0.466	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.7	-34.9	177.1	-91.8	167.9	0	0	0	112	H1523	H1523-L1525 PolarHBondContact O-N 3.46Å
1526	D	77.4	Confident	63.2	Low	66 Å²	66	82.8 Å²	82.8	35%	0.353	50%	0.499	S	S	.	.	S	Bend	trans	-53.4	145.6	-170.8	-64.4	-3.2	0	0	0	111.1	R1492 H1523 W1524 T1528	R1492-D1526 PolarHBondContact NH1-O 3.22Å; H1523-D1526 WeakPolarHBondContact CB-OD2 3.31Å; H1523-D1526 IonicContact CD2-OD2 2.68Å; H1523-D1526 PolarHBondContact CD2-OD2 3.3Å; H1523-D1526 VanDerWaalsContact CD2-OD2 3.3Å; H1523-D1526 IonicContact CG-OD2 3.49Å; H1523-D1526 WeakPolarHBondContact O-CB 3.48Å; H1523-D1526 PolarHBondContact O-N 3.09Å; W1524-D1526 VanDerWaalsContact C-N 3.33Å; D1526-T1528 PolarHBondContact O-N 2.78Å; D1526-T1528 VanDerWaalsContact O-N 3.1Å
1527	P	60.3	Low	60.1	Low	117 Å²	117	86.3 Å²	86.3	76%	0.76	52%	0.523	S	S	*	.			trans	-53.9	121.2	168.1	-21.4	32.9	0	0	0	108.5	A1529	P1527-A1529 PolarHBondContact O-N 3.36Å
1528	T	55.4	Low	57.2	Low	60 Å²	60	94 Å²	94	37%	0.368	56%	0.564	S	S	.	*			trans	-56.5	114	165.1	40.3	0	0	0	0	106.9	E1494 D1526 T1530	E1494-T1528 HydrophobicContact CG-CG2 4.08Å; E1494-T1528 WeakPolarHBondContact OE1-CG2 3.38Å; E1494-T1528 WeakPolarHBondContact OE2-CG2 3.33Å; D1526-T1528 PolarHBondContact O-N 2.78Å; D1526-T1528 VanDerWaalsContact O-N 3.1Å; T1528-T1530 VanDerWaalsContact C-N 3.26Å; T1528-T1530 PolarHBondContact O-N 2.96Å
1529	A	41	Very low	54.1	Low	91 Å²	91	92.4 Å²	92.4	75%	0.752	57%	0.568	S	S	*	*			trans	-59.8	97.8	169.3	0	0	0	0	0	106.9	P1527	P1527-A1529 PolarHBondContact O-N 3.36Å
1530	T	32.2	Very low	51.1	Low	111 Å²	111	97.2 Å²	97.2	68%	0.681	60%	0.602	S	S	*	*			trans	-49.9	131.8	164.8	43.1	0	0	0	0	106.7	T1528 A1532	T1528-T1530 VanDerWaalsContact C-N 3.26Å; T1528-T1530 PolarHBondContact O-N 2.96Å; T1530-A1532 PolarHBondContact O-N 2.81Å
1531	P	33.1	Very low	48.2	Very low	135 Å²	135	101.3 Å²	101.3	88%	0.877	63%	0.629	S	S	*	*			trans	-59	92	168	-22.2	34.1	0	0	0	107.9
1532	A	30.7	Very low	45.4	Very low	76 Å²	76	103.8 Å²	103.8	63%	0.628	65%	0.646	S	S	*	*			trans	-63	146.5	179.4	0	0	0	0	0	107.7	T1530 A1534	T1530-A1532 PolarHBondContact O-N 2.81Å; A1532-A1534 VanDerWaalsContact C-N 3.28Å; A1532-A1534 WeakPolarHBondContact O-CB 3.22Å; A1532-A1534 PolarHBondContact O-N 2.93Å
1533	S	29.5	Very low	42.6	Very low	133 Å²	133	103.9 Å²	103.9	93%	0.93	65%	0.646	S	S	*	*			trans	-58.3	83.8	-173.4	-49.5	0	0	0	0	112.7
1534	A	27.7	Very low	40	Very low	79 Å²	79	108.2 Å²	108.2	65%	0.653	67%	0.67	S	S	*	*			trans	-113.8	87.7	179.9	0	0	0	0	0	107.8	A1532	A1532-A1534 VanDerWaalsContact C-N 3.28Å; A1532-A1534 WeakPolarHBondContact O-CB 3.22Å; A1532-A1534 PolarHBondContact O-N 2.93Å
1535	S	27.8	Very low	37.5	Very low	100 Å²	100	111.9 Å²	111.9	70%	0.699	69%	0.691	S	S	*	*				68.2	45	84.7	79.6	0	0	0	0	114.1	S1537	S1535-S1537 PolarHBondContact O-N 3.32Å
1536	A	26.8	Very low	35.2	Very low	106 Å²	106	117.5 Å²	117.5	88%	0.876	71%	0.705	S	S	*	*			trans	-75.2	57.1	160.8	0	0	0	0	0	111.1	N1538	A1536-N1538 PolarHBondContact O-N 3.23Å
1537	S	27.3	Very low	33.2	Very low	74 Å²	74	119.2 Å²	119.2	52%	0.517	72%	0.72	S	S	.	*			trans	-101.2	68	-178.5	60.2	0	0	0	0	111.9	S1535	S1535-S1537 PolarHBondContact O-N 3.32Å
1538	N	30.7	Very low	32.1	Very low	162 Å²	162	119 Å²	119	87%	0.866	72%	0.718	S	S	*	*			trans	-116.2	96.5	159	-77.9	-15.8	0	0	0	105.1	A1536	A1536-N1538 PolarHBondContact O-N 3.23Å
1539	L	27.6	Very low	31.3	Very low	137 Å²	137	121 Å²	121	72%	0.717	73%	0.733	S	S	*	*			cis	65.3	67.3	36.9	-69.1	176.9	0	0	0	114.8
1540	T	28.6	Very low	31	Very low	141 Å²	141	122 Å²	122	87%	0.865	73%	0.73	S	S	*	*			trans	-133.9	143.9	137.5	24.9	0	0	0	0	109.5
1541	P	30.7	Very low	31.1	Very low	92 Å²	92	124.7 Å²	124.7	60%	0.597	74%	0.738	S	S	*	*				-143.6	-164.9	-121.5	35.9	-13.1	0	0	0	115.9
1542	L	29.7	Very low	31.1	Very low	148 Å²	148	122.4 Å²	122.4	78%	0.775	73%	0.725	S	S	*	*			trans	82.1	152.1	158.2	-60.8	154.2	0	0	0	118
1543	H	29.2	Very low	31.3	Very low	138 Å²	138	124.2 Å²	124.2	64%	0.639	73%	0.733	S	S	*	*			cis	-171.3	-178.8	-34.7	-146.2	-120.2	0	0	0	111.2
1544	L	33.4	Very low	31.7	Very low	142 Å²	142	122.6 Å²	122.6	74%	0.743	72%	0.722	S	S	*	*			trans	85.7	106.7	165	-63.3	124.8	0	0	0	116.4
1545	M	31	Very low	32.1	Very low	134 Å²	134	123 Å²	123	66%	0.66	72%	0.72	S	S	*	*				86.6	135.6	76.4	-77.5	-35.2	96.4	0	0	111.7
1546	R	29	Very low	32.6	Very low	226 Å²	226	126.5 Å²	126.5	85%	0.853	73%	0.725	S	S	*	*			cis	-150.8	177.8	5.3	-112	-165.7	118.6	-170.6	0.3	110.9
1547	P	35.5	Very low	33.1	Very low	102 Å²	102	126.9 Å²	126.9	66%	0.662	72%	0.717	S	S	*	*			trans	-115.5	-133.7	-163.3	44.8	-33.1	0	0	0	111.4
1548	P	38	Very low	33.6	Very low	111 Å²	111	127.6 Å²	127.6	72%	0.721	72%	0.722	S	S	*	*			cis	-120.6	-153	-43.7	35.3	-14.5	0	0	0	110.9
1549	P	38.8	Very low	33.9	Very low	104 Å²	104	128.3 Å²	128.3	68%	0.675	73%	0.725	S	S	*	*				-133.8	165.4	-61.4	38.2	-21.1	0	0	0	116.5
1550	T	34.6	Very low	34.3	Very low	112 Å²	112	125.3 Å²	125.3	69%	0.687	73%	0.727	S	S	*	*			trans	35.4	134.8	141.6	63.7	0	0	0	0	123.6
1551	I	33.8	Very low	34.8	Very low	166 Å²	166	124.2 Å²	124.2	85%	0.851	72%	0.723	S	S	*	*				-177.9	169.5	116.2	-96.3	163.2	0	0	0	111.1
1552	S	33.4	Very low	35	Very low	88 Å²	88	128.8 Å²	128.8	62%	0.615	74%	0.736	S	S	*	*				-165.8	171.1	-108.1	-71.3	0	0	0	0	112.8
1553	S	34.1	Very low	35.2	Very low	114 Å²	114	126.3 Å²	126.3	80%	0.797	74%	0.737	S	S	*	*			trans	70.5	150	154.1	62.6	0	0	0	0	120.8
1554	S	37.4	Very low	35.6	Very low	98 Å²	98	125.3 Å²	125.3	69%	0.685	74%	0.742	S	S	*	*			cis	-174.8	172.3	-20	55.7	0	0	0	0	113.5
1555	S	37.1	Very low	35.6	Very low	88 Å²	88	128.9 Å²	128.9	62%	0.615	75%	0.748	S	S	*	*			trans	74.1	146.3	139	55.2	0	0	0	0	120.4
1556	Q	38.5	Very low	35.6	Very low	173 Å²	173	127.6 Å²	127.6	81%	0.808	75%	0.751	S	S	*	*			cis	-158.3	179.9	-3.9	-119	169.3	96.9	0	0	107.5
1557	T	36.5	Very low	35.6	Very low	115 Å²	115	123 Å²	123	71%	0.706	75%	0.748	S	S	*	*			cis	-164.3	178.3	16.7	0.3	0	0	0	0	106.2
1558	S	37.7	Very low	35.4	Very low	89 Å²	89	124.3 Å²	124.3	62%	0.622	76%	0.755	S	S	*	*			cis	-174.6	161.4	-6.7	44.3	0	0	0	0	109.4
1559	L	36.8	Very low	35	Very low	176 Å²	176	122.3 Å²	122.3	92%	0.921	76%	0.755	S	S	*	*			trans	69	124.6	172.1	-47.8	170.6	0	0	0	115.1
1560	G	36.7	Very low	34.6	Very low	75 Å²	75	123 Å²	123	77%	0.773	76%	0.761	S	S	*	*			cis	133.5	150.2	-6.9	0	0	0	0	0	112.2
1561	P	39.1	Very low	34.4	Very low	118 Å²	118	123.3 Å²	123.3	77%	0.766	76%	0.763	S	S	*	*			cis	-112.5	144.7	-3.5	39.2	-26.5	0	0	0	113.8
1562	Q	34.3	Very low	34.2	Very low	188 Å²	188	122.1 Å²	122.1	88%	0.879	76%	0.764	S	S	*	*				65.3	139.2	82.5	-61.8	-173.5	-5.8	0	0	116.5
1563	A	34	Very low	34	Very low	96 Å²	96	121.8 Å²	121.8	79%	0.793	77%	0.774	S	S	*	*			cis	-143.9	156.7	24.8	0	0	0	0	0	116.8
1564	P	37.5	Very low	33.8	Very low	116 Å²	116	119.5 Å²	119.5	75%	0.753	77%	0.768	S	S	*	*			trans	-138.3	162.8	-172.9	43.2	-26.8	0	0	0	118.9
1565	Y	33.6	Very low	33.7	Very low	218 Å²	218	120.8 Å²	120.8	86%	0.855	77%	0.772	S	S	*	*			trans	-168.4	134.5	153.2	49.9	-90.7	0	0	0	109.5
1566	S	30.5	Very low	33.7	Very low	106 Å²	106	121.8 Å²	121.8	74%	0.741	78%	0.777	S	S	*	*			cis	74.7	135.4	32.6	-136.4	0	0	0	0	113.4
1567	V	30.6	Very low	33.5	Very low	130 Å²	130	124.5 Å²	124.5	79%	0.788	78%	0.78	S	S	*	*			cis	-153.4	164.7	44.8	169.2	0	0	0	0	113.8
1568	T	30.1	Very low	33.4	Very low	129 Å²	129	124.7 Å²	124.7	79%	0.791	79%	0.786	S	S	*	*			trans	-60.5	156.8	-173.5	59.7	0	0	0	0	123.4
1569	G	29.8	Very low	33.2	Very low	70 Å²	70	124 Å²	124	72%	0.722	79%	0.792	S	S	*	*			trans	74.7	177.7	139.4	0	0	0	0	0	119.8
1570	S	30.2	Very low	33.1	Very low	117 Å²	117	123.5 Å²	123.5	82%	0.818	79%	0.789	S	S	*	*			cis	169.6	146.4	-12.3	-97.1	0	0	0	0	109.9
1571	V	30.5	Very low	32.9	Very low	120 Å²	120	124.8 Å²	124.8	73%	0.727	79%	0.786	S	S	*	*			cis	-159.1	172.3	-14.2	-143.5	0	0	0	0	110.3
1572	T	29.8	Very low	32.7	Very low	141 Å²	141	124.6 Å²	124.6	87%	0.865	79%	0.788	S	S	*	*			trans	66	134.5	153.2	48	0	0	0	0	124.4
1573	G	28.6	Very low	32.7	Very low	80 Å²	80	119.8 Å²	119.8	83%	0.825	78%	0.78	S	S	*	*				138.9	99.5	120.6	0	0	0	0	0	122.8
1574	G	30	Very low	32.7	Very low	66 Å²	66	122.5 Å²	122.5	68%	0.68	79%	0.786	S	S	*	*			trans	78.7	129.5	154.1	0	0	0	0	0	118.7
1575	T	35.8	Very low	32.5	Very low	125 Å²	125	120.3 Å²	120.3	77%	0.767	79%	0.785	S	S	*	*			cis	76.6	145.8	45.3	68	0	0	0	0	115.5
1576	P	37.4	Very low	32.4	Very low	110 Å²	110	114.2 Å²	114.2	71%	0.714	79%	0.788	S	S	*	*			cis	-143.1	169.4	14.3	42.7	-23.5	0	0	0	119.7
1577	R	34.6	Very low	32.4	Very low	229 Å²	229	113 Å²	113	86%	0.864	79%	0.793	S	S	*	*			trans	29	140	143.8	-55.8	169.8	86	-177.8	8	122.5
1578	S	33.4	Very low	32.4	Very low	119 Å²	119	110.5 Å²	110.5	83%	0.832	79%	0.794	S	S	*	*				172.4	135.8	99.7	-72.7	0	0	0	0	117
1579	G	34.2	Very low	32.4	Very low	74 Å²	74	110.1 Å²	110.1	76%	0.763	80%	0.796	S	S	*	*			trans	79.9	158.8	158.5	0	0	0	0	0	118.4
1580	I	34.9	Very low	32.4	Very low	166 Å²	166	110.4 Å²	110.4	85%	0.851	79%	0.787	S	S	*	*			cis	-154	166.6	-9.2	-106.6	164.4	0	0	0	109.5
1581	S	33.3	Very low	32.5	Very low	103 Å²	103	108 Å²	108	72%	0.72	77%	0.774	S	S	*	*			trans	-48.1	175.1	173.6	-31.9	0	0	0	0	116
1582	S	33.5	Very low	32.5	Very low	114 Å²	114	113.3 Å²	113.3	80%	0.797	78%	0.783	S	S	*	*			cis	-179.7	172	7.1	22.4	0	0	0	0	108.2
1583	A	34.9	Very low	32.5	Very low	86 Å²	86	111.2 Å²	111.2	71%	0.711	77%	0.774	S	S	*	*			cis	179.6	178.3	-23.3	0	0	0	0	0	108.9
1584	V	33.8	Very low	32.4	Very low	153 Å²	153	115.4 Å²	115.4	93%	0.927	78%	0.775	S	S	*	*			trans	74.1	139.7	174.7	-172.6	0	0	0	0	115.4
1585	G	32.5	Very low	32.3	Very low	71 Å²	71	117.9 Å²	117.9	73%	0.732	78%	0.778	S	S	*	*			cis	162	148.5	-12	0	0	0	0	0	115
1586	G	32.1	Very low	31.9	Very low	89 Å²	89	120.3 Å²	120.3	92%	0.918	78%	0.78	S	S	*	*			trans	87.7	147.7	174	0	0	0	0	0	115.9
1587	G	30.6	Very low	31.6	Very low	82 Å²	82	119.5 Å²	119.5	85%	0.845	78%	0.777	S	S	*	*			cis	165.5	117.1	-12.9	0	0	0	0	0	115
1588	G	30.4	Very low	31.2	Very low	77 Å²	77	116.7 Å²	116.7	79%	0.794	78%	0.777	S	S	*	*			trans	79.7	140.3	-178.8	0	0	0	0	0	113.3
1589	S	31.1	Very low	31	Very low	121 Å²	121	116.2 Å²	116.2	85%	0.846	77%	0.77	S	S	*	*			cis	-130.4	-144.3	-1	-64.1	0	0	0	0	108.5
1590	S	29.6	Very low	30.8	Very low	76 Å²	76	116 Å²	116	53%	0.531	77%	0.768	S	S	.	*			cis	-151.3	-168.6	-6.2	-156.9	0	0	0	0	110.2
1591	A	32.4	Very low	30.7	Very low	66 Å²	66	118.6 Å²	118.6	55%	0.545	77%	0.769	S	S	.	*			trans	39.4	134.9	153.2	0	0	0	0	0	123.2
1592	Y	29.1	Very low	30.5	Very low	232 Å²	232	117.1 Å²	117.1	91%	0.91	77%	0.769	S	S	*	*			trans	-53.5	122.4	-179.8	-41.7	-87.3	0	0	0	117.8
1593	S	30.5	Very low	30.4	Very low	97 Å²	97	117.6 Å²	117.6	68%	0.678	77%	0.768	S	S	*	*			trans	-166.1	128.2	140.7	-171.4	0	0	0	0	111.3
1594	I	27.4	Very low	30.2	Very low	167 Å²	167	119 Å²	119	86%	0.856	77%	0.772	S	S	*	*			trans	-108.6	91	-179.9	-60.8	-175.8	0	0	0	110.9
1595	T	26.7	Very low	30.1	Very low	119 Å²	119	114.7 Å²	114.7	73%	0.73	76%	0.759	S	S	*	*			trans	-128	46.1	168.8	46	0	0	0	0	111.5	S1597	T1595-S1597 PolarHBondContact O-N 3.01Å; T1595-S1597 VanDerWaalsContact O-N 3.16Å
1596	Q	28.3	Very low	30.1	Very low	176 Å²	176	116.8 Å²	116.8	82%	0.822	76%	0.763	S	S	*	*			trans	-92.6	81.3	-173	-64.9	-152.3	1	0	0	115.2
1597	S	30.2	Very low	30	Very low	92 Å²	92	118.8 Å²	118.8	64%	0.643	76%	0.762	S	S	*	*			trans	-9.4	124.8	142.1	54.6	0	0	0	0	117.4	T1595 T1599	T1595-S1597 PolarHBondContact O-N 3.01Å; T1595-S1597 VanDerWaalsContact O-N 3.16Å; S1597-T1599 PolarHBondContact O-N 2.74Å
1598	I	27.2	Very low	30.2	Very low	170 Å²	170	119.3 Å²	119.3	87%	0.872	76%	0.759	S	S	*	*			trans	-68.6	96.8	170.8	-63.6	175.7	0	0	0	109.8	G1600	I1598-G1600 VanDerWaalsContact C-N 3.34Å; I1598-G1600 PolarHBondContact O-N 3.22Å; I1598-G1600 VanDerWaalsContact O-N 3.08Å
1599	T	28.8	Very low	30.5	Very low	109 Å²	109	121.8 Å²	121.8	67%	0.669	76%	0.761	S	S	*	*			trans	-82.8	74.8	175.5	39.2	0	0	0	0	111.3	S1597 Y1601	S1597-T1599 PolarHBondContact O-N 2.74Å; T1599-Y1601 PolarHBondContact O-N 2.94Å
1600	G	30.4	Very low	30.4	Very low	71 Å²	71	119.4 Å²	119.4	73%	0.732	76%	0.755	S	S	*	*			trans	-67.4	87	177.5	0	0	0	0	0	113.6	I1598 G1602	I1598-G1600 VanDerWaalsContact C-N 3.34Å; I1598-G1600 PolarHBondContact O-N 3.22Å; I1598-G1600 VanDerWaalsContact O-N 3.08Å; G1600-G1602 PolarHBondContact O-N 3.47Å
1601	Y	31.3	Very low	30.4	Very low	220 Å²	220	121 Å²	121	86%	0.863	77%	0.773	S	S	*	*			trans	-60.5	115.2	171.2	-91.9	-90.8	0	0	0	111.4	T1599	T1599-Y1601 PolarHBondContact O-N 2.94Å
1602	G	30.4	Very low	30.3	Very low	71 Å²	71	121.1 Å²	121.1	73%	0.732	78%	0.78	S	S	*	*			trans	-125.7	115.4	176.6	0	0	0	0	0	112.5	G1600	G1600-G1602 PolarHBondContact O-N 3.47Å
1603	T	30.6	Very low	30.4	Very low	125 Å²	125	116.7 Å²	116.7	77%	0.767	78%	0.777	S	S	*	*			trans	-135.3	98.6	176.2	34.1	0	0	0	0	113.1
1604	S	31.3	Very low	30.4	Very low	114 Å²	114	117.2 Å²	117.2	80%	0.797	78%	0.781	S	S	*	*			trans	59.1	143.8	139.3	60.7	0	0	0	0	123.5
1605	G	30.8	Very low	30.4	Very low	64 Å²	64	114.4 Å²	114.4	66%	0.66	78%	0.776	S	S	*	*			trans	102.4	77.6	160.6	0	0	0	0	0	114.4
1606	S	32	Very low	30.6	Very low	115 Å²	115	113.7 Å²	113.7	80%	0.804	78%	0.776	S	S	*	*				63.3	93.9	55.4	-49.4	0	0	0	0	115.1
1607	S	31.7	Very low	30.6	Very low	130 Å²	130	113.8 Å²	113.8	91%	0.909	78%	0.776	S	S	*	*			trans	-168.9	126.5	137.2	-80.9	0	0	0	0	111.1
1608	A	33.1	Very low	30.7	Very low	93 Å²	93	121 Å²	121	77%	0.769	79%	0.791	S	S	*	*			trans	-118.6	-166.9	165.4	0	0	0	0	0	106.5
1609	P	38.1	Very low	30.9	Very low	130 Å²	130	115.9 Å²	115.9	84%	0.844	78%	0.781	S	S	*	*			cis	-135.3	-168.7	-7.4	42.4	-25.7	0	0	0	113.1
1610	G	29.3	Very low	30.8	Very low	70 Å²	70	116.8 Å²	116.8	72%	0.722	79%	0.791	S	S	*	*			trans	134.6	114.5	135	0	0	0	0	0	118.3
1611	A	29.7	Very low	31	Very low	110 Å²	110	118.4 Å²	118.4	91%	0.909	79%	0.791	S	S	*	*			trans	44.9	114.3	144.1	0	0	0	0	0	120.6
1612	G	30.3	Very low	31.1	Very low	68 Å²	68	113 Å²	113	70%	0.701	79%	0.786	S	S	*	*				135.3	142.1	93.6	0	0	0	0	0	119.5
1613	V	29.8	Very low	31	Very low	139 Å²	139	116.1 Å²	116.1	84%	0.842	79%	0.791	S	S	*	*			trans	72.5	122.5	137.5	-177.1	0	0	0	0	119.5
1614	S	31	Very low	31.1	Very low	108 Å²	108	115.5 Å²	115.5	76%	0.755	79%	0.789	S	S	*	*			trans	69	138.1	162.9	-64.2	0	0	0	0	117.5
1615	S	27	Very low	30.9	Very low	109 Å²	109	115.4 Å²	115.4	76%	0.762	79%	0.788	S	S	*	*			cis	85.9	150.8	29.9	-163.1	0	0	0	0	114.8
1616	S	31.2	Very low	31	Very low	104 Å²	104	122.1 Å²	122.1	73%	0.727	80%	0.799	S	S	*	*			trans	63.4	123.8	-160.1	67.7	0	0	0	0	114.1
1617	H	27.5	Very low	30.9	Very low	178 Å²	178	119.5 Å²	119.5	82%	0.824	79%	0.791	S	S	*	*			cis	79.5	76.3	42.8	-71.7	10.2	0	0	0	115.3
1618	Y	33.1	Very low	30.8	Very low	243 Å²	243	117 Å²	117	95%	0.953	78%	0.778	S	S	*	*			trans	-147.3	147.8	136	-85.8	-83	0	0	0	107.5
1619	G	30.6	Very low	30.8	Very low	63 Å²	63	120.2 Å²	120.2	65%	0.649	78%	0.78	S	S	*	*			cis	159.4	105.2	-9.4	0	0	0	0	0	113.6
1620	S	28.3	Very low	30.3	Very low	128 Å²	128	120.4 Å²	120.4	90%	0.895	77%	0.774	S	S	*	*			trans	47.5	90.1	153.9	-178.4	0	0	0	0	120
1621	S	33.6	Very low	30.7	Very low	105 Å²	105	123.8 Å²	123.8	73%	0.734	78%	0.781	S	S	*	*			trans	-157.6	99.5	146.9	40	0	0	0	0	110.3
1622	S	34.3	Very low	31	Very low	107 Å²	107	124.4 Å²	124.4	75%	0.748	78%	0.776	S	S	*	*				72.6	105	103.7	68.9	0	0	0	0	114.9
1623	T	27.9	Very low	31	Very low	135 Å²	135	131.8 Å²	131.8	83%	0.828	78%	0.784	S	S	*	*			trans	-62.9	147.5	170.7	37.6	0	0	0	0	113.1
1624	P	33	Very low	31.3	Very low	113 Å²	113	131 Å²	131	73%	0.734	78%	0.78	S	S	*	*			trans	-115.1	126.2	139.3	33.3	-26.6	0	0	0	110.5
1625	S	27.2	Very low	31.5	Very low	111 Å²	111	130.7 Å²	130.7	78%	0.776	78%	0.775	S	S	*	*			trans	-76.9	139	166.6	-65.5	0	0	0	0	110.9
1626	F	32.2	Very low	31.9	Very low	205 Å²	205	131.1 Å²	131.1	90%	0.899	78%	0.778	S	S	*	*			trans	-145.8	111.9	161.1	-97.2	-80.1	0	0	0	108
1627	G	30.5	Very low	31.9	Very low	60 Å²	60	129.4 Å²	129.4	62%	0.619	78%	0.777	S	S	*	*			cis	123.7	113.3	-13.9	0	0	0	0	0	114.2
1628	A	29.8	Very low	32.1	Very low	77 Å²	77	130.6 Å²	130.6	64%	0.636	78%	0.783	S	S	*	*			trans	64.9	165.6	-179.4	0	0	0	0	0	114
1629	I	32.2	Very low	32.1	Very low	162 Å²	162	125.1 Å²	125.1	83%	0.831	78%	0.775	S	S	*	*			cis	-142.9	147.3	20.1	-59.5	168.4	0	0	0	109.3
1630	N	27.3	Very low	32.4	Very low	133 Å²	133	127.1 Å²	127.1	71%	0.711	78%	0.776	S	S	*	*			cis	-172.3	127.1	-35.1	-93	-16.3	0	0	0	108.2
1631	T	38.1	Very low	32.5	Very low	141 Å²	141	130.4 Å²	130.4	87%	0.865	78%	0.775	S	S	*	*			trans	-132.9	150.8	159.2	42.1	0	0	0	0	109.8
1632	P	35.6	Very low	32.5	Very low	124 Å²	124	133.5 Å²	133.5	81%	0.805	78%	0.78	S	S	*	*			trans	-88.7	136.3	-148.6	31.8	-36.2	0	0	0	116.8
1633	Y	31.4	Very low	32.5	Very low	223 Å²	223	134.2 Å²	134.2	88%	0.875	78%	0.78	S	S	*	*			trans	30.7	117.1	134.1	-113	-110.8	0	0	0	119.8
1634	T	35.7	Very low	33	Very low	122 Å²	122	131.9 Å²	131.9	75%	0.748	77%	0.767	S	S	*	*			trans	-78.3	165.8	147.6	66.8	0	0	0	0	109.3
1635	P	35.2	Very low	33.1	Very low	102 Å²	102	133.4 Å²	133.4	66%	0.662	76%	0.759	S	S	*	*				-146.9	168	79.3	39.7	-23.4	0	0	0	114.7
1636	S	34.5	Very low	33.6	Very low	118 Å²	118	132.2 Å²	132.2	83%	0.825	75%	0.747	S	S	*	*			trans	50.8	127	159.5	51.3	0	0	0	0	118.4
1637	G	31.4	Very low	34	Very low	67 Å²	67	125.9 Å²	125.9	69%	0.691	73%	0.727	S	S	*	*			cis	116.1	149.1	23.6	0	0	0	0	0	109.8
1638	Q	33.4	Very low	34.1	Very low	203 Å²	203	131.5 Å²	131.5	95%	0.949	74%	0.736	S	S	*	*			trans	79.1	131.4	-169.1	-55.9	-176.6	-47	0	0	115.8
1639	T	31.7	Very low	34.3	Very low	129 Å²	129	131.6 Å²	131.6	79%	0.791	74%	0.738	S	S	*	*			trans	-80.5	-171.5	171.4	52.3	0	0	0	0	110.1
1640	P	38.3	Very low	34.5	Very low	104 Å²	104	128.7 Å²	128.7	68%	0.675	73%	0.732	S	S	*	*			cis	-136.4	172.3	-6.7	22	3.3	0	0	0	116.2
1641	F	29.9	Very low	34.9	Very low	197 Å²	197	131.2 Å²	131.2	86%	0.864	74%	0.739	S	S	*	*			trans	65.2	157.5	142.2	-92.8	-117.5	0	0	0	123.9
1642	M	32.2	Very low	34.8	Very low	170 Å²	170	130.7 Å²	130.7	84%	0.837	74%	0.736	S	S	*	*			trans	83.1	143.8	161.3	-53.3	-145.5	73	0	0	121
1643	T	34.5	Very low	35.1	Very low	123 Å²	123	130.2 Å²	130.2	76%	0.755	73%	0.733	S	S	*	*			trans	-105.5	-164.3	175.9	58.6	0	0	0	0	108.8
1644	P	39.6	Very low	35.3	Very low	86 Å²	86	128.8 Å²	128.8	56%	0.558	73%	0.726	S	S	*	*			cis	-137.9	-176.9	-8.4	38.5	-18.5	0	0	0	116.2
1645	Y	34.5	Very low	35.4	Very low	144 Å²	144	132.9 Å²	132.9	57%	0.565	73%	0.729	S	S	*	*			trans	75.5	160.8	149.1	-68.3	-40.3	0	0	0	123.4	A1705	Y1645-A1705 VanDerWaalsContact CD1-CA 3.5Å; Y1645-A1705 HydrophobicContact CD1-CB 3.97Å; Y1645-A1705 HydrophobicContact CD2-CB 4.27Å; Y1645-A1705 HydrophobicContact CE1-CB 3.58Å; Y1645-A1705 HydrophobicContact CE2-CB 3.93Å; Y1645-A1705 HydrophobicContact CG-CB 4.3Å
1646	T	38.2	Very low	35.4	Very low	86 Å²	86	131.2 Å²	131.2	53%	0.528	73%	0.73	S	S	.	*	B	Isolated β-bridge	trans	-97.7	-141.7	-164.9	38.8	0	0	0	0	111.9	S1703 N1704	T1646-S1703 CarbonylContact O-C 3.46Å; T1646-S1703 WeakPolarHBondContact O-CA 3.46Å; T1646-S1703 PolarHBondContact O-N 2.85Å; T1646-N1704 CarbonylContact C-O 3.24Å; T1646-N1704 VanDerWaalsContact C-O 3.24Å; T1646-N1704 WeakPolarHBondContact CA-O 3.24Å; T1646-N1704 PolarHBondContact N-O 2.88Å; T1646-N1704 PolarHBondContact O-N 3.15Å; T1646-N1704 PolarHBondContact OG1-O 3.41Å
1647	P	39.3	Very low	35.3	Very low	72 Å²	72	134.4 Å²	134.4	47%	0.468	73%	0.732	S	S	.	*			cis	-140.6	-170.8	-13.2	44	-23.8	0	0	0	117.1
1648	H	32.5	Very low	35.5	Very low	178 Å²	178	138.1 Å²	138.1	82%	0.824	74%	0.736	S	S	*	*			trans	66.5	117	152.2	-72.2	-53.5	0	0	0	125
1649	A	35.5	Very low	35.5	Very low	80 Å²	80	134.8 Å²	134.8	66%	0.661	73%	0.729	S	S	*	*				90.7	121.1	115.7	0	0	0	0	0	124.6
1650	S	35.5	Very low	35.7	Very low	101 Å²	101	134.1 Å²	134.1	71%	0.706	73%	0.727	S	S	*	*			trans	73.8	124.7	135.3	75.1	0	0	0	0	121.8
1651	Q	36	Very low	35.7	Very low	186 Å²	186	134.5 Å²	134.5	87%	0.869	73%	0.732	S	S	*	*				-174.7	151.2	94.4	-94.4	174.1	42.5	0	0	112.4
1652	T	36.7	Very low	36.1	Very low	129 Å²	129	131.2 Å²	131.2	79%	0.791	73%	0.731	S	S	*	*			trans	-102.7	158.6	176.5	59.1	0	0	0	0	111.2
1653	P	42.1	Very low	36.1	Very low	115 Å²	115	128 Å²	128	75%	0.747	73%	0.725	S	S	*	*				-153.4	175	105.5	39.1	-21.9	0	0	0	113.8
1654	R	35.1	Very low	36.1	Very low	192 Å²	192	126.3 Å²	126.3	73%	0.725	72%	0.718	S	S	*	*			cis	-175.5	143.2	-22.8	-102.9	-178.2	173.8	-136.1	0.8	107.5
1655	Y	36.5	Very low	35.8	Very low	208 Å²	208	130.6 Å²	130.6	82%	0.816	73%	0.731	S	S	*	*			trans	64.3	150.3	157	-65.8	-143.8	0	0	0	116.8
1656	G	35.3	Very low	35.7	Very low	67 Å²	67	128.7 Å²	128.7	69%	0.691	74%	0.739	S	S	*	*			cis	168.1	140.1	-11.2	0	0	0	0	0	114.3
1657	H	34	Very low	35.6	Very low	185 Å²	185	129.1 Å²	129.1	86%	0.856	75%	0.745	S	S	*	*			trans	60.2	146.4	161	-77.4	-44.6	0	0	0	123.2
1658	N	34.7	Very low	35.4	Very low	146 Å²	146	131 Å²	131	78%	0.781	76%	0.759	S	S	*	*			trans	88.5	110.9	153.8	-62.8	-12.9	0	0	0	121.3
1659	V	34	Very low	35.5	Very low	132 Å²	132	127.1 Å²	127.1	80%	0.8	75%	0.752	S	S	*	*			trans	-34.1	160.3	140.5	-75.4	0	0	0	0	114.8
1660	P	36.2	Very low	35.3	Very low	115 Å²	115	131.3 Å²	131.3	75%	0.747	76%	0.758	S	S	*	*			cis	-137.8	-178.2	24.7	42.6	-25	0	0	0	117
1661	S	36.9	Very low	35.3	Very low	113 Å²	113	137.6 Å²	137.6	79%	0.79	77%	0.767	S	S	*	*			trans	-52.9	148	160.9	-39.3	0	0	0	0	111.5
1662	P	39.5	Very low	35.3	Very low	128 Å²	128	135.3 Å²	135.3	83%	0.831	76%	0.756	S	S	*	*				-142.3	176.7	99.8	39.8	-27.1	0	0	0	114.8
1663	S	31.3	Very low	35.2	Very low	102 Å²	102	135.8 Å²	135.8	71%	0.713	75%	0.749	S	S	*	*			trans	-90.1	171	-169.1	53.9	0	0	0	0	115.7
1664	S	33.7	Very low	34.9	Very low	88 Å²	88	140.5 Å²	140.5	62%	0.615	75%	0.753	S	S	*	*			trans	97.8	152.4	136.4	82.5	0	0	0	0	120.5
1665	Q	34.2	Very low	34.8	Very low	176 Å²	176	135 Å²	135	82%	0.822	76%	0.757	S	S	*	*			trans	71.6	143.2	166.3	-57.1	170.4	59.9	0	0	116
1666	S	32.4	Very low	34.6	Very low	104 Å²	104	131 Å²	131	73%	0.727	76%	0.759	S	S	*	*			cis	-166.4	159.5	-23.3	52.6	0	0	0	0	104.7
1667	S	36.4	Very low	34.5	Very low	95 Å²	95	132.7 Å²	132.7	66%	0.664	76%	0.76	S	S	*	*				174.3	127.4	64.6	35.1	0	0	0	0	106.7
1668	S	34.5	Very low	34.4	Very low	110 Å²	110	129.4 Å²	129.4	77%	0.769	76%	0.758	S	S	*	*				49.3	133.4	100.1	76.2	0	0	0	0	115.8
1669	S	34.4	Very low	34.3	Very low	97 Å²	97	126.3 Å²	126.3	68%	0.678	76%	0.761	S	S	*	*			cis	-176.9	153.4	8.1	39.4	0	0	0	0	113.4
1670	Q	31	Very low	34.3	Very low	168 Å²	168	127.2 Å²	127.2	79%	0.785	77%	0.767	S	S	*	*			trans	46.8	118.6	142.1	-64.9	175.1	-18.1	0	0	121.3
1671	R	35.9	Very low	34.1	Very low	233 Å²	233	125.1 Å²	125.1	88%	0.879	77%	0.766	S	S	*	*			trans	-154.3	128	132.5	-97.4	145.2	-166.1	-120.8	-0.1	107
1672	H	35.5	Very low	34	Very low	139 Å²	139	125.1 Å²	125.1	64%	0.644	77%	0.766	S	S	*	*				56.9	129.1	74.4	-58.9	-66.2	0	0	0	112.1
1673	H	35.5	Very low	33.9	Very low	139 Å²	139	125.2 Å²	125.2	64%	0.644	76%	0.764	S	S	*	*			cis	-163.3	171.3	-3.3	-115.2	-43	0	0	0	110.1
1674	Y	35.4	Very low	34.3	Very low	213 Å²	213	126.7 Å²	126.7	84%	0.835	77%	0.772	S	S	*	*			trans	7.4	142.3	159.3	-60.2	-74	0	0	0	121.5
1675	G	33.2	Very low	34.4	Very low	78 Å²	78	132.9 Å²	132.9	80%	0.804	78%	0.781	S	S	*	*			trans	162.8	82.2	149.1	0	0	0	0	0	117.4
1676	S	32.8	Very low	34.5	Very low	123 Å²	123	134.1 Å²	134.1	86%	0.86	78%	0.78	S	S	*	*			trans	-57.5	137.5	166.5	179.3	0	0	0	0	112.7
1677	S	32.7	Very low	34.7	Very low	103 Å²	103	136.3 Å²	136.3	72%	0.72	78%	0.779	S	S	*	*				176.1	166.5	112.2	-157.6	0	0	0	0	113.7
1678	S	32.3	Very low	34.7	Very low	115 Å²	115	139.1 Å²	139.1	80%	0.804	79%	0.786	S	S	*	*			trans	-39.5	144.8	171.1	56.7	0	0	0	0	117.4
1679	G	32.6	Very low	35.1	Very low	82 Å²	82	141.5 Å²	141.5	85%	0.845	79%	0.787	S	S	*	*			trans	-164.9	123.3	163.5	0	0	0	0	0	113.6
1680	T	33	Very low	35.3	Very low	151 Å²	151	140.8 Å²	140.8	93%	0.926	79%	0.794	S	S	*	*			trans	-99.3	144	175	49.8	0	0	0	0	112.3
1681	G	32.4	Very low	35.6	Very low	70 Å²	70	136.9 Å²	136.9	72%	0.722	80%	0.799	S	S	*	*			trans	116.2	130.5	143.7	0	0	0	0	0	119
1682	S	35.8	Very low	35.7	Very low	113 Å²	113	129.7 Å²	129.7	79%	0.79	80%	0.798	S	S	*	*			trans	60.9	109.1	138.8	-54.2	0	0	0	0	122.3
1683	T	38	Very low	35.8	Very low	130 Å²	130	127.2 Å²	127.2	80%	0.798	81%	0.81	S	S	*	*				27.9	136.2	127.2	60.2	0	0	0	0	120.6
1684	P	39.6	Very low	35.8	Very low	134 Å²	134	124.5 Å²	124.5	87%	0.87	82%	0.819	S	S	*	*				-145.6	-168.3	92.2	39.5	-23	0	0	0	116.3
1685	R	34.5	Very low	35.9	Very low	217 Å²	217	118.5 Å²	118.5	82%	0.819	82%	0.822	S	S	*	*			trans	-94.9	-177	-169.6	-61.8	175.7	172.5	170.4	-3.3	115
1686	Y	36.8	Very low	36.1	Very low	202 Å²	202	118.2 Å²	118.2	79%	0.792	82%	0.819	S	S	*	*			trans	102.2	150	156.7	-68.3	-89.3	0	0	0	115.8
1687	H	35.6	Very low	36.3	Very low	151 Å²	151	119.7 Å²	119.7	70%	0.699	82%	0.823	S	S	*	*			cis	167.8	116.3	-30.3	-138.1	-66.5	0	0	0	106.4
1688	D	38.3	Very low	36.4	Very low	153 Å²	153	118.6 Å²	118.6	82%	0.818	83%	0.828	S	S	*	*			trans	-175	127.5	156.8	-113	-0.4	0	0	0	106.5
1689	M	42.1	Very low	36.6	Very low	161 Å²	161	117 Å²	117	79%	0.793	83%	0.83	S	S	*	*			cis	82.8	128	49.4	-66.2	-67.3	-167.6	0	0	114.2
1690	G	37.7	Very low	36.7	Very low	81 Å²	81	117.4 Å²	117.4	84%	0.835	83%	0.834	S	S	*	*			trans	155.4	20.8	159.5	0	0	0	0	0	125.8
1691	G	37.1	Very low	36.7	Very low	86 Å²	86	114.1 Å²	114.1	89%	0.887	83%	0.83	S	S	*	*			trans	67.7	177.6	163	0	0	0	0	0	118.9
1692	G	38.2	Very low	36.9	Very low	83 Å²	83	114.3 Å²	114.3	86%	0.856	83%	0.832	S	S	*	*			cis	164.4	114.6	-13.4	0	0	0	0	0	116.4
1693	G	37.6	Very low	36.8	Very low	86 Å²	86	112.5 Å²	112.5	89%	0.887	82%	0.819	S	S	*	*			trans	85.2	156.3	165.3	0	0	0	0	0	117.3
1694	G	37.3	Very low	36.7	Very low	82 Å²	82	111.4 Å²	111.4	85%	0.845	81%	0.809	S	S	*	*			cis	165.8	142.7	-10.6	0	0	0	0	0	114.8
1695	G	36.8	Very low	36.3	Very low	87 Å²	87	106.1 Å²	106.1	90%	0.897	78%	0.776	S	S	*	*			trans	80.5	156.7	172.5	0	0	0	0	0	116.5
1696	G	36.7	Very low	36.2	Very low	72 Å²	72	106.3 Å²	106.3	74%	0.742	78%	0.778	S	S	*	*			cis	173.6	127.3	-10.8	0	0	0	0	0	116.1
1697	V	36.8	Very low	35.9	Very low	154 Å²	154	101.7 Å²	101.7	93%	0.933	78%	0.776	S	S	*	*			trans	57.1	119.9	141.5	-171.8	0	0	0	0	122.2
1698	G	36	Very low	35.7	Very low	80 Å²	80	99.9 Å²	99.9	83%	0.825	77%	0.769	S	S	*	*			trans	99.6	143.7	144.7	0	0	0	0	0	118
1699	G	35	Very low	35.2	Very low	82 Å²	82	97.1 Å²	97.1	85%	0.845	75%	0.751	S	S	*	*			cis	162.4	129.7	-12.8	0	0	0	0	0	115.5
1700	G	35.1	Very low	34.6	Very low	90 Å²	90	95.4 Å²	95.4	93%	0.928	75%	0.752	S	S	*	*			trans	80.3	147.7	165.9	0	0	0	0	0	117.9
1701	G	34.4	Very low	34.2	Very low	82 Å²	82	99.7 Å²	99.7	85%	0.845	75%	0.75	S	S	*	*			cis	168.8	145.9	-11.7	0	0	0	0	0	115.7
1702	G	34.9	Very low	33.9	Very low	74 Å²	74	103.6 Å²	103.6	76%	0.763	75%	0.745	S	S	*	*			trans	84	160.4	164.2	0	0	0	0	0	118.6
1703	S	34.1	Very low	33.5	Very low	76 Å²	76	107.9 Å²	107.9	53%	0.531	74%	0.743	S	S	.	*			cis	176.1	123.8	-19.4	46.6	0	0	0	0	112.4	T1646	T1646-S1703 CarbonylContact O-C 3.46Å; T1646-S1703 WeakPolarHBondContact O-CA 3.46Å; T1646-S1703 PolarHBondContact O-N 2.85Å
1704	N	35.2	Very low	33.3	Very low	107 Å²	107	110.3 Å²	110.3	57%	0.572	73%	0.731	S	S	*	*	B	Isolated β-bridge	trans	171.8	168.7	144	-92.6	-8.4	0	0	0	115.5	T1646	T1646-N1704 CarbonylContact C-O 3.24Å; T1646-N1704 VanDerWaalsContact C-O 3.24Å; T1646-N1704 WeakPolarHBondContact CA-O 3.24Å; T1646-N1704 PolarHBondContact N-O 2.88Å; T1646-N1704 PolarHBondContact O-N 3.15Å; T1646-N1704 PolarHBondContact OG1-O 3.41Å
1705	A	31.6	Very low	33.1	Very low	23 Å²	23	116.1 Å²	116.1	19%	0.19	73%	0.727	C	S	.	*			trans	-56.8	172.2	-164.6	0	0	0	0	0	117	Y1645	Y1645-A1705 VanDerWaalsContact CD1-CA 3.5Å; Y1645-A1705 HydrophobicContact CD1-CB 3.97Å; Y1645-A1705 HydrophobicContact CD2-CB 4.27Å; Y1645-A1705 HydrophobicContact CE1-CB 3.58Å; Y1645-A1705 HydrophobicContact CE2-CB 3.93Å; Y1645-A1705 HydrophobicContact CG-CB 4.3Å
1706	Y	33.2	Very low	32.9	Very low	220 Å²	220	116 Å²	116	86%	0.863	72%	0.718	S	S	*	*			cis	-133.6	-165.4	43.1	-81.1	-94.7	0	0	0	115.8
1707	S	30	Very low	32.9	Very low	106 Å²	106	120.2 Å²	120.2	74%	0.741	72%	0.716	S	S	*	*			trans	-103	153.1	-166.6	-173.9	0	0	0	0	114.1
1708	M	31.1	Very low	32.9	Very low	113 Å²	113	117.4 Å²	117.4	56%	0.557	69%	0.693	S	S	*	*			trans	179.8	150.4	130.3	-100.1	-57.4	176.1	0	0	115	D1107 Y1126	D1107-M1708 VanDerWaalsContact OD2-CE 3.31Å; D1107-M1708 WeakPolarHBondContact OD2-CE 3.38Å; Y1126-M1708 VanDerWaalsContact OH-CE 3.26Å; Y1126-M1708 WeakPolarHBondContact OH-CE 3.47Å
1709	Q	29.5	Very low	32.9	Very low	94 Å²	94	119.6 Å²	119.6	44%	0.439	69%	0.686	S	S	.	*			trans	35.9	113.7	159.3	-54.9	-166.3	-35.7	0	0	122	R1129	R1129-Q1709 VanDerWaalsContact NH2-OE1 3.09Å
1710	P	28.2	Very low	32.9	Very low	126 Å²	126	120.4 Å²	120.4	82%	0.818	67%	0.67	S	S	*	*			trans	-109.1	54.7	175.2	40.8	-34.2	0	0	0	115.7	H1712	P1710-H1712 PolarHBondContact O-N 3.47Å
1711	H	28.6	Very low	33.2	Very low	171 Å²	171	120 Å²	120	79%	0.792	65%	0.647	S	S	*	*			trans	-78.8	43.1	-178.6	-110.6	-60.1	0	0	0	115.1
1712	H	31.9	Very low	33.2	Very low	167 Å²	167	121.7 Å²	121.7	77%	0.773	63%	0.628	S	S	*	*			trans	-141.2	26.4	-168.9	-107.7	36.7	0	0	0	117.2	P1710	P1710-H1712 PolarHBondContact O-N 3.47Å
1713	Q	30.2	Very low	33.3	Very low	173 Å²	173	123.6 Å²	123.6	81%	0.808	62%	0.617	S	S	*	*	S	Bend	trans	-121.1	-4.1	176.3	-69.8	-168.5	-4.6	0	0	117
1714	Q	32.6	Very low	33.4	Very low	137 Å²	137	124 Å²	124	64%	0.64	61%	0.612	S	S	*	*	S	Bend	trans	-78.5	-39.3	177.2	-112.8	156	-47.6	0	0	113.6	A1716 K1717	Q1714-A1716 PolarHBondContact O-N 2.85Å; Q1714-K1717 PolarHBondContact O-N 3.33Å
1715	R	33	Very low	33.7	Very low	204 Å²	204	120.2 Å²	120.2	77%	0.77	60%	0.596	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.6	-7	-177.1	-82	-174.6	168.9	-175.6	-4.6	116.5
1716	A	33.5	Very low	34	Very low	86 Å²	86	123.1 Å²	123.1	71%	0.711	61%	0.609	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.1	-1.8	-179.9	0	0	0	0	0	114.7	Q1714	Q1714-A1716 PolarHBondContact O-N 2.85Å
1717	K	36.6	Very low	34.1	Very low	159 Å²	159	115.1 Å²	115.1	69%	0.691	58%	0.581	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.5	-36.9	179.6	-81.9	-178.1	172	176.8	0	114.2	Q1714 N1719 L1720 D1721	Q1714-K1717 PolarHBondContact O-N 3.33Å; K1717-N1719 PolarHBondContact O-N 2.95Å; K1717-L1720 VanDerWaalsContact O-CB 3.24Å; K1717-L1720 WeakPolarHBondContact O-CB 3.48Å; K1717-L1720 PolarHBondContact O-N 3.44Å; K1717-D1721 PolarHBondContact O-N 3.28Å
1718	E	37	Very low	34.5	Very low	95 Å²	95	111.5 Å²	111.5	44%	0.444	56%	0.557	S	S	.	*	H	α-helix	trans	-69.5	-32.9	-168.6	-69.6	158.9	-154.6	0	0	114	L1720 D1721	E1718-L1720 PolarHBondContact O-N 3.03Å; E1718-D1721 PolarHBondContact O-N 2.92Å
1719	N	36	Very low	34.8	Very low	126 Å²	126	113.3 Å²	113.3	67%	0.674	56%	0.558	S	S	*	*	H	α-helix	trans	-71.4	-20.7	172.2	-77.9	3.1	0	0	0	112.7	K1717	K1717-N1719 PolarHBondContact O-N 2.95Å
1720	L	34.2	Very low	35	Very low	99 Å²	99	112.7 Å²	112.7	52%	0.518	57%	0.569	S	S	.	*	H	α-helix	trans	-76.3	-32.7	177	-147.3	75.3	0	0	0	111.3	K1717 E1718 W1722 Q1723 L1724	K1717-L1720 VanDerWaalsContact O-CB 3.24Å; K1717-L1720 WeakPolarHBondContact O-CB 3.48Å; K1717-L1720 PolarHBondContact O-N 3.44Å; E1718-L1720 PolarHBondContact O-N 3.03Å; L1720-W1722 VanDerWaalsContact C-N 3.34Å; L1720-W1722 PolarHBondContact O-N 2.88Å; L1720-Q1723 PolarHBondContact O-N 2.8Å; L1720-L1724 HydrophobicContact CB-CD1 4.39Å; L1720-L1724 HydrophobicContact CD2-CD1 3.75Å; L1720-L1724 HydrophobicContact CG-CD1 3.74Å; L1720-L1724 HydrophobicContact CG-CG 4.25Å; L1720-L1724 WeakPolarHBondContact O-CB 3.38Å; L1720-L1724 VanDerWaalsContact O-CG 3.23Å; L1720-L1724 WeakPolarHBondContact O-CG 3.22Å; L1720-L1724 PolarHBondContact O-N 3.11Å
1721	D	41.4	Very low	35.1	Very low	83 Å²	83	115 Å²	115	44%	0.444	56%	0.561	S	S	.	*	H	α-helix	trans	-68.5	-28.7	-170.3	-123.9	-37.3	0	0	0	113.8	K1717 E1718 L1724 A1725	K1717-D1721 PolarHBondContact O-N 3.28Å; E1718-D1721 PolarHBondContact O-N 2.92Å; D1721-L1724 CarbonylContact O-C 3.51Å; D1721-A1725 WeakPolarHBondContact O-CB 3.47Å; D1721-A1725 PolarHBondContact O-N 2.56Å
1722	W	34.4	Very low	35.4	Very low	116 Å²	116	114.1 Å²	114.1	44%	0.439	55%	0.551	S	S	.	*	H	α-helix	trans	-88.1	-33.7	176.5	-97	90	0	0	0	114.3	K757 L1720 L1724 A1725 N1726	K757-W1722 VanDerWaalsContact CE-CD1 3.44Å; K757-W1722 VanDerWaalsContact CE-CD2 3.5Å; K757-W1722 VanDerWaalsContact CE-CE2 3.42Å; K757-W1722 VanDerWaalsContact CE-CG 3.47Å; K757-W1722 VanDerWaalsContact NZ-CE2 3.29Å; K757-W1722 VanDerWaalsContact NZ-CG 3.31Å; L1720-W1722 VanDerWaalsContact C-N 3.34Å; L1720-W1722 PolarHBondContact O-N 2.88Å; W1722-L1724 VanDerWaalsContact C-N 3.28Å; W1722-A1725 HydrophobicContact CD2-CB 4.32Å; W1722-A1725 HydrophobicContact CE3-CB 4.15Å; W1722-A1725 WeakPolarHBondContact O-CB 3.47Å; W1722-A1725 PolarHBondContact O-N 3.48Å; W1722-A1725 VanDerWaalsContact O-N 3.07Å; W1722-N1726 PolarHBondContact O-N 2.8Å
1723	Q	36.3	Very low	35.2	Very low	115 Å²	115	115 Å²	115	54%	0.537	55%	0.548	S	S	.	.	H	α-helix	trans	-62.6	-40.9	164.2	-78.5	-172.7	-38.5	0	0	109.8	L1720 A1725 N1726 D1727	L1720-Q1723 PolarHBondContact O-N 2.8Å; Q1723-A1725 PolarHBondContact O-N 3.21Å; Q1723-N1726 PolarHBondContact O-N 3Å; Q1723-D1727 VanDerWaalsContact O-CB 3.22Å; Q1723-D1727 WeakPolarHBondContact O-CB 3.07Å; Q1723-D1727 PolarHBondContact O-N 3.49Å
1724	L	38.1	Very low	35.3	Very low	83 Å²	83	110.9 Å²	110.9	44%	0.435	54%	0.536	S	S	.	.	H	α-helix	trans	-74.8	-1	170.3	-66.3	172.4	0	0	0	114.6	K332 L1720 D1721 W1722 A1728	K332-L1724 PolarHBondContact NZ-O 2.84Å; L1720-L1724 HydrophobicContact CB-CD1 4.39Å; L1720-L1724 HydrophobicContact CD2-CD1 3.75Å; L1720-L1724 HydrophobicContact CG-CD1 3.74Å; L1720-L1724 HydrophobicContact CG-CG 4.25Å; L1720-L1724 WeakPolarHBondContact O-CB 3.38Å; L1720-L1724 VanDerWaalsContact O-CG 3.23Å; L1720-L1724 WeakPolarHBondContact O-CG 3.22Å; L1720-L1724 PolarHBondContact O-N 3.11Å; D1721-L1724 CarbonylContact O-C 3.51Å; W1722-L1724 VanDerWaalsContact C-N 3.28Å; L1724-A1728 WeakPolarHBondContact O-CB 3.49Å; L1724-A1728 PolarHBondContact O-N 2.74Å
1725	A	39.8	Very low	35	Very low	28 Å²	28	113.6 Å²	113.6	23%	0.231	55%	0.549	C	S	.	.	H	α-helix	trans	-82.8	-58.6	166	0	0	0	0	0	108.5	D1721 W1722 Q1723 A1728 W1729	D1721-A1725 WeakPolarHBondContact O-CB 3.47Å; D1721-A1725 PolarHBondContact O-N 2.56Å; W1722-A1725 HydrophobicContact CD2-CB 4.32Å; W1722-A1725 HydrophobicContact CE3-CB 4.15Å; W1722-A1725 WeakPolarHBondContact O-CB 3.47Å; W1722-A1725 PolarHBondContact O-N 3.48Å; W1722-A1725 VanDerWaalsContact O-N 3.07Å; Q1723-A1725 PolarHBondContact O-N 3.21Å; A1725-A1728 PolarHBondContact O-N 3.36Å; A1725-A1728 VanDerWaalsContact O-N 3.16Å; A1725-W1729 PolarHBondContact O-N 3.24Å; A1725-W1729 VanDerWaalsContact O-N 3.14Å
1726	N	39.3	Very low	34.9	Very low	85 Å²	85	112.3 Å²	112.3	46%	0.455	55%	0.551	S	S	.	*	H	α-helix	trans	-62	-46.3	178.3	-67.5	15.1	0	0	0	111.4	W1722 Q1723 A1728 W1729 A1730	W1722-N1726 PolarHBondContact O-N 2.8Å; Q1723-N1726 PolarHBondContact O-N 3Å; N1726-A1728 VanDerWaalsContact C-N 3.33Å; N1726-A1728 PolarHBondContact O-N 2.77Å; N1726-W1729 PolarHBondContact O-N 3.17Å; N1726-A1730 PolarHBondContact O-N 3.43Å
1727	D	35.2	Very low	34.8	Very low	51 Å²	51	117.1 Å²	117.1	27%	0.273	56%	0.559	S	S	.	*	H	α-helix	trans	-66.2	-30.4	175.1	-94.5	-31.4	0	0	0	112.8	Q1723 W1729 A1730 R1731	Q1723-D1727 VanDerWaalsContact O-CB 3.22Å; Q1723-D1727 WeakPolarHBondContact O-CB 3.07Å; Q1723-D1727 PolarHBondContact O-N 3.49Å; D1727-W1729 VanDerWaalsContact C-N 3.35Å; D1727-A1730 PolarHBondContact O-N 3.22Å; D1727-R1731 VanDerWaalsContact CG-CZ 3.41Å; D1727-R1731 WeakPolarHBondContact O-CA 3.04Å; D1727-R1731 WeakPolarHBondContact O-CB 3.49Å; D1727-R1731 WeakPolarHBondContact O-CG 3.44Å; D1727-R1731 PolarHBondContact O-N 3.06Å; D1727-R1731 IonicContact OD1-CZ 3.51Å; D1727-R1731 IonicContact OD1-NE 3.91Å; D1727-R1731 PolarHBondContact OD1-NE 3.25Å; D1727-R1731 IonicContact OD1-NH2 2.73Å; D1727-R1731 PolarHBondContact OD1-NH2 3.29Å; D1727-R1731 IonicContact OD2-CZ 1.78Å; D1727-R1731 VanDerWaalsContact OD2-CZ 3.26Å; D1727-R1731 IonicContact OD2-NE 2.77Å; D1727-R1731 PolarHBondContact OD2-NE 2.96Å; D1727-R1731 IonicContact OD2-NH2 3.65Å; D1727-R1731 PolarHBondContact OD2-NH2 3.27Å
1728	A	38.6	Very low	34.4	Very low	30 Å²	30	118.9 Å²	118.9	25%	0.248	57%	0.569	C	S	.	*	H	α-helix	trans	-71.8	-31.7	177.1	0	0	0	0	0	112.3	L1724 A1725 N1726	L1724-A1728 WeakPolarHBondContact O-CB 3.49Å; L1724-A1728 PolarHBondContact O-N 2.74Å; A1725-A1728 PolarHBondContact O-N 3.36Å; A1725-A1728 VanDerWaalsContact O-N 3.16Å; N1726-A1728 VanDerWaalsContact C-N 3.33Å; N1726-A1728 PolarHBondContact O-N 2.77Å
1729	W	37	Very low	34.2	Very low	151 Å²	151	118.6 Å²	118.6	57%	0.572	58%	0.578	S	S	*	*	H	α-helix	trans	-66.3	-47.3	167.7	-99.4	53.3	0	0	0	111	A1725 N1726 D1727 R1731	A1725-W1729 PolarHBondContact O-N 3.24Å; A1725-W1729 VanDerWaalsContact O-N 3.14Å; N1726-W1729 PolarHBondContact O-N 3.17Å; D1727-W1729 VanDerWaalsContact C-N 3.35Å; W1729-R1731 PolarHBondContact O-N 2.61Å
1730	A	34.2	Very low	33.9	Very low	82 Å²	82	121 Å²	121	68%	0.678	59%	0.585	S	S	*	*	H	α-helix	trans	-69.7	-23.2	179.2	0	0	0	0	0	115	N1726 D1727	N1726-A1730 PolarHBondContact O-N 3.43Å; D1727-A1730 PolarHBondContact O-N 3.22Å
1731	R	30.2	Very low	33.8	Very low	173 Å²	173	124.9 Å²	124.9	65%	0.653	60%	0.6	S	S	*	*	T	Hydrogen-bonded Turn	trans	-120.8	22.7	-166.6	-55.1	-176.1	-166.3	-163.4	11.5	116.6	D1727 W1729 R1733	D1727-R1731 VanDerWaalsContact CG-CZ 3.41Å; D1727-R1731 WeakPolarHBondContact O-CA 3.04Å; D1727-R1731 WeakPolarHBondContact O-CB 3.49Å; D1727-R1731 WeakPolarHBondContact O-CG 3.44Å; D1727-R1731 PolarHBondContact O-N 3.06Å; D1727-R1731 IonicContact OD1-CZ 3.51Å; D1727-R1731 IonicContact OD1-NE 3.91Å; D1727-R1731 PolarHBondContact OD1-NE 3.25Å; D1727-R1731 IonicContact OD1-NH2 2.73Å; D1727-R1731 PolarHBondContact OD1-NH2 3.29Å; D1727-R1731 IonicContact OD2-CZ 1.78Å; D1727-R1731 VanDerWaalsContact OD2-CZ 3.26Å; D1727-R1731 IonicContact OD2-NE 2.77Å; D1727-R1731 PolarHBondContact OD2-NE 2.96Å; D1727-R1731 IonicContact OD2-NH2 3.65Å; D1727-R1731 PolarHBondContact OD2-NH2 3.27Å; W1729-R1731 PolarHBondContact O-N 2.61Å; R1731-R1733 PolarHBondContact O-N 3.08Å
1732	R	33.9	Very low	33.3	Very low	153 Å²	153	125.7 Å²	125.7	58%	0.577	61%	0.613	S	S	*	*			trans	-77.5	65.1	164	-79.3	-169.5	176	-164.7	2.3	112.6	P1734	R1732-P1734 WeakPolarHBondContact O-CD 3.45Å
1733	R	28.1	Very low	33.2	Very low	187 Å²	187	131.4 Å²	131.4	71%	0.706	64%	0.636	S	S	*	*			trans	-87.3	111.8	154.3	-78.8	-167.5	174.7	-153.2	-1.5	108.4	R1731 Q1735	R1731-R1733 PolarHBondContact O-N 3.08Å; R1733-Q1735 PolarHBondContact O-N 2.74Å
1734	P	32.1	Very low	33	Very low	86 Å²	86	134.7 Å²	134.7	56%	0.558	65%	0.651	S	S	*	*			trans	-63.5	130.1	169.7	-18.4	32	0	0	0	109.8	R1732 Q1736	R1732-P1734 WeakPolarHBondContact O-CD 3.45Å; P1734-Q1736 PolarHBondContact O-N 3.22Å; P1734-Q1736 VanDerWaalsContact O-N 3.07Å
1735	Q	26.9	Very low	32.8	Very low	194 Å²	194	134.1 Å²	134.1	91%	0.907	66%	0.658	S	S	*	*			trans	-70.9	99.6	163	-72.9	-170.8	-1.9	0	0	108	R1733 H1737	R1733-Q1735 PolarHBondContact O-N 2.74Å; Q1735-H1737 PolarHBondContact O-N 3.1Å
1736	Q	30.1	Very low	32.4	Very low	176 Å²	176	140.5 Å²	140.5	82%	0.822	68%	0.683	S	S	*	*			trans	-63.6	122.3	170.6	-78	-176.6	-23.5	0	0	109.4	P1734 Q1738	P1734-Q1736 PolarHBondContact O-N 3.22Å; P1734-Q1736 VanDerWaalsContact O-N 3.07Å; Q1736-Q1738 PolarHBondContact O-N 2.86Å
1737	H	31.3	Very low	32.1	Very low	188 Å²	188	143.6 Å²	143.6	87%	0.87	70%	0.695	S	S	*	*			trans	-59.6	105.1	167.1	-98.4	-69.9	0	0	0	109.4	Q1735 S1739	Q1735-H1737 PolarHBondContact O-N 3.1Å; H1737-S1739 PolarHBondContact O-N 3.01Å; H1737-S1739 VanDerWaalsContact O-N 3.16Å
1738	Q	28.8	Very low	32	Very low	195 Å²	195	148.7 Å²	148.7	91%	0.911	72%	0.717	S	S	*	*			trans	-71.6	106.2	167.7	-70.9	-173.6	-5.8	0	0	109.1	Q1736	Q1736-Q1738 PolarHBondContact O-N 2.86Å
1739	S	31.5	Very low	31.8	Very low	90 Å²	90	154.4 Å²	154.4	63%	0.629	74%	0.738	S	S	*	*			trans	-111.4	128.2	167.2	59.1	0	0	0	0	109.5	H1737	H1737-S1739 PolarHBondContact O-N 3.01Å; H1737-S1739 VanDerWaalsContact O-N 3.16Å
1740	H	31	Very low	31.6	Very low	177 Å²	177	153.5 Å²	153.5	82%	0.819	74%	0.74	S	S	*	*			trans	63.8	133.7	-175.5	-45.1	-87.7	0	0	0	113.4
1741	Q	31.6	Very low	31.6	Very low	179 Å²	179	157.5 Å²	157.5	84%	0.836	75%	0.745	S	S	*	*			cis	-140.2	155.1	33	-68.5	174.1	8.1	0	0	113.5
1742	S	30.9	Very low	31.8	Very low	101 Å²	101	153 Å²	153	71%	0.706	74%	0.74	S	S	*	*			trans	-59.1	138.5	169.6	51.5	0	0	0	0	113.9
1743	Y	31.3	Very low	31.9	Very low	235 Å²	235	153.4 Å²	153.4	92%	0.922	75%	0.748	S	S	*	*			trans	-134.2	151.1	138.8	-99.6	-78.5	0	0	0	110.9
1744	H	33.5	Very low	32.4	Very low	184 Å²	184	152 Å²	152	85%	0.852	75%	0.749	S	S	*	*			trans	-111.2	178.5	-162.3	-135.6	-74.2	0	0	0	111.6
1745	A	33	Very low	32.5	Very low	72 Å²	72	156.2 Å²	156.2	60%	0.595	76%	0.762	S	S	*	*			trans	80.3	144.2	169.5	0	0	0	0	0	115.1
1746	Q	33	Very low	33.2	Very low	161 Å²	161	151.4 Å²	151.4	75%	0.752	75%	0.747	S	S	*	*			cis	-160.7	169.7	-6	-111.1	166.6	43	0	0	105.9
1747	Q	31.9	Very low	33.5	Very low	151 Å²	151	150.1 Å²	150.1	71%	0.706	74%	0.741	S	S	*	*			cis	-167.4	149	20.5	-140.4	173.5	77.4	0	0	108.4
1748	Q	32.8	Very low	33.8	Very low	157 Å²	157	149.1 Å²	149.1	73%	0.734	74%	0.739	S	S	*	*			trans	144.4	122.6	141	-82.1	-179.7	21.6	0	0	114.4
1749	H	33.8	Very low	34.1	Very low	151 Å²	151	142.9 Å²	142.9	70%	0.699	73%	0.727	S	S	*	*			trans	56.9	138.4	161.4	-53	-60.4	0	0	0	118.9
1750	H	34.2	Very low	34.3	Very low	131 Å²	131	147.9 Å²	147.9	61%	0.606	74%	0.743	S	S	*	*			cis	-157.7	133.6	-10.4	-125.6	-64.2	0	0	0	109.9
1751	H	33.7	Very low	34.5	Very low	167 Å²	167	145.2 Å²	145.2	77%	0.773	74%	0.744	S	S	*	*			trans	61.6	149.8	155.6	-68.9	-18.9	0	0	0	119.6
1752	S	34.8	Very low	34.6	Very low	79 Å²	79	144.8 Å²	144.8	55%	0.552	74%	0.744	S	S	*	*			cis	-169.6	156.1	-12	54.6	0	0	0	0	112
1753	Q	36.1	Very low	34.8	Very low	160 Å²	160	146.8 Å²	146.8	75%	0.748	75%	0.747	S	S	*	*			trans	68.7	143.4	157.1	-69.4	171.8	78.8	0	0	117.1
1754	Q	38	Very low	35.1	Very low	157 Å²	157	143.9 Å²	143.9	73%	0.734	74%	0.744	S	S	*	*			cis	-144.7	141.7	-15	-85.7	155.2	45	0	0	104.7
1755	Q	34.9	Very low	35.2	Very low	175 Å²	175	139 Å²	139	82%	0.818	74%	0.744	S	S	*	*				57.5	148.4	62	-82.1	-152.8	16.2	0	0	115.8
1756	P	40.8	Very low	35.3	Very low	94 Å²	94	143.4 Å²	143.4	61%	0.61	76%	0.755	S	S	*	*			cis	-147.7	-176.2	-24.5	36.8	-15.7	0	0	0	116.7
1757	H	37.1	Very low	35.5	Very low	149 Å²	149	142.4 Å²	142.4	69%	0.69	76%	0.76	S	S	*	*			trans	93.1	140.2	131.2	-106.5	-61.5	0	0	0	125.1
1758	M	37.6	Very low	35.6	Very low	166 Å²	166	144 Å²	144	82%	0.818	77%	0.77	S	S	*	*			trans	67.8	147.6	161.2	-51.6	-53.2	-176.1	0	0	118.4
1759	G	35.2	Very low	35.7	Very low	65 Å²	65	142 Å²	142	67%	0.67	77%	0.773	S	S	*	*			cis	156.5	130.5	-11.6	0	0	0	0	0	114.7
1760	M	34.8	Very low	35.8	Very low	195 Å²	195	143 Å²	143	96%	0.961	78%	0.783	S	S	*	*			trans	32.4	130.5	156.1	-60.4	179.5	174.3	0	0	120.9
1761	S	35.1	Very low	35.8	Very low	120 Å²	120	140.5 Å²	140.5	84%	0.839	79%	0.793	S	S	*	*				173.8	172.2	96.8	-158.5	0	0	0	0	113.7
1762	M	33.4	Very low	36	Very low	170 Å²	170	144.9 Å²	144.9	84%	0.837	80%	0.803	S	S	*	*			trans	-81.8	163.3	-175.7	-44	168.4	-169.2	0	0	113.1
1763	N	36.7	Very low	36.1	Very low	143 Å²	143	144.1 Å²	144.1	77%	0.765	81%	0.807	S	S	*	*				158.7	155.3	95.7	-157.1	20.6	0	0	0	115.2
1764	M	36.2	Very low	36.1	Very low	175 Å²	175	143.7 Å²	143.7	86%	0.862	82%	0.816	S	S	*	*			trans	-8.4	145.9	162.4	-65.1	-93.1	-163.1	0	0	121.4
1765	G	35.9	Very low	36	Very low	82 Å²	82	140 Å²	140	85%	0.845	82%	0.82	S	S	*	*			trans	171.3	90.8	156	0	0	0	0	0	118.9
1766	I	35.8	Very low	36.1	Very low	163 Å²	163	135.9 Å²	135.9	84%	0.836	82%	0.824	S	S	*	*			trans	-68.5	136.8	175.3	-51.6	162.1	0	0	0	112.2
1767	T	36.2	Very low	35.9	Very low	140 Å²	140	135.3 Å²	135.3	86%	0.859	84%	0.835	S	S	*	*				174.1	156.1	125.9	30	0	0	0	0	116.9
1768	M	33.8	Very low	35.9	Very low	184 Å²	184	132.4 Å²	132.4	91%	0.906	85%	0.846	S	S	*	*			trans	-47.5	147.6	177.1	-54.8	-77.5	-170.9	0	0	117
1769	S	36.2	Very low	35.9	Very low	116 Å²	116	128.6 Å²	128.6	81%	0.811	85%	0.849	S	S	*	*				178.3	170.2	112.3	-159.9	0	0	0	0	113.3
1770	L	34.4	Very low	35.9	Very low	172 Å²	172	129.4 Å²	129.4	90%	0.901	86%	0.857	S	S	*	*			trans	-77.8	156.3	176.9	-51.5	88.3	0	0	0	112.7
1771	G	36.1	Very low	36	Very low	79 Å²	79	123.3 Å²	123.3	81%	0.814	85%	0.845	S	S	*	*			trans	175.9	124.4	162.7	0	0	0	0	0	116.5
1772	R	36.4	Very low	36	Very low	259 Å²	259	129.2 Å²	129.2	98%	0.977	85%	0.85	S	S	*	*			trans	-71.7	155.5	166.4	-71.5	171	158.5	-166.6	-5.6	111.4
1773	G	37.1	Very low	36.1	Very low	63 Å²	63	124.4 Å²	124.4	65%	0.649	84%	0.844	S	S	*	*				125.3	107.3	127.7	0	0	0	0	0	119.4
1774	T	36.9	Very low	36.2	Very low	151 Å²	151	123.4 Å²	123.4	93%	0.926	85%	0.848	S	S	*	*				38.5	125.8	129.9	57.4	0	0	0	0	121.7
1775	G	36.2	Very low	36.2	Very low	79 Å²	79	121 Å²	121	81%	0.814	84%	0.844	S	S	*	*				134.8	89	129.8	0	0	0	0	0	120.3
1776	G	36.7	Very low	36.6	Very low	89 Å²	89	123 Å²	123	92%	0.918	84%	0.841	S	S	*	*			trans	45.7	155.3	133	0	0	0	0	0	125.4
1777	G	36.5	Very low	36.7	Very low	81 Å²	81	120.5 Å²	120.5	84%	0.835	83%	0.834	S	S	*	*			trans	142.4	105.8	145.3	0	0	0	0	0	119.4
1778	G	36.6	Very low	36.7	Very low	89 Å²	89	120 Å²	120	92%	0.918	83%	0.826	S	S	*	*			trans	76	152.4	161.9	0	0	0	0	0	116.7
1779	G	36.8	Very low	36.7	Very low	86 Å²	86	116 Å²	116	89%	0.887	81%	0.808	S	S	*	*			cis	128	140.5	3.6	0	0	0	0	0	110.8
1780	G	35.7	Very low	36.8	Very low	82 Å²	82	119.6 Å²	119.6	85%	0.845	81%	0.805	S	S	*	*			cis	177.7	-178.8	-2.6	0	0	0	0	0	110.3
1781	G	36.4	Very low	36.9	Very low	67 Å²	67	116 Å²	116	69%	0.691	80%	0.795	S	S	*	*			trans	112.4	139.3	175.6	0	0	0	0	0	115.2
1782	Y	34.9	Very low	37	Very low	243 Å²	243	118.7 Å²	118.7	95%	0.953	80%	0.795	S	S	*	*			cis	144.6	125	-20	-90.4	-55	0	0	0	109
1783	G	36.6	Very low	36.9	Very low	69 Å²	69	110.3 Å²	110.3	71%	0.711	79%	0.79	S	S	*	*			trans	91.9	152.1	166.2	0	0	0	0	0	116.5
1784	S	38.6	Very low	36.7	Very low	122 Å²	122	111.3 Å²	111.3	85%	0.853	80%	0.8	S	S	*	*			cis	-161.2	158.5	-12.7	-83.4	0	0	0	0	110.2
1785	T	37.1	Very low	36.6	Very low	126 Å²	126	107.5 Å²	107.5	77%	0.773	79%	0.791	S	S	*	*			trans	-78.9	154.8	171.1	47.3	0	0	0	0	112.4
1786	P	43.3	Very low	36.5	Very low	122 Å²	122	112.6 Å²	112.6	79%	0.792	79%	0.793	S	S	*	*				-129.5	156.8	107.1	8.4	13.6	0	0	0	112.3
1787	V	38.2	Very low	36.4	Very low	111 Å²	111	115.5 Å²	115.5	67%	0.673	79%	0.787	S	S	*	*			cis	107.1	116.2	20.2	168.5	0	0	0	0	113.3
1788	N	35.3	Very low	36.2	Very low	129 Å²	129	123.4 Å²	123.4	69%	0.69	79%	0.792	S	S	*	*			trans	70.3	158.5	154.7	-74.3	32.4	0	0	0	119.7
1789	D	35.6	Very low	35.9	Very low	101 Å²	101	122.8 Å²	122.8	54%	0.54	79%	0.786	S	S	.	*			cis	-160.4	178	4	-128.3	-29.6	0	0	0	114.3
1790	Y	36.4	Very low	35.7	Very low	191 Å²	191	127.6 Å²	127.6	75%	0.749	79%	0.788	S	S	*	*			trans	73.6	113.7	161.7	-53.5	-46.8	0	0	0	119
1791	S	37	Very low	35.5	Very low	98 Å²	98	128.4 Å²	128.4	69%	0.685	78%	0.78	S	S	*	*				88.2	137.9	70	-67.9	0	0	0	0	113.3
1792	T	37.9	Very low	35.3	Very low	134 Å²	134	129.4 Å²	129.4	82%	0.822	78%	0.776	S	S	*	*			cis	-163.2	137.4	5.3	6.6	0	0	0	0	112
1793	G	34.3	Very low	35.1	Very low	84 Å²	84	127 Å²	127	87%	0.866	77%	0.771	S	S	*	*			trans	71.9	146.6	162.7	0	0	0	0	0	117.2
1794	G	33.8	Very low	34.9	Very low	84 Å²	84	128.4 Å²	128.4	87%	0.866	78%	0.776	S	S	*	*			cis	173.5	160	-7.8	0	0	0	0	0	110.9
1795	G	34	Very low	34.4	Very low	70 Å²	70	128.3 Å²	128.3	72%	0.722	78%	0.775	S	S	*	*			trans	109.8	81.8	167.5	0	0	0	0	0	118.6
1796	H	35	Very low	34.3	Very low	187 Å²	187	128.5 Å²	128.5	87%	0.866	78%	0.776	S	S	*	*			trans	64	151.6	148.3	-62.3	-27.7	0	0	0	123.9
1797	N	33.5	Very low	33.7	Very low	149 Å²	149	131.6 Å²	131.6	80%	0.797	77%	0.772	S	S	*	*			trans	51.4	95.7	165.3	-69	-0.2	0	0	0	121.6
1798	R	32.7	Very low	33.5	Very low	247 Å²	247	131.9 Å²	131.9	93%	0.932	78%	0.779	S	S	*	*				5.2	138.2	119.9	-56.2	174.7	179.6	176.9	-0.4	116
1799	G	31.3	Very low	33.4	Very low	77 Å²	77	131.9 Å²	131.9	79%	0.794	78%	0.784	S	S	*	*			cis	172.4	148.9	-1.3	0	0	0	0	0	110.8
1800	M	32.2	Very low	33.4	Very low	187 Å²	187	133.2 Å²	133.2	92%	0.921	80%	0.798	S	S	*	*			trans	-113.5	150.6	-169.2	-62.5	173.3	64.6	0	0	113.8
1801	S	32.4	Very low	33.3	Very low	98 Å²	98	135.9 Å²	135.9	69%	0.685	81%	0.806	S	S	*	*			trans	71.7	101.5	139.2	-158.3	0	0	0	0	121.2
1802	S	30.5	Very low	33.2	Very low	88 Å²	88	137.5 Å²	137.5	62%	0.615	81%	0.812	S	S	*	*				78.1	155.8	127	83.7	0	0	0	0	121.8
1803	K	32.2	Very low	33.2	Very low	194 Å²	194	139 Å²	139	84%	0.843	82%	0.815	S	S	*	*			trans	75.2	100.9	157.5	-64.7	173.4	-175.5	178.6	0	119.6
1804	A	31.1	Very low	33.3	Very low	97 Å²	97	139.4 Å²	139.4	80%	0.802	81%	0.81	S	S	*	*				66	127	122.3	0	0	0	0	0	121.9
1805	S	29.7	Very low	33.3	Very low	121 Å²	121	140.7 Å²	140.7	85%	0.846	81%	0.806	S	S	*	*			trans	79.5	169.9	148.7	-156.3	0	0	0	0	119
1806	V	33.2	Very low	33.6	Very low	130 Å²	130	142 Å²	142	79%	0.788	80%	0.802	S	S	*	*			trans	93	114.2	170.3	-173	0	0	0	0	117.5
1807	R	31.3	Very low	33.8	Very low	187 Å²	187	142 Å²	142	71%	0.706	80%	0.802	S	S	*	*			trans	-60.9	146	164	-66.8	169.6	161.1	-170	-7.6	112
1808	S	33.3	Very low	33.8	Very low	117 Å²	117	139.6 Å²	139.6	82%	0.818	80%	0.797	S	S	*	*			trans	-157.9	130.7	144.5	58.7	0	0	0	0	112
1809	T	34	Very low	34.1	Very low	129 Å²	129	136.8 Å²	136.8	79%	0.791	80%	0.797	S	S	*	*			trans	-75.7	150.2	178.9	50.9	0	0	0	0	112.7
1810	P	36.7	Very low	34.3	Very low	129 Å²	129	139.8 Å²	139.8	84%	0.838	79%	0.794	S	S	*	*			trans	-69.6	154.4	166.7	31.6	-34.5	0	0	0	111
1811	R	34.4	Very low	34.5	Very low	246 Å²	246	139 Å²	139	93%	0.928	79%	0.793	S	S	*	*			trans	-110.3	135	172.6	-94.3	-176.4	165	-177.7	-4.8	110.5
1812	T	33.5	Very low	34.7	Very low	132 Å²	132	137.9 Å²	137.9	81%	0.81	80%	0.797	S	S	*	*			trans	-92.9	145.9	167.6	47.4	0	0	0	0	111.4
1813	N	37.5	Very low	34.9	Very low	165 Å²	165	141.6 Å²	141.6	88%	0.882	81%	0.81	S	S	*	*			trans	166.9	136.7	162.7	-91.5	-26.8	0	0	0	107.4
1814	A	37.2	Very low	35.1	Very low	93 Å²	93	136.9 Å²	136.9	77%	0.769	81%	0.807	S	S	*	*			cis	-159.5	162.5	-10.8	0	0	0	0	0	109.9
1815	S	33.1	Very low	35.5	Very low	112 Å²	112	138.6 Å²	138.6	78%	0.783	81%	0.808	S	S	*	*			trans	-88.1	-179.4	165.7	-145.9	0	0	0	0	109.3
1816	P	41.2	Very low	36.1	Very low	96 Å²	96	137.8 Å²	137.8	62%	0.623	80%	0.8	S	S	*	*			cis	-144.5	-164.9	6.2	44.5	-24.2	0	0	0	116.9
1817	H	38.2	Very low	36.2	Very low	188 Å²	188	138.2 Å²	138.2	87%	0.87	80%	0.797	S	S	*	*			trans	107.2	151.1	153.6	-73.5	-15.3	0	0	0	119.4
1818	S	35.3	Very low	36.6	Very low	99 Å²	99	138.4 Å²	138.4	69%	0.692	80%	0.799	S	S	*	*			trans	-112.2	155.7	-164.6	49.9	0	0	0	0	112.8
1819	M	37.7	Very low	36.8	Very low	188 Å²	188	139.2 Å²	139.2	93%	0.926	79%	0.794	S	S	*	*			trans	-163.4	156.2	132.9	-111.5	-178.4	-66.3	0	0	112.2
1820	N	36.7	Very low	36.9	Very low	139 Å²	139	141.2 Å²	141.2	74%	0.743	79%	0.794	S	S	*	*			trans	-73.4	167	-166.2	-65.8	0.9	0	0	0	116.4
1821	L	35.6	Very low	36.7	Very low	171 Å²	171	146.5 Å²	146.5	90%	0.895	82%	0.816	S	S	*	*			trans	71.4	124.2	144.6	-77.1	155.6	0	0	0	119.1
1822	G	35.6	Very low	36.8	Very low	75 Å²	75	141.6 Å²	141.6	77%	0.773	81%	0.81	S	S	*	*			trans	164.9	111.3	162.9	0	0	0	0	0	112.5
1823	D	36	Very low	37	Very low	166 Å²	166	142.1 Å²	142.1	89%	0.888	81%	0.81	S	S	*	*			trans	-68	175	176	-61.7	-77.7	0	0	0	114
1824	A	37.1	Very low	37	Very low	94 Å²	94	140.8 Å²	140.8	78%	0.777	81%	0.806	S	S	*	*			trans	97.7	93.1	158.8	0	0	0	0	0	119
1825	T	37.9	Very low	37	Very low	134 Å²	134	143.6 Å²	143.6	82%	0.822	81%	0.808	S	S	*	*			trans	-44.2	169.8	130.9	16.1	0	0	0	0	113.6
1826	P	42.3	Very low	37.2	Very low	104 Å²	104	145.6 Å²	145.6	68%	0.675	81%	0.81	S	S	*	*			cis	-142.8	-163.9	1.3	31.5	-5.8	0	0	0	115.5
1827	L	36.7	Very low	36.9	Very low	138 Å²	138	148.9 Å²	148.9	72%	0.723	82%	0.823	S	S	*	*			trans	88.6	129.5	149	-68.3	161.7	0	0	0	122.1
1828	Y	38.6	Very low	36.8	Very low	192 Å²	192	146.1 Å²	146.1	75%	0.753	82%	0.819	S	S	*	*			trans	71.5	118.1	147.1	-75.7	-57.4	0	0	0	124.2
1829	D	37.1	Very low	37	Very low	134 Å²	134	149.7 Å²	149.7	72%	0.717	83%	0.829	S	S	*	*				97.6	134.3	124.8	-76.3	-24.3	0	0	0	124.8
1830	E	36.8	Very low	36.9	Very low	170 Å²	170	146.5 Å²	146.5	79%	0.794	82%	0.821	S	S	*	*			trans	54	98.6	154	-64	-174.1	158.4	0	0	120.2
1831	N	32.5	Very low	36.9	Very low	241 Å²	241	147.2 Å²	147.2	100%	1.289	83%	0.828	S	S	*	*				-164.4	0	107.6	-102.1	-94.9	0	0	0	111.4

Retrieved 1,831 of 1,831 residues in 787.5 ms (Link to these results)

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